Starting phenix.hbond on Mon Aug 19 15:38:02 2024 by afonine =============================================================================== Processing files: ------------------------------------------------------------------------------- Found model, ../amber/pairs/1fp9.pdb Found model, ../amber/pairs/1jkt.pdb Found model, ../amber/pairs/1m10.pdb Found model, ../amber/pairs/1u87.pdb Found model, ../amber/pairs/1u9o.pdb Found model, ../amber/pairs/1w60.pdb Found model, ../amber/pairs/1wl3.pdb Found model, ../amber/pairs/1x24.pdb Found model, ../amber/pairs/1xgo.pdb Found model, ../amber/pairs/1yab.pdb Found model, ../amber/pairs/2a8z.pdb Found model, ../amber/pairs/2fdq.pdb Found model, ../amber/pairs/2h1g.pdb Found model, ../amber/pairs/2jcl.pdb Found model, ../amber/pairs/2ogu.pdb Found model, ../amber/pairs/2pej.pdb Found model, ../amber/pairs/2yhj.pdb Found model, ../amber/pairs/3fm7.pdb Found model, ../amber/pairs/4xcr.pdb Found model, ../amber/pairs/4yei.pdb Processing PHIL parameters: ------------------------------------------------------------------------------- Adding command-line PHIL: ------------------------- output_sk_coordinates=true output_skew_kurtosis_plot=true dot_size=40 prefix=X_SK_amber Final processed PHIL parameters: ------------------------------------------------------------------------------- data_manager { model { file = "../amber/pairs/1fp9.pdb" } model { file = "../amber/pairs/1jkt.pdb" } model { file = "../amber/pairs/1m10.pdb" } model { file = "../amber/pairs/1u87.pdb" } model { file = "../amber/pairs/1u9o.pdb" } model { file = "../amber/pairs/1w60.pdb" } model { file = "../amber/pairs/1wl3.pdb" } model { file = "../amber/pairs/1x24.pdb" } model { file = "../amber/pairs/1xgo.pdb" } model { file = "../amber/pairs/1yab.pdb" } model { file = "../amber/pairs/2a8z.pdb" } model { file = "../amber/pairs/2fdq.pdb" } model { file = "../amber/pairs/2h1g.pdb" } model { file = "../amber/pairs/2jcl.pdb" } model { file = "../amber/pairs/2ogu.pdb" } model { file = "../amber/pairs/2pej.pdb" } model { file = "../amber/pairs/2yhj.pdb" } model { file = "../amber/pairs/3fm7.pdb" } model { file = "../amber/pairs/4xcr.pdb" } model { file = "../amber/pairs/4yei.pdb" } default_model = "../amber/pairs/1fp9.pdb" } hbond { dot_size = 40 } output_skew_kurtosis_plot = true output_sk_coordinates = true output { prefix = X_SK_amber } Starting job =============================================================================== Validating inputs Using model: ../amber/pairs/1fp9.pdb 3737 4209 "HH21 ARG A 264 "<>" O LEU A 234 " d_HA=2.941 d_AD=3.828 a_DHA=146.835 symop: x,y,z a_YAH=138 1965 2022 " H ALA A 129 "<>" O GLU A 125 " d_HA=1.728 d_AD=2.736 a_DHA=170.923 symop: x,y,z a_YAH=170 2010 2080 " H GLU A 132 "<>" O ALA A 128 " d_HA=2.121 d_AD=3.067 a_DHA=153.789 symop: x,y,z a_YAH=152 2010 2058 " H ARG A 131 "<>" O ALA A 128 " d_HA=2.240 d_AD=2.966 a_DHA=127.085 symop: x,y,z a_YAH=97 1990 2058 " H ARG A 131 "<>" O PHE A 127 " d_HA=2.398 d_AD=3.203 a_DHA=135.392 symop: x,y,z a_YAH=141 1998 1926 " H PHE A 127 "<>" O GLU A 123 " d_HA=1.942 d_AD=2.879 a_DHA=152.191 symop: x,y,z a_YAH=132 2012 1941 " H ALA A 128 "<>" O ARG A 124 " d_HA=1.979 d_AD=2.948 a_DHA=158.138 symop: x,y,z a_YAH=138 2128 2211 " H GLU A 139 "<>" O ALA A 135 " d_HA=1.964 d_AD=2.974 a_DHA=170.765 symop: x,y,z a_YAH=152 2162 2241 " H TYR A 141 "<>" O TRP A 137 " d_HA=2.051 d_AD=3.055 a_DHA=168.226 symop: x,y,z a_YAH=152 3080 2998 " H PHE A 192 "<>" O THR A 188 " d_HA=1.932 d_AD=2.951 a_DHA=174.950 symop: x,y,z a_YAH=161 3012 3100 " H PHE A 193 "<>" O GLN A 189 " d_HA=2.071 d_AD=3.081 a_DHA=173.112 symop: x,y,z a_YAH=164 1014 3016 " H GLY A 67 "<>" OE1 GLN A 189 " d_HA=1.781 d_AD=2.758 a_DHA=162.367 symop: x,y,z a_YAH=155 964 1005 " H ALA A 66 "<>" OG SER A 63 " d_HA=2.059 d_AD=3.062 a_DHA=168.870 symop: x,y,z a_YAH=100 a_YAH=140 964 991 " H PHE A 65 "<>" OG SER A 63 " d_HA=2.442 d_AD=3.392 a_DHA=155.917 symop: x,y,z a_YAH=112 a_YAH=91 969 3570 " HG SER A 63 "<>" OE2 GLU A 224 " d_HA=1.632 d_AD=2.579 a_DHA=156.826 symop: x,y,z a_YAH=134 3555 3622 " H ALA A 227 "<>" O ALA A 223 " d_HA=1.837 d_AD=2.803 a_DHA=157.896 symop: x,y,z a_YAH=146 3565 3637 " H HIS A 228 "<>" O GLU A 224 " d_HA=1.899 d_AD=2.818 a_DHA=149.419 symop: x,y,z a_YAH=145 3630 3687 " H TRP A 231 "<>" O HIS A 228 " d_HA=2.441 d_AD=3.370 a_DHA=151.913 symop: x,y,z a_YAH=112 3647 3708 " H PHE A 232 "<>" O PRO A 229 " d_HA=2.261 d_AD=3.234 a_DHA=160.086 symop: x,y,z a_YAH=112 3700 3742 " H LEU A 234 "<>" O PHE A 232 " d_HA=2.181 d_AD=2.908 a_DHA=127.453 symop: x,y,z a_YAH=112 3700 4206 " HE ARG A 264 "<>" O PHE A 232 " d_HA=2.084 d_AD=2.860 a_DHA=131.428 symop: x,y,z a_YAH=130 1112 3140 " H ASP A 73 "<>" OE1 GLN A 195 " d_HA=1.887 d_AD=2.871 a_DHA=161.792 symop: x,y,z a_YAH=134 3149 1107 "HE22 GLN A 195 "<>" O ASP A 73 " d_HA=1.953 d_AD=2.971 a_DHA=174.417 symop: x,y,z a_YAH=124 1020 1074 " H LEU A 71 "<>" O ASN A 68 " d_HA=2.213 d_AD=3.100 a_DHA=144.763 symop: x,y,z a_YAH=125 1013 3025 "HE22 GLN A 189 "<>" O GLY A 67 " d_HA=2.021 d_AD=3.010 a_DHA=164.885 symop: x,y,z a_YAH=149 3546 3584 " H VAL A 225 "<>" OG SER A 222 " d_HA=2.266 d_AD=3.262 a_DHA=167.184 symop: x,y,z a_YAH=143 a_YAH=110 3727 4150 " H HIS A 233 "<>" O LEU A 262 " d_HA=1.990 d_AD=2.976 a_DHA=162.497 symop: x,y,z a_YAH=152 3720 3847 " H THR A 241 "<>" O HIS A 233 " d_HA=1.853 d_AD=2.816 a_DHA=157.692 symop: x,y,z a_YAH=124 3720 3861 " H VAL A 242 "<>" O HIS A 233 " d_HA=2.863 d_AD=3.824 a_DHA=160.648 symop: x,y,z a_YAH=143 1110 1154 " HE ARG A 75 "<>" OD1 ASP A 73 " d_HA=1.901 d_AD=2.674 a_DHA=129.624 symop: x,y,z a_YAH=97 1154 1110 " HE ARG A 75 "<>" OD1 ASP A 73 " d_HA=1.901 d_AD=2.674 a_DHA=129.624 symop: x,y,z a_YAH=97 793 950 " H PHE A 62 "<>" O PRO A 51 " d_HA=2.261 d_AD=3.186 a_DHA=150.969 symop: x,y,z a_YAH=137 3491 4132 "HD22 ASN A 260 "<>" O VAL A 218 " d_HA=2.075 d_AD=3.017 a_DHA=153.131 symop: x,y,z a_YAH=124 3891 4122 " H ALA A 244 "<>" O ASN A 260 " d_HA=1.789 d_AD=2.734 a_DHA=153.802 symop: x,y,z a_YAH=147 3843 4942 " H ALA A 306 "<>" O THR A 241 " d_HA=2.315 d_AD=3.259 a_DHA=153.415 symop: x,y,z a_YAH=118 3877 4907 " H VAL A 243 "<>" O ILE A 304 " d_HA=1.795 d_AD=2.800 a_DHA=171.363 symop: x,y,z a_YAH=156 1971 1897 " H GLU A 125 "<>" O PRO A 121 " d_HA=2.326 d_AD=3.238 a_DHA=149.634 symop: x,y,z a_YAH=109 2074 2130 " H ALA A 135 "<>" O GLU A 132 " d_HA=2.487 d_AD=3.432 a_DHA=154.247 symop: x,y,z a_YAH=104 2223 2669 "HH22 ARG A 166 "<>" OD1 ASP A 140 " d_HA=1.644 d_AD=2.556 a_DHA=144.081 symop: x,y,z a_YAH=135 1941 2012 " H ALA A 128 "<>" O ARG A 124 " d_HA=1.979 d_AD=2.948 a_DHA=158.138 symop: x,y,z a_YAH=138 1926 1998 " H PHE A 127 "<>" O GLU A 123 " d_HA=1.942 d_AD=2.879 a_DHA=152.191 symop: x,y,z a_YAH=132 1886 1949 " H ARG A 124 "<>" O SER A 120 " d_HA=1.827 d_AD=2.798 a_DHA=159.318 symop: x,y,z a_YAH=160 1886 1932 " H GLU A 123 "<>" O SER A 120 " d_HA=2.075 d_AD=2.862 a_DHA=132.985 symop: x,y,z a_YAH=118 1888 1917 " H GLU A 122 "<>" OG SER A 120 " d_HA=2.470 d_AD=3.370 a_DHA=148.913 symop: x,y,z a_YAH=100 a_YAH=134 1888 1932 " H GLU A 123 "<>" OG SER A 120 " d_HA=2.518 d_AD=3.408 a_DHA=146.501 symop: x,y,z a_YAH=129 a_YAH=121 1911 1982 " H ALA A 126 "<>" O GLU A 122 " d_HA=2.104 d_AD=3.055 a_DHA=155.316 symop: x,y,z a_YAH=123 1980 2038 " H PHE A 130 "<>" O ALA A 126 " d_HA=2.263 d_AD=3.242 a_DHA=160.874 symop: x,y,z a_YAH=134 2020 2097 " H ARG A 133 "<>" O ALA A 129 " d_HA=1.910 d_AD=2.920 a_DHA=172.011 symop: x,y,z a_YAH=165 2030 2119 " H GLU A 134 "<>" O PHE A 130 " d_HA=2.006 d_AD=2.986 a_DHA=161.611 symop: x,y,z a_YAH=142 2089 2154 " HE1 TRP A 136 "<>" O ARG A 133 " d_HA=2.595 d_AD=3.363 a_DHA=132.273 symop: x,y,z a_YAH=147 2113 2191 " H LEU A 138 "<>" O GLU A 134 " d_HA=1.956 d_AD=2.941 a_DHA=162.443 symop: x,y,z a_YAH=164 2113 2173 " H TRP A 137 "<>" O GLU A 134 " d_HA=2.662 d_AD=3.344 a_DHA=124.953 symop: x,y,z a_YAH=128 3622 3555 " H ALA A 227 "<>" O ALA A 223 " d_HA=1.837 d_AD=2.803 a_DHA=157.896 symop: x,y,z a_YAH=146 2205 2268 " H LEU A 143 "<>" O GLU A 139 " d_HA=2.057 d_AD=3.014 a_DHA=155.973 symop: x,y,z a_YAH=148 2220 2290 " H PHE A 144 "<>" O ASP A 140 " d_HA=1.805 d_AD=2.769 a_DHA=156.945 symop: x,y,z a_YAH=148 2186 2255 " H ALA A 142 "<>" O LEU A 138 " d_HA=1.829 d_AD=2.833 a_DHA=169.836 symop: x,y,z a_YAH=153 2968 3040 " H TRP A 190 "<>" O ALA A 186 " d_HA=1.812 d_AD=2.787 a_DHA=158.398 symop: x,y,z a_YAH=156 2978 3058 " H LEU A 191 "<>" O PHE A 187 " d_HA=2.030 d_AD=3.047 a_DHA=175.691 symop: x,y,z a_YAH=157 1268 1930 " HH TYR A 82 "<>" OE1 GLU A 123 " d_HA=1.671 d_AD=2.636 a_DHA=168.721 symop: x,y,z a_YAH=109 2117 2178 " HE1 TRP A 137 "<>" OE1 GLU A 134 " d_HA=1.755 d_AD=2.754 a_DHA=165.077 symop: x,y,z a_YAH=115 2117 4538 " HZ1 LYS A 282 "<>" OE1 GLU A 134 " d_HA=1.765 d_AD=2.763 a_DHA=162.815 symop: x,y,z a_YAH=95 3544 3607 " H TRP A 226 "<>" O SER A 222 " d_HA=2.087 d_AD=3.092 a_DHA=171.418 symop: x,y,z a_YAH=154 2951 3005 " HG1 THR A 188 "<>" O HIS A 185 " d_HA=1.780 d_AD=2.746 a_DHA=175.770 symop: x,y,z a_YAH=132 2951 3018 " H GLN A 189 "<>" O HIS A 185 " d_HA=2.006 d_AD=2.958 a_DHA=155.734 symop: x,y,z a_YAH=153 2998 3080 " H PHE A 192 "<>" O THR A 188 " d_HA=1.932 d_AD=2.951 a_DHA=174.950 symop: x,y,z a_YAH=161 3025 1013 "HE22 GLN A 189 "<>" O GLY A 67 " d_HA=2.021 d_AD=3.010 a_DHA=164.885 symop: x,y,z a_YAH=149 3029 3120 " H ARG A 194 "<>" O TRP A 190 " d_HA=1.932 d_AD=2.871 a_DHA=152.218 symop: x,y,z a_YAH=157 3053 3142 " H GLN A 195 "<>" O LEU A 191 " d_HA=1.966 d_AD=2.970 a_DHA=171.193 symop: x,y,z a_YAH=164 3072 3164 " H TRP A 196 "<>" O PHE A 192 " d_HA=1.864 d_AD=2.848 a_DHA=163.634 symop: x,y,z a_YAH=159 3676 4198 " H ARG A 264 "<>" O TRP A 231 " d_HA=1.767 d_AD=2.775 a_DHA=171.378 symop: x,y,z a_YAH=147 3517 3547 " H SER A 222 "<>" O GLU A 220 " d_HA=2.313 d_AD=3.114 a_DHA=135.099 symop: x,y,z a_YAH=99 942 3557 " H ALA A 223 "<>" O PHE A 62 " d_HA=1.865 d_AD=2.863 a_DHA=168.064 symop: x,y,z a_YAH=146 950 793 " H PHE A 62 "<>" O PRO A 51 " d_HA=2.261 d_AD=3.186 a_DHA=150.969 symop: x,y,z a_YAH=137 1034 1093 " H ILE A 72 "<>" O PRO A 69 " d_HA=2.122 d_AD=3.087 a_DHA=157.611 symop: x,y,z a_YAH=107 1088 1626 " HZ1 LYS A 104 "<>" O ILE A 72 " d_HA=1.713 d_AD=2.709 a_DHA=163.879 symop: x,y,z a_YAH=157 1107 3149 "HE22 GLN A 195 "<>" O ASP A 73 " d_HA=1.953 d_AD=2.971 a_DHA=174.417 symop: x,y,z a_YAH=124 1119 1181 " H LEU A 77 "<>" O LEU A 74 " d_HA=2.060 d_AD=2.956 a_DHA=145.921 symop: x,y,z a_YAH=117 1119 1197 " H ALA A 78 "<>" O LEU A 74 " d_HA=2.172 d_AD=3.133 a_DHA=157.143 symop: x,y,z a_YAH=145 1138 1211 " H GLU A 79 "<>" O ARG A 75 " d_HA=1.864 d_AD=2.823 a_DHA=155.501 symop: x,y,z a_YAH=166 767 1025 " H ASN A 68 "<>" O LEU A 49 " d_HA=1.817 d_AD=2.685 a_DHA=141.662 symop: x,y,z a_YAH=164 4169 4225 " H TRP A 265 "<>" O TYR A 263 " d_HA=2.238 d_AD=3.051 a_DHA=136.504 symop: x,y,z a_YAH=101 809 1029 "HD21 ASN A 68 "<>" OG1 THR A 52 " d_HA=2.509 d_AD=3.364 a_DHA=142.268 symop: x,y,z a_YAH=123 a_YAH=105 1023 1057 " H TYR A 70 "<>" OD1 ASN A 68 " d_HA=1.983 d_AD=2.934 a_DHA=154.213 symop: x,y,z a_YAH=141 1048 1628 " HZ3 LYS A 104 "<>" O TYR A 70 " d_HA=2.001 d_AD=2.841 a_DHA=137.763 symop: x,y,z a_YAH=151 412 1158 "HH22 ARG A 75 "<>" OE1 GLU A 28 " d_HA=1.768 d_AD=2.592 a_DHA=134.336 symop: x,y,z a_YAH=93 384 425 " H ALA A 29 "<>" O GLY A 26 " d_HA=2.083 d_AD=2.991 a_DHA=147.844 symop: x,y,z a_YAH=123 384 441 " H ARG A 30 "<>" O GLY A 26 " d_HA=2.747 d_AD=3.643 a_DHA=148.321 symop: x,y,z a_YAH=131 370 1069 " H LEU A 25 "<>" O LEU A 71 " d_HA=1.951 d_AD=2.906 a_DHA=155.769 symop: x,y,z a_YAH=176 3471 4132 "HD22 ASN A 260 "<>" O PHE A 217 " d_HA=2.678 d_AD=3.403 a_DHA=128.401 symop: x,y,z a_YAH=101 4897 5067 "HH21 ARG A 315 "<>" OE2 GLU A 303 " d_HA=1.759 d_AD=2.598 a_DHA=135.287 symop: x,y,z a_YAH=108 6468 6865 "HH21 ARG A 404 "<>" OE2 GLU A 429 " d_HA=2.914 d_AD=3.685 a_DHA=133.403 symop: x,y,z a_YAH=125 1797 1878 " H ALA A 119 "<>" O PHE A 115 " d_HA=1.879 d_AD=2.796 a_DHA=149.397 symop: x,y,z a_YAH=159 1876 1957 " HE ARG A 124 "<>" O ALA A 119 " d_HA=2.162 d_AD=2.835 a_DHA=122.115 symop: x,y,z a_YAH=125 1876 1960 "HH21 ARG A 124 "<>" O ALA A 119 " d_HA=2.112 d_AD=2.814 a_DHA=124.676 symop: x,y,z a_YAH=131 2105 6849 " HE ARG A 133 "<>" OE1 GLU A 428 " d_HA=2.179 d_AD=2.942 a_DHA=130.129 symop: x,y-1,z a_YAH=104 4457 4511 "HH11 ARG A 278 "<>" OE1 GLU A 281 " d_HA=2.128 d_AD=2.969 a_DHA=138.474 symop: x,y,z a_YAH=109 4324 4369 " H SER A 274 "<>" O GLU A 271 " d_HA=2.233 d_AD=3.175 a_DHA=153.551 symop: x,y,z a_YAH=119 2263 2334 " H LEU A 147 "<>" O LEU A 143 " d_HA=1.854 d_AD=2.845 a_DHA=164.306 symop: x,y,z a_YAH=156 2253 2321 " H ALA A 146 "<>" O ALA A 142 " d_HA=2.032 d_AD=2.992 a_DHA=157.363 symop: x,y,z a_YAH=140 2890 2958 " H HIS A 185 "<>" O GLU A 181 " d_HA=2.117 d_AD=3.121 a_DHA=167.471 symop: x,y,z a_YAH=149 2905 2970 " H ALA A 186 "<>" O VAL A 182 " d_HA=2.120 d_AD=3.116 a_DHA=165.768 symop: x,y,z a_YAH=154 2921 2986 " H PHE A 187 "<>" O ALA A 183 " d_HA=1.971 d_AD=2.922 a_DHA=154.727 symop: x,y,z a_YAH=138 2931 3002 " H THR A 188 "<>" O PHE A 184 " d_HA=1.992 d_AD=2.963 a_DHA=157.804 symop: x,y,z a_YAH=156 1746 1823 " H LYS A 116 "<>" O PHE A 112 " d_HA=1.978 d_AD=2.987 a_DHA=172.529 symop: x,y,z a_YAH=155 1790 1860 " H LYS A 118 "<>" O GLY A 114 " d_HA=2.421 d_AD=3.338 a_DHA=150.306 symop: x,y,z a_YAH=131 2106 2118 "HH11 ARG A 133 "<>" OE2 GLU A 134 " d_HA=1.969 d_AD=2.731 a_DHA=129.719 symop: x,y,z a_YAH=116 2107 4578 "HH12 ARG A 133 "<>" OE2 GLU A 285 " d_HA=2.085 d_AD=2.954 a_DHA=141.921 symop: x,y,z a_YAH=104 2109 4578 "HH22 ARG A 133 "<>" OE2 GLU A 285 " d_HA=1.621 d_AD=2.636 a_DHA=171.110 symop: x,y,z a_YAH=146 4540 4577 " HZ3 LYS A 282 "<>" OE1 GLU A 285 " d_HA=1.979 d_AD=2.896 a_DHA=147.591 symop: x,y,z a_YAH=169 4440 4528 " H LYS A 282 "<>" O ARG A 278 " d_HA=2.149 d_AD=3.161 a_DHA=176.586 symop: x,y,z a_YAH=145 4366 4448 " H ARG A 278 "<>" O SER A 274 " d_HA=1.877 d_AD=2.863 a_DHA=162.831 symop: x,y,z a_YAH=146 4250 4330 " H GLU A 271 "<>" O VAL A 267 " d_HA=2.015 d_AD=2.995 a_DHA=161.645 symop: x,y,z a_YAH=157 4266 4354 " H PHE A 273 "<>" O LEU A 268 " d_HA=1.789 d_AD=2.730 a_DHA=152.743 symop: x,y,z a_YAH=155 4238 4308 " H ARG A 270 "<>" O ASP A 266 " d_HA=2.411 d_AD=3.334 a_DHA=151.169 symop: x,y,z a_YAH=139 3756 3799 " H GLY A 238 "<>" O ASP A 235 " d_HA=2.075 d_AD=3.066 a_DHA=163.012 symop: x,y,z a_YAH=117 2232 2307 " H MET A 145 "<>" O TYR A 141 " d_HA=1.874 d_AD=2.884 a_DHA=174.506 symop: x,y,z a_YAH=160 2282 2354 " H LYS A 148 "<>" O PHE A 144 " d_HA=1.817 d_AD=2.803 a_DHA=162.631 symop: x,y,z a_YAH=149 1680 1754 " H PHE A 112 "<>" O LEU A 108 " d_HA=2.004 d_AD=2.978 a_DHA=159.959 symop: x,y,z a_YAH=153 1176 1228 " H ARG A 80 "<>" O LEU A 77 " d_HA=2.049 d_AD=2.975 a_DHA=150.262 symop: x,y,z a_YAH=108 1176 1260 " H TYR A 82 "<>" O LEU A 77 " d_HA=2.055 d_AD=3.045 a_DHA=162.822 symop: x,y,z a_YAH=137 1244 1871 " HZ2 LYS A 118 "<>" O GLY A 81 " d_HA=1.801 d_AD=2.803 a_DHA=166.585 symop: x,y,z a_YAH=141 1195 1245 " H GLY A 81 "<>" O ALA A 78 " d_HA=2.312 d_AD=3.231 a_DHA=150.438 symop: x,y,z a_YAH=101 3092 3178 " H GLY A 197 "<>" O PHE A 193 " d_HA=1.859 d_AD=2.755 a_DHA=145.741 symop: x,y,z a_YAH=132 3112 3186 " H ALA A 198 "<>" O ARG A 194 " d_HA=2.051 d_AD=3.031 a_DHA=163.129 symop: x,y,z a_YAH=151 4522 4579 " H GLU A 285 "<>" O LYS A 282 " d_HA=2.585 d_AD=3.235 a_DHA=121.923 symop: x,y,z a_YAH=90 4522 4593 " H LEU A 286 "<>" O LYS A 282 " d_HA=2.415 d_AD=3.253 a_DHA=139.863 symop: x,y,z a_YAH=143 4464 4546 " H ALA A 283 "<>" O ARG A 279 " d_HA=2.119 d_AD=3.023 a_DHA=147.576 symop: x,y,z a_YAH=132 4377 4472 " H ARG A 279 "<>" O PHE A 275 " d_HA=2.006 d_AD=2.899 a_DHA=145.721 symop: x,y,z a_YAH=135 4190 4271 " H LEU A 268 "<>" O ARG A 264 " d_HA=2.133 d_AD=3.131 a_DHA=166.827 symop: x,y,z a_YAH=157 4190 4254 " H VAL A 267 "<>" O ARG A 264 " d_HA=2.149 d_AD=2.893 a_DHA=128.076 symop: x,y,z a_YAH=114 4214 4291 " H GLU A 269 "<>" O TRP A 265 " d_HA=1.970 d_AD=2.941 a_DHA=159.420 symop: x,y,z a_YAH=145 3759 3789 " H GLU A 237 "<>" OD1 ASP A 235 " d_HA=2.179 d_AD=2.979 a_DHA=134.268 symop: x,y,z a_YAH=100 3759 3813 " H ARG A 239 "<>" OD1 ASP A 235 " d_HA=2.421 d_AD=3.171 a_DHA=129.958 symop: x,y,z a_YAH=147 3760 3821 " HE ARG A 239 "<>" OD2 ASP A 235 " d_HA=2.703 d_AD=3.625 a_DHA=150.390 symop: x,y,z a_YAH=115 3760 3824 "HH21 ARG A 239 "<>" OD2 ASP A 235 " d_HA=2.378 d_AD=3.360 a_DHA=159.383 symop: x,y,z a_YAH=151 3761 3805 " H ASP A 235 "<>" O ARG A 239 " d_HA=2.061 d_AD=3.055 a_DHA=165.114 symop: x,y,z a_YAH=162 2467 3517 " HE1 TRP A 156 "<>" O GLU A 220 " d_HA=1.877 d_AD=2.867 a_DHA=162.378 symop: x,y,z a_YAH=148 2484 3522 "HD21 ASN A 157 "<>" OE2 GLU A 220 " d_HA=1.999 d_AD=2.950 a_DHA=153.911 symop: x,y,z a_YAH=125 2364 3536 " HZ1 LYS A 148 "<>" OD2 ASP A 221 " d_HA=1.672 d_AD=2.633 a_DHA=154.869 symop: x,y,z a_YAH=125 2462 3535 " H TRP A 156 "<>" OD1 ASP A 221 " d_HA=1.997 d_AD=2.992 a_DHA=164.215 symop: x,y,z a_YAH=136 1610 1685 " H LEU A 108 "<>" O LYS A 104 " d_HA=1.976 d_AD=2.727 a_DHA=128.919 symop: x,y,z a_YAH=156 1670 1738 " H ALA A 111 "<>" O ALA A 107 " d_HA=2.377 d_AD=3.354 a_DHA=161.974 symop: x,y,z a_YAH=119 3136 3199 " H LEU A 199 "<>" O GLN A 195 " d_HA=1.834 d_AD=2.812 a_DHA=162.133 symop: x,y,z a_YAH=144 3153 3219 " H LYS A 200 "<>" O TRP A 196 " d_HA=1.799 d_AD=2.730 a_DHA=150.760 symop: x,y,z a_YAH=147 3169 4588 " HE1 TRP A 196 "<>" O LEU A 286 " d_HA=1.981 d_AD=2.944 a_DHA=156.573 symop: x,y,z a_YAH=106 3452 4482 "HH12 ARG A 279 "<>" O ILE A 216 " d_HA=2.204 d_AD=3.114 a_DHA=149.642 symop: x,y,z a_YAH=121 3452 4186 " HH TYR A 263 "<>" O ILE A 216 " d_HA=1.570 d_AD=2.530 a_DHA=170.892 symop: x,y,z a_YAH=157 1536 1597 " H TRP A 103 "<>" O LEU A 100 " d_HA=2.531 d_AD=3.302 a_DHA=132.152 symop: x,y,z a_YAH=90 1536 1616 " H LYS A 104 "<>" O LEU A 100 " d_HA=1.912 d_AD=2.794 a_DHA=143.504 symop: x,y,z a_YAH=134 315 395 " HH TYR A 20 "<>" OE1 GLN A 27 " d_HA=2.854 d_AD=3.510 a_DHA=126.784 symop: -x+1,y,-z+1 a_YAH=137 391 462 " H ASP A 31 "<>" O GLN A 27 " d_HA=1.741 d_AD=2.691 a_DHA=154.449 symop: x,y,z a_YAH=155 527 460 "HH21 ARG A 34 "<>" OD1 ASP A 31 " d_HA=1.574 d_AD=2.568 a_DHA=160.660 symop: x,y,z a_YAH=126 423 494 " H LEU A 33 "<>" O ALA A 29 " d_HA=1.852 d_AD=2.816 a_DHA=155.938 symop: x,y,z a_YAH=143 3426 3412 " H MET A 214 "<>" OD1 ASP A 213 " d_HA=2.204 d_AD=2.891 a_DHA=123.010 symop: x,y,z a_YAH=114 3426 4679 " H MET A 214 "<>" O ARG A 291 " d_HA=2.155 d_AD=2.903 a_DHA=128.404 symop: x,y,z a_YAH=130 3421 4727 " H ASP A 293 "<>" O MET A 214 " d_HA=2.366 d_AD=3.202 a_DHA=139.795 symop: x,y,z a_YAH=132 3438 4482 "HH12 ARG A 279 "<>" O PRO A 215 " d_HA=2.652 d_AD=3.397 a_DHA=130.832 symop: x,y,z a_YAH=150 3438 4484 "HH22 ARG A 279 "<>" O PRO A 215 " d_HA=1.669 d_AD=2.665 a_DHA=166.085 symop: x,y,z a_YAH=144 3457 4722 " H ILE A 216 "<>" O ASP A 293 " d_HA=2.210 d_AD=3.195 a_DHA=160.854 symop: x,y,z a_YAH=140 4856 5096 " H TYR A 301 "<>" O VAL A 317 " d_HA=1.823 d_AD=2.800 a_DHA=160.146 symop: x,y,z a_YAH=153 5100 4847 " H VAL A 317 "<>" O TYR A 301 " d_HA=1.829 d_AD=2.772 a_DHA=152.640 symop: x,y,z a_YAH=152 2688 2771 "HH11 ARG A 172 "<>" O GLU A 168 " d_HA=1.968 d_AD=2.958 a_DHA=165.708 symop: x,y,z a_YAH=101 2688 2762 " H ARG A 172 "<>" O GLU A 168 " d_HA=2.238 d_AD=3.088 a_DHA=140.180 symop: x,y,z a_YAH=139 2703 2762 " H ARG A 172 "<>" O LYS A 169 " d_HA=2.201 d_AD=2.873 a_DHA=122.126 symop: x,y,z a_YAH=106 2703 2784 " H GLU A 173 "<>" O LYS A 169 " d_HA=1.832 d_AD=2.840 a_DHA=174.594 symop: x,y,z a_YAH=173 2754 2828 " H SER A 176 "<>" O ARG A 172 " d_HA=1.890 d_AD=2.871 a_DHA=162.407 symop: x,y,z a_YAH=149 6830 6881 " H GLU A 430 "<>" O GLU A 427 " d_HA=2.756 d_AD=3.645 a_DHA=147.024 symop: x,y,z a_YAH=91 6501 6547 " H THR A 407 "<>" OE2 GLU A 410 " d_HA=1.751 d_AD=2.742 a_DHA=162.268 symop: x,y,z a_YAH=147 6504 6547 " HG1 THR A 407 "<>" OE2 GLU A 410 " d_HA=2.668 d_AD=3.534 a_DHA=148.758 symop: x,y,z a_YAH=94 2570 2679 " H GLU A 167 "<>" O PRO A 162 " d_HA=1.826 d_AD=2.816 a_DHA=164.881 symop: x,y,z a_YAH=166 2673 2740 " H LEU A 171 "<>" O GLU A 167 " d_HA=1.909 d_AD=2.922 a_DHA=174.293 symop: x,y,z a_YAH=166 2725 2795 " H ALA A 174 "<>" O ALA A 170 " d_HA=2.035 d_AD=2.995 a_DHA=157.332 symop: x,y,z a_YAH=148 2735 2809 " H LYS A 175 "<>" O LEU A 171 " d_HA=2.364 d_AD=3.292 a_DHA=152.266 symop: x,y,z a_YAH=121 2793 2851 " H LEU A 178 "<>" O ALA A 174 " d_HA=2.097 d_AD=3.030 a_DHA=152.098 symop: x,y,z a_YAH=147 2846 2909 " H VAL A 182 "<>" O LEU A 178 " d_HA=1.906 d_AD=2.846 a_DHA=152.287 symop: x,y,z a_YAH=163 2865 2923 " H ALA A 183 "<>" O ALA A 179 " d_HA=2.053 d_AD=2.997 a_DHA=154.209 symop: x,y,z a_YAH=134 1817 1959 "HH12 ARG A 124 "<>" O LYS A 116 " d_HA=1.868 d_AD=2.803 a_DHA=152.439 symop: x,y,z a_YAH=105 1817 1961 "HH22 ARG A 124 "<>" O LYS A 116 " d_HA=2.015 d_AD=2.883 a_DHA=142.191 symop: x,y,z a_YAH=113 6497 6563 " H LYS A 411 "<>" O THR A 407 " d_HA=2.130 d_AD=3.144 a_DHA=174.820 symop: x,y,z a_YAH=163 6511 6581 " H ALA A 412 "<>" O PRO A 408 " d_HA=2.168 d_AD=3.125 a_DHA=156.859 symop: x,y,z a_YAH=145 6499 6532 " H HIS A 409 "<>" OG1 THR A 407 " d_HA=2.973 d_AD=3.617 a_DHA=122.749 symop: x,y,z a_YAH=105 a_YAH=133 2537 2589 " H LEU A 163 "<>" O PRO A 160 " d_HA=2.029 d_AD=2.880 a_DHA=140.120 symop: x,y,z a_YAH=128 2537 2611 " H ARG A 164 "<>" O PRO A 160 " d_HA=1.971 d_AD=2.967 a_DHA=166.101 symop: x,y,z a_YAH=145 2551 2633 " H LYS A 165 "<>" O LEU A 161 " d_HA=1.900 d_AD=2.884 a_DHA=162.954 symop: x,y,z a_YAH=152 2584 2657 " H ARG A 166 "<>" O LEU A 163 " d_HA=2.310 d_AD=3.189 a_DHA=144.846 symop: x,y,z a_YAH=94 2584 3612 " HE1 TRP A 226 "<>" O LEU A 163 " d_HA=1.889 d_AD=2.848 a_DHA=155.259 symop: x,y,z a_YAH=142 2875 2939 " H PHE A 184 "<>" O GLU A 180 " d_HA=1.881 d_AD=2.771 a_DHA=144.589 symop: x,y,z a_YAH=143 1766 1845 " H GLU A 117 "<>" O ARG A 113 " d_HA=2.300 d_AD=3.219 a_DHA=150.439 symop: x,y,z a_YAH=153 4421 4513 " H GLU A 281 "<>" O ILE A 277 " d_HA=1.888 d_AD=2.829 a_DHA=153.054 symop: x,y,z a_YAH=151 4346 4408 " H TRP A 276 "<>" O PHE A 273 " d_HA=2.166 d_AD=2.886 a_DHA=126.564 symop: x,y,z a_YAH=122 4346 4426 " H ILE A 277 "<>" O PHE A 273 " d_HA=1.932 d_AD=2.944 a_DHA=173.557 symop: x,y,z a_YAH=157 4285 4340 " H GLY A 272 "<>" O GLU A 269 " d_HA=2.139 d_AD=3.043 a_DHA=147.283 symop: x,y,z a_YAH=109 2620 3783 "HH11 ARG A 164 "<>" O GLU A 237 " d_HA=2.184 d_AD=3.106 a_DHA=149.823 symop: x,y,z a_YAH=117 2451 2524 " H TRP A 159 "<>" O TRP A 156 " d_HA=2.057 d_AD=3.016 a_DHA=157.358 symop: x,y,z a_YAH=116 2319 2379 " H ALA A 150 "<>" O ALA A 146 " d_HA=1.951 d_AD=2.923 a_DHA=159.735 symop: x,y,z a_YAH=143 2329 2394 " H HIS A 151 "<>" O LEU A 147 " d_HA=1.904 d_AD=2.884 a_DHA=161.499 symop: x,y,z a_YAH=160 2302 2371 " H GLY A 149 "<>" O MET A 145 " d_HA=1.917 d_AD=2.899 a_DHA=161.890 symop: x,y,z a_YAH=146 1699 1774 " H ARG A 113 "<>" O LYS A 109 " d_HA=2.254 d_AD=3.218 a_DHA=157.590 symop: x,y,z a_YAH=141 1721 1791 " H GLY A 114 "<>" O GLU A 110 " d_HA=1.808 d_AD=2.816 a_DHA=174.860 symop: x,y,z a_YAH=164 3177 3237 " H ALA A 201 "<>" O GLY A 197 " d_HA=2.309 d_AD=3.296 a_DHA=164.108 symop: x,y,z a_YAH=137 3230 3275 " HZ2 LYS A 200 "<>" OE2 GLU A 204 " d_HA=1.786 d_AD=2.599 a_DHA=133.616 symop: x,y,z a_YAH=133 4507 4579 " H GLU A 285 "<>" O GLU A 281 " d_HA=2.277 d_AD=3.151 a_DHA=143.849 symop: x,y,z a_YAH=147 4544 4593 " H LEU A 286 "<>" O ALA A 283 " d_HA=2.245 d_AD=3.008 a_DHA=131.176 symop: x,y,z a_YAH=105 4544 4615 " H PHE A 287 "<>" O ALA A 283 " d_HA=1.863 d_AD=2.851 a_DHA=163.203 symop: x,y,z a_YAH=164 4488 4559 " H LEU A 284 "<>" O LEU A 280 " d_HA=1.972 d_AD=2.984 a_DHA=172.879 symop: x,y,z a_YAH=157 4397 4493 " H LEU A 280 "<>" O TRP A 276 " d_HA=1.817 d_AD=2.787 a_DHA=159.756 symop: x,y,z a_YAH=154 2366 2418 " HZ3 LYS A 148 "<>" O LEU A 154 " d_HA=1.753 d_AD=2.742 a_DHA=163.729 symop: x,y,z a_YAH=113 2418 2529 " HE1 TRP A 159 "<>" O LEU A 154 " d_HA=2.403 d_AD=3.251 a_DHA=140.863 symop: x,y,z a_YAH=117 2437 2497 " H ARG A 158 "<>" O PRO A 155 " d_HA=2.182 d_AD=3.071 a_DHA=144.909 symop: x,y,z a_YAH=117 2348 2423 " H LEU A 154 "<>" O LYS A 148 " d_HA=2.965 d_AD=3.636 a_DHA=124.497 symop: x,y,z a_YAH=147 2348 2412 " H GLY A 153 "<>" O LYS A 148 " d_HA=2.180 d_AD=2.888 a_DHA=125.411 symop: x,y,z a_YAH=146 2365 2411 " HZ2 LYS A 148 "<>" O GLY A 153 " d_HA=2.977 d_AD=3.607 a_DHA=121.500 symop: x,y,z a_YAH=104 1632 1705 " H LYS A 109 "<>" O TRP A 105 " d_HA=2.105 d_AD=3.083 a_DHA=161.038 symop: x,y,z a_YAH=150 1632 1685 " H LEU A 108 "<>" O TRP A 105 " d_HA=2.546 d_AD=3.310 a_DHA=132.160 symop: x,y,z a_YAH=90 1656 1727 " H GLU A 110 "<>" O PRO A 106 " d_HA=1.964 d_AD=2.916 a_DHA=154.939 symop: x,y,z a_YAH=157 1307 3249 "HH21 ARG A 84 "<>" OE1 GLU A 202 " d_HA=1.671 d_AD=2.647 a_DHA=157.513 symop: -x+1,y,-z+1 a_YAH=135 3184 3251 " H GLU A 202 "<>" O ALA A 198 " d_HA=1.894 d_AD=2.878 a_DHA=162.479 symop: x,y,z a_YAH=156 3235 3287 " H ALA A 205 "<>" O ALA A 201 " d_HA=1.900 d_AD=2.832 a_DHA=151.650 symop: x,y,z a_YAH=141 3245 3300 " H LEU A 206 "<>" O GLU A 202 " d_HA=2.108 d_AD=3.088 a_DHA=161.920 symop: x,y,z a_YAH=135 3194 3262 " H ALA A 203 "<>" O LEU A 199 " d_HA=2.269 d_AD=3.160 a_DHA=146.080 symop: x,y,z a_YAH=133 3213 3276 " H GLU A 204 "<>" O LYS A 200 " d_HA=1.796 d_AD=2.782 a_DHA=162.404 symop: x,y,z a_YAH=153 5134 5159 " H GLY A 321 "<>" O ALA A 319 " d_HA=1.985 d_AD=2.878 a_DHA=144.391 symop: x,y,z a_YAH=103 1555 1643 " H TRP A 105 "<>" O TYR A 101 " d_HA=2.851 d_AD=3.640 a_DHA=135.297 symop: x,y,z a_YAH=122 1586 1672 " H ALA A 107 "<>" O TRP A 103 " d_HA=1.959 d_AD=2.952 a_DHA=165.065 symop: x,y,z a_YAH=158 1597 1517 " H TRP A 103 "<>" O LEU A 99 " d_HA=2.099 d_AD=2.846 a_DHA=128.419 symop: x,y,z a_YAH=144 1335 1602 " HE1 TRP A 103 "<>" OE1 GLU A 86 " d_HA=2.343 d_AD=3.274 a_DHA=150.841 symop: x,y,z a_YAH=116 433 516 " H ARG A 34 "<>" O ARG A 30 " d_HA=1.943 d_AD=2.828 a_DHA=144.234 symop: x,y,z a_YAH=138 3388 677 " H ILE A 211 "<>" O TRP A 44 " d_HA=1.752 d_AD=2.702 a_DHA=155.327 symop: x,y,z a_YAH=155 3383 722 " H VAL A 46 "<>" O ILE A 211 " d_HA=2.001 d_AD=2.960 a_DHA=156.722 symop: x,y,z a_YAH=168 3402 4687 " H ARG A 291 "<>" O GLY A 212 " d_HA=1.884 d_AD=2.886 a_DHA=167.620 symop: x,y,z a_YAH=130 3403 4644 " H GLY A 212 "<>" O LEU A 289 " d_HA=1.977 d_AD=2.950 a_DHA=161.503 symop: x,y,z a_YAH=159 4663 5440 " H LEU A 338 "<>" O VAL A 290 " d_HA=1.770 d_AD=2.780 a_DHA=173.868 symop: x,y,z a_YAH=131 4708 5435 " H ILE A 292 "<>" O LEU A 338 " d_HA=2.221 d_AD=3.080 a_DHA=141.643 symop: x,y,z a_YAH=171 4751 4810 " H PHE A 298 "<>" O PHE A 295 " d_HA=2.061 d_AD=3.070 a_DHA=172.409 symop: x,y,z a_YAH=134 4828 4771 " H GLU A 299 "<>" O ARG A 296 " d_HA=2.128 d_AD=3.011 a_DHA=144.899 symop: x,y,z a_YAH=116 4839 4771 " H ALA A 300 "<>" O ARG A 296 " d_HA=2.051 d_AD=3.054 a_DHA=171.708 symop: x,y,z a_YAH=165 4822 5136 " H ALA A 319 "<>" O GLU A 299 " d_HA=1.830 d_AD=2.840 a_DHA=175.563 symop: x,y,z a_YAH=126 6542 6614 " H MET A 414 "<>" O GLU A 410 " d_HA=1.825 d_AD=2.782 a_DHA=155.218 symop: x,y,z a_YAH=153 2778 2838 " H ALA A 177 "<>" O GLU A 173 " d_HA=1.987 d_AD=2.916 a_DHA=150.937 symop: x,y,z a_YAH=144 2825 2867 " H ALA A 179 "<>" O SER A 176 " d_HA=2.611 d_AD=3.600 a_DHA=165.981 symop: x,y,z a_YAH=95 6814 6879 " H ARG A 426 "<>" OE1 GLU A 430 " d_HA=2.134 d_AD=3.116 a_DHA=160.912 symop: x,y,z a_YAH=117 6786 6823 "HH11 ARG A 426 "<>" O PHE A 425 " d_HA=1.845 d_AD=2.740 a_DHA=145.103 symop: x,y,z a_YAH=103 6557 6628 " H ALA A 415 "<>" O LYS A 411 " d_HA=2.394 d_AD=3.395 a_DHA=167.868 symop: x,y,z a_YAH=135 6525 6597 " H PHE A 413 "<>" O HIS A 409 " d_HA=1.777 d_AD=2.772 a_DHA=165.621 symop: x,y,z a_YAH=166 1782 7885 " HE ARG A 113 "<>" O GLU A 495 " d_HA=2.720 d_AD=3.580 a_DHA=143.566 symop: x+1/2,y-1/2,z a_YAH=146 7885 7930 " H GLU A 498 "<>" O GLU A 495 " d_HA=2.133 d_AD=3.083 a_DHA=155.348 symop: x,y,z a_YAH=110 1785 7885 "HH21 ARG A 113 "<>" O GLU A 495 " d_HA=2.667 d_AD=3.500 a_DHA=140.728 symop: x+1/2,y-1/2,z a_YAH=99 5258 5335 " H VAL A 331 "<>" O LYS A 327 " d_HA=2.033 d_AD=2.980 a_DHA=153.975 symop: x,y,z a_YAH=148 2513 2619 " HE ARG A 164 "<>" O TRP A 159 " d_HA=2.282 d_AD=3.068 a_DHA=133.776 symop: x,y,z a_YAH=133 2513 2622 "HH21 ARG A 164 "<>" O TRP A 159 " d_HA=1.860 d_AD=2.797 a_DHA=151.490 symop: x,y,z a_YAH=139 2370 2405 " H GLY A 152 "<>" O GLY A 149 " d_HA=2.526 d_AD=3.235 a_DHA=126.781 symop: x,y,z a_YAH=124 1726 1784 "HH12 ARG A 113 "<>" OE2 GLU A 110 " d_HA=1.686 d_AD=2.587 a_DHA=143.914 symop: x,y,z a_YAH=125 1786 7890 "HH22 ARG A 113 "<>" OE2 GLU A 495 " d_HA=2.264 d_AD=2.975 a_DHA=125.621 symop: x+1/2,y-1/2,z a_YAH=124 3275 4640 " HE2 HIS A 288 "<>" OE2 GLU A 204 " d_HA=2.830 d_AD=3.613 a_DHA=134.025 symop: x,y,z a_YAH=94 5280 5355 " H PHE A 332 "<>" O ILE A 328 " d_HA=1.917 d_AD=2.932 a_DHA=174.343 symop: x,y,z a_YAH=169 5202 5285 " H ILE A 328 "<>" O LEU A 324 " d_HA=1.913 d_AD=2.901 a_DHA=161.846 symop: x,y,z a_YAH=151 5144 5207 " H LEU A 324 "<>" O PRO A 320 " d_HA=1.862 d_AD=2.867 a_DHA=168.024 symop: x,y,z a_YAH=154 5180 5247 " H GLN A 326 "<>" O LYS A 323 " d_HA=2.648 d_AD=3.296 a_DHA=121.704 symop: x,y,z a_YAH=93 5180 5264 " H LYS A 327 "<>" O LYS A 323 " d_HA=2.090 d_AD=3.090 a_DHA=167.516 symop: x,y,z a_YAH=154 2387 2423 " H LEU A 154 "<>" O HIS A 151 " d_HA=2.286 d_AD=3.104 a_DHA=136.949 symop: x,y,z a_YAH=115 3260 3326 " H ILE A 208 "<>" O ALA A 203 " d_HA=1.946 d_AD=2.800 a_DHA=139.340 symop: x,y,z a_YAH=145 3270 3315 " H GLY A 207 "<>" O GLU A 204 " d_HA=2.699 d_AD=3.603 a_DHA=148.803 symop: x,y,z a_YAH=99 3369 4630 " H ILE A 210 "<>" ND1 HIS A 288 " d_HA=1.875 d_AD=2.823 a_DHA=155.720 symop: x,y,z a_YAH=128 a_YAH=98 4667 5405 " H VAL A 290 "<>" O PRO A 336 " d_HA=1.998 d_AD=3.002 a_DHA=165.815 symop: x,y,z a_YAH=162 5158 5229 " H PHE A 325 "<>" O GLY A 321 " d_HA=1.991 d_AD=3.007 a_DHA=175.982 symop: x,y,z a_YAH=163 632 3348 " H ARG A 209 "<>" O ARG A 42 " d_HA=1.843 d_AD=2.824 a_DHA=162.515 symop: x,y,z a_YAH=143 3340 688 " H TRP A 44 "<>" O ARG A 209 " d_HA=2.058 d_AD=3.032 a_DHA=159.063 symop: x,y,z a_YAH=136 3364 4634 " H HIS A 288 "<>" O ILE A 210 " d_HA=1.962 d_AD=2.904 a_DHA=153.212 symop: x,y,z a_YAH=141 3364 4649 " H LEU A 289 "<>" O ILE A 210 " d_HA=2.474 d_AD=3.388 a_DHA=149.550 symop: x,y,z a_YAH=152 5682 6185 "HH12 ARG A 386 "<>" OD1 ASP A 354 " d_HA=2.286 d_AD=3.289 a_DHA=167.861 symop: x,y,z a_YAH=154 5682 6187 "HH22 ARG A 386 "<>" OD1 ASP A 354 " d_HA=2.772 d_AD=3.652 a_DHA=146.049 symop: x,y,z a_YAH=126 5682 6156 " HE2 HIS A 384 "<>" OD1 ASP A 354 " d_HA=2.997 d_AD=3.663 a_DHA=123.832 symop: x,y,z a_YAH=119 6186 2783 "HH21 ARG A 386 "<>" OE2 GLU A 173 " d_HA=1.939 d_AD=2.862 a_DHA=147.967 symop: x-1/2,y+1/2,z a_YAH=99 37 7126 "HH11 ARG A 445 "<>" O LEU A 3 " d_HA=1.767 d_AD=2.749 a_DHA=161.754 symop: x,y,z a_YAH=130 6589 6669 " H TYR A 417 "<>" O PHE A 413 " d_HA=2.030 d_AD=2.918 a_DHA=144.959 symop: x,y,z a_YAH=137 6146 6175 " H ARG A 386 "<>" ND1 HIS A 384 " d_HA=2.113 d_AD=2.989 a_DHA=143.782 symop: x,y,z a_YAH=119 a_YAH=133 6160 7117 " H ARG A 445 "<>" O GLY A 385 " d_HA=1.875 d_AD=2.864 a_DHA=165.264 symop: x,y,z a_YAH=140 6160 6195 " H VAL A 387 "<>" O GLY A 385 " d_HA=1.858 d_AD=2.750 a_DHA=145.255 symop: x,y,z a_YAH=105 651 7939 "HH21 ARG A 42 "<>" O ARG A 499 " d_HA=1.960 d_AD=2.898 a_DHA=152.398 symop: x,y,z a_YAH=121 6774 6824 "HH12 ARG A 426 "<>" OG1 THR A 424 " d_HA=2.022 d_AD=2.979 a_DHA=157.284 symop: x,y,z a_YAH=126 a_YAH=114 6626 6702 " H ALA A 419 "<>" O ALA A 415 " d_HA=2.168 d_AD=3.108 a_DHA=154.245 symop: x,y,z a_YAH=137 6579 6644 " H ARG A 416 "<>" O ALA A 412 " d_HA=1.971 d_AD=2.958 a_DHA=162.857 symop: x,y,z a_YAH=158 6119 6161 " H GLY A 385 "<>" O PRO A 382 " d_HA=2.253 d_AD=3.180 a_DHA=151.825 symop: x,y,z a_YAH=115 88 7072 "HH12 ARG A 5 "<>" O SER A 442 " d_HA=2.189 d_AD=3.041 a_DHA=141.201 symop: x,y,z a_YAH=136 90 7072 "HH22 ARG A 5 "<>" O SER A 442 " d_HA=1.814 d_AD=2.784 a_DHA=158.389 symop: x,y,z a_YAH=145 7099 7959 "HH22 ARG A 499 "<>" O ALA A 444 " d_HA=1.738 d_AD=2.741 a_DHA=167.906 symop: x,y,z a_YAH=151 7099 7957 "HH12 ARG A 499 "<>" O ALA A 444 " d_HA=2.283 d_AD=3.114 a_DHA=138.445 symop: x,y,z a_YAH=142 86 7910 " HE ARG A 5 "<>" O THR A 497 " d_HA=2.153 d_AD=3.155 a_DHA=167.267 symop: x,y,z a_YAH=165 89 7910 "HH21 ARG A 5 "<>" O THR A 497 " d_HA=2.971 d_AD=3.754 a_DHA=135.364 symop: x,y,z a_YAH=142 7875 7969 " H LEU A 500 "<>" O ALA A 494 " d_HA=2.774 d_AD=3.461 a_DHA=125.934 symop: x,y,z a_YAH=126 7875 7947 " H ARG A 499 "<>" O ALA A 494 " d_HA=1.787 d_AD=2.757 a_DHA=158.460 symop: x,y,z a_YAH=168 5299 5368 " H GLY A 333 "<>" O GLN A 329 " d_HA=2.117 d_AD=2.828 a_DHA=125.319 symop: x,y,z a_YAH=126 5241 5322 " H GLU A 330 "<>" O GLN A 326 " d_HA=1.903 d_AD=2.874 a_DHA=158.214 symop: x,y,z a_YAH=157 6053 6107 " H TYR A 381 "<>" O PRO A 378 " d_HA=2.575 d_AD=3.549 a_DHA=160.994 symop: x,y,z a_YAH=100 7033 7958 "HH21 ARG A 499 "<>" O MET A 440 " d_HA=1.982 d_AD=2.840 a_DHA=141.196 symop: x,y,z a_YAH=109 7033 7955 " HE ARG A 499 "<>" O MET A 440 " d_HA=2.326 d_AD=3.080 a_DHA=130.952 symop: x,y,z a_YAH=92 7858 7914 " H THR A 497 "<>" O MET A 493 " d_HA=1.900 d_AD=2.797 a_DHA=145.447 symop: x,y,z a_YAH=155 7858 7917 " HG1 THR A 497 "<>" O MET A 493 " d_HA=1.600 d_AD=2.562 a_DHA=169.000 symop: x,y,z a_YAH=129 7848 7902 " H ALA A 496 "<>" O ALA A 492 " d_HA=1.911 d_AD=2.914 a_DHA=168.970 symop: x,y,z a_YAH=160 5221 5305 " H GLN A 329 "<>" O PHE A 325 " d_HA=1.907 d_AD=2.899 a_DHA=163.838 symop: x,y,z a_YAH=142 5165 5247 " H GLN A 326 "<>" O GLU A 322 " d_HA=2.210 d_AD=3.082 a_DHA=143.154 symop: x,y,z a_YAH=143 6722 7067 " HZ2 LYS A 441 "<>" O TRP A 421 " d_HA=1.800 d_AD=2.675 a_DHA=141.453 symop: x,y,z a_YAH=151 5389 5423 " H VAL A 337 "<>" O VAL A 335 " d_HA=1.950 d_AD=2.878 a_DHA=151.228 symop: x,y,z a_YAH=98 6660 6733 " H TRP A 421 "<>" O TYR A 417 " d_HA=2.657 d_AD=3.399 a_DHA=130.274 symop: x,y,z a_YAH=140 6681 6733 " H TRP A 421 "<>" O LEU A 418 " d_HA=2.188 d_AD=3.015 a_DHA=137.908 symop: x,y,z a_YAH=103 6681 6758 " H ILE A 423 "<>" O LEU A 418 " d_HA=1.934 d_AD=2.857 a_DHA=149.647 symop: x,y,z a_YAH=133 6747 6700 " H GLY A 422 "<>" O ALA A 419 " d_HA=1.935 d_AD=2.917 a_DHA=160.681 symop: x,y,z a_YAH=120 5655 5747 " H LEU A 358 "<>" O ARG A 353 " d_HA=1.882 d_AD=2.862 a_DHA=161.228 symop: x,y,z a_YAH=161 5655 5723 " H PHE A 356 "<>" O ARG A 353 " d_HA=2.868 d_AD=3.675 a_DHA=136.929 symop: x,y,z a_YAH=101 5626 5699 " H ARG A 355 "<>" O ALA A 351 " d_HA=1.852 d_AD=2.741 a_DHA=143.680 symop: x,y,z a_YAH=148 5636 5723 " H PHE A 356 "<>" O LEU A 352 " d_HA=2.574 d_AD=3.484 a_DHA=149.034 symop: x,y,z a_YAH=154 5663 5595 " H ARG A 353 "<>" O VAL A 349 " d_HA=1.832 d_AD=2.847 a_DHA=175.992 symop: x,y,z a_YAH=163 5580 5641 " H LEU A 352 "<>" O GLU A 348 " d_HA=2.186 d_AD=3.150 a_DHA=157.463 symop: x,y,z a_YAH=127 5611 5684 " H ASP A 354 "<>" O GLU A 350 " d_HA=1.883 d_AD=2.876 a_DHA=165.186 symop: x,y,z a_YAH=155 6700 6747 " H GLY A 422 "<>" O ALA A 419 " d_HA=1.935 d_AD=2.917 a_DHA=160.681 symop: x,y,z a_YAH=120 6636 6715 " H ASP A 420 "<>" O ARG A 416 " d_HA=2.613 d_AD=3.606 a_DHA=166.603 symop: x,y,z a_YAH=135 5566 5628 " H ALA A 351 "<>" O PRO A 347 " d_HA=1.788 d_AD=2.788 a_DHA=168.079 symop: x,y,z a_YAH=155 5674 5683 "HH21 ARG A 353 "<>" OD2 ASP A 354 " d_HA=1.691 d_AD=2.713 a_DHA=171.338 symop: x,y,z a_YAH=138 5776 6167 " H GLY A 360 "<>" O ARG A 386 " d_HA=2.437 d_AD=3.378 a_DHA=154.254 symop: x,y,z a_YAH=119 6191 7138 " H LEU A 446 "<>" O VAL A 387 " d_HA=2.769 d_AD=3.769 a_DHA=171.600 symop: x,y,z a_YAH=148 7109 7957 "HH12 ARG A 499 "<>" O ARG A 445 " d_HA=2.048 d_AD=2.764 a_DHA=125.693 symop: x,y,z a_YAH=106 94 7154 " H ALA A 447 "<>" O ALA A 6 " d_HA=2.322 d_AD=3.152 a_DHA=138.494 symop: x,y,z a_YAH=135 94 7956 "HH11 ARG A 499 "<>" O ALA A 6 " d_HA=2.159 d_AD=2.817 a_DHA=121.421 symop: x,y,z a_YAH=101 96 7109 " H ALA A 6 "<>" O ARG A 445 " d_HA=1.881 d_AD=2.854 a_DHA=159.874 symop: x,y,z a_YAH=156 104 640 " H ARG A 42 "<>" O PHE A 7 " d_HA=2.372 d_AD=3.329 a_DHA=157.279 symop: x,y,z a_YAH=164 104 665 " H TYR A 43 "<>" O PHE A 7 " d_HA=2.814 d_AD=3.589 a_DHA=133.962 symop: x,y,z a_YAH=132 571 619 " H GLY A 40 "<>" O LYS A 37 " d_HA=2.008 d_AD=2.848 a_DHA=139.082 symop: x,y,z a_YAH=98 593 7841 "HH11 ARG A 491 "<>" O GLU A 38 " d_HA=2.094 d_AD=2.942 a_DHA=139.539 symop: x,y,z a_YAH=138 5816 6000 " HZ2 LYS A 362 "<>" O PRO A 375 " d_HA=1.919 d_AD=2.905 a_DHA=160.031 symop: x,y,z a_YAH=136 6227 7133 " H VAL A 389 "<>" O LEU A 446 " d_HA=1.967 d_AD=2.973 a_DHA=170.690 symop: x,y,z a_YAH=151 7824 7891 " H GLU A 495 "<>" O ARG A 491 " d_HA=1.902 d_AD=2.893 a_DHA=162.844 symop: x,y,z a_YAH=158 6034 6089 " H ASN A 380 "<>" O LEU A 377 " d_HA=1.875 d_AD=2.851 a_DHA=160.780 symop: x,y,z a_YAH=129 7007 7075 " H SER A 442 "<>" O LEU A 438 " d_HA=2.678 d_AD=3.389 a_DHA=127.407 symop: x,y,z a_YAH=144 7026 7958 "HH21 ARG A 499 "<>" O GLY A 439 " d_HA=2.847 d_AD=3.535 a_DHA=125.888 symop: x,y,z a_YAH=124 7026 7075 " H SER A 442 "<>" O GLY A 439 " d_HA=2.480 d_AD=3.369 a_DHA=146.366 symop: x,y,z a_YAH=103 7026 7079 " HG SER A 442 "<>" O GLY A 439 " d_HA=1.668 d_AD=2.647 a_DHA=178.267 symop: x,y,z a_YAH=150 7074 7101 " H ALA A 444 "<>" OG SER A 442 " d_HA=2.535 d_AD=3.341 a_DHA=136.975 symop: x,y,z a_YAH=94 a_YAH=146 6973 7038 " H MET A 440 "<>" O MET A 436 " d_HA=2.199 d_AD=3.106 a_DHA=148.122 symop: x,y,z a_YAH=148 6973 7195 " HH TYR A 449 "<>" O MET A 436 " d_HA=1.614 d_AD=2.582 a_DHA=174.638 symop: x,y,z a_YAH=141 6990 7056 " H LYS A 441 "<>" O HIS A 437 " d_HA=2.106 d_AD=3.086 a_DHA=160.216 symop: x,y,z a_YAH=156 7805 7877 " H ALA A 494 "<>" O LEU A 490 " d_HA=1.891 d_AD=2.904 a_DHA=173.115 symop: x,y,z a_YAH=155 7771 7850 " H ALA A 492 "<>" O ALA A 488 " d_HA=1.947 d_AD=2.885 a_DHA=153.698 symop: x,y,z a_YAH=142 7781 7863 " H MET A 493 "<>" O ARG A 489 " d_HA=2.687 d_AD=3.679 a_DHA=167.498 symop: x,y,z a_YAH=133 5986 6039 " H LEU A 377 "<>" O ASN A 374 " d_HA=1.845 d_AD=2.829 a_DHA=161.136 symop: x,y,z a_YAH=133 6944 7012 " H LEU A 438 "<>" O ALA A 434 " d_HA=1.946 d_AD=2.938 a_DHA=163.894 symop: x,y,z a_YAH=149 5947 5991 " H ASN A 374 "<>" O GLY A 371 " d_HA=2.023 d_AD=3.015 a_DHA=164.919 symop: x,y,z a_YAH=129 6609 6686 " H LEU A 418 "<>" O MET A 414 " d_HA=1.761 d_AD=2.769 a_DHA=172.323 symop: x,y,z a_YAH=167 5679 5736 " H GLY A 357 "<>" O ASP A 354 " d_HA=2.061 d_AD=3.009 a_DHA=154.567 symop: x,y,z a_YAH=102 5595 5663 " H ARG A 353 "<>" O VAL A 349 " d_HA=1.832 d_AD=2.847 a_DHA=175.992 symop: x,y,z a_YAH=163 5456 5761 " H ALA A 339 "<>" O PRO A 359 " d_HA=1.860 d_AD=2.851 a_DHA=163.806 symop: x,y,z a_YAH=170 688 3340 " H TRP A 44 "<>" O ARG A 209 " d_HA=2.058 d_AD=3.032 a_DHA=159.063 symop: x,y,z a_YAH=136 5559 5584 " HG1 THR A 346 "<>" OE1 GLU A 348 " d_HA=2.481 d_AD=3.351 a_DHA=151.894 symop: x,y,z a_YAH=109 5552 5617 " H GLU A 350 "<>" O THR A 346 " d_HA=2.400 d_AD=3.378 a_DHA=162.202 symop: x,y,z a_YAH=141 5552 5599 " H VAL A 349 "<>" O THR A 346 " d_HA=2.135 d_AD=3.016 a_DHA=144.282 symop: x,y,z a_YAH=123 5482 5787 " H MET A 361 "<>" OD1 ASP A 341 " d_HA=1.734 d_AD=2.733 a_DHA=165.039 symop: x,y,z a_YAH=149 5483 5672 "HH11 ARG A 353 "<>" OD2 ASP A 341 " d_HA=1.668 d_AD=2.569 a_DHA=143.802 symop: x,y,z a_YAH=140 5775 6211 " H VAL A 388 "<>" O GLY A 360 " d_HA=1.866 d_AD=2.832 a_DHA=157.296 symop: x,y,z a_YAH=141 125 7152 " H GLY A 8 "<>" O ALA A 447 " d_HA=1.841 d_AD=2.829 a_DHA=163.317 symop: x,y,z a_YAH=131 136 656 " H LEU A 9 "<>" O TYR A 43 " d_HA=1.993 d_AD=2.915 a_DHA=150.144 symop: x,y,z a_YAH=146 532 610 " H ALA A 39 "<>" O PHE A 35 " d_HA=1.813 d_AD=2.817 a_DHA=169.547 symop: x,y,z a_YAH=155 552 626 " H GLY A 41 "<>" O LEU A 36 " d_HA=1.769 d_AD=2.682 a_DHA=148.583 symop: x,y,z a_YAH=147 508 599 " H GLU A 38 "<>" O ARG A 34 " d_HA=1.795 d_AD=2.805 a_DHA=172.896 symop: x,y,z a_YAH=164 5799 6248 " H TYR A 390 "<>" O LYS A 362 " d_HA=1.817 d_AD=2.824 a_DHA=170.207 symop: x,y,z a_YAH=162 5805 6207 " H LYS A 362 "<>" O VAL A 388 " d_HA=1.979 d_AD=2.831 a_DHA=139.686 symop: x,y,z a_YAH=168 6223 7166 " H VAL A 448 "<>" O VAL A 389 " d_HA=2.183 d_AD=3.004 a_DHA=136.651 symop: x,y,z a_YAH=155 124 7187 " H TYR A 449 "<>" O GLY A 8 " d_HA=2.043 d_AD=3.025 a_DHA=162.012 symop: x,y,z a_YAH=135 7764 7832 " H ARG A 491 "<>" O GLY A 487 " d_HA=1.882 d_AD=2.893 a_DHA=174.683 symop: x,y,z a_YAH=164 7764 7810 " H LEU A 490 "<>" O GLY A 487 " d_HA=2.532 d_AD=3.170 a_DHA=120.479 symop: x,y,z a_YAH=102 5821 5881 " H PHE A 366 "<>" O VAL A 363 " d_HA=2.495 d_AD=3.449 a_DHA=157.970 symop: x,y,z a_YAH=110 5842 6239 " H LEU A 364 "<>" O TYR A 390 " d_HA=1.939 d_AD=2.921 a_DHA=160.911 symop: x,y,z a_YAH=155 7747 7810 " H LEU A 490 "<>" O HIS A 486 " d_HA=2.108 d_AD=3.029 a_DHA=150.051 symop: x,y,z a_YAH=145 7718 7773 " H ALA A 488 "<>" O PRO A 484 " d_HA=1.835 d_AD=2.851 a_DHA=175.585 symop: x,y,z a_YAH=165 7732 7789 " H ARG A 489 "<>" O GLU A 485 " d_HA=1.951 d_AD=2.911 a_DHA=156.355 symop: x,y,z a_YAH=152 5873 5995 "HD21 ASN A 374 "<>" O PHE A 366 " d_HA=2.281 d_AD=2.993 a_DHA=125.098 symop: x,y,z a_YAH=152 5873 5928 " H ASP A 369 "<>" O PHE A 366 " d_HA=2.846 d_AD=3.854 a_DHA=174.275 symop: x,y,z a_YAH=118 5926 5995 "HD21 ASN A 374 "<>" OD1 ASP A 369 " d_HA=1.975 d_AD=2.861 a_DHA=142.653 symop: x,y,z a_YAH=164 5989 6022 " H PHE A 376 "<>" OD1 ASN A 374 " d_HA=2.596 d_AD=3.579 a_DHA=162.798 symop: x,y,z a_YAH=132 5837 5895 " H ALA A 367 "<>" O LEU A 364 " d_HA=1.975 d_AD=2.919 a_DHA=153.028 symop: x,y,z a_YAH=109 6954 7027 " H GLY A 439 "<>" O LEU A 435 " d_HA=1.905 d_AD=2.879 a_DHA=159.723 symop: x,y,z a_YAH=148 6890 6959 " H LEU A 435 "<>" O VAL A 431 " d_HA=2.117 d_AD=3.113 a_DHA=164.792 symop: x,y,z a_YAH=169 6906 6978 " H MET A 436 "<>" O PRO A 432 " d_HA=2.162 d_AD=3.070 a_DHA=147.354 symop: x,y,z a_YAH=135 6920 6997 " H HIS A 437 "<>" O TRP A 433 " d_HA=1.856 d_AD=2.867 a_DHA=171.973 symop: x,y,z a_YAH=145 5938 5948 " H GLY A 371 "<>" OD1 ASP A 370 " d_HA=2.080 d_AD=2.811 a_DHA=127.609 symop: x,y,z a_YAH=91 6875 6946 " H ALA A 434 "<>" O GLU A 430 " d_HA=2.047 d_AD=2.950 a_DHA=146.391 symop: x,y,z a_YAH=145 6875 6931 " H TRP A 433 "<>" O GLU A 430 " d_HA=2.172 d_AD=2.911 a_DHA=128.452 symop: x,y,z a_YAH=112 26 7127 "HH12 ARG A 445 "<>" OE1 GLU A 2 " d_HA=2.701 d_AD=3.659 a_DHA=158.805 symop: x,y,z a_YAH=107 2783 6183 " HE ARG A 386 "<>" OE2 GLU A 173 " d_HA=2.268 d_AD=3.128 a_DHA=141.313 symop: x+1/2,y-1/2,z a_YAH=117 2783 6186 "HH21 ARG A 386 "<>" OE2 GLU A 173 " d_HA=1.939 d_AD=2.862 a_DHA=147.967 symop: x+1/2,y-1/2,z a_YAH=99 4771 4828 " H GLU A 299 "<>" O ARG A 296 " d_HA=2.128 d_AD=3.011 a_DHA=144.899 symop: x,y,z a_YAH=116 4771 4839 " H ALA A 300 "<>" O ARG A 296 " d_HA=2.051 d_AD=3.054 a_DHA=171.708 symop: x,y,z a_YAH=165 4788 4837 "HH11 ARG A 296 "<>" O ALA A 300 " d_HA=2.394 d_AD=3.337 a_DHA=155.768 symop: x,y,z a_YAH=119 4734 4796 " H GLY A 297 "<>" O HIS A 294 " d_HA=2.186 d_AD=3.146 a_DHA=157.627 symop: x,y,z a_YAH=121 4703 5470 " H GLU A 340 "<>" O ILE A 292 " d_HA=2.550 d_AD=3.380 a_DHA=139.361 symop: x,y,z a_YAH=136 677 3388 " H ILE A 211 "<>" O TRP A 44 " d_HA=1.752 d_AD=2.702 a_DHA=155.327 symop: x,y,z a_YAH=155 722 3383 " H VAL A 46 "<>" O ILE A 211 " d_HA=2.001 d_AD=2.960 a_DHA=156.722 symop: x,y,z a_YAH=168 489 577 " H LYS A 37 "<>" O LEU A 33 " d_HA=2.179 d_AD=3.170 a_DHA=165.236 symop: x,y,z a_YAH=135 494 423 " H LEU A 33 "<>" O ALA A 29 " d_HA=1.852 d_AD=2.816 a_DHA=155.938 symop: x,y,z a_YAH=143 516 433 " H ARG A 34 "<>" O ARG A 30 " d_HA=1.943 d_AD=2.828 a_DHA=144.234 symop: x,y,z a_YAH=138 1517 1597 " H TRP A 103 "<>" O LEU A 99 " d_HA=2.099 d_AD=2.846 a_DHA=128.419 symop: x,y,z a_YAH=144 4789 4826 "HH12 ARG A 296 "<>" OE1 GLU A 299 " d_HA=1.992 d_AD=2.945 a_DHA=153.686 symop: x,y,z a_YAH=162 4759 5464 " H PHE A 295 "<>" O GLU A 340 " d_HA=1.898 d_AD=2.821 a_DHA=149.332 symop: x,y,z a_YAH=154 5469 5496 " H LEU A 342 "<>" OE2 GLU A 340 " d_HA=1.761 d_AD=2.752 a_DHA=163.005 symop: x,y,z a_YAH=143 705 6256 " HH TYR A 390 "<>" OE1 GLN A 45 " d_HA=1.617 d_AD=2.588 a_DHA=177.041 symop: x,y,z a_YAH=113 131 707 " H GLN A 45 "<>" O LEU A 9 " d_HA=1.710 d_AD=2.714 a_DHA=172.931 symop: x,y,z a_YAH=159 469 557 " H LEU A 36 "<>" O PHE A 32 " d_HA=1.748 d_AD=2.749 a_DHA=166.897 symop: x,y,z a_YAH=150 457 540 " H PHE A 35 "<>" O ASP A 31 " d_HA=1.772 d_AD=2.776 a_DHA=169.460 symop: x,y,z a_YAH=149 1510 1578 " H ALA A 102 "<>" O GLY A 98 " d_HA=2.210 d_AD=3.199 a_DHA=163.423 symop: x,y,z a_YAH=144 155 7178 " H LEU A 10 "<>" O TYR A 449 " d_HA=1.863 d_AD=2.829 a_DHA=157.402 symop: x,y,z a_YAH=121 5862 6260 " H GLN A 365 "<>" O THR A 391 " d_HA=2.135 d_AD=3.117 a_DHA=162.423 symop: x,y,z a_YAH=165 6285 6327 " H THR A 393 "<>" OD1 ASN A 396 " d_HA=1.904 d_AD=2.826 a_DHA=149.452 symop: x,y,z a_YAH=117 5868 6366 "HE21 GLN A 365 "<>" OG1 THR A 399 " d_HA=2.364 d_AD=3.334 a_DHA=161.052 symop: x,y,z a_YAH=116 a_YAH=124 6267 7250 " HG1 THR A 391 "<>" OD2 ASP A 453 " d_HA=1.931 d_AD=2.778 a_DHA=148.486 symop: x,y,z a_YAH=160 7199 7262 " H VAL A 454 "<>" O PRO A 450 " d_HA=2.478 d_AD=3.432 a_DHA=156.939 symop: x,y,z a_YAH=142 7199 7251 " H ASP A 453 "<>" O PRO A 450 " d_HA=2.234 d_AD=3.123 a_DHA=145.716 symop: x,y,z a_YAH=117 7707 7754 " H HIS A 486 "<>" O SER A 483 " d_HA=2.586 d_AD=3.249 a_DHA=123.175 symop: x,y,z a_YAH=113 7707 7765 " H GLY A 487 "<>" O SER A 483 " d_HA=2.504 d_AD=3.489 a_DHA=163.503 symop: x,y,z a_YAH=150 7709 7754 " H HIS A 486 "<>" OG SER A 483 " d_HA=2.866 d_AD=3.849 a_DHA=165.019 symop: x,y,z a_YAH=130 a_YAH=115 6364 6437 " H TYR A 403 "<>" O THR A 399 " d_HA=1.861 d_AD=2.842 a_DHA=160.445 symop: x,y,z a_YAH=144 6371 7250 " HG1 THR A 399 "<>" OD2 ASP A 453 " d_HA=2.348 d_AD=3.054 a_DHA=130.170 symop: x,y,z a_YAH=104 6547 6501 " H THR A 407 "<>" OE2 GLU A 410 " d_HA=1.751 d_AD=2.742 a_DHA=162.268 symop: x,y,z a_YAH=147 6547 6504 " HG1 THR A 407 "<>" OE2 GLU A 410 " d_HA=2.668 d_AD=3.534 a_DHA=148.758 symop: x,y,z a_YAH=94 6845 6894 " H VAL A 431 "<>" O GLU A 428 " d_HA=2.105 d_AD=3.016 a_DHA=148.087 symop: x,y,z a_YAH=110 6881 6830 " H GLU A 430 "<>" O GLU A 427 " d_HA=2.756 d_AD=3.645 a_DHA=147.024 symop: x,y,z a_YAH=91 4847 5100 " H VAL A 317 "<>" O TYR A 301 " d_HA=1.829 d_AD=2.772 a_DHA=152.640 symop: x,y,z a_YAH=152 4722 3457 " H ILE A 216 "<>" O ASP A 293 " d_HA=2.210 d_AD=3.195 a_DHA=160.854 symop: x,y,z a_YAH=140 4727 3421 " H ASP A 293 "<>" O MET A 214 " d_HA=2.366 d_AD=3.202 a_DHA=139.795 symop: x,y,z a_YAH=132 3412 4695 " HE ARG A 291 "<>" OD1 ASP A 213 " d_HA=2.258 d_AD=3.120 a_DHA=141.807 symop: x,y,z a_YAH=104 3412 3426 " H MET A 214 "<>" OD1 ASP A 213 " d_HA=2.204 d_AD=2.891 a_DHA=123.010 symop: x,y,z a_YAH=114 460 524 " HE ARG A 34 "<>" OD1 ASP A 31 " d_HA=2.283 d_AD=3.073 a_DHA=133.419 symop: x,y,z a_YAH=149 460 527 "HH21 ARG A 34 "<>" OD1 ASP A 31 " d_HA=1.574 d_AD=2.568 a_DHA=160.660 symop: x,y,z a_YAH=126 462 391 " H ASP A 31 "<>" O GLN A 27 " d_HA=1.741 d_AD=2.691 a_DHA=154.449 symop: x,y,z a_YAH=155 821 861 " H ASP A 56 "<>" O GLY A 53 " d_HA=2.086 d_AD=3.006 a_DHA=150.056 symop: x,y,z a_YAH=136 4940 4083 " HE ARG A 257 "<>" O ALA A 306 " d_HA=2.993 d_AD=3.667 a_DHA=124.274 symop: x,y,z a_YAH=118 4741 5468 " H HIS A 294 "<>" OE1 GLU A 340 " d_HA=1.890 d_AD=2.821 a_DHA=149.777 symop: x,y,z a_YAH=129 910 3413 " HH TYR A 59 "<>" OD2 ASP A 213 " d_HA=1.556 d_AD=2.511 a_DHA=163.730 symop: x,y,z a_YAH=142 169 693 " HE1 TRP A 44 "<>" O LEU A 11 " d_HA=1.974 d_AD=2.867 a_DHA=145.295 symop: x,y,z a_YAH=115 174 701 " H LEU A 11 "<>" O GLN A 45 " d_HA=1.924 d_AD=2.907 a_DHA=160.443 symop: x,y,z a_YAH=171 408 477 " H PHE A 32 "<>" O GLU A 28 " d_HA=2.065 d_AD=3.056 a_DHA=164.719 symop: x,y,z a_YAH=134 1349 1373 " H GLY A 89 "<>" OD1 ASP A 87 " d_HA=1.917 d_AD=2.796 a_DHA=143.412 symop: x,y,z a_YAH=136 1349 1387 " H PHE A 90 "<>" OD1 ASP A 87 " d_HA=2.113 d_AD=3.044 a_DHA=150.812 symop: x,y,z a_YAH=137 1477 1541 " H LEU A 100 "<>" O ASP A 96 " d_HA=1.735 d_AD=2.729 a_DHA=164.581 symop: x,y,z a_YAH=166 1489 1564 " H TYR A 101 "<>" O TYR A 97 " d_HA=1.874 d_AD=2.810 a_DHA=151.186 symop: x,y,z a_YAH=130 6283 6317 " H ASP A 395 "<>" OG1 THR A 393 " d_HA=2.673 d_AD=3.515 a_DHA=141.158 symop: x,y,z a_YAH=115 a_YAH=108 6288 6327 " HG1 THR A 393 "<>" OD1 ASN A 396 " d_HA=1.836 d_AD=2.792 a_DHA=166.923 symop: x,y,z a_YAH=153 6281 6329 " H ASN A 396 "<>" O THR A 393 " d_HA=2.278 d_AD=3.191 a_DHA=150.275 symop: x,y,z a_YAH=105 150 7217 " H VAL A 451 "<>" O LEU A 10 " d_HA=2.236 d_AD=3.208 a_DHA=159.365 symop: x,y,z a_YAH=151 1379 1425 "HE21 GLN A 92 "<>" O PHE A 90 " d_HA=2.712 d_AD=3.522 a_DHA=137.508 symop: x,y,z a_YAH=152 1480 1522 " H LEU A 99 "<>" OD1 ASP A 96 " d_HA=1.998 d_AD=3.015 a_DHA=178.127 symop: x,y,z a_YAH=118 1480 1511 " H GLY A 98 "<>" OD1 ASP A 96 " d_HA=2.665 d_AD=3.353 a_DHA=125.788 symop: x,y,z a_YAH=146 3955 4003 " H ASP A 249 "<>" O SER A 252 " d_HA=2.028 d_AD=3.014 a_DHA=163.344 symop: x,y,z a_YAH=123 5869 6338 "HE22 GLN A 365 "<>" O ASP A 397 " d_HA=1.784 d_AD=2.799 a_DHA=176.855 symop: x,y,z a_YAH=148 7213 7279 " H LEU A 455 "<>" O VAL A 451 " d_HA=2.156 d_AD=3.087 a_DHA=151.547 symop: x,y,z a_YAH=157 7229 7308 " H LEU A 457 "<>" O GLN A 452 " d_HA=2.039 d_AD=2.995 a_DHA=156.531 symop: x,y,z a_YAH=157 7673 7710 " H SER A 483 "<>" O GLU A 481 " d_HA=2.195 d_AD=3.047 a_DHA=140.528 symop: x,y,z a_YAH=103 6350 6415 " H TRP A 402 "<>" O THR A 398 " d_HA=1.844 d_AD=2.722 a_DHA=142.889 symop: x,y,z a_YAH=154 6352 6398 " H GLY A 401 "<>" OG1 THR A 398 " d_HA=2.179 d_AD=3.109 a_DHA=151.220 symop: x,y,z a_YAH=128 a_YAH=95 6357 7303 " HG1 THR A 398 "<>" O LEU A 457 " d_HA=1.923 d_AD=2.727 a_DHA=138.413 symop: x,y,z a_YAH=131 6368 7249 " H THR A 399 "<>" OD1 ASP A 453 " d_HA=1.765 d_AD=2.695 a_DHA=148.678 symop: x,y,z a_YAH=115 6378 6457 " H ARG A 404 "<>" O LEU A 400 " d_HA=2.057 d_AD=2.997 a_DHA=153.049 symop: x,y,z a_YAH=157 6404 6489 " H ALA A 406 "<>" O TRP A 402 " d_HA=1.927 d_AD=2.749 a_DHA=136.372 symop: x,y,z a_YAH=159 6404 6477 " H THR A 405 "<>" O TRP A 402 " d_HA=2.002 d_AD=2.925 a_DHA=149.827 symop: x,y,z a_YAH=112 2771 2688 "HH11 ARG A 172 "<>" O GLU A 168 " d_HA=1.968 d_AD=2.958 a_DHA=165.708 symop: x,y,z a_YAH=101 2693 2774 "HH22 ARG A 172 "<>" OE2 GLU A 168 " d_HA=1.900 d_AD=2.741 a_DHA=136.578 symop: x,y,z a_YAH=149 4892 5056 " H ARG A 315 "<>" O GLU A 303 " d_HA=2.174 d_AD=3.001 a_DHA=137.521 symop: x,y,z a_YAH=127 4898 5048 " H GLU A 303 "<>" O ARG A 315 " d_HA=1.762 d_AD=2.722 a_DHA=156.119 symop: x,y,z a_YAH=171 3873 4912 " H ILE A 304 "<>" O VAL A 243 " d_HA=1.983 d_AD=2.945 a_DHA=156.799 symop: x,y,z a_YAH=166 191 739 " H LEU A 47 "<>" ND1 HIS A 12 " d_HA=2.285 d_AD=3.205 a_DHA=151.104 symop: x,y,z a_YAH=117 a_YAH=126 4884 5000 " HE1 TRP A 302 "<>" O ALA A 311 " d_HA=2.232 d_AD=3.046 a_DHA=136.605 symop: x,y,z a_YAH=122 3910 4050 " H VAL A 246 "<>" O GLN A 256 " d_HA=2.230 d_AD=3.149 a_DHA=150.329 symop: x,y,z a_YAH=132 188 236 " H SER A 15 "<>" O HIS A 12 " d_HA=1.986 d_AD=2.856 a_DHA=142.081 symop: x,y,z a_YAH=132 205 249 " H LEU A 16 "<>" O PRO A 13 " d_HA=2.111 d_AD=3.064 a_DHA=156.168 symop: x,y,z a_YAH=112 244 7606 " HE ARG A 476 "<>" O LEU A 16 " d_HA=2.570 d_AD=3.465 a_DHA=147.573 symop: x,y,z a_YAH=146 244 7609 "HH21 ARG A 476 "<>" O LEU A 16 " d_HA=2.074 d_AD=3.076 a_DHA=167.572 symop: x,y,z a_YAH=143 277 7610 "HH22 ARG A 476 "<>" O GLY A 18 " d_HA=1.774 d_AD=2.778 a_DHA=169.994 symop: x,y,z a_YAH=125 4086 4940 "HH21 ARG A 257 "<>" O ALA A 306 " d_HA=1.685 d_AD=2.694 a_DHA=170.458 symop: x,y,z a_YAH=123 5000 5042 " H GLY A 314 "<>" O ALA A 311 " d_HA=2.532 d_AD=3.393 a_DHA=142.944 symop: x,y,z a_YAH=111 3906 4056 " H GLN A 256 "<>" O VAL A 246 " d_HA=2.192 d_AD=3.167 a_DHA=160.988 symop: x,y,z a_YAH=151 4054 4107 " HE1 TRP A 258 "<>" OE1 GLN A 256 " d_HA=1.879 d_AD=2.885 a_DHA=168.149 symop: x,y,z a_YAH=113 6315 7416 "HD22 ASN A 464 "<>" OD1 ASP A 395 " d_HA=1.724 d_AD=2.729 a_DHA=163.533 symop: x,y,z a_YAH=150 6295 7411 " H ASN A 464 "<>" O HIS A 394 " d_HA=2.109 d_AD=3.040 a_DHA=151.448 symop: x,y,z a_YAH=171 7241 7355 "HE21 GLN A 452 "<>" O ALA A 461 " d_HA=2.603 d_AD=3.547 a_DHA=154.878 symop: x,y,z a_YAH=163 233 7619 " H LEU A 477 "<>" O SER A 15 " d_HA=1.967 d_AD=2.874 a_DHA=147.852 symop: x,y,z a_YAH=123 7633 7679 " H GLU A 481 "<>" O LEU A 478 " d_HA=2.195 d_AD=3.188 a_DHA=166.522 symop: x,y,z a_YAH=121 7638 7677 " H LEU A 478 "<>" OE1 GLU A 481 " d_HA=2.173 d_AD=3.183 a_DHA=168.879 symop: x,y,z a_YAH=141 1465 7556 " H VAL A 95 "<>" O ALA A 474 " d_HA=1.681 d_AD=2.665 a_DHA=164.368 symop: x,y,z a_YAH=137 4003 4044 " H GLY A 255 "<>" O SER A 252 " d_HA=2.204 d_AD=2.965 a_DHA=130.753 symop: x,y,z a_YAH=93 6312 7384 "HH21 ARG A 462 "<>" O ASP A 395 " d_HA=2.088 d_AD=3.075 a_DHA=162.324 symop: x,y,z a_YAH=132 7381 7406 " HE ARG A 462 "<>" O ASN A 464 " d_HA=2.075 d_AD=2.913 a_DHA=138.186 symop: x,y,z a_YAH=135 7511 7558 " H ALA A 474 "<>" O GLY A 471 " d_HA=2.831 d_AD=3.722 a_DHA=147.492 symop: x,y,z a_YAH=107 7462 7527 "HD21 ASN A 472 "<>" O ARG A 468 " d_HA=2.051 d_AD=2.824 a_DHA=131.395 symop: x,y,z a_YAH=126 7478 7500 " HE ARG A 468 "<>" O SER A 470 " d_HA=2.254 d_AD=3.170 a_DHA=149.443 symop: x,y,z a_YAH=164 3983 4020 " H GLU A 253 "<>" O PHE A 251 " d_HA=2.588 d_AD=3.326 a_DHA=129.259 symop: x,y,z a_YAH=105 6341 6354 " H THR A 398 "<>" OD1 ASP A 397 " d_HA=1.958 d_AD=2.852 a_DHA=144.404 symop: x,y,z a_YAH=125 6342 7382 "HH11 ARG A 462 "<>" OD2 ASP A 397 " d_HA=2.374 d_AD=3.282 a_DHA=147.770 symop: x,y,z a_YAH=106 7329 7373 " H ARG A 462 "<>" O SER A 459 " d_HA=2.158 d_AD=3.095 a_DHA=152.478 symop: x,y,z a_YAH=102 7322 7357 " H ALA A 461 "<>" O GLY A 458 " d_HA=2.071 d_AD=3.008 a_DHA=152.151 symop: x,y,z a_YAH=127 7323 7345 " H GLY A 458 "<>" OE2 GLU A 460 " d_HA=2.122 d_AD=2.878 a_DHA=129.388 symop: x,y,z a_YAH=141 2078 6466 "HH11 ARG A 404 "<>" OE1 GLU A 132 " d_HA=2.767 d_AD=3.447 a_DHA=125.166 symop: x,y-1,z a_YAH=110 2079 7346 " H GLU A 460 "<>" OE2 GLU A 132 " d_HA=2.265 d_AD=3.155 a_DHA=144.439 symop: x,y-1,z a_YAH=148 4907 3877 " H VAL A 243 "<>" O ILE A 304 " d_HA=1.795 d_AD=2.800 a_DHA=171.363 symop: x,y,z a_YAH=156 868 920 " H GLN A 60 "<>" O SER A 57 " d_HA=2.185 d_AD=3.164 a_DHA=163.175 symop: x,y,z a_YAH=123 413 1156 "HH12 ARG A 75 "<>" OE2 GLU A 28 " d_HA=1.701 d_AD=2.667 a_DHA=155.449 symop: x,y,z a_YAH=138 4926 4964 " H CYS A 308 "<>" O PRO A 305 " d_HA=1.999 d_AD=2.923 a_DHA=150.499 symop: x,y,z a_YAH=125 3889 4102 " H TRP A 258 "<>" O ALA A 244 " d_HA=2.229 d_AD=2.976 a_DHA=129.480 symop: x,y,z a_YAH=127 3889 4116 " H GLY A 259 "<>" O ALA A 244 " d_HA=2.461 d_AD=3.354 a_DHA=147.473 symop: x,y,z a_YAH=152 870 902 " H TYR A 59 "<>" OG SER A 57 " d_HA=2.471 d_AD=3.457 a_DHA=165.355 symop: x,y,z a_YAH=112 a_YAH=129 1506 7532 " HH TYR A 97 "<>" O TRP A 473 " d_HA=1.860 d_AD=2.804 a_DHA=166.495 symop: x,y,z a_YAH=119 219 343 " H GLY A 23 "<>" O THR A 14 " d_HA=2.174 d_AD=2.921 a_DHA=129.064 symop: x,y,z a_YAH=119 4029 5002 " H ALA A 311 "<>" O THR A 254 " d_HA=2.322 d_AD=3.202 a_DHA=144.758 symop: x,y,z a_YAH=147 4963 4990 " H THR A 310 "<>" SG CYS A 308 " d_HA=2.326 d_AD=3.261 a_DHA=152.728 symop: x,y,z a_YAH=113 a_YAH=144 4988 5014 " H VAL A 312 "<>" OG1 THR A 310 " d_HA=2.502 d_AD=3.498 a_DHA=168.109 symop: x,y,z a_YAH=101 a_YAH=100 7527 7462 "HD21 ASN A 472 "<>" O ARG A 468 " d_HA=2.051 d_AD=2.824 a_DHA=131.395 symop: x,y,z a_YAH=126 7389 7543 " H TRP A 473 "<>" O MET A 463 " d_HA=1.862 d_AD=2.816 a_DHA=154.477 symop: x,y,z a_YAH=125 7558 7511 " H ALA A 474 "<>" O GLY A 471 " d_HA=2.831 d_AD=3.722 a_DHA=147.492 symop: x,y,z a_YAH=107 7420 7470 " H ARG A 468 "<>" O TYR A 465 " d_HA=2.006 d_AD=2.905 a_DHA=146.015 symop: x,y,z a_YAH=136 7429 7521 " H TYR A 465 "<>" OD1 ASN A 472 " d_HA=1.972 d_AD=2.925 a_DHA=155.322 symop: x,y,z a_YAH=111 7481 7521 "HH21 ARG A 468 "<>" OD1 ASN A 472 " d_HA=2.270 d_AD=3.015 a_DHA=129.177 symop: x,y,z a_YAH=126 1430 7598 " H ARG A 476 "<>" O GLY A 93 " d_HA=2.188 d_AD=2.928 a_DHA=128.251 symop: x,y,z a_YAH=119 1897 1971 " H GLU A 125 "<>" O PRO A 121 " d_HA=2.326 d_AD=3.238 a_DHA=149.634 symop: x,y,z a_YAH=109 4083 4940 " HE ARG A 257 "<>" O ALA A 306 " d_HA=2.993 d_AD=3.667 a_DHA=124.274 symop: x,y,z a_YAH=118 4083 4961 " HE ARG A 257 "<>" O CYS A 308 " d_HA=1.922 d_AD=2.801 a_DHA=142.143 symop: x,y,z a_YAH=168 ------------------------------------------------------------------------------- Total: 572 Symmetry: 0 Per residue: 1.1440 Mean SD Skew Kurtosis theta_1: 144.336 21.442 -0.609 2.282 theta_2: 131.359 22.711 -0.104 1.795 d_HA: 2.326 0.310 0.472 2.169 765 6085 "HH12 ARG A 48 "<>" OE2 GLU B 100 " d_HA=1.885 d_AD=2.847 a_DHA=154.442 symop: x,y+1,z a_YAH=119 6080 6139 " H ASP B 103 "<>" O GLU B 100 " d_HA=2.348 d_AD=3.103 a_DHA=130.750 symop: x,y,z a_YAH=102 764 6137 "HH11 ARG A 48 "<>" OD1 ASP B 103 " d_HA=2.873 d_AD=3.658 a_DHA=135.188 symop: x,y+1,z a_YAH=105 4715 4903 " H LYS B 29 "<>" O GLY B 16 " d_HA=2.886 d_AD=3.549 a_DHA=123.576 symop: x,y,z a_YAH=96 4722 4903 " H LYS B 29 "<>" O GLU B 17 " d_HA=1.754 d_AD=2.715 a_DHA=156.659 symop: x,y,z a_YAH=135 4757 4859 " H LEU B 19 "<>" O VAL B 27 " d_HA=1.903 d_AD=2.823 a_DHA=149.295 symop: x,y,z a_YAH=139 7437 7943 " HG SER B 215 "<>" OE2 GLU B 182 " d_HA=2.781 d_AD=3.713 a_DHA=161.104 symop: x,y,z a_YAH=97 4947 4693 "HH11 ARG B 31 "<>" OD2 ASP B 14 " d_HA=2.845 d_AD=3.855 a_DHA=174.155 symop: x,y,z a_YAH=119 4919 5054 "HE21 GLN B 38 "<>" O CYS B 30 " d_HA=2.684 d_AD=3.401 a_DHA=128.536 symop: x,y,z a_YAH=105 4919 5068 " H TYR B 39 "<>" O CYS B 30 " d_HA=2.060 d_AD=3.070 a_DHA=172.982 symop: x,y,z a_YAH=143 5059 4922 " H CYS B 30 "<>" O TYR B 39 " d_HA=1.881 d_AD=2.858 a_DHA=160.521 symop: x,y,z a_YAH=143 6806 6750 " H ASN B 144 "<>" O LYS B 141 " d_HA=2.107 d_AD=2.990 a_DHA=144.274 symop: x,y,z a_YAH=115 6756 6719 " H LYS B 141 "<>" O ASP B 139 " d_HA=1.966 d_AD=2.885 a_DHA=149.005 symop: x,y,z a_YAH=94 8181 8220 " H TYR B 234 "<>" O VAL B 232 " d_HA=2.200 d_AD=3.032 a_DHA=138.719 symop: x,y,z a_YAH=99 6095 6154 " H PHE B 104 "<>" O LEU B 101 " d_HA=2.168 d_AD=3.113 a_DHA=154.275 symop: x,y,z a_YAH=109 6095 6171 " H LEU B 105 "<>" O LEU B 101 " d_HA=1.868 d_AD=2.872 a_DHA=169.074 symop: x,y,z a_YAH=168 7851 7911 " H SER B 212 "<>" O ILE B 209 " d_HA=2.077 d_AD=3.022 a_DHA=154.407 symop: x,y,z a_YAH=106 7851 7920 " H GLY B 213 "<>" O ILE B 209 " d_HA=1.749 d_AD=2.732 a_DHA=162.329 symop: x,y,z a_YAH=153 7910 7928 " H ALA B 214 "<>" OG SER B 212 " d_HA=2.039 d_AD=2.999 a_DHA=156.915 symop: x,y,z a_YAH=103 a_YAH=138 7915 7830 " HG SER B 212 "<>" O TYR B 208 " d_HA=1.655 d_AD=2.617 a_DHA=166.682 symop: x,y,z a_YAH=137 825 853 " HG SER A 52 "<>" O ARG A 54 " d_HA=1.871 d_AD=2.798 a_DHA=157.527 symop: x,y,z a_YAH=138 4785 4742 " HG SER B 21 "<>" OE2 GLU B 18 " d_HA=1.590 d_AD=2.578 a_DHA=173.135 symop: x,y,z a_YAH=128 8019 8091 " H THR B 225 "<>" O THR B 221 " d_HA=2.120 d_AD=3.113 a_DHA=167.069 symop: x,y,z a_YAH=145 8019 8094 " HG1 THR B 225 "<>" O THR B 221 " d_HA=1.815 d_AD=2.709 a_DHA=151.792 symop: x,y,z a_YAH=158 8078 8021 " H GLU B 224 "<>" OG1 THR B 221 " d_HA=2.066 d_AD=3.072 a_DHA=171.487 symop: x,y,z a_YAH=146 a_YAH=98 4954 5006 " H THR B 35 "<>" O GLU B 32 " d_HA=2.663 d_AD=3.482 a_DHA=138.060 symop: x,y,z a_YAH=105 4954 5017 " H GLY B 36 "<>" O GLU B 32 " d_HA=2.222 d_AD=3.189 a_DHA=158.070 symop: x,y,z a_YAH=159 4960 5023 " H GLU B 32 "<>" O LEU B 37 " d_HA=1.994 d_AD=2.964 a_DHA=159.429 symop: x,y,z a_YAH=153 5082 5987 " H ALA B 40 "<>" O LEU B 93 " d_HA=1.946 d_AD=2.928 a_DHA=161.364 symop: x,y,z a_YAH=154 6707 7694 " H PHE B 138 "<>" OD1 ASP B 199 " d_HA=1.931 d_AD=2.738 a_DHA=134.089 symop: x,y,z a_YAH=98 6736 6699 " H LEU B 140 "<>" O PHE B 138 " d_HA=1.846 d_AD=2.789 a_DHA=152.926 symop: x,y,z a_YAH=103 7681 7747 " H SER B 202 "<>" O ALA B 198 " d_HA=2.404 d_AD=3.402 a_DHA=167.115 symop: x,y,z a_YAH=137 8726 7511 "HH22 ARG B 263 "<>" OE1 GLU B 187 " d_HA=1.721 d_AD=2.749 a_DHA=178.198 symop: x,y,z a_YAH=116 6892 6930 " H ASN B 151 "<>" OD1 ASP B 149 " d_HA=1.877 d_AD=2.885 a_DHA=169.706 symop: x,y,z a_YAH=138 6892 6943 " H VAL B 152 "<>" OD1 ASP B 149 " d_HA=1.737 d_AD=2.748 a_DHA=171.412 symop: x,y,z a_YAH=142 6893 6934 "HD21 ASN B 151 "<>" OD2 ASP B 149 " d_HA=1.808 d_AD=2.766 a_DHA=153.585 symop: x,y,z a_YAH=109 8382 6296 " HG1 THR B 244 "<>" OE2 GLU B 113 " d_HA=2.186 d_AD=3.113 a_DHA=159.581 symop: x,y,z a_YAH=148 5775 5968 " H HIS B 80 "<>" O ILE B 92 " d_HA=1.834 d_AD=2.771 a_DHA=151.678 symop: x,y,z a_YAH=164 5968 5791 " H GLU B 81 "<>" O ILE B 92 " d_HA=2.266 d_AD=3.223 a_DHA=157.307 symop: x,y,z a_YAH=122 6695 7089 " HE2 HIS B 137 "<>" O ILE B 160 " d_HA=2.639 d_AD=3.485 a_DHA=139.889 symop: x,y,z a_YAH=124 6695 7108 " HE2 HIS B 137 "<>" O ASP B 161 " d_HA=1.866 d_AD=2.791 a_DHA=148.504 symop: x,y,z a_YAH=167 6672 7183 " H HIS B 166 "<>" O ALA B 136 " d_HA=1.887 d_AD=2.811 a_DHA=149.651 symop: x,y,z a_YAH=150 7640 7683 " H ALA B 198 "<>" O GLY B 195 " d_HA=2.035 d_AD=2.998 a_DHA=157.434 symop: x,y,z a_YAH=103 7512 8724 "HH12 ARG B 263 "<>" OE2 GLU B 187 " d_HA=1.650 d_AD=2.669 a_DHA=171.957 symop: x,y,z a_YAH=117 8640 8678 " HZ1 LYS B 261 "<>" OD2 ASP B 259 " d_HA=2.336 d_AD=3.083 a_DHA=129.283 symop: x,y,z a_YAH=138 6277 6338 " H ALA B 116 "<>" O THR B 112 " d_HA=1.908 d_AD=2.896 a_DHA=162.832 symop: x,y,z a_YAH=166 125 174 " H TYR A 12 "<>" O VAL A 9 " d_HA=1.831 d_AD=2.793 a_DHA=156.653 symop: x,y,z a_YAH=122 125 195 " H TYR A 13 "<>" O VAL A 9 " d_HA=1.783 d_AD=2.696 a_DHA=148.022 symop: x,y,z a_YAH=164 5588 5517 " H LYS B 69 "<>" O VAL B 65 " d_HA=1.936 d_AD=2.925 a_DHA=163.166 symop: x,y,z a_YAH=160 6674 7176 " H ALA B 136 "<>" O HIS B 166 " d_HA=1.908 d_AD=2.864 a_DHA=155.676 symop: x,y,z a_YAH=173 524 472 " H THR A 35 "<>" O GLU A 32 " d_HA=2.869 d_AD=3.864 a_DHA=169.800 symop: x,y,z a_YAH=99 165 493 " H LYS A 33 "<>" O TYR A 12 " d_HA=1.826 d_AD=2.812 a_DHA=161.314 symop: x,y,z a_YAH=141 240 421 " H LYS A 29 "<>" O GLU A 17 " d_HA=1.949 d_AD=2.953 a_DHA=167.536 symop: x,y,z a_YAH=159 5533 5610 " H GLU B 70 "<>" O SER B 66 " d_HA=2.150 d_AD=3.018 a_DHA=142.619 symop: x,y,z a_YAH=142 478 541 " H GLU A 32 "<>" O LEU A 37 " d_HA=2.178 d_AD=3.111 a_DHA=152.285 symop: x,y,z a_YAH=134 7847 8232 " HH TYR B 208 "<>" O GLU B 235 " d_HA=1.734 d_AD=2.706 a_DHA=175.340 symop: x,y,z a_YAH=159 8237 8255 " H PHE B 236 "<>" OE2 GLU B 235 " d_HA=2.550 d_AD=3.468 a_DHA=150.489 symop: x,y,z a_YAH=104 4693 4947 "HH11 ARG B 31 "<>" OD2 ASP B 14 " d_HA=2.845 d_AD=3.855 a_DHA=174.155 symop: x,y,z a_YAH=119 4922 5059 " H CYS B 30 "<>" O TYR B 39 " d_HA=1.881 d_AD=2.858 a_DHA=160.521 symop: x,y,z a_YAH=143 6073 6856 " H LEU B 147 "<>" O GLY B 99 " d_HA=1.831 d_AD=2.786 a_DHA=154.855 symop: x,y,z a_YAH=156 6100 6815 " H LEU B 101 "<>" O ILE B 145 " d_HA=2.139 d_AD=3.133 a_DHA=165.343 symop: x,y,z a_YAH=159 6750 6806 " H ASN B 144 "<>" O LYS B 141 " d_HA=2.107 d_AD=2.990 a_DHA=144.274 symop: x,y,z a_YAH=115 7781 7856 " H ILE B 209 "<>" O VAL B 205 " d_HA=1.992 d_AD=2.986 a_DHA=164.401 symop: x,y,z a_YAH=153 6134 6920 "HH21 ARG B 150 "<>" O ASP B 103 " d_HA=1.805 d_AD=2.814 a_DHA=171.518 symop: x,y,z a_YAH=142 6137 764 "HH11 ARG A 48 "<>" OD1 ASP B 103 " d_HA=2.873 d_AD=3.658 a_DHA=135.188 symop: x,y-1,z a_YAH=105 6114 6187 " H ALA B 106 "<>" O PHE B 102 " d_HA=2.266 d_AD=3.132 a_DHA=142.700 symop: x,y,z a_YAH=130 1400 4737 " HZ1 LYS A 86 "<>" O GLU B 18 " d_HA=1.839 d_AD=2.730 a_DHA=143.865 symop: x,y+1,z a_YAH=125 4692 4986 " HZ2 LYS B 33 "<>" OD1 ASP B 14 " d_HA=1.906 d_AD=2.875 a_DHA=156.616 symop: x,y,z a_YAH=152 4689 4938 " H ARG B 31 "<>" O ASP B 14 " d_HA=2.282 d_AD=3.202 a_DHA=149.402 symop: x,y,z a_YAH=135 4694 4930 " H ASP B 14 "<>" O ARG B 31 " d_HA=1.939 d_AD=2.933 a_DHA=166.224 symop: x,y,z a_YAH=152 4716 4897 " H GLY B 16 "<>" O LYS B 29 " d_HA=1.821 d_AD=2.746 a_DHA=150.516 symop: x,y,z a_YAH=123 4875 5092 " H ALA B 41 "<>" O LYS B 28 " d_HA=1.828 d_AD=2.828 a_DHA=168.303 symop: x,y,z a_YAH=165 4881 5090 " H LYS B 28 "<>" O ALA B 41 " d_HA=1.968 d_AD=2.961 a_DHA=163.910 symop: x,y,z a_YAH=150 4771 4863 " H VAL B 27 "<>" O GLY B 20 " d_HA=1.932 d_AD=2.862 a_DHA=150.827 symop: x,y,z a_YAH=155 7418 7471 " H VAL B 184 "<>" O PRO B 181 " d_HA=2.959 d_AD=3.935 a_DHA=162.678 symop: x,y,z a_YAH=128 8087 8148 " H VAL B 229 "<>" O THR B 225 " d_HA=1.987 d_AD=2.996 a_DHA=170.280 symop: x,y,z a_YAH=151 4950 8133 "HH22 ARG B 31 "<>" OD1 ASN B 228 " d_HA=1.940 d_AD=2.701 a_DHA=129.239 symop: y+1,-x+1,z-1/4 a_YAH=155 8130 8202 " H ASN B 233 "<>" O ASN B 228 " d_HA=1.839 d_AD=2.843 a_DHA=169.331 symop: x,y,z a_YAH=144 8130 8185 " H VAL B 232 "<>" O ASN B 228 " d_HA=2.124 d_AD=2.797 a_DHA=122.080 symop: x,y,z a_YAH=134 6839 7048 " H MET B 146 "<>" O LYS B 158 " d_HA=1.982 d_AD=2.944 a_DHA=157.138 symop: x,y,z a_YAH=168 6772 6820 " H ILE B 145 "<>" O PRO B 142 " d_HA=2.091 d_AD=3.035 a_DHA=154.094 symop: x,y,z a_YAH=120 7720 7775 " H GLY B 204 "<>" O TRP B 201 " d_HA=2.400 d_AD=3.047 a_DHA=120.553 symop: x,y,z a_YAH=98 7720 7785 " H VAL B 205 "<>" O TRP B 201 " d_HA=1.877 d_AD=2.880 a_DHA=167.439 symop: x,y,z a_YAH=157 7744 7802 " H ILE B 206 "<>" O SER B 202 " d_HA=1.845 d_AD=2.829 a_DHA=162.011 symop: x,y,z a_YAH=152 6909 6928 " H ARG B 150 "<>" OD1 ASN B 151 " d_HA=2.933 d_AD=3.670 a_DHA=130.424 symop: x,y,z a_YAH=116 6146 6201 " H GLU B 107 "<>" O PHE B 104 " d_HA=1.954 d_AD=2.913 a_DHA=156.547 symop: x,y,z a_YAH=112 6146 6216 " H LYS B 108 "<>" O PHE B 104 " d_HA=2.821 d_AD=3.773 a_DHA=156.275 symop: x,y,z a_YAH=146 8267 8318 " H TYR B 240 "<>" O GLU B 237 " d_HA=1.911 d_AD=2.881 a_DHA=158.972 symop: x,y,z a_YAH=127 8267 8338 " H PHE B 241 "<>" O GLU B 237 " d_HA=1.839 d_AD=2.846 a_DHA=170.627 symop: x,y,z a_YAH=155 4626 4708 " HG1 THR B 15 "<>" OD1 ASP B 10 " d_HA=1.847 d_AD=2.829 a_DHA=173.148 symop: x,y,z a_YAH=144 4843 5130 " H PHE B 43 "<>" O VAL B 26 " d_HA=2.133 d_AD=3.137 a_DHA=173.133 symop: x,y,z a_YAH=156 4790 4833 " H GLY B 22 "<>" O ALA B 25 " d_HA=1.848 d_AD=2.787 a_DHA=152.371 symop: x,y,z a_YAH=165 4847 5122 " H VAL B 26 "<>" O PHE B 43 " d_HA=2.569 d_AD=3.393 a_DHA=138.040 symop: x,y,z a_YAH=144 8033 8106 " H LEU B 226 "<>" O LYS B 222 " d_HA=2.229 d_AD=3.159 a_DHA=151.516 symop: x,y,z a_YAH=145 8055 8122 " H ALA B 227 "<>" O GLN B 223 " d_HA=1.983 d_AD=2.972 a_DHA=164.170 symop: x,y,z a_YAH=148 8072 8135 " H ASN B 228 "<>" O GLU B 224 " d_HA=1.770 d_AD=2.778 a_DHA=170.129 symop: x,y,z a_YAH=173 5004 5028 " H LEU B 37 "<>" OG1 THR B 35 " d_HA=2.239 d_AD=3.164 a_DHA=150.467 symop: x,y,z a_YAH=121 a_YAH=128 6801 7094 " H ILE B 160 "<>" O ASN B 144 " d_HA=1.953 d_AD=2.947 a_DHA=165.008 symop: x,y,z a_YAH=153 7666 7731 " H TRP B 201 "<>" O GLU B 197 " d_HA=2.077 d_AD=2.933 a_DHA=140.347 symop: x,y,z a_YAH=138 7666 8723 "HH11 ARG B 263 "<>" O GLU B 197 " d_HA=1.810 d_AD=2.775 a_DHA=159.076 symop: x,y,z a_YAH=107 7691 7760 " H ILE B 203 "<>" O ASP B 199 " d_HA=1.961 d_AD=2.893 a_DHA=150.545 symop: x,y,z a_YAH=148 7703 7775 " H GLY B 204 "<>" O MET B 200 " d_HA=2.029 d_AD=2.924 a_DHA=145.365 symop: x,y,z a_YAH=144 8560 8602 " H VAL B 257 "<>" O LEU B 255 " d_HA=1.970 d_AD=2.881 a_DHA=147.628 symop: x,y,z a_YAH=99 8598 8722 " HE ARG B 263 "<>" O VAL B 257 " d_HA=2.177 d_AD=3.039 a_DHA=142.831 symop: x,y,z a_YAH=130 8598 8725 "HH21 ARG B 263 "<>" O VAL B 257 " d_HA=1.869 d_AD=2.793 a_DHA=151.606 symop: x,y,z a_YAH=162 6249 6263 " H LEU B 111 "<>" OG SER B 110 " d_HA=1.945 d_AD=2.759 a_DHA=134.788 symop: x,y,z a_YAH=96 a_YAH=146 6254 7889 " HG SER B 110 "<>" O LEU B 211 " d_HA=1.777 d_AD=2.729 a_DHA=163.449 symop: x,y,z a_YAH=106 8330 8456 " HZ2 LYS B 249 "<>" O PHE B 241 " d_HA=1.782 d_AD=2.800 a_DHA=171.928 symop: x,y,z a_YAH=132 739 877 " HE ARG A 47 "<>" O GLY A 55 " d_HA=1.991 d_AD=2.865 a_DHA=143.288 symop: x,y,z a_YAH=93 742 877 "HH21 ARG A 47 "<>" O GLY A 55 " d_HA=1.915 d_AD=2.817 a_DHA=145.898 symop: x,y,z a_YAH=155 3544 3594 " HG1 THR A 221 "<>" OE1 GLU A 224 " d_HA=1.934 d_AD=2.893 a_DHA=166.215 symop: x,y,z a_YAH=165 114 146 " H ASP A 10 "<>" OD1 ASN A 8 " d_HA=2.100 d_AD=3.083 a_DHA=162.415 symop: x,y,z a_YAH=129 120 4796 "HD21 ASN A 8 "<>" O GLN B 23 " d_HA=2.487 d_AD=3.405 a_DHA=150.025 symop: x,y+1,z a_YAH=165 259 409 " HZ1 LYS A 28 "<>" OE1 GLU A 18 " d_HA=1.719 d_AD=2.581 a_DHA=138.765 symop: x,y,z a_YAH=131 4958 5009 " HG1 THR B 35 "<>" OE1 GLU B 32 " d_HA=1.612 d_AD=2.603 a_DHA=174.548 symop: x,y,z a_YAH=121 4958 5076 " HH TYR B 39 "<>" OE1 GLU B 32 " d_HA=2.878 d_AD=3.756 a_DHA=151.641 symop: x,y,z a_YAH=126 5735 6012 " H GLU B 94 "<>" O THR B 78 " d_HA=2.233 d_AD=3.245 a_DHA=175.589 symop: x,y,z a_YAH=165 5739 6010 " H THR B 78 "<>" OE1 GLU B 94 " d_HA=2.437 d_AD=3.406 a_DHA=159.167 symop: x,y,z a_YAH=137 5721 7070 " H ILE B 77 "<>" O ILE B 159 " d_HA=2.520 d_AD=3.397 a_DHA=144.742 symop: x,y,z a_YAH=164 6602 7647 " HE2 HIS B 131 "<>" O LEU B 196 " d_HA=1.892 d_AD=2.839 a_DHA=153.386 symop: x,y,z a_YAH=132 6689 7695 " H HIS B 137 "<>" OD2 ASP B 199 " d_HA=1.783 d_AD=2.754 a_DHA=158.105 symop: x,y,z a_YAH=121 7647 7708 " H MET B 200 "<>" O LEU B 196 " d_HA=2.732 d_AD=3.633 a_DHA=148.581 symop: x,y,z a_YAH=123 8648 8714 " H ARG B 263 "<>" O PRO B 260 " d_HA=2.284 d_AD=3.235 a_DHA=155.828 symop: x,y,z a_YAH=107 8636 8690 " H LYS B 262 "<>" O ASP B 259 " d_HA=2.421 d_AD=3.336 a_DHA=149.671 symop: x,y,z a_YAH=116 8639 8668 " H LYS B 261 "<>" OD1 ASP B 259 " d_HA=2.023 d_AD=2.918 a_DHA=145.655 symop: x,y,z a_YAH=140 8639 8690 " H LYS B 262 "<>" OD1 ASP B 259 " d_HA=2.911 d_AD=3.731 a_DHA=138.352 symop: x,y,z a_YAH=141 6279 6327 " H GLU B 115 "<>" OG1 THR B 112 " d_HA=2.018 d_AD=3.035 a_DHA=173.753 symop: x,y,z a_YAH=137 a_YAH=111 6284 6326 " HG1 THR B 112 "<>" OE2 GLU B 115 " d_HA=1.677 d_AD=2.646 a_DHA=166.505 symop: x,y,z a_YAH=120 2411 6297 " H GLU B 113 "<>" OD2 ASP A 149 " d_HA=2.632 d_AD=3.527 a_DHA=146.969 symop: x-1,y+1,z a_YAH=141 3577 3596 " H GLU A 224 "<>" OE1 GLN A 223 " d_HA=2.811 d_AD=3.585 a_DHA=133.796 symop: x,y,z a_YAH=90 144 5351 " HE ARG B 54 "<>" OD1 ASP A 10 " d_HA=1.907 d_AD=2.807 a_DHA=145.452 symop: x,y+1,z a_YAH=114 144 5354 "HH21 ARG B 54 "<>" OD1 ASP A 10 " d_HA=1.713 d_AD=2.680 a_DHA=154.202 symop: x,y+1,z a_YAH=164 5563 5624 " H ILE B 71 "<>" O LEU B 68 " d_HA=2.265 d_AD=3.254 a_DHA=164.496 symop: x,y,z a_YAH=110 6570 6658 " H ILE B 135 "<>" O LEU B 130 " d_HA=1.847 d_AD=2.848 a_DHA=169.265 symop: x,y,z a_YAH=122 6636 7220 " H ILE B 168 "<>" O GLN B 134 " d_HA=2.446 d_AD=3.300 a_DHA=141.729 symop: x,y,z a_YAH=156 522 546 " H LEU A 37 "<>" OG1 THR A 35 " d_HA=2.012 d_AD=3.009 a_DHA=167.268 symop: x,y,z a_YAH=124 a_YAH=120 2410 2448 " H ASN A 151 "<>" OD1 ASP A 149 " d_HA=1.876 d_AD=2.864 a_DHA=163.498 symop: x,y,z a_YAH=118 2410 2453 "HD22 ASN A 151 "<>" OD1 ASP A 149 " d_HA=1.856 d_AD=2.794 a_DHA=150.915 symop: x,y,z a_YAH=132 2840 2881 " H ILE A 177 "<>" O LYS A 175 " d_HA=1.794 d_AD=2.714 a_DHA=148.958 symop: x,y,z a_YAH=110 2871 3115 "HD21 ASN A 176 "<>" OE2 GLU A 192 " d_HA=1.831 d_AD=2.768 a_DHA=149.700 symop: x,y,z a_YAH=128 3573 3640 " H ALA A 227 "<>" O GLN A 223 " d_HA=2.248 d_AD=3.019 a_DHA=131.430 symop: x,y,z a_YAH=131 153 504 " HZ2 LYS A 33 "<>" O ASP A 11 " d_HA=1.798 d_AD=2.717 a_DHA=147.444 symop: x,y,z a_YAH=107 207 456 " H ARG A 31 "<>" O ASP A 14 " d_HA=2.041 d_AD=2.996 a_DHA=155.424 symop: x,y,z a_YAH=154 210 5352 "HH11 ARG B 54 "<>" OD1 ASP A 14 " d_HA=1.831 d_AD=2.783 a_DHA=152.369 symop: x,y+1,z a_YAH=131 212 448 " H ASP A 14 "<>" O ARG A 31 " d_HA=2.141 d_AD=3.073 a_DHA=152.319 symop: x,y,z a_YAH=146 5608 7210 " HZ2 LYS B 167 "<>" OE1 GLU B 70 " d_HA=1.930 d_AD=2.711 a_DHA=130.837 symop: x,y,z a_YAH=109 476 527 " HG1 THR A 35 "<>" OE1 GLU A 32 " d_HA=1.517 d_AD=2.509 a_DHA=170.867 symop: x,y,z a_YAH=132 476 594 " HH TYR A 39 "<>" OE1 GLU A 32 " d_HA=2.802 d_AD=3.625 a_DHA=143.652 symop: x,y,z a_YAH=107 1576 2388 " H ALA A 97 "<>" O LEU A 148 " d_HA=2.707 d_AD=3.479 a_DHA=133.148 symop: x,y,z a_YAH=137 1585 2369 " H GLY A 98 "<>" O LEU A 147 " d_HA=2.078 d_AD=2.821 a_DHA=128.670 symop: x,y,z a_YAH=146 1584 2435 " HE ARG A 150 "<>" O GLY A 98 " d_HA=1.731 d_AD=2.729 a_DHA=167.210 symop: x,y,z a_YAH=125 1584 2438 "HH21 ARG A 150 "<>" O GLY A 98 " d_HA=2.560 d_AD=3.316 a_DHA=131.448 symop: x,y,z a_YAH=150 1652 1705 " H ALA A 106 "<>" O ASP A 103 " d_HA=2.305 d_AD=3.202 a_DHA=146.758 symop: x,y,z a_YAH=96 3059 3085 "HD22 ASN A 190 "<>" O VAL A 189 " d_HA=1.862 d_AD=2.756 a_DHA=144.801 symop: x,y,z a_YAH=104 244 432 " HZ2 LYS A 29 "<>" OE1 GLU A 17 " d_HA=1.841 d_AD=2.779 a_DHA=150.620 symop: x,y,z a_YAH=118 5609 7209 " HZ1 LYS B 167 "<>" OE2 GLU B 70 " d_HA=1.744 d_AD=2.679 a_DHA=149.738 symop: x,y,z a_YAH=103 7830 7915 " HG SER B 212 "<>" O TYR B 208 " d_HA=1.655 d_AD=2.617 a_DHA=166.682 symop: x,y,z a_YAH=137 771 821 " H SER A 52 "<>" O THR A 49 " d_HA=1.959 d_AD=2.912 a_DHA=155.617 symop: x,y,z a_YAH=125 4742 4785 " HG SER B 21 "<>" OE2 GLU B 18 " d_HA=1.590 d_AD=2.578 a_DHA=173.135 symop: x,y,z a_YAH=128 8021 8078 " H GLU B 224 "<>" OG1 THR B 221 " d_HA=2.066 d_AD=3.072 a_DHA=171.487 symop: x,y,z a_YAH=146 a_YAH=98 8023 8076 " H THR B 221 "<>" OE1 GLU B 224 " d_HA=2.921 d_AD=3.620 a_DHA=127.113 symop: x,y,z a_YAH=113 8026 8076 " HG1 THR B 221 "<>" OE1 GLU B 224 " d_HA=2.930 d_AD=3.861 a_DHA=160.480 symop: x,y,z a_YAH=128 5080 5992 " H LEU B 93 "<>" O ALA B 40 " d_HA=1.970 d_AD=2.974 a_DHA=169.308 symop: x,y,z a_YAH=157 6719 6756 " H LYS B 141 "<>" O ASP B 139 " d_HA=1.966 d_AD=2.885 a_DHA=149.005 symop: x,y,z a_YAH=94 7774 7839 " H TYR B 208 "<>" O GLY B 204 " d_HA=2.019 d_AD=2.976 a_DHA=156.083 symop: x,y,z a_YAH=155 7797 7875 " H LEU B 210 "<>" O ILE B 206 " d_HA=1.732 d_AD=2.685 a_DHA=155.744 symop: x,y,z a_YAH=150 7816 7894 " H LEU B 211 "<>" O THR B 207 " d_HA=2.256 d_AD=3.244 a_DHA=164.740 symop: x,y,z a_YAH=145 773 810 " H SER A 51 "<>" OG1 THR A 49 " d_HA=2.695 d_AD=3.656 a_DHA=159.691 symop: x,y,z a_YAH=99 a_YAH=118 778 6185 " HG1 THR A 49 "<>" O ALA B 106 " d_HA=2.648 d_AD=3.618 a_DHA=177.460 symop: x,y+1,z a_YAH=123 91 4741 "HE21 GLN A 6 "<>" OE1 GLU B 18 " d_HA=2.964 d_AD=3.644 a_DHA=125.556 symop: x,y+1,z a_YAH=151 1373 1425 " H ASP A 88 "<>" OD1 ASN A 85 " d_HA=1.922 d_AD=2.868 a_DHA=153.318 symop: x,y,z a_YAH=170 697 1423 " HZ3 LYS A 45 "<>" OD1 ASP A 88 " d_HA=1.809 d_AD=2.762 a_DHA=153.148 symop: x,y,z a_YAH=102 695 1424 " HZ1 LYS A 45 "<>" OD2 ASP A 88 " d_HA=1.910 d_AD=2.661 a_DHA=127.689 symop: x,y,z a_YAH=115 307 353 " H ALA A 25 "<>" O GLY A 22 " d_HA=1.832 d_AD=2.834 a_DHA=167.902 symop: x,y,z a_YAH=133 4647 4975 " H LYS B 33 "<>" O TYR B 12 " d_HA=1.764 d_AD=2.740 a_DHA=159.718 symop: x,y,z a_YAH=134 4607 4656 " H TYR B 12 "<>" O VAL B 9 " d_HA=2.101 d_AD=2.948 a_DHA=139.886 symop: x,y,z a_YAH=121 4607 4677 " H TYR B 13 "<>" O VAL B 9 " d_HA=2.042 d_AD=2.943 a_DHA=146.377 symop: x,y,z a_YAH=163 4668 4987 " HZ3 LYS B 33 "<>" O TYR B 13 " d_HA=2.304 d_AD=3.044 a_DHA=128.584 symop: x,y,z a_YAH=109 5106 5949 " H LYS B 42 "<>" O LEU B 91 " d_HA=2.004 d_AD=3.014 a_DHA=169.895 symop: x,y,z a_YAH=142 5116 7111 " HZ1 LYS B 42 "<>" OD1 ASP B 161 " d_HA=1.858 d_AD=2.728 a_DHA=140.448 symop: x,y,z a_YAH=119 7111 7141 " H GLY B 163 "<>" OD1 ASP B 161 " d_HA=2.202 d_AD=3.178 a_DHA=161.122 symop: x,y,z a_YAH=120 6723 6767 " HZ2 LYS B 141 "<>" OD2 ASP B 139 " d_HA=1.692 d_AD=2.674 a_DHA=158.070 symop: x,y,z a_YAH=101 8101 8163 " H SER B 230 "<>" O LEU B 226 " d_HA=1.906 d_AD=2.915 a_DHA=170.389 symop: x,y,z a_YAH=161 8120 8173 " H ALA B 231 "<>" O ALA B 227 " d_HA=1.900 d_AD=2.844 a_DHA=152.950 symop: x,y,z a_YAH=138 8144 8185 " H VAL B 232 "<>" O VAL B 229 " d_HA=2.288 d_AD=3.027 a_DHA=128.747 symop: x,y,z a_YAH=93 8160 8632 " HZ3 LYS B 258 "<>" O SER B 230 " d_HA=1.875 d_AD=2.675 a_DHA=132.572 symop: x,y,z a_YAH=136 6834 7054 " H LYS B 158 "<>" O MET B 146 " d_HA=1.749 d_AD=2.757 a_DHA=171.358 symop: x,y,z a_YAH=156 6875 7005 " H LEU B 148 "<>" O ARG B 156 " d_HA=2.376 d_AD=3.385 a_DHA=175.321 symop: x,y,z a_YAH=146 7755 7820 " H THR B 207 "<>" O ILE B 203 " d_HA=2.336 d_AD=3.288 a_DHA=156.229 symop: x,y,z a_YAH=129 7755 7823 " HG1 THR B 207 "<>" O ILE B 203 " d_HA=1.817 d_AD=2.785 a_DHA=173.023 symop: x,y,z a_YAH=166 8493 8565 " H LEU B 255 "<>" O ILE B 252 " d_HA=2.179 d_AD=3.130 a_DHA=155.843 symop: x,y,z a_YAH=116 8493 8584 " H LEU B 256 "<>" O ILE B 252 " d_HA=2.008 d_AD=2.999 a_DHA=165.211 symop: x,y,z a_YAH=175 8219 8529 "HH11 ARG B 253 "<>" OH TYR B 234 " d_HA=2.445 d_AD=3.133 a_DHA=125.024 symop: x,y,z a_YAH=116 a_YAH=133 6200 6919 "HH12 ARG B 150 "<>" OE2 GLU B 107 " d_HA=1.917 d_AD=2.904 a_DHA=160.690 symop: x,y,z a_YAH=163 6200 6921 "HH22 ARG B 150 "<>" OE2 GLU B 107 " d_HA=2.129 d_AD=3.059 a_DHA=151.668 symop: x,y,z a_YAH=108 847 6237 "HH12 ARG A 53 "<>" OE2 GLU B 109 " d_HA=1.769 d_AD=2.744 a_DHA=157.158 symop: x,y+1,z a_YAH=91 849 6236 "HH22 ARG A 53 "<>" OE1 GLU B 109 " d_HA=1.775 d_AD=2.737 a_DHA=153.772 symop: x,y+1,z a_YAH=108 929 1359 "HH12 ARG A 58 "<>" OE1 GLU A 84 " d_HA=1.714 d_AD=2.713 a_DHA=162.107 symop: x,y,z a_YAH=147 717 1370 " HZ1 LYS A 46 "<>" O ASN A 85 " d_HA=1.920 d_AD=2.741 a_DHA=135.235 symop: x,y,z a_YAH=172 717 1420 " HZ1 LYS A 46 "<>" O ASP A 88 " d_HA=2.725 d_AD=3.441 a_DHA=127.246 symop: x,y,z a_YAH=103 718 1384 " HZ2 LYS A 46 "<>" O LYS A 86 " d_HA=2.264 d_AD=2.945 a_DHA=123.032 symop: x,y,z a_YAH=107 718 1406 " HZ2 LYS A 46 "<>" O THR A 87 " d_HA=1.947 d_AD=2.823 a_DHA=142.356 symop: x,y,z a_YAH=96 660 1436 " H VAL A 89 "<>" O ILE A 44 " d_HA=2.860 d_AD=3.842 a_DHA=162.862 symop: x,y,z a_YAH=148 707 1423 " H LYS A 46 "<>" OD1 ASP A 88 " d_HA=1.972 d_AD=2.950 a_DHA=160.060 symop: x,y,z a_YAH=143 331 685 " H LYS A 45 "<>" O PHE A 24 " d_HA=1.751 d_AD=2.760 a_DHA=171.763 symop: x,y,z a_YAH=155 679 888 " H VAL A 56 "<>" O LYS A 45 " d_HA=1.730 d_AD=2.690 a_DHA=156.374 symop: x,y,z a_YAH=164 4623 4987 " HZ3 LYS B 33 "<>" O ASP B 10 " d_HA=2.504 d_AD=3.191 a_DHA=124.438 symop: x,y,z a_YAH=138 5100 5954 " H LEU B 91 "<>" O LYS B 42 " d_HA=1.808 d_AD=2.804 a_DHA=166.484 symop: x,y,z a_YAH=146 6010 7065 " HZ2 LYS B 158 "<>" OE1 GLU B 94 " d_HA=1.806 d_AD=2.634 a_DHA=135.237 symop: x,y,z a_YAH=109 6011 7064 " HZ1 LYS B 158 "<>" OE2 GLU B 94 " d_HA=1.780 d_AD=2.644 a_DHA=139.754 symop: x,y,z a_YAH=106 6453 6516 " H VAL B 127 "<>" O ILE B 123 " d_HA=1.951 d_AD=2.965 a_DHA=175.510 symop: x,y,z a_YAH=167 6453 6506 " H GLY B 126 "<>" O ILE B 123 " d_HA=2.229 d_AD=3.050 a_DHA=136.939 symop: x,y,z a_YAH=99 8536 8735 " H MET B 264 "<>" O ARG B 254 " d_HA=2.126 d_AD=3.109 a_DHA=164.146 symop: x,y,z a_YAH=148 6199 6228 " HZ3 LYS B 108 "<>" OE1 GLU B 107 " d_HA=1.797 d_AD=2.671 a_DHA=140.611 symop: x,y,z a_YAH=137 2473 8371 "HD22 ASN B 243 "<>" O PRO A 153 " d_HA=2.006 d_AD=2.801 a_DHA=134.353 symop: x-1,y+1,z a_YAH=91 8282 8353 " H SER B 242 "<>" O ASP B 238 " d_HA=2.410 d_AD=3.287 a_DHA=144.811 symop: x,y,z a_YAH=103 8282 8357 " HG SER B 242 "<>" O ASP B 238 " d_HA=1.670 d_AD=2.599 a_DHA=156.360 symop: x,y,z a_YAH=158 927 986 " HE ARG A 58 "<>" OE2 GLU A 62 " d_HA=2.496 d_AD=3.387 a_DHA=145.858 symop: x,y,z a_YAH=111 900 967 " H ILE A 61 "<>" O SER A 57 " d_HA=2.354 d_AD=3.302 a_DHA=155.556 symop: x,y,z a_YAH=144 911 987 " H GLU A 62 "<>" O ARG A 58 " d_HA=1.966 d_AD=2.969 a_DHA=167.740 symop: x,y,z a_YAH=167 4596 4628 " H ASP B 10 "<>" OD1 ASN B 8 " d_HA=2.900 d_AD=3.817 a_DHA=150.970 symop: x,y,z a_YAH=123 3528 5179 " HZ3 LYS B 45 "<>" OD1 ASP A 220 " d_HA=2.934 d_AD=3.671 a_DHA=129.051 symop: -y+1,x,z+1/4 a_YAH=100 3528 5895 " HG1 THR B 87 "<>" OD1 ASP A 220 " d_HA=1.652 d_AD=2.638 a_DHA=172.080 symop: -y+1,x,z+1/4 a_YAH=175 5179 5905 " HZ3 LYS B 45 "<>" OD1 ASP B 88 " d_HA=1.724 d_AD=2.644 a_DHA=146.307 symop: x,y,z a_YAH=125 4813 5167 " H LYS B 45 "<>" O PHE B 24 " d_HA=2.568 d_AD=3.456 a_DHA=146.497 symop: x,y,z a_YAH=155 5655 5704 " H VAL B 76 "<>" O HIS B 73 " d_HA=2.102 d_AD=3.033 a_DHA=151.853 symop: x,y,z a_YAH=140 5686 7075 " H ILE B 159 "<>" O ASN B 75 " d_HA=1.971 d_AD=2.937 a_DHA=158.812 symop: x,y,z a_YAH=136 6512 6596 " H HIS B 131 "<>" O VAL B 127 " d_HA=1.926 d_AD=2.916 a_DHA=164.244 symop: x,y,z a_YAH=177 6528 6609 " H SER B 132 "<>" O TYR B 128 " d_HA=2.347 d_AD=3.013 a_DHA=122.444 symop: x,y,z a_YAH=130 6528 6613 " HG SER B 132 "<>" O TYR B 128 " d_HA=1.694 d_AD=2.666 a_DHA=171.146 symop: x,y,z a_YAH=156 935 1004 " H ARG A 63 "<>" O GLU A 59 " d_HA=1.855 d_AD=2.748 a_DHA=144.671 symop: x,y,z a_YAH=161 953 1015 "HH21 ARG A 63 "<>" OD1 ASP A 60 " d_HA=1.708 d_AD=2.725 a_DHA=171.528 symop: x,y,z a_YAH=134 1016 2658 "HH22 ARG A 63 "<>" O GLY A 163 " d_HA=2.171 d_AD=3.092 a_DHA=150.877 symop: x,y,z a_YAH=163 3537 3596 " H GLU A 224 "<>" O THR A 221 " d_HA=2.671 d_AD=3.311 a_DHA=121.424 symop: x,y,z a_YAH=98 3537 3609 " H THR A 225 "<>" O THR A 221 " d_HA=2.021 d_AD=3.007 a_DHA=164.212 symop: x,y,z a_YAH=158 3537 3612 " HG1 THR A 225 "<>" O THR A 221 " d_HA=1.930 d_AD=2.850 a_DHA=158.509 symop: x,y,z a_YAH=124 3551 3624 " H LEU A 226 "<>" O LYS A 222 " d_HA=2.139 d_AD=3.076 a_DHA=153.029 symop: x,y,z a_YAH=148 5638 6566 " HH TYR B 129 "<>" O GLN B 72 " d_HA=1.774 d_AD=2.709 a_DHA=160.703 symop: x,y,z a_YAH=147 6505 6558 " H TYR B 129 "<>" O GLY B 126 " d_HA=1.986 d_AD=2.883 a_DHA=146.164 symop: x,y,z a_YAH=114 6505 6575 " H LEU B 130 "<>" O GLY B 126 " d_HA=2.667 d_AD=3.608 a_DHA=154.977 symop: x,y,z a_YAH=142 6609 6549 " H SER B 132 "<>" O TYR B 129 " d_HA=2.363 d_AD=3.173 a_DHA=136.362 symop: x,y,z a_YAH=97 2393 2523 " H LEU A 148 "<>" O ARG A 156 " d_HA=1.935 d_AD=2.902 a_DHA=158.636 symop: x,y,z a_YAH=153 1684 1734 " H LYS A 108 "<>" O LEU A 105 " d_HA=2.569 d_AD=3.452 a_DHA=145.446 symop: x,y,z a_YAH=111 1728 1768 " H SER A 110 "<>" O LYS A 108 " d_HA=2.023 d_AD=2.940 a_DHA=149.176 symop: x,y,z a_YAH=94 940 2856 " HZ1 LYS A 175 "<>" OE2 GLU A 59 " d_HA=1.699 d_AD=2.671 a_DHA=155.547 symop: x,y,z a_YAH=147 2820 2867 " H ASN A 176 "<>" O PHE A 174 " d_HA=1.833 d_AD=2.776 a_DHA=152.873 symop: x,y,z a_YAH=109 3590 3640 " H ALA A 227 "<>" O GLU A 224 " d_HA=2.250 d_AD=2.977 a_DHA=127.300 symop: x,y,z a_YAH=100 3590 3653 " H ASN A 228 "<>" O GLU A 224 " d_HA=2.193 d_AD=3.134 a_DHA=152.469 symop: x,y,z a_YAH=149 3605 3666 " H VAL A 229 "<>" O THR A 225 " d_HA=1.986 d_AD=2.985 a_DHA=165.553 symop: x,y,z a_YAH=156 3619 3681 " H SER A 230 "<>" O LEU A 226 " d_HA=1.896 d_AD=2.886 a_DHA=164.058 symop: x,y,z a_YAH=145 3619 3685 " HG SER A 230 "<>" O LEU A 226 " d_HA=1.789 d_AD=2.745 a_DHA=165.479 symop: x,y,z a_YAH=132 6549 6622 " H LEU B 133 "<>" O TYR B 129 " d_HA=1.838 d_AD=2.774 a_DHA=151.977 symop: x,y,z a_YAH=150 6549 6609 " H SER B 132 "<>" O TYR B 129 " d_HA=2.363 d_AD=3.173 a_DHA=136.362 symop: x,y,z a_YAH=97 2374 1591 " H LEU A 147 "<>" O GLY A 99 " d_HA=2.066 d_AD=3.020 a_DHA=155.361 symop: x,y,z a_YAH=163 1613 1689 " H LEU A 105 "<>" O LEU A 101 " d_HA=2.390 d_AD=3.283 a_DHA=146.556 symop: x,y,z a_YAH=150 1672 1598 " H PHE A 104 "<>" O GLU A 100 " d_HA=2.155 d_AD=3.118 a_DHA=157.145 symop: x,y,z a_YAH=141 1689 1632 " H LEU A 105 "<>" O PHE A 102 " d_HA=2.533 d_AD=3.318 a_DHA=134.127 symop: x,y,z a_YAH=114 1703 1756 " H GLU A 109 "<>" O ALA A 106 " d_HA=1.953 d_AD=2.913 a_DHA=156.881 symop: x,y,z a_YAH=122 1755 4505 " H VAL B 3 "<>" OE2 GLU A 109 " d_HA=1.781 d_AD=2.805 a_DHA=176.936 symop: -y+1,x,z+1/4 a_YAH=131 2707 2791 " HE2 HIS A 166 "<>" O ASN A 172 " d_HA=2.677 d_AD=3.675 a_DHA=168.222 symop: x,y,z a_YAH=113 2791 2857 " HZ2 LYS A 175 "<>" O ASN A 172 " d_HA=2.788 d_AD=3.649 a_DHA=143.177 symop: x,y,z a_YAH=165 2791 2828 " H PHE A 174 "<>" O ASN A 172 " d_HA=2.058 d_AD=2.886 a_DHA=137.781 symop: x,y,z a_YAH=109 3638 3691 " H ALA A 231 "<>" O ALA A 227 " d_HA=2.523 d_AD=3.481 a_DHA=157.139 symop: x,y,z a_YAH=134 4685 5789 " HH TYR B 13 "<>" OE1 GLU B 81 " d_HA=1.622 d_AD=2.585 a_DHA=165.750 symop: x,y,z a_YAH=139 5789 5833 " HH TYR B 83 "<>" OE1 GLU B 81 " d_HA=1.717 d_AD=2.695 a_DHA=175.015 symop: x,y,z a_YAH=102 5791 5968 " H GLU B 81 "<>" O ILE B 92 " d_HA=2.266 d_AD=3.223 a_DHA=157.307 symop: x,y,z a_YAH=122 7108 6695 " HE2 HIS B 137 "<>" O ASP B 161 " d_HA=1.866 d_AD=2.791 a_DHA=148.504 symop: x,y,z a_YAH=167 6682 6724 " H ASP B 139 "<>" O HIS B 137 " d_HA=2.583 d_AD=3.334 a_DHA=130.860 symop: x,y,z a_YAH=106 6699 6736 " H LEU B 140 "<>" O PHE B 138 " d_HA=1.846 d_AD=2.789 a_DHA=152.926 symop: x,y,z a_YAH=103 7511 8726 "HH22 ARG B 263 "<>" OE1 GLU B 187 " d_HA=1.721 d_AD=2.749 a_DHA=178.198 symop: x,y,z a_YAH=116 6336 6400 " H LEU B 120 "<>" O ALA B 116 " d_HA=1.817 d_AD=2.827 a_DHA=171.179 symop: x,y,z a_YAH=154 6336 6383 " H PHE B 119 "<>" O ALA B 116 " d_HA=2.289 d_AD=3.148 a_DHA=141.349 symop: x,y,z a_YAH=99 8429 8498 " H ILE B 252 "<>" O ALA B 248 " d_HA=2.115 d_AD=3.132 a_DHA=176.694 symop: x,y,z a_YAH=165 8439 8520 " H ARG B 253 "<>" O LYS B 249 " d_HA=2.083 d_AD=3.013 a_DHA=150.702 symop: x,y,z a_YAH=135 55 1361 " H GLU A 84 "<>" O ARG A 5 " d_HA=1.726 d_AD=2.711 a_DHA=162.140 symop: x,y,z a_YAH=136 102 1355 " H GLU A 7 "<>" O GLU A 84 " d_HA=2.913 d_AD=3.794 a_DHA=145.930 symop: x,y,z a_YAH=142 1375 1420 " H ASN A 85 "<>" O ASP A 88 " d_HA=2.095 d_AD=3.087 a_DHA=164.807 symop: x,y,z a_YAH=166 365 640 " H VAL A 26 "<>" O PHE A 43 " d_HA=2.356 d_AD=3.270 a_DHA=149.153 symop: x,y,z a_YAH=152 5785 5973 " H ILE B 92 "<>" O GLU B 81 " d_HA=1.783 d_AD=2.779 a_DHA=166.395 symop: x,y,z a_YAH=150 5118 5507 " HZ3 LYS B 42 "<>" OE2 GLU B 64 " d_HA=1.714 d_AD=2.694 a_DHA=157.372 symop: x,y,z a_YAH=144 5507 7128 " H PHE B 162 "<>" OE2 GLU B 64 " d_HA=2.898 d_AD=3.820 a_DHA=152.027 symop: x,y,z a_YAH=95 7120 7168 " H ALA B 165 "<>" O PHE B 162 " d_HA=1.894 d_AD=2.902 a_DHA=173.673 symop: x,y,z a_YAH=115 7483 7545 " H VAL B 189 "<>" O ALA B 185 " d_HA=2.106 d_AD=2.880 a_DHA=131.732 symop: x,y,z a_YAH=145 6375 6442 " H GLN B 122 "<>" O PHE B 119 " d_HA=1.988 d_AD=2.868 a_DHA=143.416 symop: x,y,z a_YAH=112 6375 6458 " H ILE B 123 "<>" O PHE B 119 " d_HA=2.783 d_AD=3.614 a_DHA=139.576 symop: x,y,z a_YAH=138 6414 6496 " H ASN B 125 "<>" O LYS B 121 " d_HA=1.853 d_AD=2.828 a_DHA=160.629 symop: x,y,z a_YAH=145 6414 6501 "HD22 ASN B 125 "<>" O LYS B 121 " d_HA=1.770 d_AD=2.751 a_DHA=162.043 symop: x,y,z a_YAH=128 6395 6458 " H ILE B 123 "<>" O LEU B 120 " d_HA=2.203 d_AD=2.930 a_DHA=127.266 symop: x,y,z a_YAH=107 6395 6477 " H LEU B 124 "<>" O LEU B 120 " d_HA=1.889 d_AD=2.896 a_DHA=170.542 symop: x,y,z a_YAH=163 8473 8565 " H LEU B 255 "<>" O PHE B 251 " d_HA=2.984 d_AD=3.637 a_DHA=123.096 symop: x,y,z a_YAH=144 8473 8544 " H ARG B 254 "<>" O PHE B 251 " d_HA=2.190 d_AD=2.928 a_DHA=127.857 symop: x,y,z a_YAH=111 8461 8544 " H ARG B 254 "<>" O ASP B 250 " d_HA=2.186 d_AD=3.051 a_DHA=141.530 symop: x,y,z a_YAH=151 1334 1453 " H ILE A 90 "<>" O TYR A 83 " d_HA=2.179 d_AD=3.192 a_DHA=175.826 symop: x,y,z a_YAH=139 665 1432 " H ILE A 44 "<>" O VAL A 89 " d_HA=2.001 d_AD=3.015 a_DHA=175.913 symop: x,y,z a_YAH=169 4593 4640 " H ASP B 11 "<>" O ASN B 8 " d_HA=1.947 d_AD=2.936 a_DHA=164.041 symop: x,y,z a_YAH=120 5816 5935 " H ILE B 90 "<>" O TYR B 83 " d_HA=1.730 d_AD=2.732 a_DHA=168.816 symop: x,y,z a_YAH=153 5825 5930 " H TYR B 83 "<>" O ILE B 90 " d_HA=1.878 d_AD=2.890 a_DHA=173.745 symop: x,y,z a_YAH=152 5147 5914 " H ILE B 44 "<>" O VAL B 89 " d_HA=1.939 d_AD=2.887 a_DHA=154.404 symop: x,y,z a_YAH=135 7522 7562 " H ASN B 190 "<>" O ILE B 188 " d_HA=1.872 d_AD=2.735 a_DHA=140.783 symop: x,y,z a_YAH=108 6436 6506 " H GLY B 126 "<>" O GLN B 122 " d_HA=2.574 d_AD=3.232 a_DHA=122.358 symop: x,y,z a_YAH=123 6472 6537 " H TYR B 128 "<>" O LEU B 124 " d_HA=1.934 d_AD=2.917 a_DHA=162.115 symop: x,y,z a_YAH=154 3 930 "HH21 ARG A 58 "<>" O THR A 2 " d_HA=2.373 d_AD=3.153 a_DHA=133.672 symop: x,y,z a_YAH=153 43 1360 " H PHE A 4 "<>" OE2 GLU A 84 " d_HA=1.866 d_AD=2.791 a_DHA=149.182 symop: x,y,z a_YAH=136 962 1039 " H VAL A 65 "<>" O ILE A 61 " d_HA=1.797 d_AD=2.796 a_DHA=166.743 symop: x,y,z a_YAH=153 2241 2328 "HD21 ASN A 144 "<>" OD2 ASP A 139 " d_HA=1.866 d_AD=2.776 a_DHA=146.211 symop: x,y,z a_YAH=109 5855 5907 " H ASP B 88 "<>" OD1 ASN B 85 " d_HA=1.908 d_AD=2.744 a_DHA=137.424 symop: x,y,z a_YAH=135 5855 5892 " H THR B 87 "<>" OD1 ASN B 85 " d_HA=2.058 d_AD=2.871 a_DHA=135.380 symop: x,y,z a_YAH=136 5857 5902 " H ASN B 85 "<>" O ASP B 88 " d_HA=2.235 d_AD=3.202 a_DHA=159.231 symop: x,y,z a_YAH=166 5142 5918 " H VAL B 89 "<>" O ILE B 44 " d_HA=2.174 d_AD=3.102 a_DHA=151.842 symop: x,y,z a_YAH=126 5161 5370 " H VAL B 56 "<>" O LYS B 45 " d_HA=1.980 d_AD=2.826 a_DHA=139.239 symop: x,y,z a_YAH=129 5189 5888 " H LYS B 46 "<>" O THR B 87 " d_HA=1.832 d_AD=2.828 a_DHA=165.971 symop: x,y,z a_YAH=154 5668 6491 " HE2 HIS B 73 "<>" O ASN B 125 " d_HA=1.816 d_AD=2.822 a_DHA=168.793 symop: x,y,z a_YAH=124 5696 6436 "HD22 ASN B 75 "<>" O GLN B 122 " d_HA=1.838 d_AD=2.787 a_DHA=153.954 symop: x,y,z a_YAH=124 6506 6453 " H GLY B 126 "<>" O ILE B 123 " d_HA=2.229 d_AD=3.050 a_DHA=136.939 symop: x,y,z a_YAH=99 8747 8816 " HG SER B 269 "<>" O THR B 265 " d_HA=2.775 d_AD=3.567 a_DHA=140.057 symop: x,y,z a_YAH=122 8747 8812 " H SER B 269 "<>" O THR B 265 " d_HA=2.285 d_AD=3.291 a_DHA=171.870 symop: x,y,z a_YAH=147 8749 8786 " H GLN B 267 "<>" OG1 THR B 265 " d_HA=1.975 d_AD=2.915 a_DHA=152.852 symop: x,y,z a_YAH=140 a_YAH=97 8749 8802 " H ASP B 268 "<>" OG1 THR B 265 " d_HA=2.852 d_AD=3.750 a_DHA=147.335 symop: x,y,z a_YAH=124 a_YAH=113 8761 8816 " HG SER B 269 "<>" O ILE B 266 " d_HA=2.540 d_AD=3.205 a_DHA=126.197 symop: x,y,z a_YAH=93 8761 8825 " H LEU B 270 "<>" O ILE B 266 " d_HA=2.381 d_AD=3.332 a_DHA=155.811 symop: x,y,z a_YAH=135 8751 8801 " H THR B 265 "<>" OD2 ASP B 268 " d_HA=1.980 d_AD=2.958 a_DHA=159.532 symop: x,y,z a_YAH=120 2509 2540 "HH11 ARG A 156 "<>" O PRO A 155 " d_HA=1.922 d_AD=2.916 a_DHA=162.676 symop: x,y,z a_YAH=146 1797 1845 " H GLU A 115 "<>" OG1 THR A 112 " d_HA=2.829 d_AD=3.707 a_DHA=145.595 symop: x,y,z a_YAH=137 a_YAH=110 1802 1843 " HG1 THR A 112 "<>" OE1 GLU A 115 " d_HA=1.562 d_AD=2.534 a_DHA=164.407 symop: x,y,z a_YAH=124 981 1054 " H SER A 66 "<>" O GLU A 62 " d_HA=1.739 d_AD=2.689 a_DHA=153.873 symop: x,y,z a_YAH=125 950 1026 " H GLU A 64 "<>" O ASP A 60 " d_HA=1.773 d_AD=2.778 a_DHA=169.381 symop: x,y,z a_YAH=151 996 1067 " H ILE A 67 "<>" O ARG A 63 " d_HA=1.900 d_AD=2.823 a_DHA=149.495 symop: x,y,z a_YAH=161 1014 2658 "HH12 ARG A 63 "<>" O GLY A 163 " d_HA=2.489 d_AD=3.282 a_DHA=135.669 symop: x,y,z a_YAH=113 2922 2989 " H VAL A 184 "<>" O THR A 180 " d_HA=2.426 d_AD=3.389 a_DHA=158.644 symop: x,y,z a_YAH=172 2922 2973 " H PHE A 183 "<>" O THR A 180 " d_HA=2.991 d_AD=3.617 a_DHA=121.146 symop: x,y,z a_YAH=118 3519 3607 " H GLY A 219 "<>" OG1 THR A 225 " d_HA=2.141 d_AD=3.144 a_DHA=171.011 symop: x,y,z a_YAH=113 a_YAH=107 3499 5872 " H LYS B 86 "<>" O LEU A 218 " d_HA=1.940 d_AD=2.916 a_DHA=160.091 symop: -y+1,x,z+1/4 a_YAH=163 8754 8784 " HG1 THR B 265 "<>" OE1 GLN B 267 " d_HA=1.844 d_AD=2.660 a_DHA=139.185 symop: x,y,z a_YAH=137 1529 2583 " HZ2 LYS A 158 "<>" OE2 GLU A 94 " d_HA=1.765 d_AD=2.675 a_DHA=145.766 symop: x,y,z a_YAH=107 1190 2582 " HZ1 LYS A 158 "<>" O PRO A 74 " d_HA=1.939 d_AD=2.948 a_DHA=173.130 symop: x,y,z a_YAH=142 1958 2552 " H ILE A 157 "<>" OE1 GLN A 122 " d_HA=2.212 d_AD=3.171 a_DHA=157.638 symop: x,y,z a_YAH=97 1013 2684 "HH11 ARG A 63 "<>" O ALA A 165 " d_HA=2.090 d_AD=2.779 a_DHA=123.570 symop: x,y,z a_YAH=159 2697 2717 " H LYS A 167 "<>" ND1 HIS A 166 " d_HA=2.214 d_AD=3.161 a_DHA=154.384 symop: x,y,z a_YAH=100 a_YAH=131 2985 3254 " HE1 TRP A 201 "<>" O VAL A 184 " d_HA=2.454 d_AD=3.152 a_DHA=125.124 symop: x,y,z a_YAH=107 5255 5307 " HG SER B 52 "<>" OG1 THR B 49 " d_HA=2.784 d_AD=3.496 a_DHA=130.816 symop: x,y,z a_YAH=121 a_YAH=132 5302 5319 " H ARG B 53 "<>" OG SER B 52 " d_HA=2.022 d_AD=2.860 a_DHA=138.358 symop: x,y,z a_YAH=93 a_YAH=149 1528 1257 " H THR A 78 "<>" OE1 GLU A 94 " d_HA=1.975 d_AD=2.850 a_DHA=142.387 symop: x,y,z a_YAH=138 1218 2584 " HZ3 LYS A 158 "<>" O VAL A 76 " d_HA=2.141 d_AD=2.800 a_DHA=120.408 symop: x,y,z a_YAH=126 2352 2572 " H LYS A 158 "<>" O MET A 146 " d_HA=1.882 d_AD=2.795 a_DHA=147.540 symop: x,y,z a_YAH=164 3001 3063 " H VAL A 189 "<>" O ALA A 185 " d_HA=2.492 d_AD=3.426 a_DHA=153.383 symop: x,y,z a_YAH=160 3662 3703 " H VAL A 232 "<>" O VAL A 229 " d_HA=1.975 d_AD=2.856 a_DHA=143.952 symop: x,y,z a_YAH=100 3648 3720 " H ASN A 233 "<>" O ASN A 228 " d_HA=1.905 d_AD=2.873 a_DHA=158.393 symop: x,y,z a_YAH=139 3718 5883 " HZ2 LYS B 86 "<>" OD1 ASN A 233 " d_HA=2.222 d_AD=2.888 a_DHA=122.159 symop: -y+1,x,z+1/4 a_YAH=140 6338 6277 " H ALA B 116 "<>" O THR B 112 " d_HA=1.908 d_AD=2.896 a_DHA=162.832 symop: x,y,z a_YAH=166 6295 8396 " HG SER B 245 "<>" OE1 GLU B 113 " d_HA=1.663 d_AD=2.652 a_DHA=171.506 symop: x,y,z a_YAH=126 6295 8903 " HE1 TRP B 274 "<>" OE1 GLU B 113 " d_HA=2.079 d_AD=3.037 a_DHA=155.089 symop: x,y,z a_YAH=140 6296 8382 " HG1 THR B 244 "<>" OE2 GLU B 113 " d_HA=2.186 d_AD=3.113 a_DHA=159.581 symop: x,y,z a_YAH=148 6296 8392 " H SER B 245 "<>" OE2 GLU B 113 " d_HA=2.022 d_AD=2.989 a_DHA=157.652 symop: x,y,z a_YAH=117 101 182 " HH TYR A 12 "<>" OE2 GLU A 7 " d_HA=1.709 d_AD=2.674 a_DHA=166.031 symop: x,y,z a_YAH=148 275 377 " H LEU A 19 "<>" O VAL A 27 " d_HA=1.906 d_AD=2.879 a_DHA=160.540 symop: x,y,z a_YAH=131 5517 5568 " H LEU B 68 "<>" O VAL B 65 " d_HA=2.586 d_AD=3.232 a_DHA=121.263 symop: x,y,z a_YAH=98 5517 5588 " H LYS B 69 "<>" O VAL B 65 " d_HA=1.936 d_AD=2.925 a_DHA=163.166 symop: x,y,z a_YAH=160 7183 6672 " H HIS B 166 "<>" O ALA B 136 " d_HA=1.887 d_AD=2.811 a_DHA=149.651 symop: x,y,z a_YAH=150 6306 6366 " H GLU B 118 "<>" O GLU B 114 " d_HA=2.191 d_AD=3.180 a_DHA=163.256 symop: x,y,z a_YAH=148 6291 6350 " H THR B 117 "<>" O GLU B 113 " d_HA=2.069 d_AD=3.071 a_DHA=167.202 symop: x,y,z a_YAH=139 6291 6353 " HG1 THR B 117 "<>" O GLU B 113 " d_HA=2.364 d_AD=3.289 a_DHA=159.054 symop: x,y,z a_YAH=146 8391 8431 " H ALA B 248 "<>" OG SER B 245 " d_HA=2.092 d_AD=3.076 a_DHA=162.741 symop: x,y,z a_YAH=142 a_YAH=106 8391 8415 " H LEU B 247 "<>" OG SER B 245 " d_HA=2.870 d_AD=3.586 a_DHA=128.448 symop: x,y,z a_YAH=91 a_YAH=162 8389 8445 " H LYS B 249 "<>" O SER B 245 " d_HA=2.173 d_AD=3.177 a_DHA=168.675 symop: x,y,z a_YAH=155 8400 8466 " H ASP B 250 "<>" O ALA B 246 " d_HA=2.180 d_AD=3.064 a_DHA=144.960 symop: x,y,z a_YAH=124 73 100 "HH12 ARG A 5 "<>" OE1 GLU A 7 " d_HA=1.716 d_AD=2.668 a_DHA=152.046 symop: x,y,z a_YAH=146 75 100 "HH22 ARG A 5 "<>" OE1 GLU A 7 " d_HA=1.752 d_AD=2.709 a_DHA=152.845 symop: x,y,z a_YAH=145 361 648 " H PHE A 43 "<>" O VAL A 26 " d_HA=2.055 d_AD=3.047 a_DHA=165.616 symop: x,y,z a_YAH=161 399 608 " H LYS A 28 "<>" O ALA A 41 " d_HA=2.173 d_AD=3.121 a_DHA=154.653 symop: x,y,z a_YAH=133 289 381 " H VAL A 27 "<>" O GLY A 20 " d_HA=2.025 d_AD=2.882 a_DHA=140.675 symop: x,y,z a_YAH=155 4556 4583 "HH21 ARG B 5 "<>" OE2 GLU B 7 " d_HA=1.709 d_AD=2.694 a_DHA=159.009 symop: x,y,z a_YAH=129 4553 4582 " HE ARG B 5 "<>" OE1 GLU B 7 " d_HA=1.989 d_AD=2.989 a_DHA=164.281 symop: x,y,z a_YAH=100 4554 5790 "HH11 ARG B 5 "<>" OE2 GLU B 81 " d_HA=1.950 d_AD=2.948 a_DHA=163.976 symop: x,y,z a_YAH=129 5502 5568 " H LEU B 68 "<>" O GLU B 64 " d_HA=2.284 d_AD=3.210 a_DHA=150.753 symop: x,y,z a_YAH=150 5478 5549 " H ILE B 67 "<>" O ARG B 63 " d_HA=1.987 d_AD=2.996 a_DHA=170.130 symop: x,y,z a_YAH=163 6360 6987 " HZ3 LYS B 154 "<>" O GLU B 118 " d_HA=1.844 d_AD=2.839 a_DHA=162.829 symop: x,y,z a_YAH=102 6346 6420 " H LYS B 121 "<>" O THR B 117 " d_HA=1.776 d_AD=2.774 a_DHA=165.944 symop: x,y,z a_YAH=154 8410 8481 " H PHE B 251 "<>" O LEU B 247 " d_HA=1.793 d_AD=2.787 a_DHA=164.352 symop: x,y,z a_YAH=145 8859 8898 " H TRP B 274 "<>" ND1 HIS B 272 " d_HA=2.046 d_AD=2.917 a_DHA=143.016 symop: x,y,z a_YAH=121 a_YAH=127 8465 8552 " HE ARG B 254 "<>" OD2 ASP B 250 " d_HA=1.869 d_AD=2.833 a_DHA=156.046 symop: x,y,z a_YAH=128 8465 8869 " HE2 HIS B 272 "<>" OD2 ASP B 250 " d_HA=1.879 d_AD=2.885 a_DHA=168.019 symop: x,y,z a_YAH=141 1343 1448 " H TYR A 83 "<>" O ILE A 90 " d_HA=1.993 d_AD=2.994 a_DHA=167.673 symop: x,y,z a_YAH=152 618 1472 " H LEU A 91 "<>" O LYS A 42 " d_HA=1.873 d_AD=2.826 a_DHA=155.519 symop: x,y,z a_YAH=167 624 1467 " H LYS A 42 "<>" O LEU A 91 " d_HA=1.992 d_AD=2.958 a_DHA=157.439 symop: x,y,z a_YAH=156 4583 4664 " HH TYR B 12 "<>" OE2 GLU B 7 " d_HA=1.630 d_AD=2.580 a_DHA=160.858 symop: x,y,z a_YAH=123 4537 5843 " H GLU B 84 "<>" O ARG B 5 " d_HA=1.906 d_AD=2.816 a_DHA=147.208 symop: x,y,z a_YAH=164 4545 5800 " H ARG B 5 "<>" O VAL B 82 " d_HA=2.234 d_AD=3.217 a_DHA=163.318 symop: x,y,z a_YAH=147 5444 5521 " H VAL B 65 "<>" O ILE B 61 " d_HA=1.931 d_AD=2.929 a_DHA=165.908 symop: x,y,z a_YAH=155 5432 5508 " H GLU B 64 "<>" O ASP B 60 " d_HA=1.750 d_AD=2.756 a_DHA=172.447 symop: x,y,z a_YAH=172 5432 5486 " H ARG B 63 "<>" O ASP B 60 " d_HA=1.961 d_AD=2.758 a_DHA=133.758 symop: x,y,z a_YAH=98 5435 5495 "HH11 ARG B 63 "<>" OD1 ASP B 60 " d_HA=2.814 d_AD=3.490 a_DHA=124.833 symop: x,y,z a_YAH=133 5435 7340 " HZ3 LYS B 175 "<>" OD1 ASP B 60 " d_HA=1.755 d_AD=2.676 a_DHA=148.037 symop: x,y,z a_YAH=106 7349 7597 " H ASN B 176 "<>" OE2 GLU B 192 " d_HA=2.693 d_AD=3.358 a_DHA=123.315 symop: x,y,z a_YAH=104 8797 8863 " H HIS B 272 "<>" O ASP B 268 " d_HA=2.016 d_AD=2.769 a_DHA=129.221 symop: x,y,z a_YAH=150 8856 8916 " H ILE B 275 "<>" O HIS B 272 " d_HA=1.752 d_AD=2.673 a_DHA=149.861 symop: x,y,z a_YAH=135 8856 8936 " H LYS B 276 "<>" O HIS B 272 " d_HA=1.806 d_AD=2.817 a_DHA=175.596 symop: x,y,z a_YAH=136 1883 1949 " HZ2 LYS A 121 "<>" OE2 GLU A 118 " d_HA=1.758 d_AD=2.765 a_DHA=164.737 symop: x,y,z a_YAH=153 636 1025 " HZ3 LYS A 42 "<>" OE2 GLU A 64 " d_HA=2.363 d_AD=3.141 a_DHA=132.470 symop: x,y,z a_YAH=94 1025 2646 " H PHE A 162 "<>" OE2 GLU A 64 " d_HA=2.032 d_AD=2.822 a_DHA=132.601 symop: x,y,z a_YAH=129 2285 2308 " HZ2 LYS A 141 "<>" OE1 GLU A 143 " d_HA=2.509 d_AD=3.419 a_DHA=148.238 symop: x,y,z a_YAH=127 5199 5841 " HZ1 LYS B 46 "<>" OE1 GLU B 84 " d_HA=1.659 d_AD=2.607 a_DHA=151.979 symop: x,y,z a_YAH=138 5200 5852 " HZ2 LYS B 46 "<>" O ASN B 85 " d_HA=1.678 d_AD=2.675 a_DHA=166.941 symop: x,y,z a_YAH=154 5411 5841 "HH12 ARG B 58 "<>" OE1 GLU B 84 " d_HA=1.749 d_AD=2.664 a_DHA=145.880 symop: x,y,z a_YAH=94 5382 5437 " H ASP B 60 "<>" O SER B 57 " d_HA=2.467 d_AD=3.407 a_DHA=155.402 symop: x,y,z a_YAH=96 5382 5449 " H ILE B 61 "<>" O SER B 57 " d_HA=1.935 d_AD=2.913 a_DHA=161.954 symop: x,y,z a_YAH=145 5389 5436 " HG SER B 57 "<>" OD2 ASP B 60 " d_HA=1.742 d_AD=2.712 a_DHA=165.352 symop: x,y,z a_YAH=128 4157 4186 " H LYS A 261 "<>" OD1 ASP A 259 " d_HA=2.372 d_AD=3.207 a_DHA=138.880 symop: x,y,z a_YAH=144 4158 4219 " HZ2 LYS A 262 "<>" OD2 ASP A 259 " d_HA=1.808 d_AD=2.714 a_DHA=144.722 symop: x,y,z a_YAH=156 8780 8845 " H GLN B 271 "<>" O GLN B 267 " d_HA=1.893 d_AD=2.806 a_DHA=147.824 symop: x,y,z a_YAH=147 8780 8851 "HE21 GLN B 271 "<>" O GLN B 267 " d_HA=2.731 d_AD=3.640 a_DHA=150.099 symop: x,y,z a_YAH=133 1878 1960 " H GLN A 122 "<>" O GLU A 118 " d_HA=1.932 d_AD=2.866 a_DHA=151.346 symop: x,y,z a_YAH=140 1824 1884 " H GLU A 118 "<>" O GLU A 114 " d_HA=2.851 d_AD=3.557 a_DHA=127.154 symop: x,y,z a_YAH=133 1795 1856 " H ALA A 116 "<>" O THR A 112 " d_HA=1.790 d_AD=2.679 a_DHA=144.423 symop: x,y,z a_YAH=164 1809 1868 " H THR A 117 "<>" O GLU A 113 " d_HA=1.905 d_AD=2.876 a_DHA=158.078 symop: x,y,z a_YAH=148 1809 1871 " HG1 THR A 117 "<>" O GLU A 113 " d_HA=2.376 d_AD=3.266 a_DHA=151.859 symop: x,y,z a_YAH=132 1020 1086 " H LEU A 68 "<>" O GLU A 64 " d_HA=1.912 d_AD=2.910 a_DHA=165.360 symop: x,y,z a_YAH=145 1035 1106 " H LYS A 69 "<>" O VAL A 65 " d_HA=1.856 d_AD=2.809 a_DHA=154.567 symop: x,y,z a_YAH=156 2213 2626 " HE2 HIS A 137 "<>" O ASP A 161 " d_HA=2.105 d_AD=3.034 a_DHA=149.854 symop: x,y,z a_YAH=106 2237 2274 " H LYS A 141 "<>" O ASP A 139 " d_HA=2.247 d_AD=2.937 a_DHA=124.059 symop: x,y,z a_YAH=115 2237 2329 "HD22 ASN A 144 "<>" O ASP A 139 " d_HA=1.833 d_AD=2.812 a_DHA=161.330 symop: x,y,z a_YAH=146 2249 3269 " HG SER A 202 "<>" O LEU A 140 " d_HA=2.032 d_AD=2.914 a_DHA=150.244 symop: x,y,z a_YAH=114 2955 3461 " HG SER A 215 "<>" OE2 GLU A 182 " d_HA=1.559 d_AD=2.527 a_DHA=161.591 symop: x,y,z a_YAH=162 3790 5246 "HH11 ARG B 48 "<>" OE2 GLU A 237 " d_HA=1.843 d_AD=2.758 a_DHA=146.320 symop: -y+1,x,z+1/4 a_YAH=118 5213 5366 " H ARG B 47 "<>" O VAL B 56 " d_HA=1.972 d_AD=2.721 a_DHA=128.472 symop: x,y,z a_YAH=146 5221 5300 " HE ARG B 47 "<>" O SER B 52 " d_HA=2.921 d_AD=3.655 a_DHA=130.323 symop: x,y,z a_YAH=151 4166 4232 " H ARG A 263 "<>" O PRO A 260 " d_HA=2.160 d_AD=3.083 a_DHA=150.833 symop: x,y,z a_YAH=105 4154 4208 " H LYS A 262 "<>" O ASP A 259 " d_HA=1.967 d_AD=2.917 a_DHA=154.440 symop: x,y,z a_YAH=120 4357 4465 " HZ2 LYS A 276 "<>" O GLN A 271 " d_HA=2.237 d_AD=3.032 a_DHA=134.272 symop: x,y,z a_YAH=129 4374 4434 " H ILE A 275 "<>" O HIS A 272 " d_HA=1.868 d_AD=2.708 a_DHA=138.303 symop: x,y,z a_YAH=134 1173 1222 " H VAL A 76 "<>" O HIS A 73 " d_HA=2.566 d_AD=3.514 a_DHA=155.625 symop: x,y,z a_YAH=114 1176 1209 " H ASN A 75 "<>" ND1 HIS A 73 " d_HA=2.393 d_AD=3.314 a_DHA=150.895 symop: x,y,z a_YAH=140 a_YAH=104 1207 1966 "HE21 GLN A 122 "<>" OD1 ASN A 75 " d_HA=1.895 d_AD=2.770 a_DHA=142.327 symop: x,y,z a_YAH=124 1954 2014 " H ASN A 125 "<>" O GLN A 122 " d_HA=2.667 d_AD=3.373 a_DHA=126.870 symop: x,y,z a_YAH=97 1954 2024 " H GLY A 126 "<>" O GLN A 122 " d_HA=2.485 d_AD=3.300 a_DHA=136.801 symop: x,y,z a_YAH=141 1893 1976 " H ILE A 123 "<>" O PHE A 119 " d_HA=2.099 d_AD=3.079 a_DHA=160.813 symop: x,y,z a_YAH=151 1854 1918 " H LEU A 120 "<>" O ALA A 116 " d_HA=2.077 d_AD=3.062 a_DHA=162.900 symop: x,y,z a_YAH=150 1127 2728 " HZ2 LYS A 167 "<>" OE2 GLU A 70 " d_HA=1.972 d_AD=2.720 a_DHA=127.752 symop: x,y,z a_YAH=114 2190 2701 " H HIS A 166 "<>" O ALA A 136 " d_HA=2.046 d_AD=2.969 a_DHA=149.997 symop: x,y,z a_YAH=147 2200 2242 " H ASP A 139 "<>" O HIS A 137 " d_HA=1.928 d_AD=2.863 a_DHA=151.993 symop: x,y,z a_YAH=97 2207 3213 " H HIS A 137 "<>" OD2 ASP A 199 " d_HA=1.796 d_AD=2.798 a_DHA=165.885 symop: x,y,z a_YAH=101 2225 3212 " H PHE A 138 "<>" OD1 ASP A 199 " d_HA=1.733 d_AD=2.701 a_DHA=157.132 symop: x,y,z a_YAH=135 2965 3254 " HE1 TRP A 201 "<>" O PHE A 183 " d_HA=2.505 d_AD=3.191 a_DHA=124.160 symop: x,y,z a_YAH=112 3754 5249 "HH22 ARG B 48 "<>" OE1 GLU A 235 " d_HA=1.888 d_AD=2.636 a_DHA=127.007 symop: -y+1,x,z+1/4 a_YAH=91 3754 5884 " HZ3 LYS B 86 "<>" OE1 GLU A 235 " d_HA=1.774 d_AD=2.774 a_DHA=163.369 symop: -y+1,x,z+1/4 a_YAH=147 3755 5247 "HH12 ARG B 48 "<>" OE2 GLU A 235 " d_HA=1.884 d_AD=2.861 a_DHA=159.852 symop: -y+1,x,z+1/4 a_YAH=95 4429 4464 " HZ1 LYS A 276 "<>" O ILE A 275 " d_HA=1.822 d_AD=2.733 a_DHA=146.898 symop: x,y,z a_YAH=123 1162 2075 " H GLN A 72 "<>" OH TYR A 129 " d_HA=1.954 d_AD=2.950 a_DHA=167.710 symop: x,y,z a_YAH=111 a_YAH=92 3412 3334 " H LEU A 211 "<>" O THR A 207 " d_HA=2.240 d_AD=3.071 a_DHA=138.501 symop: x,y,z a_YAH=144 3412 3348 " H LEU A 211 "<>" O TYR A 208 " d_HA=2.607 d_AD=3.326 a_DHA=128.014 symop: x,y,z a_YAH=91 3800 3856 " H PHE A 241 "<>" O ASP A 238 " d_HA=2.262 d_AD=3.115 a_DHA=141.145 symop: x,y,z a_YAH=97 3800 3871 " H SER A 242 "<>" O ASP A 238 " d_HA=1.923 d_AD=2.800 a_DHA=142.471 symop: x,y,z a_YAH=149 2192 2694 " H ALA A 136 "<>" O HIS A 166 " d_HA=2.329 d_AD=3.289 a_DHA=157.518 symop: x,y,z a_YAH=155 3199 3265 " H SER A 202 "<>" O ALA A 198 " d_HA=2.278 d_AD=3.276 a_DHA=168.013 symop: x,y,z a_YAH=148 3199 3249 " H TRP A 201 "<>" O ALA A 198 " d_HA=2.628 d_AD=3.437 a_DHA=136.636 symop: x,y,z a_YAH=96 3249 3184 " H TRP A 201 "<>" O GLU A 197 " d_HA=2.175 d_AD=2.922 a_DHA=128.980 symop: x,y,z a_YAH=143 3738 3699 " H TYR A 234 "<>" O VAL A 232 " d_HA=2.268 d_AD=3.085 a_DHA=137.013 symop: x,y,z a_YAH=100 440 577 " H CYS A 30 "<>" O TYR A 39 " d_HA=1.779 d_AD=2.787 a_DHA=171.489 symop: x,y,z a_YAH=137 393 610 " H ALA A 41 "<>" O LYS A 28 " d_HA=2.037 d_AD=2.999 a_DHA=157.748 symop: x,y,z a_YAH=154 7176 6674 " H ALA B 136 "<>" O HIS B 166 " d_HA=1.908 d_AD=2.864 a_DHA=155.676 symop: x,y,z a_YAH=173 598 1510 " H LEU A 93 "<>" O ALA A 40 " d_HA=2.130 d_AD=3.097 a_DHA=158.934 symop: x,y,z a_YAH=146 600 1505 " H ALA A 40 "<>" O LEU A 93 " d_HA=2.352 d_AD=3.342 a_DHA=164.532 symop: x,y,z a_YAH=156 5463 5536 " H SER B 66 "<>" O GLU B 62 " d_HA=1.914 d_AD=2.836 a_DHA=149.149 symop: x,y,z a_YAH=132 5497 7291 "HH21 ARG B 63 "<>" OE1 GLU B 173 " d_HA=1.785 d_AD=2.781 a_DHA=161.234 symop: x,y,z a_YAH=104 7199 7291 " H LYS B 167 "<>" OE1 GLU B 173 " d_HA=2.771 d_AD=3.696 a_DHA=151.954 symop: x,y,z a_YAH=141 6365 6430 " HZ1 LYS B 121 "<>" OE2 GLU B 118 " d_HA=1.671 d_AD=2.697 a_DHA=178.583 symop: x,y,z a_YAH=122 1307 1351 " HH TYR A 83 "<>" OE1 GLU A 81 " d_HA=1.736 d_AD=2.702 a_DHA=165.799 symop: x,y,z a_YAH=162 1303 1491 " H ILE A 92 "<>" O GLU A 81 " d_HA=2.103 d_AD=3.065 a_DHA=157.780 symop: x,y,z a_YAH=155 1293 1486 " H HIS A 80 "<>" O ILE A 92 " d_HA=1.854 d_AD=2.858 a_DHA=168.417 symop: x,y,z a_YAH=134 1602 1657 " H ASP A 103 "<>" OE1 GLU A 100 " d_HA=2.672 d_AD=3.657 a_DHA=163.671 symop: x,y,z a_YAH=120 4485 5412 "HH21 ARG B 58 "<>" O THR B 2 " d_HA=2.020 d_AD=2.852 a_DHA=138.172 symop: x,y,z a_YAH=162 4489 5468 " H1 THR B 2 "<>" OE2 GLU B 62 " d_HA=1.913 d_AD=2.870 a_DHA=155.250 symop: x,y,z a_YAH=128 5412 5468 "HH21 ARG B 58 "<>" OE2 GLU B 62 " d_HA=2.952 d_AD=3.730 a_DHA=134.611 symop: x,y,z a_YAH=138 5393 5469 " H GLU B 62 "<>" O ARG B 58 " d_HA=1.752 d_AD=2.766 a_DHA=176.305 symop: x,y,z a_YAH=171 5417 5495 "HH11 ARG B 63 "<>" O GLU B 59 " d_HA=2.376 d_AD=3.080 a_DHA=126.072 symop: x,y,z a_YAH=145 2784 2811 " H GLU A 173 "<>" O GLY A 171 " d_HA=2.287 d_AD=3.149 a_DHA=142.178 symop: x,y,z a_YAH=94 3078 4148 " HZ1 LYS A 258 "<>" OD1 ASN A 190 " d_HA=1.844 d_AD=2.725 a_DHA=142.401 symop: x,y,z a_YAH=152 3678 4150 " HZ3 LYS A 258 "<>" O SER A 230 " d_HA=2.655 d_AD=3.611 a_DHA=157.598 symop: x,y,z a_YAH=124 1253 1530 " H GLU A 94 "<>" O THR A 78 " d_HA=1.906 d_AD=2.902 a_DHA=166.234 symop: x,y,z a_YAH=165 2268 2324 " H ASN A 144 "<>" O LYS A 141 " d_HA=2.166 d_AD=3.101 a_DHA=153.057 symop: x,y,z a_YAH=118 2268 2338 " H ILE A 145 "<>" O LYS A 141 " d_HA=2.330 d_AD=3.315 a_DHA=163.442 symop: x,y,z a_YAH=151 3844 5842 " HH TYR A 240 "<>" OE2 GLU B 84 " d_HA=1.727 d_AD=2.647 a_DHA=155.686 symop: -y+1,x,z+1/4 a_YAH=128 5409 5468 " HE ARG B 58 "<>" OE2 GLU B 62 " d_HA=2.418 d_AD=3.383 a_DHA=158.662 symop: x,y,z a_YAH=135 5413 5842 "HH22 ARG B 58 "<>" OE2 GLU B 84 " d_HA=1.804 d_AD=2.785 a_DHA=158.866 symop: x,y,z a_YAH=136 2785 5422 " H GLY A 171 "<>" OE2 GLU B 59 " d_HA=1.901 d_AD=2.754 a_DHA=139.083 symop: x,y,z a_YAH=132 3030 4242 "HH12 ARG A 263 "<>" OE2 GLU A 187 " d_HA=1.692 d_AD=2.704 a_DHA=168.051 symop: x,y,z a_YAH=116 3139 7588 " HH TYR B 191 "<>" O LEU A 194 " d_HA=1.673 d_AD=2.640 a_DHA=170.620 symop: x,y,z a_YAH=95 3029 4244 "HH22 ARG A 263 "<>" OE1 GLU A 187 " d_HA=1.699 d_AD=2.715 a_DHA=170.783 symop: x,y,z a_YAH=109 4132 4243 "HH21 ARG A 263 "<>" O LYS A 258 " d_HA=1.971 d_AD=2.875 a_DHA=147.924 symop: x,y,z a_YAH=137 4302 8946 " HZ1 LYS B 276 "<>" OE1 GLN A 267 " d_HA=2.110 d_AD=3.023 a_DHA=148.150 symop: x-1,y,z a_YAH=151 8843 8947 " HZ2 LYS B 276 "<>" OE1 GLN B 271 " d_HA=1.781 d_AD=2.796 a_DHA=173.623 symop: x,y,z a_YAH=149 1864 1938 " H LYS A 121 "<>" O THR A 117 " d_HA=1.729 d_AD=2.728 a_DHA=167.852 symop: x,y,z a_YAH=144 1866 1948 " HZ1 LYS A 121 "<>" OG1 THR A 117 " d_HA=2.116 d_AD=2.976 a_DHA=140.396 symop: x,y,z a_YAH=125 a_YAH=124 1814 4421 " HE1 TRP A 274 "<>" OE2 GLU A 113 " d_HA=1.866 d_AD=2.728 a_DHA=140.092 symop: x,y,z a_YAH=92 1814 3914 " HG SER A 245 "<>" OE2 GLU A 113 " d_HA=1.518 d_AD=2.524 a_DHA=177.081 symop: x,y,z a_YAH=117 1813 3910 " H SER A 245 "<>" OE1 GLU A 113 " d_HA=2.058 d_AD=3.051 a_DHA=162.211 symop: x,y,z a_YAH=147 1062 1128 " H GLU A 70 "<>" O ILE A 67 " d_HA=2.185 d_AD=3.185 a_DHA=168.092 symop: x,y,z a_YAH=125 1081 1142 " H ILE A 71 "<>" O LEU A 68 " d_HA=1.878 d_AD=2.865 a_DHA=163.144 symop: x,y,z a_YAH=126 3299 3374 " H ILE A 209 "<>" O VAL A 205 " d_HA=2.148 d_AD=3.130 a_DHA=162.386 symop: x,y,z a_YAH=157 3315 3393 " H LEU A 210 "<>" O ILE A 206 " d_HA=1.786 d_AD=2.789 a_DHA=168.977 symop: x,y,z a_YAH=166 3428 3446 " H ALA A 214 "<>" OG SER A 212 " d_HA=2.367 d_AD=3.228 a_DHA=142.932 symop: x,y,z a_YAH=115 a_YAH=112 3785 3836 " H TYR A 240 "<>" O GLU A 237 " d_HA=1.846 d_AD=2.789 a_DHA=153.452 symop: x,y,z a_YAH=116 3785 3856 " H PHE A 241 "<>" O GLU A 237 " d_HA=2.467 d_AD=3.137 a_DHA=123.121 symop: x,y,z a_YAH=140 2752 5223 "HH12 ARG B 47 "<>" O ASP A 169 " d_HA=1.990 d_AD=2.925 a_DHA=150.586 symop: x,y,z a_YAH=172 2756 5284 " HZ2 LYS B 50 "<>" OD2 ASP A 169 " d_HA=2.887 d_AD=3.669 a_DHA=134.047 symop: x,y,z a_YAH=148 3170 3188 " H LEU A 196 "<>" OE1 GLU A 197 " d_HA=1.898 d_AD=2.864 a_DHA=156.547 symop: x,y,z a_YAH=140 4116 4240 " HE ARG A 263 "<>" O VAL A 257 " d_HA=2.385 d_AD=3.308 a_DHA=152.180 symop: x,y,z a_YAH=136 4116 4243 "HH21 ARG A 263 "<>" O VAL A 257 " d_HA=2.701 d_AD=3.394 a_DHA=126.115 symop: x,y,z a_YAH=135 4279 4343 " H LEU A 270 "<>" O ILE A 266 " d_HA=2.030 d_AD=2.991 a_DHA=157.299 symop: x,y,z a_YAH=152 4279 4334 " HG SER A 269 "<>" O ILE A 266 " d_HA=1.836 d_AD=2.748 a_DHA=155.244 symop: x,y,z a_YAH=101 4298 4343 " H LEU A 270 "<>" O GLN A 267 " d_HA=2.826 d_AD=3.449 a_DHA=120.185 symop: x,y,z a_YAH=96 4315 4363 " H GLN A 271 "<>" O ASP A 268 " d_HA=2.358 d_AD=3.282 a_DHA=151.312 symop: x,y,z a_YAH=109 4377 4416 " H TRP A 274 "<>" ND1 HIS A 272 " d_HA=2.025 d_AD=3.019 a_DHA=166.040 symop: x,y,z a_YAH=129 a_YAH=120 3983 4070 " HE ARG A 254 "<>" OD2 ASP A 250 " d_HA=1.888 d_AD=2.905 a_DHA=169.318 symop: x,y,z a_YAH=129 2009 2076 " H TYR A 129 "<>" O ASN A 125 " d_HA=2.736 d_AD=3.719 a_DHA=164.510 symop: x,y,z a_YAH=144 1932 2019 "HD22 ASN A 125 "<>" O LYS A 121 " d_HA=1.739 d_AD=2.680 a_DHA=153.067 symop: x,y,z a_YAH=130 1932 2014 " H ASN A 125 "<>" O LYS A 121 " d_HA=2.499 d_AD=3.390 a_DHA=146.575 symop: x,y,z a_YAH=140 1990 2055 " H TYR A 128 "<>" O LEU A 124 " d_HA=2.187 d_AD=3.040 a_DHA=140.888 symop: x,y,z a_YAH=130 1913 1995 " H LEU A 124 "<>" O LEU A 120 " d_HA=2.033 d_AD=3.039 a_DHA=168.862 symop: x,y,z a_YAH=174 3848 3897 " H THR A 244 "<>" O PHE A 241 " d_HA=2.468 d_AD=3.157 a_DHA=124.663 symop: x,y,z a_YAH=127 3848 3973 " HZ1 LYS A 249 "<>" O PHE A 241 " d_HA=1.897 d_AD=2.886 a_DHA=161.061 symop: x,y,z a_YAH=141 3893 3974 " HZ2 LYS A 249 "<>" O THR A 244 " d_HA=1.803 d_AD=2.755 a_DHA=154.345 symop: x,y,z a_YAH=122 1126 2727 " HZ1 LYS A 167 "<>" OE1 GLU A 70 " d_HA=1.774 d_AD=2.732 a_DHA=154.175 symop: x,y,z a_YAH=105 3209 3278 " H ILE A 203 "<>" O ASP A 199 " d_HA=1.951 d_AD=2.960 a_DHA=170.085 symop: x,y,z a_YAH=151 3238 3293 " H GLY A 204 "<>" O TRP A 201 " d_HA=1.983 d_AD=2.778 a_DHA=132.973 symop: x,y,z a_YAH=110 3238 3303 " H VAL A 205 "<>" O TRP A 201 " d_HA=2.255 d_AD=3.191 a_DHA=152.645 symop: x,y,z a_YAH=149 3262 3320 " H ILE A 206 "<>" O SER A 202 " d_HA=1.953 d_AD=2.954 a_DHA=167.121 symop: x,y,z a_YAH=165 3273 3338 " H THR A 207 "<>" O ILE A 203 " d_HA=2.067 d_AD=3.036 a_DHA=159.422 symop: x,y,z a_YAH=137 3273 3341 " HG1 THR A 207 "<>" O ILE A 203 " d_HA=1.715 d_AD=2.684 a_DHA=171.906 symop: x,y,z a_YAH=154 3292 3357 " H TYR A 208 "<>" O GLY A 204 " d_HA=2.322 d_AD=3.283 a_DHA=157.675 symop: x,y,z a_YAH=144 3365 3750 " HH TYR A 208 "<>" O GLU A 235 " d_HA=1.684 d_AD=2.628 a_DHA=162.392 symop: x,y,z a_YAH=166 2107 2160 " H GLN A 134 "<>" O HIS A 131 " d_HA=2.224 d_AD=3.199 a_DHA=161.258 symop: x,y,z a_YAH=109 4054 4253 " H MET A 264 "<>" O ARG A 254 " d_HA=2.320 d_AD=3.298 a_DHA=162.950 symop: x,y,z a_YAH=164 4327 4381 " H HIS A 272 "<>" O SER A 269 " d_HA=2.272 d_AD=3.189 a_DHA=150.139 symop: x,y,z a_YAH=98 3918 3984 " H ASP A 250 "<>" O ALA A 246 " d_HA=1.994 d_AD=2.864 a_DHA=142.213 symop: x,y,z a_YAH=130 3928 3999 " H PHE A 251 "<>" O LEU A 247 " d_HA=1.967 d_AD=2.829 a_DHA=140.940 symop: x,y,z a_YAH=146 3933 3909 " H LEU A 247 "<>" OG SER A 245 " d_HA=2.298 d_AD=3.091 a_DHA=134.283 symop: x,y,z a_YAH=96 a_YAH=153 3999 3947 " H PHE A 251 "<>" O ALA A 248 " d_HA=2.284 d_AD=2.944 a_DHA=121.428 symop: x,y,z a_YAH=100 2023 2093 " H LEU A 130 "<>" O GLY A 126 " d_HA=2.950 d_AD=3.956 a_DHA=174.245 symop: x,y,z a_YAH=138 1971 2024 " H GLY A 126 "<>" O ILE A 123 " d_HA=2.158 d_AD=2.912 a_DHA=129.504 symop: x,y,z a_YAH=106 1971 2034 " H VAL A 127 "<>" O ILE A 123 " d_HA=1.999 d_AD=2.999 a_DHA=168.231 symop: x,y,z a_YAH=167 2088 2140 " H LEU A 133 "<>" O LEU A 130 " d_HA=2.134 d_AD=2.948 a_DHA=135.958 symop: x,y,z a_YAH=95 2088 2176 " H ILE A 135 "<>" O LEU A 130 " d_HA=2.126 d_AD=3.076 a_DHA=155.186 symop: x,y,z a_YAH=143 3226 3165 " H MET A 200 "<>" O LEU A 196 " d_HA=2.163 d_AD=3.120 a_DHA=156.605 symop: x,y,z a_YAH=142 3221 3293 " H GLY A 204 "<>" O MET A 200 " d_HA=2.732 d_AD=3.488 a_DHA=131.281 symop: x,y,z a_YAH=117 4265 4330 " H SER A 269 "<>" O THR A 265 " d_HA=1.897 d_AD=2.865 a_DHA=158.385 symop: x,y,z a_YAH=157 4267 4304 " H GLN A 267 "<>" OG1 THR A 265 " d_HA=2.489 d_AD=3.265 a_DHA=133.159 symop: x,y,z a_YAH=113 a_YAH=122 4269 4318 " H THR A 265 "<>" OD1 ASP A 268 " d_HA=1.875 d_AD=2.831 a_DHA=154.879 symop: x,y,z a_YAH=158 4272 4318 " HG1 THR A 265 "<>" OD1 ASP A 268 " d_HA=1.666 d_AD=2.630 a_DHA=164.152 symop: x,y,z a_YAH=125 4062 3979 " H ARG A 254 "<>" O ASP A 250 " d_HA=2.465 d_AD=3.324 a_DHA=141.876 symop: x,y,z a_YAH=128 4046 3982 " HE ARG A 253 "<>" OD1 ASP A 250 " d_HA=1.841 d_AD=2.830 a_DHA=160.767 symop: x,y,z a_YAH=148 433 6311 " HZ3 LYS A 29 "<>" OE2 GLU B 114 " d_HA=1.871 d_AD=2.861 a_DHA=160.810 symop: x-1,y+1,z a_YAH=143 437 586 " H TYR A 39 "<>" O CYS A 30 " d_HA=1.925 d_AD=2.776 a_DHA=139.374 symop: x,y,z a_YAH=143 472 524 " H THR A 35 "<>" O GLU A 32 " d_HA=2.869 d_AD=3.864 a_DHA=169.800 symop: x,y,z a_YAH=99 472 535 " H GLY A 36 "<>" O GLU A 32 " d_HA=2.637 d_AD=3.552 a_DHA=150.648 symop: x,y,z a_YAH=126 3085 3059 "HD22 ASN A 190 "<>" O VAL A 189 " d_HA=1.862 d_AD=2.756 a_DHA=144.801 symop: x,y,z a_YAH=104 466 487 "HH12 ARG A 31 "<>" O LYS A 33 " d_HA=1.877 d_AD=2.749 a_DHA=142.525 symop: x,y,z a_YAH=119 1591 2374 " H LEU A 147 "<>" O GLY A 99 " d_HA=2.066 d_AD=3.020 a_DHA=155.361 symop: x,y,z a_YAH=163 1598 1672 " H PHE A 104 "<>" O GLU A 100 " d_HA=2.155 d_AD=3.118 a_DHA=157.145 symop: x,y,z a_YAH=141 1618 2333 " H LEU A 101 "<>" O ILE A 145 " d_HA=1.890 d_AD=2.877 a_DHA=162.275 symop: x,y,z a_YAH=148 1632 1689 " H LEU A 105 "<>" O PHE A 102 " d_HA=2.533 d_AD=3.318 a_DHA=134.127 symop: x,y,z a_YAH=114 4505 1755 " H VAL B 3 "<>" OE2 GLU A 109 " d_HA=1.781 d_AD=2.805 a_DHA=176.936 symop: y,-x+1,z-1/4 a_YAH=131 4494 5467 " HG1 THR B 2 "<>" OE1 GLU B 62 " d_HA=1.709 d_AD=2.675 a_DHA=164.963 symop: x,y,z a_YAH=133 2805 7283 "HD22 ASN B 172 "<>" O GLU A 173 " d_HA=2.299 d_AD=3.132 a_DHA=139.072 symop: x,y,z a_YAH=179 3110 7282 "HD21 ASN B 172 "<>" O GLU A 192 " d_HA=2.736 d_AD=3.677 a_DHA=155.110 symop: x,y,z a_YAH=135 3025 3080 " H ASN A 190 "<>" O GLU A 187 " d_HA=1.991 d_AD=2.986 a_DHA=164.640 symop: x,y,z a_YAH=122 3011 4149 " HZ2 LYS A 258 "<>" O PRO A 186 " d_HA=1.782 d_AD=2.720 a_DHA=151.205 symop: x,y,z a_YAH=122 3691 3638 " H ALA A 231 "<>" O ALA A 227 " d_HA=2.523 d_AD=3.481 a_DHA=157.139 symop: x,y,z a_YAH=134 1260 1267 " HG1 THR A 78 "<>" O LEU A 79 " d_HA=2.184 d_AD=3.148 a_DHA=174.136 symop: x,y,z a_YAH=121 1239 2588 " H ILE A 77 "<>" O ILE A 159 " d_HA=1.963 d_AD=2.962 a_DHA=167.122 symop: x,y,z a_YAH=151 1257 1528 " H THR A 78 "<>" OE1 GLU A 94 " d_HA=1.975 d_AD=2.850 a_DHA=142.387 symop: x,y,z a_YAH=138 3369 3438 " H GLY A 213 "<>" O ILE A 209 " d_HA=1.894 d_AD=2.848 a_DHA=155.794 symop: x,y,z a_YAH=158 3369 3429 " H SER A 212 "<>" O ILE A 209 " d_HA=2.034 d_AD=3.009 a_DHA=161.084 symop: x,y,z a_YAH=113 3703 3662 " H VAL A 232 "<>" O VAL A 229 " d_HA=1.975 d_AD=2.856 a_DHA=143.952 symop: x,y,z a_YAH=100 4405 4454 " H LYS A 276 "<>" O TRP A 274 " d_HA=2.497 d_AD=3.282 a_DHA=133.728 symop: x,y,z a_YAH=94 3909 3933 " H LEU A 247 "<>" OG SER A 245 " d_HA=2.298 d_AD=3.091 a_DHA=134.283 symop: x,y,z a_YAH=96 a_YAH=153 3909 3949 " H ALA A 248 "<>" OG SER A 245 " d_HA=1.912 d_AD=2.921 a_DHA=173.281 symop: x,y,z a_YAH=159 a_YAH=93 3334 3412 " H LEU A 211 "<>" O THR A 207 " d_HA=2.240 d_AD=3.071 a_DHA=138.501 symop: x,y,z a_YAH=144 3348 3433 " HG SER A 212 "<>" O TYR A 208 " d_HA=1.654 d_AD=2.632 a_DHA=178.829 symop: x,y,z a_YAH=137 3348 3412 " H LEU A 211 "<>" O TYR A 208 " d_HA=2.607 d_AD=3.326 a_DHA=128.014 symop: x,y,z a_YAH=91 3856 3800 " H PHE A 241 "<>" O ASP A 238 " d_HA=2.262 d_AD=3.115 a_DHA=141.145 symop: x,y,z a_YAH=97 2154 2738 " H ILE A 168 "<>" O GLN A 134 " d_HA=2.074 d_AD=2.848 a_DHA=131.626 symop: x,y,z a_YAH=150 3184 3249 " H TRP A 201 "<>" O GLU A 197 " d_HA=2.175 d_AD=2.922 a_DHA=128.980 symop: x,y,z a_YAH=143 3184 4241 "HH11 ARG A 263 "<>" O GLU A 197 " d_HA=1.862 d_AD=2.849 a_DHA=164.980 symop: x,y,z a_YAH=105 3699 3738 " H TYR A 234 "<>" O VAL A 232 " d_HA=2.268 d_AD=3.085 a_DHA=137.013 symop: x,y,z a_YAH=100 4304 4267 " H GLN A 267 "<>" OG1 THR A 265 " d_HA=2.489 d_AD=3.265 a_DHA=133.159 symop: x,y,z a_YAH=113 a_YAH=122 4330 4265 " H SER A 269 "<>" O THR A 265 " d_HA=1.897 d_AD=2.865 a_DHA=158.385 symop: x,y,z a_YAH=157 3979 4062 " H ARG A 254 "<>" O ASP A 250 " d_HA=2.465 d_AD=3.324 a_DHA=141.876 symop: x,y,z a_YAH=128 3982 4046 " HE ARG A 253 "<>" OD1 ASP A 250 " d_HA=1.841 d_AD=2.830 a_DHA=160.767 symop: x,y,z a_YAH=148 3982 4049 "HH21 ARG A 253 "<>" OD1 ASP A 250 " d_HA=2.163 d_AD=3.052 a_DHA=144.891 symop: x,y,z a_YAH=105 3907 3963 " H LYS A 249 "<>" O SER A 245 " d_HA=2.272 d_AD=3.259 a_DHA=163.978 symop: x,y,z a_YAH=137 1122 2084 " HH TYR A 129 "<>" O GLU A 70 " d_HA=2.540 d_AD=3.366 a_DHA=143.588 symop: x,y,z a_YAH=135 2093 2023 " H LEU A 130 "<>" O GLY A 126 " d_HA=2.950 d_AD=3.956 a_DHA=174.245 symop: x,y,z a_YAH=138 2140 2088 " H LEU A 133 "<>" O LEU A 130 " d_HA=2.134 d_AD=2.948 a_DHA=135.958 symop: x,y,z a_YAH=95 2176 2088 " H ILE A 135 "<>" O LEU A 130 " d_HA=2.126 d_AD=3.076 a_DHA=155.186 symop: x,y,z a_YAH=143 3165 3226 " H MET A 200 "<>" O LEU A 196 " d_HA=2.163 d_AD=3.120 a_DHA=156.605 symop: x,y,z a_YAH=142 4078 4120 " H VAL A 257 "<>" O LEU A 255 " d_HA=2.123 d_AD=2.992 a_DHA=142.195 symop: x,y,z a_YAH=102 4011 4083 " H LEU A 255 "<>" O ILE A 252 " d_HA=1.980 d_AD=2.908 a_DHA=151.413 symop: x,y,z a_YAH=105 4011 4102 " H LEU A 256 "<>" O ILE A 252 " d_HA=1.806 d_AD=2.781 a_DHA=160.618 symop: x,y,z a_YAH=164 3957 4038 " H ARG A 253 "<>" O LYS A 249 " d_HA=2.274 d_AD=3.186 a_DHA=148.759 symop: x,y,z a_YAH=144 2046 2127 " H SER A 132 "<>" O TYR A 128 " d_HA=1.941 d_AD=2.900 a_DHA=156.548 symop: x,y,z a_YAH=153 3947 3999 " H PHE A 251 "<>" O ALA A 248 " d_HA=2.284 d_AD=2.944 a_DHA=121.428 symop: x,y,z a_YAH=100 3947 4016 " H ILE A 252 "<>" O ALA A 248 " d_HA=2.459 d_AD=3.344 a_DHA=145.824 symop: x,y,z a_YAH=173 2030 2114 " H HIS A 131 "<>" O VAL A 127 " d_HA=1.797 d_AD=2.803 a_DHA=171.809 symop: x,y,z a_YAH=168 2127 2046 " H SER A 132 "<>" O TYR A 128 " d_HA=1.941 d_AD=2.900 a_DHA=156.548 symop: x,y,z a_YAH=153 3991 4062 " H ARG A 254 "<>" O PHE A 251 " d_HA=2.168 d_AD=2.969 a_DHA=134.425 symop: x,y,z a_YAH=118 4038 3957 " H ARG A 253 "<>" O LYS A 249 " d_HA=2.274 d_AD=3.186 a_DHA=148.759 symop: x,y,z a_YAH=144 ------------------------------------------------------------------------------- Total: 610 Symmetry: 0 Per residue: 1.1051 Mean SD Skew Kurtosis theta_1: 143.017 21.141 -0.493 2.281 theta_2: 130.535 22.643 -0.036 1.856 d_HA: 2.314 0.310 0.417 2.170 2095 6820 "HH12 ARG A 632 "<>" OE2 GLU B 225 " d_HA=1.696 d_AD=2.683 a_DHA=159.274 symop: x,y,z a_YAH=126 2096 6819 "HH21 ARG A 632 "<>" OE1 GLU B 225 " d_HA=1.711 d_AD=2.650 a_DHA=149.673 symop: x,y,z a_YAH=113 6714 6783 "HH21 ARG B 218 "<>" OD2 ASP B 222 " d_HA=1.744 d_AD=2.726 a_DHA=157.122 symop: x,y,z a_YAH=149 6272 6317 " H HIS B 195 "<>" O PHE B 192 " d_HA=2.811 d_AD=3.785 a_DHA=162.351 symop: x,y,z a_YAH=149 6001 5631 " H ASP B 175 "<>" O GLU B 151 " d_HA=1.856 d_AD=2.814 a_DHA=155.775 symop: x,y,z a_YAH=128 5889 5934 " H LEU B 171 "<>" O LEU B 168 " d_HA=2.598 d_AD=3.531 a_DHA=154.242 symop: x,y,z a_YAH=112 5889 6323 " HE2 HIS B 195 "<>" O LEU B 168 " d_HA=1.992 d_AD=2.988 a_DHA=165.157 symop: x,y,z a_YAH=161 5929 5982 " H LEU B 174 "<>" O LEU B 171 " d_HA=2.560 d_AD=3.548 a_DHA=166.796 symop: x,y,z a_YAH=98 5913 5863 " H ASN B 169 "<>" O GLY B 166 " d_HA=2.077 d_AD=3.012 a_DHA=152.383 symop: x,y,z a_YAH=126 300 1384 " HG SER A 523 "<>" O SER A 589 " d_HA=1.980 d_AD=2.952 a_DHA=178.740 symop: x,y,z a_YAH=131 2044 2052 "HH21 ARG A 629 "<>" SD MET A 630 " d_HA=2.490 d_AD=3.470 a_DHA=163.448 symop: x,y,z a_YAH=90 a_YAH=102 1974 2490 "HE21 GLN A 625 "<>" O HIS A 656 " d_HA=2.713 d_AD=3.537 a_DHA=139.278 symop: x,y,z a_YAH=102 1994 2054 " H MET A 630 "<>" O PRO A 627 " d_HA=1.828 d_AD=2.836 a_DHA=173.403 symop: x,y,z a_YAH=152 4869 5244 " H GLN B 127 "<>" O THR B 103 " d_HA=1.846 d_AD=2.789 a_DHA=153.890 symop: x,y,z a_YAH=121 4869 5261 " H GLU B 128 "<>" O THR B 103 " d_HA=1.960 d_AD=2.939 a_DHA=161.595 symop: x,y,z a_YAH=155 5128 5183 " H LEU B 123 "<>" O LEU B 120 " d_HA=1.993 d_AD=2.982 a_DHA=164.057 symop: x,y,z a_YAH=146 5238 5652 " H LYS B 152 "<>" O GLN B 127 " d_HA=1.986 d_AD=2.981 a_DHA=164.839 symop: x,y,z a_YAH=157 5238 5637 " H GLU B 151 "<>" O GLN B 127 " d_HA=1.871 d_AD=2.791 a_DHA=149.501 symop: x,y,z a_YAH=125 5515 5566 " H THR B 147 "<>" O LEU B 144 " d_HA=2.031 d_AD=2.990 a_DHA=156.905 symop: x,y,z a_YAH=118 5562 5617 " H LEU B 150 "<>" O THR B 147 " d_HA=2.411 d_AD=3.355 a_DHA=156.023 symop: x,y,z a_YAH=120 5538 5489 " H THR B 145 "<>" O GLY B 142 " d_HA=2.331 d_AD=3.177 a_DHA=140.672 symop: x,y,z a_YAH=97 5952 5968 " H ASN B 173 "<>" OE1 GLU B 172 " d_HA=2.320 d_AD=2.996 a_DHA=122.812 symop: x,y,z a_YAH=130 5952 5973 "HD22 ASN B 173 "<>" OE1 GLU B 172 " d_HA=1.814 d_AD=2.719 a_DHA=144.794 symop: x,y,z a_YAH=116 5922 5954 " H GLU B 172 "<>" O GLY B 170 " d_HA=2.525 d_AD=3.330 a_DHA=135.271 symop: x,y,z a_YAH=93 282 333 " H LEU A 525 "<>" O SER A 522 " d_HA=2.444 d_AD=3.443 a_DHA=169.260 symop: x,y,z a_YAH=120 275 1378 " H GLY A 588 "<>" O GLY A 521 " d_HA=2.142 d_AD=2.858 a_DHA=126.105 symop: x,y,z a_YAH=136 275 1387 " H SER A 589 "<>" O GLY A 521 " d_HA=2.172 d_AD=3.049 a_DHA=143.561 symop: x,y,z a_YAH=144 296 1384 " H SER A 523 "<>" O SER A 589 " d_HA=1.805 d_AD=2.811 a_DHA=172.881 symop: x,y,z a_YAH=144 921 1391 " HG SER A 589 "<>" OD2 ASP A 560 " d_HA=1.622 d_AD=2.614 a_DHA=172.065 symop: x,y,z a_YAH=161 1386 1401 " H GLN A 590 "<>" OG SER A 589 " d_HA=2.070 d_AD=2.747 a_DHA=121.864 symop: x,y,z a_YAH=102 a_YAH=145 1386 1416 " H VAL A 591 "<>" OG SER A 589 " d_HA=2.436 d_AD=3.440 a_DHA=170.043 symop: x,y,z a_YAH=93 a_YAH=103 266 285 " H SER A 522 "<>" OD1 ASP A 520 " d_HA=1.904 d_AD=2.874 a_DHA=157.973 symop: x,y,z a_YAH=152 266 289 " HG SER A 522 "<>" OD1 ASP A 520 " d_HA=1.714 d_AD=2.684 a_DHA=165.873 symop: x,y,z a_YAH=128 284 312 " H ARG A 524 "<>" OG SER A 522 " d_HA=2.303 d_AD=3.280 a_DHA=161.239 symop: x,y,z a_YAH=103 a_YAH=133 900 1441 " H SER A 593 "<>" O HIS A 559 " d_HA=2.085 d_AD=3.099 a_DHA=174.506 symop: x,y,z a_YAH=137 900 930 " H GLY A 561 "<>" O HIS A 559 " d_HA=2.343 d_AD=3.147 a_DHA=135.701 symop: x,y,z a_YAH=97 267 1943 " H ALA A 623 "<>" OD2 ASP A 520 " d_HA=1.887 d_AD=2.847 a_DHA=155.673 symop: x,y,z a_YAH=112 267 1954 " H SER A 624 "<>" OD2 ASP A 520 " d_HA=2.227 d_AD=2.984 a_DHA=130.186 symop: x,y,z a_YAH=162 267 1958 " HG SER A 624 "<>" OD2 ASP A 520 " d_HA=1.671 d_AD=2.651 a_DHA=169.825 symop: x,y,z a_YAH=117 1951 2522 " H ASN A 658 "<>" O SER A 624 " d_HA=2.171 d_AD=2.963 a_DHA=133.708 symop: x,y,z a_YAH=153 1466 1983 " H SER A 595 "<>" OE1 GLU A 626 " d_HA=1.809 d_AD=2.821 a_DHA=170.370 symop: x,y,z a_YAH=119 4812 4750 " H LEU B 99 "<>" O LEU B 95 " d_HA=1.849 d_AD=2.798 a_DHA=154.441 symop: x,y,z a_YAH=164 4168 4522 " H GLY B 80 "<>" O THR B 58 " d_HA=2.019 d_AD=2.820 a_DHA=133.934 symop: x,y,z a_YAH=128 4168 4532 " H THR B 81 "<>" O THR B 58 " d_HA=2.320 d_AD=3.253 a_DHA=152.834 symop: x,y,z a_YAH=156 4521 4887 " H VAL B 104 "<>" O GLY B 80 " d_HA=1.998 d_AD=2.881 a_DHA=144.252 symop: x,y,z a_YAH=155 4521 4873 " H THR B 103 "<>" O GLY B 80 " d_HA=1.889 d_AD=2.801 a_DHA=148.818 symop: x,y,z a_YAH=115 4521 4876 " HG1 THR B 103 "<>" O GLY B 80 " d_HA=1.897 d_AD=2.830 a_DHA=159.877 symop: x,y,z a_YAH=129 4807 4855 " H LEU B 102 "<>" O LEU B 99 " d_HA=2.077 d_AD=3.071 a_DHA=166.597 symop: x,y,z a_YAH=123 5178 5224 " H LEU B 126 "<>" O LEU B 123 " d_HA=1.993 d_AD=2.970 a_DHA=161.363 symop: x,y,z a_YAH=130 5250 5636 "HE21 GLN B 127 "<>" OE2 GLU B 151 " d_HA=1.754 d_AD=2.703 a_DHA=151.087 symop: x,y,z a_YAH=133 869 913 " HE2 HIS A 559 "<>" OE2 GLU A 557 " d_HA=1.915 d_AD=2.817 a_DHA=145.325 symop: x,y,z a_YAH=123 917 7066 " HG1 THR B 240 "<>" O ASP A 560 " d_HA=1.987 d_AD=2.924 a_DHA=160.278 symop: x,y,z a_YAH=156 7059 6885 " H VAL B 229 "<>" O THR B 240 " d_HA=1.901 d_AD=2.868 a_DHA=157.922 symop: x,y,z a_YAH=142 244 888 " H TYR A 558 "<>" O LEU A 519 " d_HA=2.134 d_AD=3.026 a_DHA=145.537 symop: x,y,z a_YAH=169 268 1905 " H ASP A 520 "<>" O LEU A 621 " d_HA=2.457 d_AD=3.203 a_DHA=130.149 symop: x,y,z a_YAH=143 276 879 " H GLY A 521 "<>" O TYR A 558 " d_HA=1.959 d_AD=2.888 a_DHA=150.748 symop: x,y,z a_YAH=155 907 929 " H HIS A 559 "<>" O GLY A 561 " d_HA=2.053 d_AD=3.067 a_DHA=173.187 symop: x,y,z a_YAH=158 1478 7076 " H SER B 241 "<>" OE1 GLU A 596 " d_HA=2.991 d_AD=3.792 a_DHA=136.592 symop: x,y,z a_YAH=162 1929 2427 " H MET A 622 "<>" O VAL A 651 " d_HA=1.821 d_AD=2.826 a_DHA=169.250 symop: x,y,z a_YAH=151 896 1905 " HH TYR A 558 "<>" O LEU A 621 " d_HA=2.342 d_AD=3.293 a_DHA=167.674 symop: x,y,z a_YAH=123 1438 1493 " H VAL A 597 "<>" O SER A 593 " d_HA=1.990 d_AD=3.006 a_DHA=176.334 symop: x,y,z a_YAH=160 1474 1555 " H TYR A 600 "<>" O GLU A 596 " d_HA=1.777 d_AD=2.788 a_DHA=173.405 symop: x,y,z a_YAH=166 1479 6877 " HH TYR B 228 "<>" OE2 GLU A 596 " d_HA=1.585 d_AD=2.545 a_DHA=161.517 symop: x,y,z a_YAH=123 6868 1542 " HZ3 LYS A 599 "<>" OH TYR B 228 " d_HA=1.871 d_AD=2.811 a_DHA=151.325 symop: x,y,z a_YAH=118 a_YAH=126 1886 2431 " H VAL A 651 "<>" O LEU A 620 " d_HA=1.913 d_AD=2.925 a_DHA=171.471 symop: x,y,z a_YAH=133 1449 1510 " H LEU A 598 "<>" O THR A 594 " d_HA=2.357 d_AD=3.306 a_DHA=155.250 symop: x,y,z a_YAH=133 1463 1530 " H LYS A 599 "<>" O SER A 595 " d_HA=2.021 d_AD=2.953 a_DHA=151.054 symop: x,y,z a_YAH=140 4090 4154 " H LEU B 57 "<>" O TYR B 54 " d_HA=2.057 d_AD=3.053 a_DHA=168.138 symop: x,y,z a_YAH=139 4040 4099 " H TYR B 54 "<>" O LEU B 51 " d_HA=1.872 d_AD=2.859 a_DHA=162.670 symop: x,y,z a_YAH=134 4062 4443 " H THR B 75 "<>" SD MET B 52 " d_HA=2.613 d_AD=3.611 a_DHA=168.700 symop: x,y,z a_YAH=98 a_YAH=111 4432 4800 " HG1 THR B 98 "<>" O GLY B 74 " d_HA=2.039 d_AD=2.984 a_DHA=165.022 symop: x,y,z a_YAH=144 4453 4507 " H LEU B 79 "<>" O LEU B 76 " d_HA=2.549 d_AD=3.555 a_DHA=177.350 symop: x,y,z a_YAH=119 4458 4793 " H LEU B 76 "<>" O THR B 98 " d_HA=1.789 d_AD=2.802 a_DHA=176.432 symop: x,y,z a_YAH=161 5208 5608 " HZ3 LYS B 149 "<>" OE1 GLU B 125 " d_HA=1.865 d_AD=2.693 a_DHA=135.674 symop: x,y,z a_YAH=109 5209 5607 " HZ2 LYS B 149 "<>" OE2 GLU B 125 " d_HA=1.836 d_AD=2.692 a_DHA=138.695 symop: x,y,z a_YAH=101 1308 486 " HZ3 LYS A 534 "<>" O VAL A 584 " d_HA=1.833 d_AD=2.813 a_DHA=161.448 symop: x,y,z a_YAH=160 982 1330 " H LYS A 585 "<>" OH TYR A 565 " d_HA=2.259 d_AD=3.215 a_DHA=156.573 symop: x,y,z a_YAH=94 a_YAH=124 936 7047 " H VAL B 239 "<>" O SER A 562 " d_HA=1.984 d_AD=2.982 a_DHA=166.478 symop: x,y,z a_YAH=155 6881 7063 " H THR B 240 "<>" O VAL B 229 " d_HA=2.085 d_AD=3.071 a_DHA=163.720 symop: x,y,z a_YAH=146 6927 7033 " H LYS B 231 "<>" O ALA B 238 " d_HA=1.939 d_AD=2.939 a_DHA=166.428 symop: x,y,z a_YAH=145 249 848 " H LEU A 519 "<>" O VAL A 556 " d_HA=1.811 d_AD=2.815 a_DHA=168.549 symop: x,y,z a_YAH=159 864 954 " H HIS A 563 "<>" O GLU A 557 " d_HA=1.807 d_AD=2.791 a_DHA=161.085 symop: x,y,z a_YAH=178 870 947 " H GLU A 557 "<>" O HIS A 563 " d_HA=1.993 d_AD=2.975 a_DHA=162.616 symop: x,y,z a_YAH=147 939 7043 " H SER A 562 "<>" O VAL B 239 " d_HA=1.997 d_AD=2.919 a_DHA=150.364 symop: x,y,z a_YAH=154 225 1910 " H LEU A 621 "<>" O LEU A 518 " d_HA=2.069 d_AD=2.965 a_DHA=145.676 symop: x,y,z a_YAH=150 230 1867 " H LEU A 518 "<>" O LEU A 619 " d_HA=2.130 d_AD=3.089 a_DHA=156.993 symop: x,y,z a_YAH=164 1489 1574 " HG1 THR A 601 "<>" O VAL A 597 " d_HA=1.773 d_AD=2.734 a_DHA=169.722 symop: x,y,z a_YAH=142 1489 1571 " H THR A 601 "<>" O VAL A 597 " d_HA=1.876 d_AD=2.847 a_DHA=160.274 symop: x,y,z a_YAH=140 1524 1608 " H PHE A 603 "<>" O LYS A 599 " d_HA=2.134 d_AD=3.135 a_DHA=169.998 symop: x,y,z a_YAH=156 4076 4115 " H THR B 55 "<>" O PRO B 53 " d_HA=2.441 d_AD=3.314 a_DHA=143.858 symop: x,y,z a_YAH=90 6960 6988 " H ASP B 235 "<>" O GLY B 233 " d_HA=1.846 d_AD=2.751 a_DHA=146.797 symop: x,y,z a_YAH=111 6961 6995 " H GLY B 233 "<>" O VAL B 236 " d_HA=1.792 d_AD=2.807 a_DHA=174.862 symop: x,y,z a_YAH=144 6921 7035 " H ALA B 238 "<>" O LYS B 231 " d_HA=1.855 d_AD=2.852 a_DHA=167.205 symop: x,y,z a_YAH=139 1270 1312 " H VAL A 584 "<>" O ALA A 581 " d_HA=2.257 d_AD=3.237 a_DHA=161.846 symop: x,y,z a_YAH=114 1251 1297 " H GLN A 583 "<>" O ILE A 580 " d_HA=2.285 d_AD=2.959 a_DHA=122.673 symop: x,y,z a_YAH=98 964 7017 " H LYS B 237 "<>" O ALA A 564 " d_HA=1.940 d_AD=2.912 a_DHA=158.596 symop: x,y,z a_YAH=147 966 7011 " H ALA A 564 "<>" O LYS B 237 " d_HA=1.896 d_AD=2.815 a_DHA=149.355 symop: x,y,z a_YAH=173 832 983 " H TYR A 565 "<>" O VAL A 555 " d_HA=1.934 d_AD=2.906 a_DHA=159.220 symop: x,y,z a_YAH=158 832 1000 " H ILE A 566 "<>" O VAL A 555 " d_HA=2.299 d_AD=3.286 a_DHA=164.267 symop: x,y,z a_YAH=139 836 995 " H VAL A 555 "<>" O ILE A 566 " d_HA=2.173 d_AD=3.141 a_DHA=158.749 symop: x,y,z a_YAH=120 189 1872 " H LEU A 619 "<>" O VAL A 516 " d_HA=1.850 d_AD=2.855 a_DHA=169.074 symop: x,y,z a_YAH=170 205 852 " H VAL A 556 "<>" O PHE A 517 " d_HA=1.982 d_AD=2.964 a_DHA=161.310 symop: x,y,z a_YAH=158 213 822 " H PHE A 517 "<>" O ALA A 554 " d_HA=1.826 d_AD=2.839 a_DHA=175.093 symop: x,y,z a_YAH=153 1546 1642 " H ILE A 605 "<>" O TYR A 600 " d_HA=2.865 d_AD=3.499 a_DHA=121.331 symop: x,y,z a_YAH=145 1546 1626 " H GLN A 604 "<>" O TYR A 600 " d_HA=1.794 d_AD=2.744 a_DHA=154.690 symop: x,y,z a_YAH=150 1642 1567 " H ILE A 605 "<>" O THR A 601 " d_HA=2.552 d_AD=3.360 a_DHA=136.674 symop: x,y,z a_YAH=111 1600 5663 " HZ2 LYS B 152 "<>" O PHE A 603 " d_HA=1.772 d_AD=2.665 a_DHA=145.431 symop: x,y,z a_YAH=138 1624 5664 " HZ3 LYS B 152 "<>" OE1 GLN A 604 " d_HA=2.744 d_AD=3.628 a_DHA=146.451 symop: x,y,z a_YAH=107 193 1838 " H VAL A 516 "<>" O ILE A 617 " d_HA=1.815 d_AD=2.818 a_DHA=169.618 symop: x,y,z a_YAH=173 1227 1297 " H GLN A 583 "<>" O ARG A 579 " d_HA=2.079 d_AD=2.951 a_DHA=142.615 symop: x,y,z a_YAH=150 1227 1287 " HG SER A 582 "<>" O ARG A 579 " d_HA=1.671 d_AD=2.629 a_DHA=165.810 symop: x,y,z a_YAH=127 1244 1295 "HH11 ARG A 579 "<>" OE1 GLN A 583 " d_HA=1.790 d_AD=2.760 a_DHA=159.531 symop: x,y,z a_YAH=124 1245 6987 "HH12 ARG A 579 "<>" OD2 ASP B 235 " d_HA=1.809 d_AD=2.789 a_DHA=159.187 symop: x,y,z a_YAH=157 1247 6987 "HH22 ARG A 579 "<>" OD2 ASP B 235 " d_HA=1.991 d_AD=2.904 a_DHA=147.614 symop: x,y,z a_YAH=109 1184 1272 " H ALA A 581 "<>" O LEU A 577 " d_HA=1.860 d_AD=2.873 a_DHA=176.222 symop: x,y,z a_YAH=167 1015 1066 " H GLY A 567 "<>" OD2 ASP A 570 " d_HA=1.939 d_AD=2.917 a_DHA=159.525 symop: x,y,z a_YAH=98 170 824 " H ALA A 554 "<>" O LEU A 515 " d_HA=2.074 d_AD=2.998 a_DHA=150.057 symop: x,y,z a_YAH=153 175 782 " H LEU A 515 "<>" O ARG A 552 " d_HA=1.903 d_AD=2.904 a_DHA=167.294 symop: x,y,z a_YAH=161 1678 1693 " H LYS A 608 "<>" OG SER A 607 " d_HA=2.055 d_AD=2.847 a_DHA=133.007 symop: x,y,z a_YAH=94 a_YAH=96 1683 5260 " HG SER A 607 "<>" OE2 GLU B 128 " d_HA=1.853 d_AD=2.837 a_DHA=172.594 symop: x,y,z a_YAH=153 2625 2674 "HH11 ARG A 663 "<>" OE1 GLU A 666 " d_HA=1.773 d_AD=2.800 a_DHA=176.223 symop: x,y,z a_YAH=93 2675 2801 " H ALA A 674 "<>" OE2 GLU A 666 " d_HA=2.625 d_AD=3.525 a_DHA=148.410 symop: x,y,z a_YAH=107 1174 1243 " HE ARG A 579 "<>" OE2 GLU A 576 " d_HA=1.793 d_AD=2.751 a_DHA=154.311 symop: x,y,z a_YAH=104 1174 1246 "HH21 ARG A 579 "<>" OE2 GLU A 576 " d_HA=1.814 d_AD=2.744 a_DHA=149.596 symop: x,y,z a_YAH=148 1120 1189 " H LEU A 577 "<>" O ARG A 573 " d_HA=2.043 d_AD=2.928 a_DHA=144.225 symop: x,y,z a_YAH=152 1189 1144 " H LEU A 577 "<>" O PRO A 574 " d_HA=2.406 d_AD=3.057 a_DHA=121.126 symop: x,y,z a_YAH=96 1169 1256 " H ILE A 580 "<>" O GLU A 576 " d_HA=2.044 d_AD=3.052 a_DHA=172.863 symop: x,y,z a_YAH=145 1014 1067 " H ASP A 570 "<>" O GLY A 567 " d_HA=1.907 d_AD=2.897 a_DHA=164.514 symop: x,y,z a_YAH=120 1062 1104 " H LYS A 572 "<>" O ASP A 570 " d_HA=2.423 d_AD=3.142 a_DHA=127.228 symop: x,y,z a_YAH=107 790 139 " H ARG A 552 "<>" O LEU A 513 " d_HA=1.920 d_AD=2.928 a_DHA=170.737 symop: x,y,z a_YAH=164 800 1732 "HH12 ARG A 552 "<>" OD2 ASP A 610 " d_HA=1.903 d_AD=2.887 a_DHA=160.831 symop: x,y,z a_YAH=126 1056 1731 " HZ1 LYS A 569 "<>" OD1 ASP A 610 " d_HA=1.822 d_AD=2.769 a_DHA=151.298 symop: x,y,z a_YAH=133 798 161 " HE ARG A 552 "<>" OD1 ASP A 514 " d_HA=1.728 d_AD=2.747 a_DHA=174.925 symop: x,y,z a_YAH=121 1732 802 "HH22 ARG A 552 "<>" OD2 ASP A 610 " d_HA=2.198 d_AD=3.089 a_DHA=146.386 symop: x,y,z a_YAH=120 2507 2536 " H LEU A 659 "<>" O ALA A 657 " d_HA=1.913 d_AD=2.776 a_DHA=140.686 symop: x,y,z a_YAH=114 2413 2817 " H PHE A 675 "<>" O PRO A 650 " d_HA=2.007 d_AD=2.992 a_DHA=162.144 symop: x,y,z a_YAH=159 2793 3038 " HZ1 LYS A 673 "<>" OE2 GLU A 689 " d_HA=1.794 d_AD=2.740 a_DHA=150.430 symop: x,y,z a_YAH=160 3111 2748 " HH TYR A 693 "<>" O GLU A 671 " d_HA=1.762 d_AD=2.720 a_DHA=168.844 symop: x,y,z a_YAH=108 5798 5810 " HG1 THR B 161 "<>" OE2 GLU B 162 " d_HA=1.660 d_AD=2.649 a_DHA=177.284 symop: x,y,z a_YAH=122 4282 4606 "HH21 ARG B 64 "<>" ND1 HIS B 86 " d_HA=1.966 d_AD=2.813 a_DHA=139.619 symop: x,y,z a_YAH=116 a_YAH=95 4255 4280 "HH11 ARG B 64 "<>" OD2 ASP B 63 " d_HA=1.794 d_AD=2.650 a_DHA=138.200 symop: x,y,z a_YAH=145 707 1090 " HE ARG A 571 "<>" OE1 GLN A 548 " d_HA=1.817 d_AD=2.798 a_DHA=162.138 symop: x,y,z a_YAH=168 707 1093 "HH21 ARG A 571 "<>" OE1 GLN A 548 " d_HA=2.028 d_AD=2.925 a_DHA=146.982 symop: x,y,z a_YAH=128 649 699 " HG SER A 547 "<>" O ARG A 545 " d_HA=2.176 d_AD=3.134 a_DHA=167.114 symop: x,y,z a_YAH=141 649 770 " H VAL A 551 "<>" O ARG A 545 " d_HA=2.436 d_AD=3.347 a_DHA=149.662 symop: x,y,z a_YAH=142 694 753 " H TRP A 550 "<>" OG SER A 547 " d_HA=1.960 d_AD=2.955 a_DHA=167.003 symop: x,y,z a_YAH=149 a_YAH=101 695 766 " H SER A 547 "<>" O VAL A 551 " d_HA=2.019 d_AD=3.031 a_DHA=170.819 symop: x,y,z a_YAH=145 2469 2509 " H ALA A 657 "<>" O GLY A 654 " d_HA=2.170 d_AD=3.183 a_DHA=176.722 symop: x,y,z a_YAH=134 2470 2845 " H GLY A 654 "<>" O LEU A 677 " d_HA=1.803 d_AD=2.811 a_DHA=172.120 symop: x,y,z a_YAH=149 2867 2918 " H SER A 678 "<>" OE1 GLU A 682 " d_HA=1.787 d_AD=2.792 a_DHA=166.875 symop: x,y,z a_YAH=126 2871 2918 " HG SER A 678 "<>" OE1 GLU A 682 " d_HA=1.599 d_AD=2.587 a_DHA=172.367 symop: x,y,z a_YAH=155 2443 2850 " H LEU A 677 "<>" O GLY A 652 " d_HA=1.896 d_AD=2.877 a_DHA=161.951 symop: x,y,z a_YAH=141 1924 2455 " H ILE A 653 "<>" O MET A 622 " d_HA=1.864 d_AD=2.801 a_DHA=151.892 symop: x,y,z a_YAH=168 2427 1929 " H MET A 622 "<>" O VAL A 651 " d_HA=1.821 d_AD=2.826 a_DHA=169.250 symop: x,y,z a_YAH=151 2444 2809 " H GLY A 652 "<>" O PHE A 675 " d_HA=1.913 d_AD=2.894 a_DHA=161.817 symop: x,y,z a_YAH=154 5078 5120 " H ALA B 119 "<>" O PRO B 116 " d_HA=2.384 d_AD=3.324 a_DHA=153.955 symop: x,y,z a_YAH=124 3033 3103 " H TYR A 693 "<>" O GLU A 689 " d_HA=2.042 d_AD=3.018 a_DHA=160.094 symop: x,y,z a_YAH=153 3048 3120 " H LEU A 694 "<>" O ILE A 690 " d_HA=2.246 d_AD=3.147 a_DHA=147.359 symop: x,y,z a_YAH=147 3094 3161 " H LEU A 697 "<>" O TYR A 693 " d_HA=2.916 d_AD=3.561 a_DHA=122.186 symop: x,y,z a_YAH=133 5461 5501 " H LEU B 143 "<>" O PRO B 140 " d_HA=2.905 d_AD=3.761 a_DHA=142.657 symop: x,y,z a_YAH=107 3083 3149 " H ASP A 696 "<>" O SER A 692 " d_HA=2.290 d_AD=3.285 a_DHA=166.341 symop: x,y,z a_YAH=159 3115 3161 " H LEU A 697 "<>" O LEU A 694 " d_HA=2.484 d_AD=3.399 a_DHA=149.916 symop: x,y,z a_YAH=103 3134 3177 " H ALA A 698 "<>" O CYS A 695 " d_HA=2.188 d_AD=3.163 a_DHA=160.894 symop: x,y,z a_YAH=124 113 3134 "HH11 ARG A 511 "<>" O CYS A 695 " d_HA=1.733 d_AD=2.714 a_DHA=161.228 symop: x,y,z a_YAH=101 114 3147 "HH12 ARG A 511 "<>" OD1 ASP A 696 " d_HA=2.533 d_AD=3.390 a_DHA=141.864 symop: x,y,z a_YAH=152 3535 3868 " HZ1 LYS B 19 "<>" OE1 GLU B 40 " d_HA=2.197 d_AD=2.969 a_DHA=131.147 symop: x,y,z a_YAH=132 3537 3864 " HZ3 LYS B 19 "<>" O GLU B 40 " d_HA=2.917 d_AD=3.848 a_DHA=153.253 symop: x,y,z a_YAH=122 3860 4254 " HG SER B 39 "<>" OD1 ASP B 63 " d_HA=1.580 d_AD=2.571 a_DHA=174.135 symop: x,y,z a_YAH=124 3870 4251 " H GLU B 40 "<>" O ASP B 63 " d_HA=2.171 d_AD=3.121 a_DHA=154.717 symop: x,y,z a_YAH=140 1092 3486 "HH12 ARG A 571 "<>" OD1 ASN B 16 " d_HA=1.843 d_AD=2.839 a_DHA=166.123 symop: x,y,z a_YAH=153 1094 3457 "HH22 ARG A 571 "<>" OE2 GLU B 14 " d_HA=2.130 d_AD=2.879 a_DHA=129.078 symop: x,y,z a_YAH=152 3820 4228 "HD22 ASN B 61 "<>" ND1 HIS B 37 " d_HA=1.946 d_AD=2.847 a_DHA=146.663 symop: x,y,z a_YAH=121 a_YAH=92 3457 3830 " HE2 HIS B 37 "<>" OE2 GLU B 14 " d_HA=1.830 d_AD=2.777 a_DHA=152.293 symop: x,y,z a_YAH=128 2008 2069 " H SER A 631 "<>" O GLN A 628 " d_HA=2.722 d_AD=3.413 a_DHA=125.919 symop: x,y,z a_YAH=96 2536 2507 " H LEU A 659 "<>" O ALA A 657 " d_HA=1.913 d_AD=2.776 a_DHA=140.686 symop: x,y,z a_YAH=114 2520 2556 " H LYS A 660 "<>" OD1 ASN A 658 " d_HA=2.781 d_AD=3.406 a_DHA=120.350 symop: x,y,z a_YAH=142 2520 2578 " H GLN A 661 "<>" OD1 ASN A 658 " d_HA=2.245 d_AD=3.176 a_DHA=151.713 symop: x,y,z a_YAH=118 333 282 " H LEU A 525 "<>" O SER A 522 " d_HA=2.444 d_AD=3.443 a_DHA=169.260 symop: x,y,z a_YAH=120 2882 2905 " HG SER A 679 "<>" OD1 ASP A 681 " d_HA=1.649 d_AD=2.619 a_DHA=166.211 symop: x,y,z a_YAH=122 2967 5165 "HH12 ARG B 121 "<>" OE1 GLN A 685 " d_HA=2.114 d_AD=3.006 a_DHA=145.795 symop: -x+1,-y+1,z-1/2 a_YAH=110 2967 5167 "HH22 ARG B 121 "<>" OE1 GLN A 685 " d_HA=1.891 d_AD=2.849 a_DHA=155.893 symop: -x+1,-y+1,z-1/2 a_YAH=100 2875 2920 " H GLU A 682 "<>" O SER A 679 " d_HA=2.130 d_AD=3.077 a_DHA=154.112 symop: x,y,z a_YAH=108 2886 2934 " H LEU A 683 "<>" O VAL A 680 " d_HA=1.974 d_AD=2.969 a_DHA=165.652 symop: x,y,z a_YAH=117 2902 2975 "HE21 GLN A 685 "<>" O ASP A 681 " d_HA=1.943 d_AD=2.946 a_DHA=167.129 symop: x,y,z a_YAH=108 2914 2969 " H GLN A 685 "<>" O GLU A 682 " d_HA=2.205 d_AD=2.989 a_DHA=132.929 symop: x,y,z a_YAH=99 2914 2986 " H GLN A 686 "<>" O GLU A 682 " d_HA=2.270 d_AD=3.088 a_DHA=136.641 symop: x,y,z a_YAH=152 2929 2986 " H GLN A 686 "<>" O LEU A 683 " d_HA=2.457 d_AD=3.253 a_DHA=134.868 symop: x,y,z a_YAH=103 2929 3005 " H ARG A 687 "<>" O LEU A 683 " d_HA=2.099 d_AD=2.953 a_DHA=140.264 symop: x,y,z a_YAH=157 2980 3039 " H GLU A 689 "<>" O GLN A 686 " d_HA=2.178 d_AD=2.986 a_DHA=135.388 symop: x,y,z a_YAH=115 2980 3053 " H ILE A 690 "<>" O GLN A 686 " d_HA=1.929 d_AD=2.932 a_DHA=168.133 symop: x,y,z a_YAH=160 2997 3071 " H VAL A 691 "<>" O ARG A 687 " d_HA=1.935 d_AD=2.950 a_DHA=173.665 symop: x,y,z a_YAH=170 5489 5538 " H THR B 145 "<>" O GLY B 142 " d_HA=2.331 d_AD=3.177 a_DHA=140.672 symop: x,y,z a_YAH=97 3021 3090 " HG SER A 692 "<>" O ASP A 688 " d_HA=1.683 d_AD=2.659 a_DHA=173.976 symop: x,y,z a_YAH=157 3021 3086 " H SER A 692 "<>" O ASP A 688 " d_HA=2.464 d_AD=3.279 a_DHA=137.281 symop: x,y,z a_YAH=121 3067 3137 " H CYS A 695 "<>" O VAL A 691 " d_HA=2.023 d_AD=2.964 a_DHA=152.957 symop: x,y,z a_YAH=151 3204 3577 "HE21 GLN B 21 "<>" OE2 GLU A 700 " d_HA=1.758 d_AD=2.775 a_DHA=168.123 symop: y,-x+y+1,z-1/6 a_YAH=154 3884 4289 " H ASN B 41 "<>" SG CYS B 65 " d_HA=2.691 d_AD=3.625 a_DHA=153.270 symop: x,y,z a_YAH=121 a_YAH=116 3898 3582 " H LEU B 42 "<>" O LEU B 22 " d_HA=1.890 d_AD=2.779 a_DHA=144.731 symop: x,y,z a_YAH=150 6553 6597 " H ILE B 213 "<>" O ASN B 210 " d_HA=2.699 d_AD=3.440 a_DHA=129.841 symop: x,y,z a_YAH=102 6556 6597 " H ILE B 213 "<>" OD1 ASN B 210 " d_HA=2.413 d_AD=3.346 a_DHA=152.264 symop: x,y,z a_YAH=164 6556 6583 " H GLU B 212 "<>" OD1 ASN B 210 " d_HA=2.072 d_AD=2.900 a_DHA=136.781 symop: x,y,z a_YAH=109 3510 3560 "HH21 ARG B 20 "<>" OD1 ASP B 18 " d_HA=2.163 d_AD=2.882 a_DHA=125.620 symop: x,y,z a_YAH=145 3497 3888 "HD21 ASN B 41 "<>" O CYS B 17 " d_HA=2.399 d_AD=3.349 a_DHA=156.971 symop: x,y,z a_YAH=133 3507 3560 "HH21 ARG B 20 "<>" O ASP B 18 " d_HA=2.288 d_AD=3.080 a_DHA=133.286 symop: x,y,z a_YAH=119 3507 3557 " HE ARG B 20 "<>" O ASP B 18 " d_HA=1.774 d_AD=2.769 a_DHA=164.118 symop: x,y,z a_YAH=137 3525 3853 " H LYS B 19 "<>" O SER B 39 " d_HA=1.984 d_AD=2.932 a_DHA=154.007 symop: x,y,z a_YAH=149 736 3319 " HZ1 LYS A 549 "<>" OE1 GLU B 5 " d_HA=1.994 d_AD=2.868 a_DHA=141.674 symop: x,y,z a_YAH=104 3319 3493 "HD22 ASN B 16 "<>" OE1 GLU B 5 " d_HA=2.985 d_AD=3.653 a_DHA=125.073 symop: x,y,z a_YAH=110 3500 3817 " H CYS B 17 "<>" O HIS B 37 " d_HA=1.935 d_AD=2.873 a_DHA=151.769 symop: x,y,z a_YAH=152 3839 4218 " H LEU B 38 "<>" O ASN B 61 " d_HA=1.988 d_AD=2.940 a_DHA=154.463 symop: x,y,z a_YAH=152 738 3320 " HZ3 LYS A 549 "<>" OE2 GLU B 5 " d_HA=2.084 d_AD=2.790 a_DHA=124.414 symop: x,y,z a_YAH=113 3349 3452 " H SER B 7 "<>" O GLU B 14 " d_HA=1.952 d_AD=2.923 a_DHA=158.204 symop: x,y,z a_YAH=155 3353 3452 " HG SER B 7 "<>" O GLU B 14 " d_HA=2.666 d_AD=3.630 a_DHA=175.022 symop: x,y,z a_YAH=127 3467 3824 " H HIS B 37 "<>" O VAL B 15 " d_HA=1.941 d_AD=2.955 a_DHA=176.343 symop: x,y,z a_YAH=171 3471 3779 " H VAL B 15 "<>" O ILE B 35 " d_HA=1.997 d_AD=2.970 a_DHA=158.917 symop: x,y,z a_YAH=139 3798 4223 " H ASN B 61 "<>" O LEU B 36 " d_HA=2.022 d_AD=3.029 a_DHA=172.234 symop: x,y,z a_YAH=166 3803 4182 " H LEU B 36 "<>" O GLN B 59 " d_HA=2.088 d_AD=3.060 a_DHA=159.573 symop: x,y,z a_YAH=146 1456 2576 " HG1 THR A 594 "<>" OE1 GLN A 661 " d_HA=1.736 d_AD=2.671 a_DHA=160.195 symop: x,y,z a_YAH=106 1984 2073 " HG SER A 631 "<>" OE2 GLU A 626 " d_HA=1.636 d_AD=2.618 a_DHA=171.949 symop: x,y,z a_YAH=116 1984 2585 "HE22 GLN A 661 "<>" OE2 GLU A 626 " d_HA=1.931 d_AD=2.833 a_DHA=145.724 symop: x,y,z a_YAH=105 1470 1984 " HG SER A 595 "<>" OE2 GLU A 626 " d_HA=1.627 d_AD=2.595 a_DHA=164.695 symop: x,y,z a_YAH=111 2531 2616 " H ARG A 663 "<>" O LEU A 659 " d_HA=1.765 d_AD=2.777 a_DHA=175.891 symop: x,y,z a_YAH=158 2517 2578 " H GLN A 661 "<>" O ASN A 658 " d_HA=2.218 d_AD=2.892 a_DHA=122.332 symop: x,y,z a_YAH=117 2517 2594 " H ILE A 662 "<>" O ASN A 658 " d_HA=2.040 d_AD=3.034 a_DHA=166.129 symop: x,y,z a_YAH=151 2572 2637 " H LEU A 664 "<>" O GLN A 661 " d_HA=2.157 d_AD=3.062 a_DHA=147.634 symop: x,y,z a_YAH=110 2572 2656 " H ILE A 665 "<>" O GLN A 661 " d_HA=2.211 d_AD=3.125 a_DHA=149.285 symop: x,y,z a_YAH=154 2066 2123 " H PHE A 634 "<>" O SER A 631 " d_HA=2.080 d_AD=3.054 a_DHA=160.170 symop: x,y,z a_YAH=107 349 389 " H GLU A 529 "<>" OG SER A 526 " d_HA=2.112 d_AD=3.063 a_DHA=155.330 symop: x,y,z a_YAH=126 a_YAH=104 350 387 " H SER A 526 "<>" OE1 GLU A 529 " d_HA=1.715 d_AD=2.698 a_DHA=161.181 symop: x,y,z a_YAH=122 354 387 " HG SER A 526 "<>" OE1 GLU A 529 " d_HA=1.655 d_AD=2.638 a_DHA=170.555 symop: x,y,z a_YAH=116 328 1363 " HH TYR A 586 "<>" O LEU A 525 " d_HA=1.682 d_AD=2.643 a_DHA=166.169 symop: x,y,z a_YAH=151 347 406 " H PHE A 530 "<>" O SER A 526 " d_HA=1.908 d_AD=2.844 a_DHA=152.017 symop: x,y,z a_YAH=159 383 454 " H LEU A 533 "<>" O GLU A 529 " d_HA=2.094 d_AD=3.034 a_DHA=153.425 symop: x,y,z a_YAH=143 433 508 " H PHE A 536 "<>" O VAL A 532 " d_HA=2.049 d_AD=3.050 a_DHA=169.137 symop: x,y,z a_YAH=151 2953 3017 "HH22 ARG A 687 "<>" OE2 GLU A 684 " d_HA=1.814 d_AD=2.800 a_DHA=160.688 symop: x,y,z a_YAH=121 2952 3015 "HH12 ARG A 687 "<>" OE1 GLU A 684 " d_HA=1.817 d_AD=2.760 a_DHA=151.619 symop: x,y,z a_YAH=97 500 569 " H MET A 540 "<>" O PHE A 536 " d_HA=2.186 d_AD=3.152 a_DHA=158.320 symop: x,y,z a_YAH=147 449 524 " H VAL A 537 "<>" O LEU A 533 " d_HA=2.236 d_AD=3.175 a_DHA=153.414 symop: x,y,z a_YAH=140 556 3014 "HH11 ARG A 687 "<>" OD2 ASP A 539 " d_HA=1.702 d_AD=2.704 a_DHA=164.860 symop: x,y,z a_YAH=135 3013 3024 " HE ARG A 687 "<>" OD1 ASP A 688 " d_HA=1.819 d_AD=2.786 a_DHA=157.096 symop: x,y,z a_YAH=124 3016 3024 "HH21 ARG A 687 "<>" OD1 ASP A 688 " d_HA=1.902 d_AD=2.820 a_DHA=148.004 symop: x,y,z a_YAH=140 25 5541 " HG1 THR B 145 "<>" OD1 ASP A 506 " d_HA=1.779 d_AD=2.760 a_DHA=175.459 symop: -x+1,-y+1,z-1/2 a_YAH=133 27 3025 " H ASP A 506 "<>" OD2 ASP A 688 " d_HA=2.871 d_AD=3.584 a_DHA=128.131 symop: x,y,z a_YAH=130 626 3025 "HE22 GLN A 543 "<>" OD2 ASP A 688 " d_HA=1.936 d_AD=2.924 a_DHA=160.337 symop: x,y,z a_YAH=115 78 613 " H CYS A 509 "<>" O GLN A 543 " d_HA=2.876 d_AD=3.666 a_DHA=135.374 symop: x,y,z a_YAH=151 6577 6639 " H TYR B 215 "<>" O GLU B 212 " d_HA=2.586 d_AD=3.597 a_DHA=173.218 symop: x,y,z a_YAH=129 6567 6616 " H LEU B 214 "<>" O CYS B 211 " d_HA=2.375 d_AD=3.329 a_DHA=156.271 symop: x,y,z a_YAH=104 3286 3558 "HH11 ARG B 20 "<>" O ILE B 3 " d_HA=2.018 d_AD=2.984 a_DHA=158.458 symop: x,y,z a_YAH=150 7377 7416 " H CYS B 264 "<>" O GLY B 261 " d_HA=2.049 d_AD=3.014 a_DHA=159.160 symop: x,y,z a_YAH=134 3321 3483 " H GLU B 5 "<>" O ASN B 16 " d_HA=1.985 d_AD=2.948 a_DHA=157.206 symop: x,y,z a_YAH=143 3315 3488 " H ASN B 16 "<>" O GLU B 5 " d_HA=1.976 d_AD=2.946 a_DHA=159.502 symop: x,y,z a_YAH=135 3334 7406 " H VAL B 6 "<>" O GLY B 263 " d_HA=1.999 d_AD=2.974 a_DHA=159.721 symop: -x+y+1,-x+1,z-1/3 a_YAH=131 2431 1886 " H VAL A 651 "<>" O LEU A 620 " d_HA=1.913 d_AD=2.925 a_DHA=171.471 symop: x,y,z a_YAH=133 2101 2184 " H TYR A 637 "<>" O ASN A 633 " d_HA=2.232 d_AD=3.197 a_DHA=158.705 symop: x,y,z a_YAH=161 2101 2159 " H ARG A 636 "<>" O ASN A 633 " d_HA=2.262 d_AD=2.956 a_DHA=124.507 symop: x,y,z a_YAH=109 2115 2200 " H VAL A 638 "<>" O PHE A 634 " d_HA=2.081 d_AD=3.087 a_DHA=169.548 symop: x,y,z a_YAH=162 2589 2656 " H ILE A 665 "<>" O ILE A 662 " d_HA=2.441 d_AD=3.134 a_DHA=125.060 symop: x,y,z a_YAH=108 2589 2676 " H GLU A 666 "<>" O ILE A 662 " d_HA=2.268 d_AD=3.272 a_DHA=170.109 symop: x,y,z a_YAH=174 2632 2719 "HE21 GLN A 668 "<>" O LEU A 664 " d_HA=2.213 d_AD=3.155 a_DHA=153.834 symop: x,y,z a_YAH=151 2651 2713 " H GLN A 668 "<>" O ILE A 665 " d_HA=1.986 d_AD=2.945 a_DHA=156.496 symop: x,y,z a_YAH=117 2651 2773 "HD22 ASN A 672 "<>" O ILE A 665 " d_HA=1.919 d_AD=2.918 a_DHA=168.526 symop: x,y,z a_YAH=130 2135 2218 " H GLN A 639 "<>" O VAL A 635 " d_HA=1.895 d_AD=2.894 a_DHA=166.781 symop: x,y,z a_YAH=156 2151 2230 " H GLY A 640 "<>" O ARG A 636 " d_HA=1.926 d_AD=2.913 a_DHA=163.225 symop: x,y,z a_YAH=145 2670 2726 " H ALA A 669 "<>" O GLU A 666 " d_HA=2.878 d_AD=3.754 a_DHA=144.734 symop: x,y,z a_YAH=104 2224 2711 "HE21 GLN A 639 "<>" OE1 GLN A 668 " d_HA=1.795 d_AD=2.803 a_DHA=169.278 symop: x,y,z a_YAH=126 358 424 " H GLU A 531 "<>" O GLU A 527 " d_HA=2.223 d_AD=3.181 a_DHA=156.664 symop: x,y,z a_YAH=149 373 437 " H VAL A 532 "<>" O ALA A 528 " d_HA=2.628 d_AD=3.539 a_DHA=149.914 symop: x,y,z a_YAH=136 418 492 " H ALA A 535 "<>" O GLU A 531 " d_HA=1.911 d_AD=2.866 a_DHA=155.335 symop: x,y,z a_YAH=143 398 474 " H LYS A 534 "<>" O PHE A 530 " d_HA=1.910 d_AD=2.885 a_DHA=159.988 symop: x,y,z a_YAH=156 468 540 " H VAL A 538 "<>" O LYS A 534 " d_HA=1.980 d_AD=2.931 a_DHA=154.914 symop: x,y,z a_YAH=152 490 557 " H ASP A 539 "<>" O ALA A 535 " d_HA=1.948 d_AD=2.950 a_DHA=168.171 symop: x,y,z a_YAH=168 536 604 " H GLU A 542 "<>" O VAL A 538 " d_HA=2.395 d_AD=3.159 a_DHA=131.532 symop: x,y,z a_YAH=143 552 604 " H GLU A 542 "<>" O ASP A 539 " d_HA=2.268 d_AD=3.042 a_DHA=132.126 symop: x,y,z a_YAH=95 552 619 " H GLN A 543 "<>" O ASP A 539 " d_HA=2.059 d_AD=3.016 a_DHA=156.225 symop: x,y,z a_YAH=155 520 586 " H MET A 541 "<>" O VAL A 537 " d_HA=2.181 d_AD=3.090 a_DHA=147.888 symop: x,y,z a_YAH=144 581 635 " H LEU A 544 "<>" O MET A 541 " d_HA=2.917 d_AD=3.735 a_DHA=138.426 symop: x,y,z a_YAH=95 71 7218 " HH TYR A 508 "<>" OD1 ASP B 252 " d_HA=1.712 d_AD=2.662 a_DHA=162.737 symop: -x+y+1,-x+1,z-1/3 a_YAH=139 630 7199 "HD21 ASN B 250 "<>" O LEU A 544 " d_HA=1.970 d_AD=2.828 a_DHA=140.651 symop: -x+y+1,-x+1,z-1/3 a_YAH=118 630 678 " H ILE A 546 "<>" O LEU A 544 " d_HA=1.918 d_AD=2.791 a_DHA=142.059 symop: x,y,z a_YAH=112 667 3224 "HH12 ARG A 545 "<>" O PRO A 702 " d_HA=1.736 d_AD=2.750 a_DHA=173.527 symop: x,y,z a_YAH=125 3253 7441 " H THR B 266 "<>" O HIS B 1 " d_HA=2.061 d_AD=2.905 a_DHA=139.244 symop: -x+y+1,-x+1,z-1/3 a_YAH=128 3272 7457 " H LEU B 267 "<>" O PRO B 2 " d_HA=2.721 d_AD=3.507 a_DHA=134.570 symop: -x+y+1,-x+1,z-1/3 a_YAH=112 3256 3308 " H CYS B 4 "<>" ND1 HIS B 1 " d_HA=2.342 d_AD=3.337 a_DHA=167.331 symop: x,y,z a_YAH=121 a_YAH=122 3256 3291 " H ILE B 3 "<>" ND1 HIS B 1 " d_HA=1.944 d_AD=2.888 a_DHA=154.101 symop: x,y,z a_YAH=136 a_YAH=105 3268 3658 " HE2 HIS B 1 "<>" O PRO B 27 " d_HA=1.794 d_AD=2.815 a_DHA=174.654 symop: x,y,z a_YAH=167 3689 4098 " H LEU B 29 "<>" OH TYR B 54 " d_HA=2.188 d_AD=3.179 a_DHA=167.476 symop: x,y,z a_YAH=115 a_YAH=111 1891 2394 " H LEU A 620 "<>" O ILE A 649 " d_HA=2.037 d_AD=2.978 a_DHA=153.130 symop: x,y,z a_YAH=131 1505 1586 " H LEU A 602 "<>" O LEU A 598 " d_HA=1.879 d_AD=2.852 a_DHA=159.137 symop: x,y,z a_YAH=147 1608 1524 " H PHE A 603 "<>" O LYS A 599 " d_HA=2.134 d_AD=3.135 a_DHA=169.998 symop: x,y,z a_YAH=156 1857 2399 " H ILE A 649 "<>" O ALA A 618 " d_HA=1.917 d_AD=2.907 a_DHA=164.296 symop: x,y,z a_YAH=157 2175 2241 " H LEU A 641 "<>" O TYR A 637 " d_HA=1.930 d_AD=2.894 a_DHA=157.247 symop: x,y,z a_YAH=159 2382 2766 " H VAL A 648 "<>" OD1 ASN A 672 " d_HA=1.855 d_AD=2.871 a_DHA=176.090 symop: x,y,z a_YAH=130 2196 2261 " H LYS A 642 "<>" O VAL A 638 " d_HA=1.957 d_AD=2.970 a_DHA=173.130 symop: x,y,z a_YAH=157 2212 2283 " H LYS A 643 "<>" O GLN A 639 " d_HA=1.739 d_AD=2.720 a_DHA=161.032 symop: x,y,z a_YAH=155 2724 2768 " H ASN A 672 "<>" O ALA A 669 " d_HA=2.052 d_AD=3.031 a_DHA=161.342 symop: x,y,z a_YAH=124 2272 2707 " HZ2 LYS A 642 "<>" O GLN A 668 " d_HA=1.817 d_AD=2.777 a_DHA=154.926 symop: x,y,z a_YAH=169 362 2169 "HH12 ARG A 636 "<>" OE1 GLU A 527 " d_HA=1.692 d_AD=2.685 a_DHA=160.685 symop: y,-x+y,z-1/6 a_YAH=148 362 2171 "HH22 ARG A 636 "<>" OE1 GLU A 527 " d_HA=2.072 d_AD=2.964 a_DHA=144.457 symop: y,-x+y,z-1/6 a_YAH=143 485 1280 " HZ2 LYS A 534 "<>" O SER A 582 " d_HA=1.854 d_AD=2.818 a_DHA=156.885 symop: x,y,z a_YAH=163 486 1308 " HZ3 LYS A 534 "<>" O VAL A 584 " d_HA=1.833 d_AD=2.813 a_DHA=161.448 symop: x,y,z a_YAH=160 1203 1283 " H SER A 582 "<>" O ARG A 578 " d_HA=1.965 d_AD=2.974 a_DHA=170.242 symop: x,y,z a_YAH=152 1287 1227 " HG SER A 582 "<>" O ARG A 579 " d_HA=1.671 d_AD=2.629 a_DHA=165.810 symop: x,y,z a_YAH=127 603 1219 " HE ARG A 578 "<>" OE2 GLU A 542 " d_HA=1.876 d_AD=2.778 a_DHA=144.849 symop: x,y,z a_YAH=133 1221 7181 "HH12 ARG A 578 "<>" OD1 ASP B 249 " d_HA=1.832 d_AD=2.807 a_DHA=158.069 symop: -x+y+1,-x+1,z-1/3 a_YAH=123 1223 7181 "HH22 ARG A 578 "<>" OD1 ASP B 249 " d_HA=1.935 d_AD=2.872 a_DHA=151.022 symop: -x+y+1,-x+1,z-1/3 a_YAH=170 1144 1211 " H ARG A 578 "<>" O PRO A 574 " d_HA=1.938 d_AD=2.937 a_DHA=166.701 symop: x,y,z a_YAH=158 1144 1189 " H LEU A 577 "<>" O PRO A 574 " d_HA=2.406 d_AD=3.057 a_DHA=121.126 symop: x,y,z a_YAH=96 7204 7257 " H PHE B 254 "<>" O SER B 251 " d_HA=1.760 d_AD=2.759 a_DHA=168.195 symop: x,y,z a_YAH=149 1838 193 " H VAL A 516 "<>" O ILE A 617 " d_HA=1.815 d_AD=2.818 a_DHA=169.618 symop: x,y,z a_YAH=173 1567 1642 " H ILE A 605 "<>" O THR A 601 " d_HA=2.552 d_AD=3.360 a_DHA=136.674 symop: x,y,z a_YAH=111 1567 1664 " H PHE A 606 "<>" O THR A 601 " d_HA=2.212 d_AD=3.128 a_DHA=149.795 symop: x,y,z a_YAH=156 1859 2359 " H ALA A 618 "<>" O ILE A 647 " d_HA=1.888 d_AD=2.894 a_DHA=170.143 symop: x,y,z a_YAH=166 2748 3111 " HH TYR A 693 "<>" O GLU A 671 " d_HA=1.762 d_AD=2.720 a_DHA=168.844 symop: x,y,z a_YAH=108 2229 2305 " H LYS A 644 "<>" O GLY A 640 " d_HA=2.069 d_AD=2.965 a_DHA=145.544 symop: x,y,z a_YAH=138 2236 2347 " H VAL A 646 "<>" O LEU A 641 " d_HA=1.894 d_AD=2.880 a_DHA=163.454 symop: x,y,z a_YAH=133 2255 2327 " H LYS A 645 "<>" O LYS A 642 " d_HA=1.996 d_AD=2.960 a_DHA=157.641 symop: x,y,z a_YAH=110 1158 1235 " H ARG A 579 "<>" O SER A 575 " d_HA=1.897 d_AD=2.874 a_DHA=160.119 symop: x,y,z a_YAH=149 1161 7182 " H SER A 575 "<>" OD2 ASP B 249 " d_HA=1.846 d_AD=2.803 a_DHA=156.166 symop: -x+y+1,-x+1,z-1/3 a_YAH=123 1165 7182 " HG SER A 575 "<>" OD2 ASP B 249 " d_HA=1.686 d_AD=2.645 a_DHA=162.419 symop: -x+y+1,-x+1,z-1/3 a_YAH=126 6500 7183 " H ASP B 249 "<>" O TRP B 207 " d_HA=1.810 d_AD=2.807 a_DHA=167.266 symop: x,y,z a_YAH=126 7171 7249 " H CYS B 248 "<>" O PHE B 254 " d_HA=1.965 d_AD=2.933 a_DHA=159.170 symop: x,y,z a_YAH=148 7269 7326 " H LYS B 258 "<>" O PRO B 255 " d_HA=1.948 d_AD=2.888 a_DHA=152.289 symop: x,y,z a_YAH=123 158 1843 " H ILE A 617 "<>" O ASP A 514 " d_HA=1.961 d_AD=2.963 a_DHA=166.765 symop: x,y,z a_YAH=156 1693 1678 " H LYS A 608 "<>" OG SER A 607 " d_HA=2.055 d_AD=2.847 a_DHA=133.007 symop: x,y,z a_YAH=94 a_YAH=96 1814 2364 " H ILE A 647 "<>" O ARG A 616 " d_HA=1.969 d_AD=2.959 a_DHA=163.791 symop: x,y,z a_YAH=154 1676 2316 " HZ2 LYS A 644 "<>" O SER A 607 " d_HA=1.706 d_AD=2.706 a_DHA=165.724 symop: x,y,z a_YAH=131 1810 3156 " HG SER A 615 "<>" O LEU A 697 " d_HA=1.647 d_AD=2.629 a_DHA=176.260 symop: x,y,z a_YAH=140 6101 6459 " HD1 HIS B 203 "<>" OE2 GLU B 181 " d_HA=2.378 d_AD=3.093 a_DHA=126.250 symop: x,y,z a_YAH=124 6116 6465 " H ASN B 182 "<>" O GLY B 204 " d_HA=2.032 d_AD=2.992 a_DHA=155.937 symop: x,y,z a_YAH=155 6448 6482 "HD22 ASN B 205 "<>" O HIS B 203 " d_HA=2.303 d_AD=3.259 a_DHA=158.875 symop: x,y,z a_YAH=122 6472 6511 " H TRP B 207 "<>" O ASN B 205 " d_HA=1.981 d_AD=2.824 a_DHA=138.651 symop: x,y,z a_YAH=111 6511 7151 " H TRP B 207 "<>" O GLN B 247 " d_HA=2.922 d_AD=3.638 a_DHA=128.194 symop: x,y,z a_YAH=164 6155 6529 " H LEU B 208 "<>" O TYR B 185 " d_HA=1.814 d_AD=2.766 a_DHA=155.571 symop: x,y,z a_YAH=125 7087 7116 " H ALA B 244 "<>" OD1 ASN B 242 " d_HA=2.011 d_AD=2.895 a_DHA=144.178 symop: x,y,z a_YAH=128 7084 7131 " HG SER B 245 "<>" O ASN B 242 " d_HA=1.829 d_AD=2.786 a_DHA=166.584 symop: x,y,z a_YAH=171 7084 7127 " H SER B 245 "<>" O ASN B 242 " d_HA=2.248 d_AD=3.225 a_DHA=161.815 symop: x,y,z a_YAH=117 7098 7139 " H VAL B 246 "<>" O VAL B 243 " d_HA=2.118 d_AD=3.107 a_DHA=164.803 symop: x,y,z a_YAH=122 7114 7163 "HE21 GLN B 247 "<>" O ALA B 244 " d_HA=2.083 d_AD=3.022 a_DHA=153.639 symop: x,y,z a_YAH=141 7135 7287 " H VAL B 256 "<>" O VAL B 246 " d_HA=1.867 d_AD=2.833 a_DHA=158.287 symop: x,y,z a_YAH=136 6524 6558 " H ASN B 210 "<>" O LEU B 208 " d_HA=1.908 d_AD=2.795 a_DHA=143.915 symop: x,y,z a_YAH=110 6592 6679 " H ARG B 217 "<>" O ILE B 213 " d_HA=1.820 d_AD=2.829 a_DHA=171.521 symop: x,y,z a_YAH=163 7283 7351 " H TYR B 259 "<>" O VAL B 256 " d_HA=2.100 d_AD=3.080 a_DHA=162.300 symop: x,y,z a_YAH=115 6687 6766 " HE ARG B 217 "<>" OE1 GLN B 221 " d_HA=2.094 d_AD=3.013 a_DHA=149.740 symop: x,y,z a_YAH=145 6688 7342 "HH11 ARG B 217 "<>" O TYR B 259 " d_HA=1.858 d_AD=2.863 a_DHA=168.976 symop: x,y,z a_YAH=160 6689 7363 "HH12 ARG B 217 "<>" O PRO B 260 " d_HA=2.251 d_AD=2.942 a_DHA=124.441 symop: x,y,z a_YAH=118 139 790 " H ARG A 552 "<>" O LEU A 513 " d_HA=1.920 d_AD=2.928 a_DHA=170.737 symop: x,y,z a_YAH=164 139 1758 "HH12 ARG A 611 "<>" O LEU A 513 " d_HA=2.062 d_AD=2.884 a_DHA=136.971 symop: x,y,z a_YAH=106 161 798 " HE ARG A 552 "<>" OD1 ASP A 514 " d_HA=1.728 d_AD=2.747 a_DHA=174.925 symop: x,y,z a_YAH=121 161 1757 "HH11 ARG A 611 "<>" OD1 ASP A 514 " d_HA=1.765 d_AD=2.732 a_DHA=156.489 symop: x,y,z a_YAH=134 162 801 "HH21 ARG A 552 "<>" OD2 ASP A 514 " d_HA=1.790 d_AD=2.812 a_DHA=171.806 symop: x,y,z a_YAH=107 802 1732 "HH22 ARG A 552 "<>" OD2 ASP A 610 " d_HA=2.198 d_AD=3.089 a_DHA=146.386 symop: x,y,z a_YAH=120 120 1806 " H SER A 615 "<>" O LEU A 512 " d_HA=2.460 d_AD=3.335 a_DHA=144.375 symop: x,y,z a_YAH=142 144 742 " H LEU A 513 "<>" O TRP A 550 " d_HA=2.245 d_AD=3.252 a_DHA=174.190 symop: x,y,z a_YAH=159 163 1803 " H ASP A 514 "<>" O SER A 615 " d_HA=2.014 d_AD=3.004 a_DHA=163.909 symop: x,y,z a_YAH=154 1740 1795 " H ALA A 614 "<>" O ARG A 611 " d_HA=2.084 d_AD=3.061 a_DHA=162.009 symop: x,y,z a_YAH=115 5008 5377 "HH11 ARG B 111 "<>" OE2 GLU B 135 " d_HA=1.727 d_AD=2.682 a_DHA=152.417 symop: x,y,z a_YAH=167 5372 5767 "HE21 GLN B 159 "<>" O GLU B 135 " d_HA=1.963 d_AD=2.845 a_DHA=143.627 symop: x,y,z a_YAH=110 5387 5761 " H GLN B 159 "<>" O LEU B 136 " d_HA=1.989 d_AD=2.793 a_DHA=134.468 symop: x,y,z a_YAH=146 5737 6079 "HD22 ASN B 157 "<>" O GLN B 180 " d_HA=2.367 d_AD=3.233 a_DHA=142.885 symop: x,y,z a_YAH=137 5732 6079 " H ASN B 157 "<>" O GLN B 180 " d_HA=2.039 d_AD=2.904 a_DHA=141.143 symop: x,y,z a_YAH=149 5732 6096 " H ASN B 157 "<>" O GLU B 181 " d_HA=2.148 d_AD=2.875 a_DHA=126.617 symop: x,y,z a_YAH=125 5746 6096 " H ASN B 158 "<>" O GLU B 181 " d_HA=2.571 d_AD=3.452 a_DHA=144.992 symop: x,y,z a_YAH=154 5772 6128 " H SER B 183 "<>" O LEU B 160 " d_HA=2.151 d_AD=2.872 a_DHA=126.629 symop: x,y,z a_YAH=134 5777 6114 " H LEU B 160 "<>" OD1 ASN B 182 " d_HA=2.082 d_AD=3.013 a_DHA=151.807 symop: x,y,z a_YAH=145 5406 5795 " H THR B 161 "<>" O LYS B 137 " d_HA=2.054 d_AD=3.028 a_DHA=159.440 symop: x,y,z a_YAH=150 5755 6132 " HG SER B 183 "<>" O GLN B 159 " d_HA=2.787 d_AD=3.504 a_DHA=132.077 symop: x,y,z a_YAH=95 6454 6908 " H TRP B 230 "<>" NE2 HIS B 203 " d_HA=1.932 d_AD=2.944 a_DHA=175.487 symop: x,y,z a_YAH=125 a_YAH=114 6060 6121 "HD22 ASN B 182 "<>" O LEU B 179 " d_HA=1.964 d_AD=2.952 a_DHA=165.250 symop: x,y,z a_YAH=112 6060 6481 "HD21 ASN B 205 "<>" O LEU B 179 " d_HA=1.993 d_AD=2.903 a_DHA=148.311 symop: x,y,z a_YAH=139 6102 6448 " H GLU B 181 "<>" O HIS B 203 " d_HA=2.210 d_AD=3.145 a_DHA=152.897 symop: x,y,z a_YAH=134 6141 6475 " H LEU B 184 "<>" OD1 ASN B 205 " d_HA=2.041 d_AD=2.942 a_DHA=146.902 symop: x,y,z a_YAH=149 5791 6164 " H TYR B 185 "<>" O THR B 161 " d_HA=2.930 d_AD=3.825 a_DHA=148.126 symop: x,y,z a_YAH=157 6885 7059 " H VAL B 229 "<>" O THR B 240 " d_HA=1.901 d_AD=2.868 a_DHA=157.922 symop: x,y,z a_YAH=142 6429 6516 " HE1 TRP B 207 "<>" O LEU B 202 " d_HA=1.950 d_AD=2.885 a_DHA=151.480 symop: x,y,z a_YAH=168 6844 7089 " H ASN B 242 "<>" O VAL B 227 " d_HA=1.895 d_AD=2.840 a_DHA=153.297 symop: x,y,z a_YAH=141 6805 6848 " H VAL B 227 "<>" O ALA B 224 " d_HA=2.545 d_AD=3.518 a_DHA=161.510 symop: x,y,z a_YAH=100 6743 6796 " H ASN B 223 "<>" O LEU B 220 " d_HA=2.386 d_AD=3.248 a_DHA=142.579 symop: x,y,z a_YAH=90 6630 6730 " H TRP B 219 "<>" O TYR B 215 " d_HA=1.975 d_AD=2.978 a_DHA=170.531 symop: x,y,z a_YAH=156 6651 6748 " H LEU B 220 "<>" O PHE B 216 " d_HA=1.870 d_AD=2.873 a_DHA=169.467 symop: x,y,z a_YAH=165 6671 6768 " H GLN B 221 "<>" O ARG B 217 " d_HA=2.042 d_AD=2.956 a_DHA=149.204 symop: x,y,z a_YAH=149 6695 6784 " H ASP B 222 "<>" O ARG B 218 " d_HA=1.945 d_AD=2.953 a_DHA=171.691 symop: x,y,z a_YAH=163 6611 6703 " H ARG B 218 "<>" O LEU B 214 " d_HA=2.300 d_AD=3.283 a_DHA=162.838 symop: x,y,z a_YAH=132 6639 6577 " H TYR B 215 "<>" O GLU B 212 " d_HA=2.586 d_AD=3.597 a_DHA=173.218 symop: x,y,z a_YAH=129 6762 6807 " H ALA B 224 "<>" O GLN B 221 " d_HA=2.989 d_AD=3.991 a_DHA=169.658 symop: x,y,z a_YAH=107 720 1759 "HH21 ARG A 611 "<>" O LYS A 549 " d_HA=1.901 d_AD=2.762 a_DHA=141.017 symop: x,y,z a_YAH=139 742 1758 "HH12 ARG A 611 "<>" O TRP A 550 " d_HA=2.682 d_AD=3.397 a_DHA=127.767 symop: x,y,z a_YAH=130 742 1760 "HH22 ARG A 611 "<>" O TRP A 550 " d_HA=1.712 d_AD=2.677 a_DHA=158.292 symop: x,y,z a_YAH=119 125 3185 " H LEU A 512 "<>" O PRO A 699 " d_HA=1.892 d_AD=2.883 a_DHA=163.540 symop: x,y,z a_YAH=151 3948 4303 " HH TYR B 44 "<>" OE2 GLU B 66 " d_HA=2.794 d_AD=3.733 a_DHA=163.825 symop: x,y,z a_YAH=104 1782 3429 " HE2 HIS B 12 "<>" OE1 GLU A 613 " d_HA=2.600 d_AD=3.539 a_DHA=153.381 symop: x,y,z a_YAH=102 1783 3408 " H SER B 11 "<>" OE2 GLU A 613 " d_HA=2.152 d_AD=3.129 a_DHA=160.160 symop: x,y,z a_YAH=153 1783 3412 " HG SER B 11 "<>" OE2 GLU A 613 " d_HA=1.537 d_AD=2.533 a_DHA=178.208 symop: x,y,z a_YAH=136 4302 4646 "HE21 GLN B 88 "<>" OE1 GLU B 66 " d_HA=2.546 d_AD=3.502 a_DHA=156.224 symop: x,y,z a_YAH=141 4606 4282 "HH21 ARG B 64 "<>" ND1 HIS B 86 " d_HA=1.966 d_AD=2.813 a_DHA=139.619 symop: x,y,z a_YAH=116 a_YAH=95 4965 5329 " H PHE B 109 "<>" O LYS B 132 " d_HA=1.905 d_AD=2.848 a_DHA=153.403 symop: x,y,z a_YAH=146 4982 5351 " H ASN B 110 "<>" O GLY B 133 " d_HA=2.329 d_AD=3.204 a_DHA=144.070 symop: x,y,z a_YAH=164 4982 5361 " H ASN B 110 "<>" OD1 ASN B 134 " d_HA=2.676 d_AD=3.351 a_DHA=124.126 symop: x,y,z a_YAH=92 5015 5378 " H GLU B 135 "<>" O LEU B 112 " d_HA=1.960 d_AD=2.818 a_DHA=140.628 symop: x,y,z a_YAH=144 5020 5361 " H LEU B 112 "<>" OD1 ASN B 134 " d_HA=2.065 d_AD=3.019 a_DHA=155.826 symop: x,y,z a_YAH=142 5310 5368 "HD22 ASN B 134 "<>" O LEU B 131 " d_HA=1.916 d_AD=2.916 a_DHA=169.818 symop: x,y,z a_YAH=112 5310 5750 "HD21 ASN B 158 "<>" O LEU B 131 " d_HA=2.081 d_AD=3.062 a_DHA=163.441 symop: x,y,z a_YAH=136 5352 5727 " H GLY B 133 "<>" O ASN B 157 " d_HA=2.203 d_AD=2.880 a_DHA=122.510 symop: x,y,z a_YAH=112 5352 5717 " H GLY B 133 "<>" O ALA B 156 " d_HA=2.148 d_AD=3.063 a_DHA=148.693 symop: x,y,z a_YAH=147 5363 5727 " H ASN B 134 "<>" O ASN B 157 " d_HA=2.181 d_AD=3.107 a_DHA=150.522 symop: x,y,z a_YAH=148 5392 5744 " H LEU B 136 "<>" OD1 ASN B 158 " d_HA=2.301 d_AD=3.149 a_DHA=140.491 symop: x,y,z a_YAH=143 5698 6120 "HD21 ASN B 182 "<>" O LEU B 155 " d_HA=1.901 d_AD=2.897 a_DHA=167.812 symop: x,y,z a_YAH=129 5698 5751 "HD22 ASN B 158 "<>" O LEU B 155 " d_HA=2.250 d_AD=3.070 a_DHA=137.507 symop: x,y,z a_YAH=102 5703 6041 " H LEU B 155 "<>" O LEU B 178 " d_HA=1.834 d_AD=2.814 a_DHA=161.194 symop: x,y,z a_YAH=163 5717 5751 "HD22 ASN B 158 "<>" O ALA B 156 " d_HA=2.421 d_AD=3.224 a_DHA=136.106 symop: x,y,z a_YAH=108 6065 6409 " H LEU B 179 "<>" O PHE B 201 " d_HA=2.013 d_AD=2.945 a_DHA=151.590 symop: x,y,z a_YAH=142 6399 6869 " H TYR B 228 "<>" O ALA B 200 " d_HA=2.020 d_AD=3.022 a_DHA=169.858 symop: x,y,z a_YAH=155 6401 6830 " H ALA B 200 "<>" O ASN B 226 " d_HA=1.851 d_AD=2.781 a_DHA=150.933 symop: x,y,z a_YAH=176 6022 6417 " H PHE B 201 "<>" O LEU B 177 " d_HA=1.949 d_AD=2.920 a_DHA=158.710 symop: x,y,z a_YAH=164 1542 6868 " HZ3 LYS A 599 "<>" OH TYR B 228 " d_HA=1.871 d_AD=2.811 a_DHA=151.325 symop: x,y,z a_YAH=118 a_YAH=126 6209 6260 " H PHE B 191 "<>" O PRO B 188 " d_HA=2.169 d_AD=3.156 a_DHA=165.253 symop: x,y,z a_YAH=132 6819 2096 "HH21 ARG A 632 "<>" OE1 GLU B 225 " d_HA=1.711 d_AD=2.650 a_DHA=149.673 symop: x,y,z a_YAH=113 6791 6835 " H ASN B 226 "<>" O ASN B 223 " d_HA=1.891 d_AD=2.859 a_DHA=158.437 symop: x,y,z a_YAH=122 6719 6801 "HD22 ASN B 223 "<>" O TRP B 219 " d_HA=1.955 d_AD=2.936 a_DHA=163.172 symop: x,y,z a_YAH=133 6794 6840 "HD22 ASN B 226 "<>" OD1 ASN B 223 " d_HA=2.322 d_AD=3.075 a_DHA=130.401 symop: x,y,z a_YAH=138 6820 2095 "HH12 ARG A 632 "<>" OE2 GLU B 225 " d_HA=1.696 d_AD=2.683 a_DHA=159.274 symop: x,y,z a_YAH=126 6711 6783 " HE ARG B 218 "<>" OD2 ASP B 222 " d_HA=1.918 d_AD=2.857 a_DHA=150.854 symop: x,y,z a_YAH=128 6783 6714 "HH21 ARG B 218 "<>" OD2 ASP B 222 " d_HA=1.744 d_AD=2.726 a_DHA=157.122 symop: x,y,z a_YAH=149 3765 4188 " H GLN B 59 "<>" O THR B 34 " d_HA=2.080 d_AD=3.047 a_DHA=158.579 symop: x,y,z a_YAH=162 3765 4172 " H THR B 58 "<>" O THR B 34 " d_HA=1.966 d_AD=2.807 a_DHA=138.782 symop: x,y,z a_YAH=124 3379 3423 " H HIS B 12 "<>" O VAL B 9 " d_HA=1.978 d_AD=2.892 a_DHA=148.850 symop: x,y,z a_YAH=144 3383 3416 " H VAL B 9 "<>" O HIS B 12 " d_HA=1.903 d_AD=2.902 a_DHA=166.035 symop: x,y,z a_YAH=143 3940 4287 " H TYR B 44 "<>" O CYS B 65 " d_HA=1.884 d_AD=2.870 a_DHA=162.146 symop: x,y,z a_YAH=168 4318 4623 " H LEU B 67 "<>" OD1 ASN B 87 " d_HA=2.110 d_AD=3.070 a_DHA=157.289 symop: x,y,z a_YAH=122 3931 4336 " H THR B 68 "<>" O TYR B 44 " d_HA=1.810 d_AD=2.817 a_DHA=173.334 symop: x,y,z a_YAH=145 3931 4339 " HG1 THR B 68 "<>" O TYR B 44 " d_HA=2.121 d_AD=2.932 a_DHA=140.251 symop: x,y,z a_YAH=140 3931 4352 " H LYS B 69 "<>" O TYR B 44 " d_HA=2.918 d_AD=3.814 a_DHA=147.706 symop: x,y,z a_YAH=143 4313 4640 " H GLN B 88 "<>" O LEU B 67 " d_HA=1.924 d_AD=2.802 a_DHA=143.122 symop: x,y,z a_YAH=133 4251 3870 " H GLU B 40 "<>" O ASP B 63 " d_HA=2.171 d_AD=3.121 a_DHA=154.717 symop: x,y,z a_YAH=140 4271 4603 " H ARG B 64 "<>" O HIS B 86 " d_HA=2.345 d_AD=3.033 a_DHA=123.928 symop: x,y,z a_YAH=115 4271 4592 " H ARG B 64 "<>" O SER B 85 " d_HA=2.307 d_AD=3.248 a_DHA=153.106 symop: x,y,z a_YAH=152 4290 4623 " H CYS B 65 "<>" OD1 ASN B 87 " d_HA=2.080 d_AD=2.945 a_DHA=142.242 symop: x,y,z a_YAH=130 4625 4957 " H ASN B 87 "<>" O PHE B 109 " d_HA=2.281 d_AD=3.181 a_DHA=147.359 symop: x,y,z a_YAH=135 4656 4980 " H LEU B 89 "<>" OD1 ASN B 110 " d_HA=2.026 d_AD=2.983 a_DHA=155.558 symop: x,y,z a_YAH=144 4651 4999 " H ARG B 111 "<>" O LEU B 89 " d_HA=2.289 d_AD=3.096 a_DHA=135.697 symop: x,y,z a_YAH=124 4670 5038 " H THR B 113 "<>" O GLN B 90 " d_HA=2.818 d_AD=3.771 a_DHA=157.476 symop: x,y,z a_YAH=148 4670 5041 " HG1 THR B 113 "<>" O GLN B 90 " d_HA=2.863 d_AD=3.632 a_DHA=137.333 symop: x,y,z a_YAH=157 4573 4630 "HD22 ASN B 87 "<>" O LEU B 84 " d_HA=1.910 d_AD=2.915 a_DHA=172.131 symop: x,y,z a_YAH=99 4573 4986 "HD21 ASN B 110 "<>" O LEU B 84 " d_HA=1.881 d_AD=2.859 a_DHA=160.708 symop: x,y,z a_YAH=146 4610 4946 " H HIS B 86 "<>" O SER B 108 " d_HA=2.026 d_AD=2.957 a_DHA=151.804 symop: x,y,z a_YAH=141 4946 4987 "HD22 ASN B 110 "<>" O SER B 108 " d_HA=2.020 d_AD=2.920 a_DHA=146.978 symop: x,y,z a_YAH=112 4930 5367 "HD21 ASN B 134 "<>" O VAL B 107 " d_HA=2.042 d_AD=3.026 a_DHA=162.930 symop: x,y,z a_YAH=143 4921 4949 " H SER B 108 "<>" OD1 ASP B 106 " d_HA=1.803 d_AD=2.803 a_DHA=164.024 symop: x,y,z a_YAH=160 4953 5329 " HG SER B 108 "<>" O LYS B 132 " d_HA=2.118 d_AD=2.975 a_DHA=147.538 symop: x,y,z a_YAH=105 4934 5289 " H VAL B 107 "<>" O TYR B 130 " d_HA=1.856 d_AD=2.859 a_DHA=167.695 symop: x,y,z a_YAH=158 5315 5687 " H LEU B 131 "<>" O SER B 154 " d_HA=1.838 d_AD=2.783 a_DHA=153.906 symop: x,y,z a_YAH=150 5668 6046 " H LEU B 178 "<>" O LEU B 153 " d_HA=1.949 d_AD=2.943 a_DHA=164.798 symop: x,y,z a_YAH=157 5673 6008 " H LEU B 153 "<>" O THR B 176 " d_HA=2.006 d_AD=3.018 a_DHA=173.931 symop: x,y,z a_YAH=171 1633 6010 "HE22 GLN A 604 "<>" OG1 THR B 176 " d_HA=1.864 d_AD=2.849 a_DHA=161.591 symop: x,y,z a_YAH=116 a_YAH=138 5996 6387 " H PHE B 199 "<>" O ASP B 175 " d_HA=2.080 d_AD=2.981 a_DHA=146.911 symop: x,y,z a_YAH=151 6027 6379 " H LEU B 177 "<>" O PHE B 199 " d_HA=1.886 d_AD=2.887 a_DHA=167.333 symop: x,y,z a_YAH=152 5839 5875 " H LEU B 167 "<>" O PRO B 164 " d_HA=2.163 d_AD=3.117 a_DHA=156.401 symop: x,y,z a_YAH=113 1540 6365 " HZ1 LYS A 599 "<>" O PRO B 198 " d_HA=1.851 d_AD=2.710 a_DHA=139.701 symop: x,y,z a_YAH=145 6245 6293 " H GLY B 193 "<>" O GLY B 190 " d_HA=1.810 d_AD=2.754 a_DHA=154.515 symop: x,y,z a_YAH=128 3346 3458 " H GLU B 14 "<>" O SER B 7 " d_HA=2.017 d_AD=2.971 a_DHA=156.033 symop: x,y,z a_YAH=154 3433 3784 " H ILE B 35 "<>" O LEU B 13 " d_HA=2.198 d_AD=3.206 a_DHA=172.481 symop: x,y,z a_YAH=136 3433 3769 " H THR B 34 "<>" O LEU B 13 " d_HA=1.995 d_AD=2.921 a_DHA=150.524 symop: x,y,z a_YAH=131 3603 7400 " HZ1 LYS B 262 "<>" OG1 THR B 23 " d_HA=2.482 d_AD=3.409 a_DHA=151.218 symop: y+1,-x+y+1,z-1/6 a_YAH=157 a_YAH=95 3438 3767 " H LEU B 13 "<>" OG1 THR B 34 " d_HA=1.878 d_AD=2.838 a_DHA=156.290 symop: x,y,z a_YAH=117 a_YAH=128 3582 3898 " H LEU B 42 "<>" O LEU B 22 " d_HA=1.890 d_AD=2.779 a_DHA=144.731 symop: x,y,z a_YAH=150 3374 3601 " HZ2 LYS B 8 "<>" O THR B 23 " d_HA=1.866 d_AD=2.856 a_DHA=164.305 symop: y,-x+y+1,z-1/6 a_YAH=176 3375 3912 " HZ3 LYS B 8 "<>" O LEU B 43 " d_HA=1.748 d_AD=2.724 a_DHA=159.120 symop: y,-x+y+1,z-1/6 a_YAH=155 3373 3954 " HZ1 LYS B 8 "<>" OG1 THR B 45 " d_HA=2.408 d_AD=3.104 a_DHA=125.165 symop: y,-x+y+1,z-1/6 a_YAH=140 a_YAH=113 4289 3884 " H ASN B 41 "<>" SG CYS B 65 " d_HA=2.691 d_AD=3.625 a_DHA=153.270 symop: x,y,z a_YAH=121 a_YAH=116 3974 4346 " H PHE B 46 "<>" O LYS B 69 " d_HA=2.612 d_AD=3.512 a_DHA=147.944 symop: x,y,z a_YAH=149 4232 4629 "HD21 ASN B 87 "<>" O LEU B 62 " d_HA=1.817 d_AD=2.823 a_DHA=169.705 symop: x,y,z a_YAH=136 4237 4561 " H LEU B 62 "<>" O ASP B 83 " d_HA=1.835 d_AD=2.835 a_DHA=166.253 symop: x,y,z a_YAH=157 4542 4923 " H ASP B 106 "<>" O LEU B 82 " d_HA=2.010 d_AD=3.018 a_DHA=171.038 symop: x,y,z a_YAH=160 4564 4599 " HG SER B 85 "<>" OD1 ASP B 83 " d_HA=1.755 d_AD=2.694 a_DHA=157.523 symop: x,y,z a_YAH=111 4564 4595 " H SER B 85 "<>" OD1 ASP B 83 " d_HA=1.818 d_AD=2.799 a_DHA=160.320 symop: x,y,z a_YAH=152 4578 4918 " H LEU B 84 "<>" O ASP B 106 " d_HA=1.799 d_AD=2.755 a_DHA=155.165 symop: x,y,z a_YAH=151 4899 5298 " H TYR B 130 "<>" O LEU B 105 " d_HA=1.911 d_AD=2.927 a_DHA=173.683 symop: x,y,z a_YAH=160 5120 5078 " H ALA B 119 "<>" O PRO B 116 " d_HA=2.384 d_AD=3.324 a_DHA=153.955 symop: x,y,z a_YAH=124 5259 5306 " HH TYR B 130 "<>" OE1 GLU B 128 " d_HA=1.617 d_AD=2.586 a_DHA=165.818 symop: x,y,z a_YAH=115 5270 5690 " H SER B 154 "<>" O LEU B 129 " d_HA=2.060 d_AD=3.011 a_DHA=154.506 symop: x,y,z a_YAH=163 5275 5646 " H LEU B 129 "<>" O LYS B 152 " d_HA=2.063 d_AD=3.019 a_DHA=155.985 symop: x,y,z a_YAH=142 5260 1683 " HG SER A 607 "<>" OE2 GLU B 128 " d_HA=1.853 d_AD=2.837 a_DHA=172.594 symop: x,y,z a_YAH=153 5663 1600 " HZ2 LYS B 152 "<>" O PHE A 603 " d_HA=1.772 d_AD=2.665 a_DHA=145.431 symop: x,y,z a_YAH=138 5664 1624 " HZ3 LYS B 152 "<>" OE1 GLN A 604 " d_HA=2.744 d_AD=3.628 a_DHA=146.451 symop: x,y,z a_YAH=107 5652 5238 " H LYS B 152 "<>" O GLN B 127 " d_HA=1.986 d_AD=2.981 a_DHA=164.839 symop: x,y,z a_YAH=157 5662 5999 " HZ1 LYS B 152 "<>" OD1 ASP B 175 " d_HA=1.773 d_AD=2.668 a_DHA=143.336 symop: x,y,z a_YAH=92 5631 6001 " H ASP B 175 "<>" O GLU B 151 " d_HA=1.856 d_AD=2.814 a_DHA=155.775 symop: x,y,z a_YAH=128 5631 6012 " H THR B 176 "<>" O GLU B 151 " d_HA=2.279 d_AD=3.256 a_DHA=161.238 symop: x,y,z a_YAH=168 5999 6015 " HG1 THR B 176 "<>" OD1 ASP B 175 " d_HA=1.667 d_AD=2.638 a_DHA=166.934 symop: x,y,z a_YAH=138 5863 5913 " H ASN B 169 "<>" O GLY B 166 " d_HA=2.077 d_AD=3.012 a_DHA=152.383 symop: x,y,z a_YAH=126 3703 3758 " HG1 THR B 33 "<>" O PRO B 30 " d_HA=1.657 d_AD=2.624 a_DHA=170.919 symop: x,y,z a_YAH=129 3703 3755 " H THR B 33 "<>" O PRO B 30 " d_HA=2.044 d_AD=3.011 a_DHA=159.361 symop: x,y,z a_YAH=124 3742 4142 "HH11 ARG B 56 "<>" OD1 ASP B 32 " d_HA=1.703 d_AD=2.679 a_DHA=156.805 symop: x,y,z a_YAH=140 3743 4400 "HE22 GLN B 71 "<>" OD2 ASP B 32 " d_HA=1.793 d_AD=2.784 a_DHA=159.640 symop: y,-x+y+1,z-1/6 a_YAH=120 3966 4393 " H GLN B 71 "<>" O PHE B 46 " d_HA=1.859 d_AD=2.870 a_DHA=172.996 symop: x,y,z a_YAH=154 4199 4566 " H ASP B 83 "<>" O LEU B 60 " d_HA=1.969 d_AD=2.977 a_DHA=170.876 symop: x,y,z a_YAH=158 4204 4528 " H LEU B 60 "<>" O THR B 81 " d_HA=1.972 d_AD=2.965 a_DHA=164.025 symop: x,y,z a_YAH=153 4717 4755 " H LEU B 95 "<>" O PRO B 93 " d_HA=2.287 d_AD=3.026 a_DHA=128.682 symop: x,y,z a_YAH=111 4547 4883 " H LEU B 82 "<>" O VAL B 104 " d_HA=1.905 d_AD=2.906 a_DHA=166.714 symop: x,y,z a_YAH=159 4904 5255 " H LEU B 105 "<>" O GLU B 128 " d_HA=2.028 d_AD=3.026 a_DHA=167.007 symop: x,y,z a_YAH=147 5111 5155 " H ARG B 121 "<>" O GLY B 118 " d_HA=1.910 d_AD=2.894 a_DHA=162.247 symop: x,y,z a_YAH=126 5261 4869 " H GLU B 128 "<>" O THR B 103 " d_HA=1.960 d_AD=2.939 a_DHA=161.595 symop: x,y,z a_YAH=155 3986 4033 " HG1 THR B 50 "<>" O SER B 47 " d_HA=1.678 d_AD=2.645 a_DHA=169.976 symop: x,y,z a_YAH=166 3986 4030 " H THR B 50 "<>" O SER B 47 " d_HA=2.277 d_AD=3.151 a_DHA=143.757 symop: x,y,z a_YAH=119 3993 4423 " HG SER B 47 "<>" OD1 ASP B 73 " d_HA=1.717 d_AD=2.675 a_DHA=162.016 symop: x,y,z a_YAH=145 4002 4387 " H LEU B 48 "<>" O GLN B 71 " d_HA=2.017 d_AD=3.019 a_DHA=168.129 symop: x,y,z a_YAH=139 3997 4045 " H LEU B 51 "<>" O LEU B 48 " d_HA=2.139 d_AD=3.103 a_DHA=157.571 symop: x,y,z a_YAH=116 4800 4432 " HG1 THR B 98 "<>" O GLY B 74 " d_HA=2.039 d_AD=2.984 a_DHA=165.022 symop: x,y,z a_YAH=144 4750 4812 " H LEU B 99 "<>" O LEU B 95 " d_HA=1.849 d_AD=2.798 a_DHA=154.441 symop: x,y,z a_YAH=164 4016 4064 " H MET B 52 "<>" O ALA B 49 " d_HA=2.026 d_AD=3.002 a_DHA=160.871 symop: x,y,z a_YAH=116 ------------------------------------------------------------------------------- Total: 516 Symmetry: 0 Per residue: 1.1073 Mean SD Skew Kurtosis theta_1: 145.456 21.517 -0.711 2.464 theta_2: 133.118 22.133 -0.178 1.942 d_HA: 2.299 0.302 0.557 2.332 2117 791 " HZ3 LYS A 45 "<>" OE2 GLU A 128 " d_HA=1.985 d_AD=2.811 a_DHA=135.907 symop: y,x,-z+1 a_YAH=119 3463 1813 " H THR A 209 "<>" O ALA A 110 " d_HA=1.927 d_AD=2.906 a_DHA=161.997 symop: x,y,z a_YAH=140 795 850 " H GLY A 49 "<>" O PHE A 46 " d_HA=2.405 d_AD=3.400 a_DHA=166.773 symop: x,y,z a_YAH=119 721 648 " H ARG A 42 "<>" O GLY A 38 " d_HA=2.008 d_AD=3.013 a_DHA=169.377 symop: x,y,z a_YAH=142 616 3407 "HH21 ARG A 35 "<>" O TRP A 206 " d_HA=2.580 d_AD=3.524 a_DHA=155.058 symop: x,y,z a_YAH=147 659 731 "HH12 ARG A 42 "<>" OD2 ASP A 39 " d_HA=1.777 d_AD=2.674 a_DHA=143.472 symop: x,y,z a_YAH=129 751 835 " H LEU A 48 "<>" O LYS A 44 " d_HA=2.404 d_AD=3.323 a_DHA=150.164 symop: x,y,z a_YAH=159 746 820 "HD21 ASN A 43 "<>" OE2 GLU A 47 " d_HA=2.336 d_AD=3.250 a_DHA=148.652 symop: x,y,z a_YAH=113 667 757 " H LYS A 44 "<>" O LYS A 40 " d_HA=2.605 d_AD=3.580 a_DHA=161.352 symop: x,y,z a_YAH=131 689 779 " H LYS A 45 "<>" O TRP A 41 " d_HA=1.898 d_AD=2.854 a_DHA=155.748 symop: x,y,z a_YAH=178 737 803 " H PHE A 46 "<>" O ASN A 43 " d_HA=2.609 d_AD=3.506 a_DHA=147.845 symop: x,y,z a_YAH=136 737 821 " H GLU A 47 "<>" O ASN A 43 " d_HA=2.955 d_AD=3.950 a_DHA=168.650 symop: x,y,z a_YAH=138 655 742 " H ASN A 43 "<>" O ASP A 39 " d_HA=1.983 d_AD=2.978 a_DHA=166.489 symop: x,y,z a_YAH=155 673 633 " H LYS A 40 "<>" O GLU A 37 " d_HA=2.339 d_AD=3.074 a_DHA=128.316 symop: x,y,z a_YAH=107 468 819 " HZ1 LYS A 27 "<>" OE1 GLU A 47 " d_HA=2.766 d_AD=3.495 a_DHA=128.658 symop: x,x-y+1,-z+1/2 a_YAH=156 500 769 " HZ3 LYS A 44 "<>" OE2 GLU A 29 " d_HA=1.798 d_AD=2.705 a_DHA=145.032 symop: x,x-y+1,-z+1/2 a_YAH=110 441 458 " H LYS A 27 "<>" OE1 GLU A 26 " d_HA=1.845 d_AD=2.747 a_DHA=145.024 symop: x,y,z a_YAH=143 10 1032 " H3 MET A 1 "<>" O ASP A 60 " d_HA=2.680 d_AD=3.678 a_DHA=167.775 symop: x,y,z a_YAH=152 443 348 " H GLU A 26 "<>" O LEU A 21 " d_HA=2.118 d_AD=3.070 a_DHA=155.465 symop: x,y,z a_YAH=157 437 483 " H TYR A 28 "<>" O GLU A 26 " d_HA=2.060 d_AD=2.933 a_DHA=142.728 symop: x,y,z a_YAH=107 33 501 " H GLU A 29 "<>" O PRO A 3 " d_HA=1.897 d_AD=2.898 a_DHA=167.455 symop: x,y,z a_YAH=147 372 3271 " HZ2 LYS A 197 "<>" OE2 GLU A 22 " d_HA=1.665 d_AD=2.668 a_DHA=164.206 symop: x,y,z a_YAH=145 3260 3234 " H LYS A 197 "<>" OG SER A 195 " d_HA=2.262 d_AD=3.200 a_DHA=153.392 symop: x,y,z a_YAH=105 a_YAH=125 1272 1342 " H HIS A 79 "<>" O ILE A 75 " d_HA=2.885 d_AD=3.514 a_DHA=121.013 symop: x,y,z a_YAH=133 1272 1346 " HD1 HIS A 79 "<>" O ILE A 75 " d_HA=1.821 d_AD=2.825 a_DHA=168.993 symop: x,y,z a_YAH=152 1342 1291 " H HIS A 79 "<>" O ALA A 76 " d_HA=2.176 d_AD=3.048 a_DHA=143.473 symop: x,y,z a_YAH=102 1036 1268 " HH TYR A 74 "<>" OD2 ASP A 60 " d_HA=1.586 d_AD=2.562 a_DHA=168.224 symop: x,y,z a_YAH=126 1055 1329 " HZ1 LYS A 78 "<>" OD2 ASP A 62 " d_HA=1.929 d_AD=2.736 a_DHA=133.624 symop: x,y,z a_YAH=155 1009 1035 " HH TYR A 58 "<>" OD1 ASP A 60 " d_HA=1.911 d_AD=2.871 a_DHA=167.772 symop: x,y,z a_YAH=144 1037 1063 " H ASP A 60 "<>" O VAL A 63 " d_HA=2.453 d_AD=3.293 a_DHA=140.215 symop: x,y,z a_YAH=124 272 353 " H LEU A 21 "<>" O THR A 17 " d_HA=2.000 d_AD=2.980 a_DHA=161.408 symop: x,y,z a_YAH=153 47 1018 " H ILE A 59 "<>" O ILE A 4 " d_HA=1.872 d_AD=2.888 a_DHA=177.069 symop: x,y,z a_YAH=162 52 1013 " H ILE A 4 "<>" O ILE A 59 " d_HA=2.188 d_AD=3.113 a_DHA=151.017 symop: x,y,z a_YAH=134 491 514 " HH TYR A 28 "<>" OE1 GLU A 30 " d_HA=1.720 d_AD=2.704 a_DHA=176.848 symop: x,y,z a_YAH=147 66 532 " H HIS A 31 "<>" O LEU A 5 " d_HA=1.843 d_AD=2.796 a_DHA=155.080 symop: x,y,z a_YAH=137 71 495 " H LEU A 5 "<>" O GLU A 29 " d_HA=1.884 d_AD=2.883 a_DHA=166.510 symop: x,y,z a_YAH=154 302 515 " HE ARG A 18 "<>" OE2 GLU A 30 " d_HA=1.896 d_AD=2.813 a_DHA=147.379 symop: x,y,z a_YAH=113 305 515 "HH21 ARG A 18 "<>" OE2 GLU A 30 " d_HA=1.747 d_AD=2.707 a_DHA=153.636 symop: x,y,z a_YAH=177 510 547 " H LEU A 32 "<>" O GLU A 30 " d_HA=2.591 d_AD=3.282 a_DHA=125.554 symop: x,y,z a_YAH=103 638 684 " HZ2 LYS A 40 "<>" OE2 GLU A 37 " d_HA=1.728 d_AD=2.657 a_DHA=148.150 symop: x,y,z a_YAH=106 154 587 " HZ3 LYS A 9 "<>" OE2 GLU A 34 " d_HA=1.749 d_AD=2.620 a_DHA=139.335 symop: x,y,z a_YAH=101 1409 1496 "HH12 ARG A 89 "<>" O GLY A 84 " d_HA=2.058 d_AD=2.978 a_DHA=151.086 symop: x,y,z a_YAH=92 1301 1357 " H ASN A 80 "<>" O ASP A 77 " d_HA=2.236 d_AD=3.219 a_DHA=162.821 symop: x,y,z a_YAH=118 1304 1497 "HH21 ARG A 89 "<>" OD1 ASP A 77 " d_HA=1.762 d_AD=2.774 a_DHA=165.943 symop: y,x,-z+1 a_YAH=126 1305 1494 " HE ARG A 89 "<>" OD2 ASP A 77 " d_HA=1.761 d_AD=2.708 a_DHA=151.868 symop: y,x,-z+1 a_YAH=101 1227 1306 " H ASP A 77 "<>" O ARG A 73 " d_HA=1.799 d_AD=2.782 a_DHA=162.087 symop: x,y,z a_YAH=159 1251 1319 " H LYS A 78 "<>" O TYR A 74 " d_HA=1.914 d_AD=2.897 a_DHA=161.382 symop: x,y,z a_YAH=155 1427 1504 " H ALA A 90 "<>" O PRO A 86 " d_HA=2.079 d_AD=3.037 a_DHA=157.262 symop: x,y,z a_YAH=144 1208 1293 " H ALA A 76 "<>" O ILE A 72 " d_HA=2.103 d_AD=3.096 a_DHA=166.182 symop: x,y,z a_YAH=144 1189 1277 " H ILE A 75 "<>" O ILE A 71 " d_HA=2.113 d_AD=3.124 a_DHA=172.344 symop: x,y,z a_YAH=160 992 1106 " H LEU A 65 "<>" O TYR A 58 " d_HA=2.075 d_AD=2.988 a_DHA=148.761 symop: x,y,z a_YAH=168 1001 1101 " H TYR A 58 "<>" O LEU A 65 " d_HA=1.876 d_AD=2.867 a_DHA=164.092 symop: x,y,z a_YAH=147 225 294 " H ARG A 18 "<>" O VAL A 14 " d_HA=2.052 d_AD=3.011 a_DHA=156.379 symop: x,y,z a_YAH=157 247 199 " H GLN A 15 "<>" O GLY A 12 " d_HA=2.741 d_AD=3.725 a_DHA=164.295 symop: x,y,z a_YAH=105 85 980 " H TYR A 57 "<>" O GLY A 6 " d_HA=2.023 d_AD=3.006 a_DHA=161.957 symop: x,y,z a_YAH=143 86 971 " H GLY A 6 "<>" O TYR A 57 " d_HA=1.808 d_AD=2.822 a_DHA=175.679 symop: x,y,z a_YAH=153 177 247 " H GLN A 15 "<>" O LYS A 11 " d_HA=2.812 d_AD=3.458 a_DHA=122.122 symop: x,y,z a_YAH=126 177 229 " H VAL A 14 "<>" O LYS A 11 " d_HA=2.978 d_AD=3.751 a_DHA=134.212 symop: x,y,z a_YAH=139 303 245 "HH11 ARG A 18 "<>" OE1 GLN A 15 " d_HA=1.953 d_AD=2.943 a_DHA=164.303 symop: x,y,z a_YAH=160 112 306 "HH22 ARG A 18 "<>" O TRP A 8 " d_HA=2.528 d_AD=3.460 a_DHA=154.562 symop: x,y,z a_YAH=161 112 163 " H ILE A 10 "<>" O TRP A 8 " d_HA=2.060 d_AD=2.976 a_DHA=149.025 symop: x,y,z a_YAH=97 158 304 "HH12 ARG A 18 "<>" O ILE A 10 " d_HA=1.770 d_AD=2.761 a_DHA=165.239 symop: x,y,z a_YAH=150 158 306 "HH22 ARG A 18 "<>" O ILE A 10 " d_HA=2.966 d_AD=3.618 a_DHA=123.554 symop: x,y,z a_YAH=157 92 570 " H TYR A 33 "<>" O PHE A 7 " d_HA=2.275 d_AD=3.195 a_DHA=150.925 symop: x,y,z a_YAH=140 100 525 " H PHE A 7 "<>" O HIS A 31 " d_HA=2.184 d_AD=3.149 a_DHA=157.559 symop: x,y,z a_YAH=147 569 988 " HH TYR A 57 "<>" OH TYR A 33 " d_HA=2.003 d_AD=2.941 a_DHA=163.327 symop: x,y,z a_YAH=116 a_YAH=132 183 3350 " H LYS A 11 "<>" O PRO A 202 " d_HA=1.841 d_AD=2.853 a_DHA=172.300 symop: x,y,z a_YAH=167 142 561 " H LYS A 9 "<>" O TYR A 33 " d_HA=1.959 d_AD=2.898 a_DHA=152.330 symop: x,y,z a_YAH=157 588 637 " H GLU A 34 "<>" OE1 GLU A 37 " d_HA=1.903 d_AD=2.921 a_DHA=175.211 symop: x,y,z a_YAH=123 633 673 " H LYS A 40 "<>" O GLU A 37 " d_HA=2.339 d_AD=3.074 a_DHA=128.316 symop: x,y,z a_YAH=107 633 700 " H TRP A 41 "<>" O GLU A 37 " d_HA=2.576 d_AD=3.489 a_DHA=149.878 symop: x,y,z a_YAH=152 637 685 " HZ3 LYS A 40 "<>" OE1 GLU A 37 " d_HA=1.957 d_AD=2.743 a_DHA=131.326 symop: x,y,z a_YAH=107 624 639 " H GLU A 37 "<>" OD1 ASP A 36 " d_HA=2.094 d_AD=2.936 a_DHA=138.694 symop: x,y,z a_YAH=115 1402 1495 "HH11 ARG A 89 "<>" O GLY A 83 " d_HA=1.980 d_AD=2.909 a_DHA=150.603 symop: x,y,z a_YAH=136 1410 1467 " H GLY A 84 "<>" OE1 GLU A 88 " d_HA=1.763 d_AD=2.737 a_DHA=157.852 symop: x,y,z a_YAH=131 1416 1486 " H ARG A 89 "<>" O CYS A 85 " d_HA=1.934 d_AD=2.947 a_DHA=174.082 symop: x,y,z a_YAH=165 1463 1532 " H ILE A 92 "<>" O GLU A 88 " d_HA=1.981 d_AD=2.991 a_DHA=172.263 symop: x,y,z a_YAH=168 1478 1549 " H SER A 93 "<>" O ARG A 89 " d_HA=2.271 d_AD=3.148 a_DHA=144.325 symop: x,y,z a_YAH=131 1478 1553 " HG SER A 93 "<>" O ARG A 89 " d_HA=1.712 d_AD=2.689 a_DHA=175.184 symop: x,y,z a_YAH=142 1441 1518 " H GLU A 91 "<>" O LYS A 87 " d_HA=2.139 d_AD=2.984 a_DHA=139.578 symop: x,y,z a_YAH=136 1502 1562 " H MET A 94 "<>" O ALA A 90 " d_HA=1.979 d_AD=2.845 a_DHA=141.864 symop: x,y,z a_YAH=140 1458 1516 " HZ2 LYS A 87 "<>" OE1 GLU A 91 " d_HA=1.729 d_AD=2.625 a_DHA=142.807 symop: x,y,z a_YAH=177 1162 1235 " H ARG A 73 "<>" O MET A 69 " d_HA=2.169 d_AD=3.117 a_DHA=154.414 symop: x,y,z a_YAH=138 1179 1260 " H TYR A 74 "<>" O ALA A 70 " d_HA=1.969 d_AD=2.931 a_DHA=157.346 symop: x,y,z a_YAH=140 1124 1560 " H THR A 66 "<>" SD MET A 94 " d_HA=2.692 d_AD=3.626 a_DHA=153.575 symop: y,x,-z+1 a_YAH=93 a_YAH=156 1134 1181 " H ALA A 70 "<>" O GLN A 67 " d_HA=2.412 d_AD=3.125 a_DHA=126.938 symop: x,y,z a_YAH=103 1134 1194 " H ILE A 71 "<>" O GLN A 67 " d_HA=2.184 d_AD=3.150 a_DHA=158.234 symop: x,y,z a_YAH=155 1151 1213 " H ILE A 72 "<>" O SER A 68 " d_HA=1.941 d_AD=2.953 a_DHA=172.655 symop: x,y,z a_YAH=162 1154 3485 " H SER A 68 "<>" O11 GSH A 500 " d_HA=1.888 d_AD=2.862 a_DHA=157.365 symop: x,y,z a_YAH=90 200 3364 " H GLY A 12 "<>" O LEU A 203 " d_HA=1.886 d_AD=2.801 a_DHA=148.667 symop: x,y,z a_YAH=143 128 3487 " HE1 TRP A 8 "<>" O2 GSH A 500 " d_HA=1.746 d_AD=2.766 a_DHA=173.825 symop: x,y,z a_YAH=162 648 721 " H ARG A 42 "<>" O GLY A 38 " d_HA=2.008 d_AD=3.013 a_DHA=169.377 symop: x,y,z a_YAH=142 648 700 " H TRP A 41 "<>" O GLY A 38 " d_HA=2.619 d_AD=3.310 a_DHA=125.385 symop: x,y,z a_YAH=92 3407 616 "HH21 ARG A 35 "<>" O TRP A 206 " d_HA=2.580 d_AD=3.524 a_DHA=155.058 symop: x,y,z a_YAH=147 621 649 " H GLY A 38 "<>" O ASP A 36 " d_HA=1.878 d_AD=2.755 a_DHA=142.650 symop: x,y,z a_YAH=92 1357 1301 " H ASN A 80 "<>" O ASP A 77 " d_HA=2.236 d_AD=3.219 a_DHA=162.821 symop: x,y,z a_YAH=118 1352 1403 " H GLY A 83 "<>" O ASN A 80 " d_HA=2.351 d_AD=3.361 a_DHA=176.481 symop: x,y,z a_YAH=134 1366 2469 " HG1 THR A 149 "<>" O MET A 81 " d_HA=2.981 d_AD=3.831 a_DHA=148.977 symop: x,y,z a_YAH=158 1245 1597 "HH12 ARG A 73 "<>" OE1 GLU A 96 " d_HA=1.695 d_AD=2.615 a_DHA=146.496 symop: x,y,z a_YAH=121 1247 1548 "HH22 ARG A 73 "<>" OG SER A 93 " d_HA=1.834 d_AD=2.810 a_DHA=159.879 symop: x,y,z a_YAH=125 a_YAH=105 1512 1579 " H LEU A 95 "<>" O GLU A 91 " d_HA=2.013 d_AD=3.005 a_DHA=165.818 symop: x,y,z a_YAH=151 1527 1599 " H GLU A 96 "<>" O ILE A 92 " d_HA=1.904 d_AD=2.886 a_DHA=161.992 symop: x,y,z a_YAH=146 1517 2267 "HH12 ARG A 136 "<>" OE2 GLU A 91 " d_HA=1.876 d_AD=2.803 a_DHA=149.600 symop: x,y,z a_YAH=119 1517 2269 "HH22 ARG A 136 "<>" OE2 GLU A 91 " d_HA=1.825 d_AD=2.778 a_DHA=153.466 symop: x,y,z a_YAH=129 2268 2377 "HH21 ARG A 136 "<>" O LEU A 143 " d_HA=2.133 d_AD=2.944 a_DHA=135.968 symop: x,y,z a_YAH=133 879 2266 "HH11 ARG A 136 "<>" OE1 GLU A 51 " d_HA=1.749 d_AD=2.767 a_DHA=171.975 symop: y,x,-z+1 a_YAH=97 1546 1609 " H GLY A 97 "<>" O SER A 93 " d_HA=2.084 d_AD=3.087 a_DHA=168.870 symop: x,y,z a_YAH=141 1557 1617 " H ALA A 98 "<>" O MET A 94 " d_HA=2.037 d_AD=3.014 a_DHA=161.209 symop: x,y,z a_YAH=150 1138 3504 "HN12 GSH A 500 "<>" OE1 GLN A 67 " d_HA=2.080 d_AD=3.057 a_DHA=157.939 symop: x,y,z a_YAH=146 1158 3486 " HG SER A 68 "<>" O12 GSH A 500 " d_HA=1.544 d_AD=2.540 a_DHA=174.304 symop: x,y,z a_YAH=133 1147 1664 "HE22 GLN A 67 "<>" OD2 ASP A 101 " d_HA=1.828 d_AD=2.775 a_DHA=151.330 symop: y,x,-z+1 a_YAH=110 890 1127 " HG1 THR A 66 "<>" O PHE A 52 " d_HA=1.711 d_AD=2.672 a_DHA=168.347 symop: x,y,z a_YAH=125 927 943 " H LEU A 55 "<>" OD1 ASN A 54 " d_HA=2.026 d_AD=2.922 a_DHA=145.628 symop: x,y,z a_YAH=115 927 3500 " HN2 GSH A 500 "<>" OD1 ASN A 54 " d_HA=2.325 d_AD=3.159 a_DHA=138.731 symop: x,y,z a_YAH=130 927 3501 " HN3 GSH A 500 "<>" OD1 ASN A 54 " d_HA=2.236 d_AD=2.996 a_DHA=130.389 symop: x,y,z a_YAH=153 791 2117 " HZ3 LYS A 45 "<>" OE2 GLU A 128 " d_HA=1.985 d_AD=2.811 a_DHA=135.907 symop: y,x,-z+1 a_YAH=119 705 3488 " HE1 TRP A 41 "<>" O31 GSH A 500 " d_HA=1.760 d_AD=2.745 a_DHA=159.627 symop: x,y,z a_YAH=114 790 3488 " HZ2 LYS A 45 "<>" O31 GSH A 500 " d_HA=1.870 d_AD=2.784 a_DHA=146.773 symop: x,y,z a_YAH=117 1831 3401 " H GLY A 205 "<>" OH TYR A 111 " d_HA=2.265 d_AD=3.236 a_DHA=160.621 symop: x,y,z a_YAH=105 a_YAH=142 3400 3450 " H ALA A 208 "<>" O GLY A 205 " d_HA=2.068 d_AD=3.048 a_DHA=162.837 symop: x,y,z a_YAH=134 1291 1342 " H HIS A 79 "<>" O ALA A 76 " d_HA=2.176 d_AD=3.048 a_DHA=143.473 symop: x,y,z a_YAH=102 1291 1371 " H MET A 81 "<>" O ALA A 76 " d_HA=2.041 d_AD=2.847 a_DHA=134.900 symop: x,y,z a_YAH=153 1598 2489 " HE2 HIS A 150 "<>" OE2 GLU A 96 " d_HA=1.742 d_AD=2.755 a_DHA=168.510 symop: x,y,z a_YAH=121 2265 2377 " HE ARG A 136 "<>" O LEU A 143 " d_HA=1.842 d_AD=2.789 a_DHA=153.629 symop: x,y,z a_YAH=153 1593 1646 " H LEU A 100 "<>" O GLU A 96 " d_HA=2.011 d_AD=2.979 a_DHA=158.257 symop: x,y,z a_YAH=148 1593 1629 " H VAL A 99 "<>" O GLU A 96 " d_HA=2.502 d_AD=3.169 a_DHA=122.678 symop: x,y,z a_YAH=98 1574 1629 " H VAL A 99 "<>" O LEU A 95 " d_HA=2.130 d_AD=3.045 a_DHA=148.658 symop: x,y,z a_YAH=149 2210 2144 " H PHE A 133 "<>" O LEU A 130 " d_HA=2.289 d_AD=3.029 a_DHA=128.927 symop: x,y,z a_YAH=109 1608 1665 " H ASP A 101 "<>" O GLY A 97 " d_HA=1.913 d_AD=2.892 a_DHA=160.342 symop: x,y,z a_YAH=158 1615 1677 " H ILE A 102 "<>" O ALA A 98 " d_HA=2.927 d_AD=3.862 a_DHA=153.426 symop: x,y,z a_YAH=130 2127 2210 " H PHE A 133 "<>" O MET A 129 " d_HA=2.854 d_AD=3.742 a_DHA=146.720 symop: x,y,z a_YAH=143 2127 2190 " H MET A 132 "<>" O MET A 129 " d_HA=2.310 d_AD=3.124 a_DHA=136.521 symop: x,y,z a_YAH=111 1663 3503 "HN11 GSH A 500 "<>" OD1 ASP A 101 " d_HA=2.071 d_AD=3.052 a_DHA=158.296 symop: y,x,-z+1 a_YAH=140 2349 2420 " HG1 THR A 141 "<>" OD1 ASP A 146 " d_HA=1.811 d_AD=2.792 a_DHA=172.352 symop: x,y,z a_YAH=158 2462 2512 " H ASP A 152 "<>" O THR A 149 " d_HA=1.961 d_AD=2.891 a_DHA=150.932 symop: x,y,z a_YAH=133 2466 2511 " H THR A 149 "<>" OD2 ASP A 152 " d_HA=1.821 d_AD=2.836 a_DHA=170.639 symop: x,y,z a_YAH=145 2382 2510 " H LEU A 143 "<>" OD1 ASP A 152 " d_HA=1.794 d_AD=2.816 a_DHA=175.410 symop: x,y,z a_YAH=127 2342 3016 "HH11 ARG A 182 "<>" O THR A 141 " d_HA=1.793 d_AD=2.748 a_DHA=154.142 symop: x,y,z a_YAH=145 2365 2410 " H TYR A 142 "<>" O GLY A 145 " d_HA=1.945 d_AD=2.805 a_DHA=140.716 symop: x,y,z a_YAH=146 2476 2527 " H PHE A 153 "<>" O HIS A 150 " d_HA=2.322 d_AD=3.038 a_DHA=126.702 symop: x,y,z a_YAH=110 2476 2544 " H MET A 154 "<>" O HIS A 150 " d_HA=2.203 d_AD=3.147 a_DHA=154.125 symop: x,y,z a_YAH=147 2493 2561 " H LEU A 155 "<>" O PRO A 151 " d_HA=1.831 d_AD=2.824 a_DHA=164.697 symop: x,y,z a_YAH=153 2507 2584 " H TYR A 156 "<>" O ASP A 152 " d_HA=2.012 d_AD=2.956 a_DHA=153.843 symop: x,y,z a_YAH=142 1641 1724 " H TYR A 104 "<>" O LEU A 100 " d_HA=1.777 d_AD=2.761 a_DHA=162.223 symop: x,y,z a_YAH=151 1625 1677 " H ILE A 102 "<>" O VAL A 99 " d_HA=2.512 d_AD=3.187 a_DHA=123.510 symop: x,y,z a_YAH=103 1625 1699 " H ARG A 103 "<>" O VAL A 99 " d_HA=2.020 d_AD=3.038 a_DHA=175.722 symop: x,y,z a_YAH=153 1715 1787 "HH11 ARG A 108 "<>" O TYR A 104 " d_HA=2.076 d_AD=3.027 a_DHA=154.985 symop: x,y,z a_YAH=112 1715 1778 " H ARG A 108 "<>" O TYR A 104 " d_HA=2.534 d_AD=3.266 a_DHA=128.749 symop: x,y,z a_YAH=118 1672 1737 " H GLY A 105 "<>" O ILE A 102 " d_HA=2.301 d_AD=3.002 a_DHA=125.175 symop: x,y,z a_YAH=93 1672 1747 " H VAL A 106 "<>" O ILE A 102 " d_HA=1.964 d_AD=2.955 a_DHA=164.289 symop: x,y,z a_YAH=160 2057 2132 " H MET A 129 "<>" O LYS A 125 " d_HA=2.475 d_AD=3.419 a_DHA=154.939 symop: x,y,z a_YAH=150 2057 2118 " H GLU A 128 "<>" O LYS A 125 " d_HA=2.267 d_AD=3.043 a_DHA=132.353 symop: x,y,z a_YAH=109 2079 2149 " H LEU A 130 "<>" O LEU A 126 " d_HA=1.891 d_AD=2.903 a_DHA=174.268 symop: x,y,z a_YAH=163 1995 2053 " HG SER A 124 "<>" O ASP A 121 " d_HA=1.785 d_AD=2.722 a_DHA=159.769 symop: x,y,z a_YAH=137 1995 2049 " H SER A 124 "<>" O ASP A 121 " d_HA=2.939 d_AD=3.618 a_DHA=124.973 symop: x,y,z a_YAH=96 1999 2073 " HZ1 LYS A 125 "<>" OD2 ASP A 121 " d_HA=1.739 d_AD=2.701 a_DHA=154.190 symop: x,y,z a_YAH=98 329 408 " H LEU A 24 "<>" O LEU A 20 " d_HA=2.037 d_AD=2.987 a_DHA=155.140 symop: x,y,z a_YAH=148 348 443 " H GLU A 26 "<>" O LEU A 21 " d_HA=2.118 d_AD=3.070 a_DHA=155.465 symop: x,y,z a_YAH=157 367 428 " H GLU A 25 "<>" O GLU A 22 " d_HA=2.184 d_AD=3.096 a_DHA=149.429 symop: x,y,z a_YAH=98 286 373 " H GLU A 22 "<>" O ARG A 18 " d_HA=2.011 d_AD=3.021 a_DHA=171.234 symop: x,y,z a_YAH=157 353 272 " H LEU A 21 "<>" O THR A 17 " d_HA=2.000 d_AD=2.980 a_DHA=161.408 symop: x,y,z a_YAH=153 258 334 " H LEU A 20 "<>" O PRO A 16 " d_HA=1.922 d_AD=2.912 a_DHA=164.318 symop: x,y,z a_YAH=152 310 391 " H TYR A 23 "<>" O LEU A 19 " d_HA=1.910 d_AD=2.876 a_DHA=157.282 symop: x,y,z a_YAH=151 2935 3028 " H ILE A 183 "<>" O PHE A 179 " d_HA=2.033 d_AD=3.015 a_DHA=162.080 symop: x,y,z a_YAH=162 241 315 " H LEU A 19 "<>" O GLN A 15 " d_HA=2.137 d_AD=3.127 a_DHA=166.045 symop: x,y,z a_YAH=156 2519 2601 " H ASP A 157 "<>" O PHE A 153 " d_HA=2.133 d_AD=3.105 a_DHA=159.561 symop: x,y,z a_YAH=143 2889 2961 " H LYS A 180 "<>" O LEU A 176 " d_HA=1.873 d_AD=2.863 a_DHA=163.012 symop: x,y,z a_YAH=154 199 247 " H GLN A 15 "<>" O GLY A 12 " d_HA=2.741 d_AD=3.725 a_DHA=164.295 symop: x,y,z a_YAH=105 1707 2600 " HE ARG A 103 "<>" OD2 ASP A 157 " d_HA=1.729 d_AD=2.746 a_DHA=170.552 symop: x,y,z a_YAH=119 1710 2599 "HH21 ARG A 103 "<>" OD1 ASP A 157 " d_HA=2.018 d_AD=3.016 a_DHA=162.049 symop: x,y,z a_YAH=101 2539 2610 " H ALA A 158 "<>" O MET A 154 " d_HA=2.001 d_AD=3.000 a_DHA=167.205 symop: x,y,z a_YAH=149 2556 2623 " H LEU A 159 "<>" O LEU A 155 " d_HA=1.881 d_AD=2.859 a_DHA=160.656 symop: x,y,z a_YAH=153 2575 2642 " H ASP A 160 "<>" O TYR A 156 " d_HA=1.883 d_AD=2.876 a_DHA=164.339 symop: x,y,z a_YAH=153 2596 2653 " H VAL A 161 "<>" O ASP A 157 " d_HA=2.048 d_AD=3.031 a_DHA=161.922 symop: x,y,z a_YAH=154 1691 1762 " H SER A 107 "<>" O ARG A 103 " d_HA=2.035 d_AD=3.038 a_DHA=168.940 symop: x,y,z a_YAH=142 1709 3387 "HH12 ARG A 103 "<>" OE1 GLN A 204 " d_HA=1.867 d_AD=2.760 a_DHA=145.069 symop: x,y,z a_YAH=154 2608 2669 " H VAL A 162 "<>" O ALA A 158 " d_HA=2.029 d_AD=3.025 a_DHA=166.054 symop: x,y,z a_YAH=153 1736 1778 " H ARG A 108 "<>" O GLY A 105 " d_HA=2.761 d_AD=3.577 a_DHA=137.770 symop: x,y,z a_YAH=94 1736 1799 " H ILE A 109 "<>" O GLY A 105 " d_HA=2.975 d_AD=3.878 a_DHA=149.023 symop: x,y,z a_YAH=138 1743 1815 " H ALA A 110 "<>" O VAL A 106 " d_HA=2.210 d_AD=3.197 a_DHA=164.682 symop: x,y,z a_YAH=163 1743 1799 " H ILE A 109 "<>" O VAL A 106 " d_HA=2.271 d_AD=3.050 a_DHA=132.770 symop: x,y,z a_YAH=116 2015 1938 " H PHE A 122 "<>" O LEU A 118 " d_HA=1.935 d_AD=2.936 a_DHA=167.745 symop: x,y,z a_YAH=156 1957 2032 " H LEU A 123 "<>" O LYS A 119 " d_HA=1.898 d_AD=2.899 a_DHA=167.844 symop: x,y,z a_YAH=153 2007 2084 " H LEU A 126 "<>" O PHE A 122 " d_HA=2.104 d_AD=2.988 a_DHA=144.699 symop: x,y,z a_YAH=146 2007 2063 " H LYS A 125 "<>" O PHE A 122 " d_HA=1.965 d_AD=2.889 a_DHA=150.100 symop: x,y,z a_YAH=124 2049 1979 " H SER A 124 "<>" O VAL A 120 " d_HA=2.200 d_AD=3.164 a_DHA=157.992 symop: x,y,z a_YAH=157 2294 2883 " HZ1 LYS A 175 "<>" SG CYS A 138 " d_HA=2.983 d_AD=3.611 a_DHA=121.020 symop: x,y,z a_YAH=118 a_YAH=126 2237 2295 " H CYS A 138 "<>" O ASP A 135 " d_HA=2.101 d_AD=3.002 a_DHA=146.455 symop: x,y,z a_YAH=100 2249 2338 " HZ3 LYS A 140 "<>" O ARG A 136 " d_HA=1.891 d_AD=2.855 a_DHA=156.255 symop: x,y,z a_YAH=137 2273 2326 " H LYS A 140 "<>" O LEU A 137 " d_HA=2.196 d_AD=3.172 a_DHA=160.206 symop: x,y,z a_YAH=110 427 3112 "HE21 GLN A 188 "<>" OE2 GLU A 25 " d_HA=1.751 d_AD=2.772 a_DHA=168.804 symop: x,y,z a_YAH=134 3018 3057 "HH21 ARG A 182 "<>" O ALA A 185 " d_HA=1.814 d_AD=2.826 a_DHA=172.293 symop: x,x-y+1,-z+3/2 a_YAH=176 3016 2342 "HH11 ARG A 182 "<>" O THR A 141 " d_HA=1.793 d_AD=2.748 a_DHA=154.142 symop: x,y,z a_YAH=145 3100 3179 " H TYR A 192 "<>" O GLN A 188 " d_HA=2.030 d_AD=2.970 a_DHA=153.031 symop: x,y,z a_YAH=137 3067 3122 " H ILE A 189 "<>" O ILE A 186 " d_HA=2.281 d_AD=2.989 a_DHA=126.078 symop: x,y,z a_YAH=112 3067 3141 " H ASP A 190 "<>" O ILE A 186 " d_HA=2.026 d_AD=3.029 a_DHA=169.359 symop: x,y,z a_YAH=161 3086 3154 " H LYS A 191 "<>" O PRO A 187 " d_HA=1.975 d_AD=2.964 a_DHA=163.655 symop: x,y,z a_YAH=147 3015 3057 " HE ARG A 182 "<>" O ALA A 185 " d_HA=2.727 d_AD=3.504 a_DHA=134.087 symop: x,x-y+1,-z+3/2 a_YAH=125 2924 3007 " H ARG A 182 "<>" O CYS A 178 " d_HA=1.952 d_AD=2.853 a_DHA=146.630 symop: x,y,z a_YAH=146 3023 3072 " H ILE A 186 "<>" O ILE A 183 " d_HA=2.127 d_AD=3.106 a_DHA=161.367 symop: x,y,z a_YAH=118 2955 3048 " H GLU A 184 "<>" O LYS A 180 " d_HA=2.167 d_AD=3.181 a_DHA=175.763 symop: x,y,z a_YAH=155 3007 2924 " H ARG A 182 "<>" O CYS A 178 " d_HA=1.952 d_AD=2.853 a_DHA=146.630 symop: x,y,z a_YAH=146 245 303 "HH11 ARG A 18 "<>" OE1 GLN A 15 " d_HA=1.953 d_AD=2.943 a_DHA=164.303 symop: x,y,z a_YAH=160 2973 3047 " HZ3 LYS A 180 "<>" OE2 GLU A 184 " d_HA=1.688 d_AD=2.653 a_DHA=154.626 symop: x,y,z a_YAH=169 2983 2908 " H LYS A 181 "<>" O VAL A 177 " d_HA=2.091 d_AD=3.093 a_DHA=168.955 symop: x,y,z a_YAH=153 2618 2686 " H LEU A 163 "<>" O LEU A 159 " d_HA=2.260 d_AD=3.235 a_DHA=160.801 symop: x,y,z a_YAH=152 3364 200 " H GLY A 12 "<>" O LEU A 203 " d_HA=1.886 d_AD=2.801 a_DHA=148.667 symop: x,y,z a_YAH=143 2649 2709 " H TYR A 164 "<>" O VAL A 161 " d_HA=2.238 d_AD=3.165 a_DHA=151.597 symop: x,y,z a_YAH=113 2665 2726 " H MET A 165 "<>" O VAL A 162 " d_HA=2.001 d_AD=2.911 a_DHA=148.259 symop: x,y,z a_YAH=109 2665 2743 " H ASP A 166 "<>" O VAL A 162 " d_HA=1.959 d_AD=2.922 a_DHA=158.029 symop: x,y,z a_YAH=164 2738 2788 " HG CYS A 169 "<>" O ASP A 166 " d_HA=1.775 d_AD=3.082 a_DHA=161.900 symop: x,y,z a_YAH=172 2738 2784 " H CYS A 169 "<>" O ASP A 166 " d_HA=2.317 d_AD=3.259 a_DHA=154.249 symop: x,y,z a_YAH=111 2741 2769 " H MET A 168 "<>" OD1 ASP A 166 " d_HA=1.919 d_AD=2.857 a_DHA=151.033 symop: x,y,z a_YAH=135 2179 2241 " HZ1 LYS A 131 "<>" OD2 ASP A 135 " d_HA=1.776 d_AD=2.639 a_DHA=139.231 symop: x,y,z a_YAH=109 2180 2240 " HZ2 LYS A 131 "<>" OD1 ASP A 135 " d_HA=1.841 d_AD=2.691 a_DHA=137.787 symop: x,y,z a_YAH=103 2163 2242 " H ASP A 135 "<>" O LYS A 131 " d_HA=1.952 d_AD=2.965 a_DHA=173.930 symop: x,y,z a_YAH=152 2185 2257 " H ARG A 136 "<>" O MET A 132 " d_HA=2.049 d_AD=3.018 a_DHA=157.984 symop: x,y,z a_YAH=137 2202 2278 " H LEU A 137 "<>" O PHE A 133 " d_HA=1.963 d_AD=2.941 a_DHA=160.061 symop: x,y,z a_YAH=157 2226 2894 " H LEU A 176 "<>" OE1 GLU A 134 " d_HA=2.023 d_AD=2.958 a_DHA=150.683 symop: x,y,z a_YAH=150 2227 2873 " H LYS A 175 "<>" OE2 GLU A 134 " d_HA=1.868 d_AD=2.870 a_DHA=164.957 symop: x,y,z a_YAH=99 2853 2927 " H CYS A 178 "<>" O PRO A 174 " d_HA=1.897 d_AD=2.910 a_DHA=172.682 symop: x,y,z a_YAH=159 2867 2943 " H PHE A 179 "<>" O LYS A 175 " d_HA=1.892 d_AD=2.831 a_DHA=152.031 symop: x,y,z a_YAH=142 3234 3260 " H LYS A 197 "<>" OG SER A 195 " d_HA=2.262 d_AD=3.200 a_DHA=153.392 symop: x,y,z a_YAH=105 a_YAH=125 3148 3216 " H LYS A 194 "<>" O LYS A 191 " d_HA=2.757 d_AD=3.410 a_DHA=122.332 symop: x,y,z a_YAH=93 3136 3216 " H LYS A 194 "<>" O ASP A 190 " d_HA=2.236 d_AD=3.152 a_DHA=149.077 symop: x,y,z a_YAH=148 3139 3227 " HZ2 LYS A 194 "<>" OD1 ASP A 190 " d_HA=1.703 d_AD=2.645 a_DHA=150.617 symop: x,y,z a_YAH=112 2908 2983 " H LYS A 181 "<>" O VAL A 177 " d_HA=2.091 d_AD=3.093 a_DHA=168.955 symop: x,y,z a_YAH=153 3117 3196 " H LEU A 193 "<>" O ILE A 189 " d_HA=1.878 d_AD=2.891 a_DHA=173.116 symop: x,y,z a_YAH=166 3170 3239 " HG SER A 195 "<>" O TYR A 192 " d_HA=1.691 d_AD=2.669 a_DHA=173.909 symop: x,y,z a_YAH=129 3170 3235 " H SER A 195 "<>" O TYR A 192 " d_HA=2.065 d_AD=2.981 a_DHA=149.644 symop: x,y,z a_YAH=105 194 2641 " HZ2 LYS A 11 "<>" OD2 ASP A 160 " d_HA=1.673 d_AD=2.672 a_DHA=163.050 symop: x,y,z a_YAH=142 195 3284 " HZ3 LYS A 11 "<>" OH TYR A 198 " d_HA=2.099 d_AD=3.005 a_DHA=148.274 symop: x,y,z a_YAH=138 a_YAH=106 2640 2717 " HH TYR A 164 "<>" OD1 ASP A 160 " d_HA=2.583 d_AD=3.540 a_DHA=170.811 symop: x,y,z a_YAH=114 2098 2169 " H LYS A 131 "<>" O PRO A 127 " d_HA=2.138 d_AD=3.124 a_DHA=163.031 symop: x,y,z a_YAH=142 2144 2228 " H GLU A 134 "<>" O LEU A 130 " d_HA=2.001 d_AD=3.000 a_DHA=167.762 symop: x,y,z a_YAH=154 2144 2210 " H PHE A 133 "<>" O LEU A 130 " d_HA=2.289 d_AD=3.029 a_DHA=128.927 symop: x,y,z a_YAH=109 2190 2127 " H MET A 132 "<>" O MET A 129 " d_HA=2.310 d_AD=3.124 a_DHA=136.521 symop: x,y,z a_YAH=111 2792 2841 " H PHE A 173 "<>" O LEU A 170 " d_HA=1.938 d_AD=2.865 a_DHA=150.660 symop: x,y,z a_YAH=109 2833 2912 " H VAL A 177 "<>" O PHE A 173 " d_HA=2.293 d_AD=3.272 a_DHA=161.421 symop: x,y,z a_YAH=148 3232 3285 " H TYR A 198 "<>" O SER A 195 " d_HA=2.504 d_AD=3.470 a_DHA=159.659 symop: x,y,z a_YAH=117 2764 2816 " H ASP A 171 "<>" O MET A 168 " d_HA=1.981 d_AD=2.969 a_DHA=163.644 symop: x,y,z a_YAH=123 1846 1882 " H ASP A 114 "<>" OG SER A 112 " d_HA=2.657 d_AD=3.522 a_DHA=143.257 symop: x,y,z a_YAH=112 a_YAH=97 1877 1928 " H THR A 117 "<>" O ASP A 114 " d_HA=2.126 d_AD=2.969 a_DHA=139.586 symop: x,y,z a_YAH=106 1877 1943 " H LEU A 118 "<>" O ASP A 114 " d_HA=1.814 d_AD=2.825 a_DHA=173.633 symop: x,y,z a_YAH=164 1924 1983 " H VAL A 120 "<>" O THR A 117 " d_HA=2.589 d_AD=3.357 a_DHA=132.702 symop: x,y,z a_YAH=108 1924 2000 " H ASP A 121 "<>" O THR A 117 " d_HA=2.696 d_AD=3.670 a_DHA=161.561 symop: x,y,z a_YAH=138 1938 2015 " H PHE A 122 "<>" O LEU A 118 " d_HA=1.935 d_AD=2.936 a_DHA=167.745 symop: x,y,z a_YAH=156 1979 2049 " H SER A 124 "<>" O VAL A 120 " d_HA=2.200 d_AD=3.164 a_DHA=157.992 symop: x,y,z a_YAH=157 1889 1963 " H LYS A 119 "<>" O PHE A 115 " d_HA=1.856 d_AD=2.802 a_DHA=153.121 symop: x,y,z a_YAH=156 1914 1975 " HZ3 LYS A 119 "<>" OE2 GLU A 116 " d_HA=1.786 d_AD=2.776 a_DHA=161.134 symop: x,y,z a_YAH=98 1794 1847 " H SER A 112 "<>" O ILE A 109 " d_HA=1.954 d_AD=2.897 a_DHA=153.714 symop: x,y,z a_YAH=116 1813 3463 " H THR A 209 "<>" O ALA A 110 " d_HA=1.927 d_AD=2.906 a_DHA=161.997 symop: x,y,z a_YAH=140 1813 3466 " HG1 THR A 209 "<>" O ALA A 110 " d_HA=2.366 d_AD=3.213 a_DHA=146.317 symop: x,y,z a_YAH=156 ------------------------------------------------------------------------------- Total: 263 Symmetry: 0 Per residue: 1.2584 Mean SD Skew Kurtosis theta_1: 143.306 22.168 -0.579 2.055 theta_2: 129.342 24.109 -0.066 1.629 d_HA: 2.349 0.323 0.436 2.004 996 938 " H ALA A 86 "<>" O GLN A 82 " d_HA=2.081 d_AD=3.040 a_DHA=156.303 symop: x,y,z a_YAH=146 1009 955 " H LEU A 87 "<>" O ALA A 83 " d_HA=1.984 d_AD=2.953 a_DHA=157.984 symop: x,y,z a_YAH=146 968 1917 " HE1 TRP A 145 "<>" OD1 ASP A 84 " d_HA=1.817 d_AD=2.767 a_DHA=152.414 symop: x,y,z a_YAH=127 969 1896 " HZ2 LYS A 144 "<>" OD2 ASP A 84 " d_HA=1.791 d_AD=2.696 a_DHA=144.784 symop: x,y,z a_YAH=115 977 1044 " H THR A 89 "<>" O MET A 85 " d_HA=2.003 d_AD=2.911 a_DHA=147.780 symop: x,y,z a_YAH=143 977 1047 " HG1 THR A 89 "<>" O MET A 85 " d_HA=1.731 d_AD=2.696 a_DHA=171.240 symop: x,y,z a_YAH=146 982 924 " H MET A 85 "<>" O ASN A 81 " d_HA=1.877 d_AD=2.891 a_DHA=174.440 symop: x,y,z a_YAH=158 965 1029 " H GLN A 88 "<>" O ASP A 84 " d_HA=1.845 d_AD=2.849 a_DHA=167.918 symop: x,y,z a_YAH=155 3278 3399 "HH22 ARG B 40 "<>" OD2 ASP B 49 " d_HA=1.811 d_AD=2.760 a_DHA=151.630 symop: x,y,z a_YAH=151 1023 1075 " H ALA A 91 "<>" O GLN A 88 " d_HA=1.906 d_AD=2.887 a_DHA=161.115 symop: x,y,z a_YAH=124 3193 3251 " H ASP B 39 "<>" O LEU B 36 " d_HA=2.610 d_AD=3.357 a_DHA=130.513 symop: x,y,z a_YAH=96 3193 3266 " H ARG B 40 "<>" O LEU B 36 " d_HA=2.482 d_AD=3.290 a_DHA=136.039 symop: x,y,z a_YAH=137 1685 1748 " H GLU A 136 "<>" O VAL A 132 " d_HA=1.810 d_AD=2.820 a_DHA=171.151 symop: x,y,z a_YAH=164 3236 4556 "HH22 ARG B 122 "<>" OE2 GLU B 38 " d_HA=1.662 d_AD=2.685 a_DHA=172.173 symop: x,y,z a_YAH=120 3236 4554 "HH12 ARG B 122 "<>" OE2 GLU B 38 " d_HA=2.636 d_AD=3.417 a_DHA=133.878 symop: x,y,z a_YAH=150 3164 3217 " H LEU B 37 "<>" O GLU B 34 " d_HA=2.257 d_AD=3.085 a_DHA=138.002 symop: x,y,z a_YAH=107 3164 3237 " H GLU B 38 "<>" O GLU B 34 " d_HA=2.778 d_AD=3.579 a_DHA=136.448 symop: x,y,z a_YAH=159 3154 3198 " H LEU B 36 "<>" O ALA B 33 " d_HA=2.252 d_AD=3.163 a_DHA=149.189 symop: x,y,z a_YAH=114 3154 3217 " H LEU B 37 "<>" O ALA B 33 " d_HA=2.310 d_AD=3.082 a_DHA=132.059 symop: x,y,z a_YAH=149 3130 3184 " H ASN B 35 "<>" O ALA B 31 " d_HA=2.058 d_AD=3.056 a_DHA=167.097 symop: x,y,z a_YAH=148 3130 3189 "HD22 ASN B 35 "<>" O ALA B 31 " d_HA=2.150 d_AD=2.886 a_DHA=128.380 symop: x,y,z a_YAH=122 3092 3156 " H ALA B 33 "<>" O ILE B 29 " d_HA=2.079 d_AD=3.011 a_DHA=151.437 symop: x,y,z a_YAH=143 3082 3144 " H THR B 32 "<>" O ALA B 28 " d_HA=2.128 d_AD=3.046 a_DHA=149.465 symop: x,y,z a_YAH=136 3082 3147 " HG1 THR B 32 "<>" O ALA B 28 " d_HA=1.671 d_AD=2.638 a_DHA=169.699 symop: x,y,z a_YAH=152 3084 3012 " H ALA B 28 "<>" O ASP B 24 " d_HA=2.140 d_AD=3.111 a_DHA=158.803 symop: x,y,z a_YAH=151 1616 1664 " H THR A 130 "<>" O ALA A 127 " d_HA=1.966 d_AD=2.938 a_DHA=160.314 symop: x,y,z a_YAH=119 1616 1677 " H SER A 131 "<>" O ALA A 127 " d_HA=1.890 d_AD=2.781 a_DHA=145.087 symop: x,y,z a_YAH=179 4536 4596 " H ALA B 126 "<>" O ARG B 122 " d_HA=1.979 d_AD=2.991 a_DHA=173.374 symop: x,y,z a_YAH=152 4496 4562 " H ALA B 123 "<>" O ALA B 119 " d_HA=1.941 d_AD=2.934 a_DHA=165.228 symop: x,y,z a_YAH=157 1676 1720 " H VAL A 134 "<>" OG SER A 131 " d_HA=2.203 d_AD=3.201 a_DHA=167.420 symop: x,y,z a_YAH=116 a_YAH=124 1674 1734 " H ALA A 135 "<>" O SER A 131 " d_HA=2.170 d_AD=3.088 a_DHA=149.472 symop: x,y,z a_YAH=136 1689 1706 " H VAL A 132 "<>" OE2 GLU A 133 " d_HA=2.273 d_AD=2.985 a_DHA=125.906 symop: x,y,z a_YAH=160 4556 3236 "HH22 ARG B 122 "<>" OE2 GLU B 38 " d_HA=1.662 d_AD=2.685 a_DHA=172.173 symop: x,y,z a_YAH=120 3235 4498 " H ALA B 119 "<>" OE1 GLU B 38 " d_HA=2.557 d_AD=3.374 a_DHA=137.012 symop: x,y,z a_YAH=135 4446 4480 " H LYS B 118 "<>" O SER B 116 " d_HA=1.991 d_AD=2.913 a_DHA=148.903 symop: x,y,z a_YAH=101 3169 4468 " HD1 HIS B 117 "<>" OE2 GLU B 34 " d_HA=1.782 d_AD=2.764 a_DHA=157.698 symop: x,y,z a_YAH=113 3111 3170 " H GLU B 34 "<>" O LEU B 30 " d_HA=2.043 d_AD=3.045 a_DHA=168.492 symop: x,y,z a_YAH=164 3728 3796 " H THR B 74 "<>" O ALA B 70 " d_HA=2.178 d_AD=3.177 a_DHA=167.396 symop: x,y,z a_YAH=136 3738 3811 " H LEU B 75 "<>" O VAL B 71 " d_HA=1.925 d_AD=2.898 a_DHA=159.436 symop: x,y,z a_YAH=151 3048 3116 " H LEU B 30 "<>" O GLU B 26 " d_HA=1.989 d_AD=2.991 a_DHA=168.248 symop: x,y,z a_YAH=159 3063 3132 " H ALA B 31 "<>" O LEU B 27 " d_HA=1.820 d_AD=2.832 a_DHA=172.263 symop: x,y,z a_YAH=162 3068 3000 " H LEU B 27 "<>" O ASP B 23 " d_HA=2.662 d_AD=3.619 a_DHA=157.378 symop: x,y,z a_YAH=137 4662 4722 " H ALA B 135 "<>" O SER B 131 " d_HA=2.202 d_AD=3.133 a_DHA=151.611 symop: x,y,z a_YAH=132 4604 4652 " H THR B 130 "<>" O ALA B 127 " d_HA=2.051 d_AD=3.020 a_DHA=159.503 symop: x,y,z a_YAH=110 4571 4506 " H GLY B 124 "<>" O VAL B 120 " d_HA=1.840 d_AD=2.849 a_DHA=171.848 symop: x,y,z a_YAH=156 4606 4570 " H ALA B 127 "<>" O GLY B 124 " d_HA=2.265 d_AD=3.178 a_DHA=149.469 symop: x,y,z a_YAH=100 3266 3193 " H ARG B 40 "<>" O LEU B 36 " d_HA=2.482 d_AD=3.290 a_DHA=136.039 symop: x,y,z a_YAH=137 4439 4491 " HZ2 LYS B 118 "<>" O GLY B 115 " d_HA=1.903 d_AD=2.906 a_DHA=167.525 symop: x,y,z a_YAH=136 4490 5661 " HZ1 LYS B 118 "<>" OE2 GLU B 196 " d_HA=1.679 d_AD=2.702 a_DHA=176.666 symop: x,y,z a_YAH=107 4457 4529 " HG1 THR B 121 "<>" O HIS B 117 " d_HA=1.787 d_AD=2.761 a_DHA=177.918 symop: x,y,z a_YAH=133 4457 4526 " H THR B 121 "<>" O HIS B 117 " d_HA=1.886 d_AD=2.869 a_DHA=162.057 symop: x,y,z a_YAH=153 4405 4449 " H SER B 116 "<>" O THR B 113 " d_HA=2.140 d_AD=2.984 a_DHA=139.510 symop: x,y,z a_YAH=109 4405 4464 " H HIS B 117 "<>" O THR B 113 " d_HA=2.277 d_AD=3.268 a_DHA=165.841 symop: x,y,z a_YAH=156 3939 4463 "HE22 GLN B 82 "<>" NE2 HIS B 117 " d_HA=2.510 d_AD=3.328 a_DHA=137.770 symop: x,y,z a_YAH=121 a_YAH=129 3830 3754 " H LEU B 76 "<>" O LEU B 72 " d_HA=1.831 d_AD=2.831 a_DHA=167.302 symop: x,y,z a_YAH=159 3849 3773 " H ASP B 77 "<>" O LEU B 73 " d_HA=1.969 d_AD=2.974 a_DHA=168.590 symop: x,y,z a_YAH=156 3806 3884 " H VAL B 79 "<>" O LEU B 75 " d_HA=2.061 d_AD=3.052 a_DHA=164.840 symop: x,y,z a_YAH=153 3792 3864 " H ARG B 78 "<>" O THR B 74 " d_HA=1.973 d_AD=2.972 a_DHA=166.497 symop: x,y,z a_YAH=155 3053 3875 "HH21 ARG B 78 "<>" OE2 GLU B 26 " d_HA=1.818 d_AD=2.683 a_DHA=139.000 symop: x,y,z a_YAH=171 4665 4614 " H SER B 131 "<>" O ARG B 128 " d_HA=2.872 d_AD=3.820 a_DHA=156.646 symop: x,y,z a_YAH=93 4664 4708 " H VAL B 134 "<>" OG SER B 131 " d_HA=1.907 d_AD=2.910 a_DHA=168.071 symop: x,y,z a_YAH=129 a_YAH=108 4669 4693 " HG SER B 131 "<>" OE1 GLU B 133 " d_HA=1.622 d_AD=2.591 a_DHA=165.045 symop: x,y,z a_YAH=144 3773 3849 " H ASP B 77 "<>" O LEU B 73 " d_HA=1.969 d_AD=2.974 a_DHA=168.590 symop: x,y,z a_YAH=156 3713 3778 " H LEU B 73 "<>" O GLU B 69 " d_HA=2.045 d_AD=3.035 a_DHA=164.606 symop: x,y,z a_YAH=154 3754 3830 " H LEU B 76 "<>" O LEU B 72 " d_HA=1.831 d_AD=2.831 a_DHA=167.302 symop: x,y,z a_YAH=159 5689 5642 " H ARG B 198 "<>" O PRO B 195 " d_HA=1.912 d_AD=2.833 a_DHA=149.414 symop: x,y,z a_YAH=130 5656 5709 " H VAL B 199 "<>" O GLU B 196 " d_HA=2.966 d_AD=3.655 a_DHA=125.999 symop: x,y,z a_YAH=93 4370 4440 " H GLY B 115 "<>" O PHE B 111 " d_HA=1.919 d_AD=2.777 a_DHA=139.930 symop: x,y,z a_YAH=144 4350 4427 " H PHE B 114 "<>" O PHE B 110 " d_HA=2.228 d_AD=3.119 a_DHA=145.817 symop: x,y,z a_YAH=134 4390 4449 " H SER B 116 "<>" O GLU B 112 " d_HA=2.574 d_AD=3.303 a_DHA=128.552 symop: x,y,z a_YAH=122 4390 4453 " HG SER B 116 "<>" O GLU B 112 " d_HA=1.767 d_AD=2.740 a_DHA=173.971 symop: x,y,z a_YAH=172 3880 3945 " H ALA B 83 "<>" O VAL B 79 " d_HA=2.256 d_AD=3.229 a_DHA=160.101 symop: x,y,z a_YAH=145 3825 3900 " H VAL B 80 "<>" O LEU B 76 " d_HA=1.910 d_AD=2.887 a_DHA=159.889 symop: x,y,z a_YAH=156 3844 3917 " H ASN B 81 "<>" O ASP B 77 " d_HA=1.836 d_AD=2.844 a_DHA=171.807 symop: x,y,z a_YAH=160 3844 3922 "HD22 ASN B 81 "<>" O ASP B 77 " d_HA=2.217 d_AD=3.009 a_DHA=133.615 symop: x,y,z a_YAH=108 3856 3932 " H GLN B 82 "<>" O ARG B 78 " d_HA=1.982 d_AD=2.888 a_DHA=147.348 symop: x,y,z a_YAH=145 3687 3717 " HG SER B 67 "<>" OE1 GLU B 69 " d_HA=1.650 d_AD=2.616 a_DHA=164.759 symop: x,y,z a_YAH=140 3680 3730 " H ALA B 70 "<>" O SER B 67 " d_HA=2.457 d_AD=3.104 a_DHA=121.392 symop: x,y,z a_YAH=109 3680 3742 " H VAL B 71 "<>" O SER B 67 " d_HA=2.576 d_AD=3.391 a_DHA=137.511 symop: x,y,z a_YAH=139 3691 3759 " H LEU B 72 "<>" O LYS B 68 " d_HA=2.222 d_AD=3.180 a_DHA=157.022 symop: x,y,z a_YAH=153 3691 3742 " H VAL B 71 "<>" O LYS B 68 " d_HA=2.371 d_AD=3.096 a_DHA=127.818 symop: x,y,z a_YAH=94 3296 3342 " H ILE B 45 "<>" O LEU B 42 " d_HA=2.560 d_AD=3.489 a_DHA=153.148 symop: x,y,z a_YAH=96 3337 3709 " HZ3 LYS B 68 "<>" O ILE B 45 " d_HA=1.911 d_AD=2.797 a_DHA=142.582 symop: x,y,z a_YAH=159 3359 3398 " H SER B 46 "<>" OD1 ASP B 49 " d_HA=1.993 d_AD=2.875 a_DHA=143.362 symop: x,y,z a_YAH=96 5699 5744 "HH12 ARG B 198 "<>" OD2 ASP B 201 " d_HA=1.774 d_AD=2.724 a_DHA=152.161 symop: x,y,z a_YAH=132 3276 3325 "HH12 ARG B 40 "<>" O ASP B 44 " d_HA=1.969 d_AD=2.780 a_DHA=134.816 symop: x,y,z a_YAH=141 4275 5743 "HH21 ARG B 104 "<>" OD1 ASP B 201 " d_HA=1.757 d_AD=2.734 a_DHA=157.565 symop: x,y,z a_YAH=131 5721 5771 " H LEU B 203 "<>" O LEU B 200 " d_HA=2.312 d_AD=2.960 a_DHA=120.416 symop: x,y,z a_YAH=105 5721 5789 " H VAL B 204 "<>" O LEU B 200 " d_HA=1.824 d_AD=2.823 a_DHA=167.989 symop: x,y,z a_YAH=158 4301 4378 " H PHE B 111 "<>" O ILE B 107 " d_HA=2.200 d_AD=3.133 a_DHA=152.363 symop: x,y,z a_YAH=143 4301 4358 " H PHE B 110 "<>" O ILE B 107 " d_HA=2.244 d_AD=2.960 a_DHA=126.557 symop: x,y,z a_YAH=108 4320 4396 " H GLU B 112 "<>" O ASN B 108 " d_HA=1.830 d_AD=2.803 a_DHA=159.037 symop: x,y,z a_YAH=157 4329 4394 "HD21 ASN B 108 "<>" OE1 GLU B 112 " d_HA=1.786 d_AD=2.775 a_DHA=159.197 symop: x,y,z a_YAH=115 4334 4409 " H THR B 113 "<>" O VAL B 109 " d_HA=1.994 d_AD=2.923 a_DHA=150.879 symop: x,y,z a_YAH=140 4334 4412 " HG1 THR B 113 "<>" O VAL B 109 " d_HA=1.794 d_AD=2.701 a_DHA=154.016 symop: x,y,z a_YAH=144 3896 3958 " H ASP B 84 "<>" O VAL B 80 " d_HA=2.071 d_AD=3.047 a_DHA=160.538 symop: x,y,z a_YAH=149 3943 3997 " H LEU B 87 "<>" O ALA B 83 " d_HA=1.946 d_AD=2.942 a_DHA=165.853 symop: x,y,z a_YAH=146 3926 3984 " H ALA B 86 "<>" O GLN B 82 " d_HA=1.950 d_AD=2.896 a_DHA=153.990 symop: x,y,z a_YAH=144 3912 3970 " H MET B 85 "<>" O ASN B 81 " d_HA=1.840 d_AD=2.849 a_DHA=170.502 symop: x,y,z a_YAH=152 3358 3388 " H ASP B 48 "<>" OG SER B 46 " d_HA=2.293 d_AD=3.199 a_DHA=148.490 symop: x,y,z a_YAH=118 a_YAH=108 3363 3398 " HG SER B 46 "<>" OD1 ASP B 49 " d_HA=1.559 d_AD=2.544 a_DHA=168.926 symop: x,y,z a_YAH=179 4190 4274 "HH12 ARG B 104 "<>" OE1 GLU B 100 " d_HA=1.906 d_AD=2.590 a_DHA=121.365 symop: x,y,z a_YAH=112 4256 4325 " H ASN B 108 "<>" O ARG B 104 " d_HA=1.855 d_AD=2.778 a_DHA=149.602 symop: x,y,z a_YAH=149 4201 4284 " H THR B 105 "<>" O ASN B 101 " d_HA=1.905 d_AD=2.903 a_DHA=167.619 symop: x,y,z a_YAH=147 4201 4287 " HG1 THR B 105 "<>" O ASN B 101 " d_HA=1.765 d_AD=2.728 a_DHA=169.876 symop: x,y,z a_YAH=142 4232 4306 " H ILE B 107 "<>" O TRP B 103 " d_HA=2.040 d_AD=3.054 a_DHA=172.805 symop: x,y,z a_YAH=164 4294 4338 " H VAL B 109 "<>" O GLY B 106 " d_HA=2.369 d_AD=3.151 a_DHA=133.076 symop: x,y,z a_YAH=102 4280 4338 " H VAL B 109 "<>" O THR B 105 " d_HA=2.316 d_AD=3.130 a_DHA=136.260 symop: x,y,z a_YAH=143 3982 4047 " H LEU B 90 "<>" O ALA B 86 " d_HA=2.840 d_AD=3.648 a_DHA=137.091 symop: x,y,z a_YAH=138 3956 4905 " HE1 TRP B 145 "<>" OD1 ASP B 84 " d_HA=1.809 d_AD=2.777 a_DHA=155.428 symop: x,y,z a_YAH=125 3953 4017 " H GLN B 88 "<>" O ASP B 84 " d_HA=1.854 d_AD=2.832 a_DHA=160.539 symop: x,y,z a_YAH=153 3965 4032 " H THR B 89 "<>" O MET B 85 " d_HA=2.219 d_AD=3.177 a_DHA=157.304 symop: x,y,z a_YAH=142 3992 4047 " H LEU B 90 "<>" O LEU B 87 " d_HA=2.231 d_AD=3.026 a_DHA=134.176 symop: x,y,z a_YAH=104 3992 4063 " H ALA B 91 "<>" O LEU B 87 " d_HA=2.488 d_AD=3.250 a_DHA=131.689 symop: x,y,z a_YAH=140 3957 4884 " HZ2 LYS B 144 "<>" OD2 ASP B 84 " d_HA=1.682 d_AD=2.679 a_DHA=162.860 symop: x,y,z a_YAH=143 4730 4806 " HG1 THR B 140 "<>" O GLU B 136 " d_HA=1.696 d_AD=2.667 a_DHA=172.629 symop: x,y,z a_YAH=136 4730 4803 " H THR B 140 "<>" O GLU B 136 " d_HA=1.870 d_AD=2.850 a_DHA=161.081 symop: x,y,z a_YAH=153 3530 5036 "HH12 ARG B 58 "<>" OD2 ASP B 154 " d_HA=1.975 d_AD=2.885 a_DHA=147.102 symop: -x+y+2,-x+1,z a_YAH=116 3532 5036 "HH22 ARG B 58 "<>" OD2 ASP B 154 " d_HA=1.998 d_AD=2.888 a_DHA=144.386 symop: -x+y+2,-x+1,z a_YAH=110 5096 5188 "HH12 ARG B 164 "<>" OD1 ASP B 158 " d_HA=1.798 d_AD=2.747 a_DHA=151.804 symop: x,y,z a_YAH=155 5096 5190 "HH22 ARG B 164 "<>" OD1 ASP B 158 " d_HA=1.738 d_AD=2.702 a_DHA=155.919 symop: x,y,z a_YAH=136 2986 4191 "HD21 ASN A 215 "<>" OE2 GLU B 100 " d_HA=1.826 d_AD=2.824 a_DHA=164.614 symop: x,y,z a_YAH=127 4153 4192 " H GLU B 100 "<>" OD1 ASP B 98 " d_HA=1.847 d_AD=2.794 a_DHA=151.987 symop: x,y,z a_YAH=148 4153 4206 " H ASN B 101 "<>" OD1 ASP B 98 " d_HA=2.664 d_AD=3.617 a_DHA=155.699 symop: x,y,z a_YAH=107 4162 4243 " H TRP B 103 "<>" O ARG B 99 " d_HA=2.437 d_AD=3.401 a_DHA=158.110 symop: x,y,z a_YAH=144 4186 4264 " H ARG B 104 "<>" O GLU B 100 " d_HA=1.823 d_AD=2.845 a_DHA=177.434 symop: x,y,z a_YAH=158 4150 4220 " H MET B 102 "<>" O ASP B 98 " d_HA=2.118 d_AD=3.071 a_DHA=154.518 symop: x,y,z a_YAH=149 4215 4295 " H GLY B 106 "<>" O MET B 102 " d_HA=2.819 d_AD=3.782 a_DHA=158.640 symop: x,y,z a_YAH=126 4114 4140 " H THR B 97 "<>" O ALA B 95 " d_HA=2.302 d_AD=2.980 a_DHA=122.673 symop: x,y,z a_YAH=111 4942 5001 " H VAL B 152 "<>" O TYR B 148 " d_HA=2.083 d_AD=3.031 a_DHA=154.090 symop: x,y,z a_YAH=153 4028 4091 " H ASN B 93 "<>" O THR B 89 " d_HA=2.596 d_AD=3.324 a_DHA=128.799 symop: x,y,z a_YAH=170 4028 4077 " H GLU B 92 "<>" O THR B 89 " d_HA=2.474 d_AD=3.312 a_DHA=139.640 symop: x,y,z a_YAH=92 4011 4063 " H ALA B 91 "<>" O GLN B 88 " d_HA=2.118 d_AD=2.916 a_DHA=134.187 symop: x,y,z a_YAH=103 4011 4077 " H GLU B 92 "<>" O GLN B 88 " d_HA=2.530 d_AD=3.249 a_DHA=127.573 symop: x,y,z a_YAH=144 3042 4076 "HH12 ARG B 25 "<>" OE2 GLU B 92 " d_HA=1.657 d_AD=2.672 a_DHA=168.256 symop: -x+y+2,-x+1,z a_YAH=124 2991 3032 " H ARG B 25 "<>" O GLY B 22 " d_HA=2.843 d_AD=3.779 a_DHA=154.053 symop: x,y,z a_YAH=111 4673 4736 " H GLU B 136 "<>" O VAL B 132 " d_HA=1.758 d_AD=2.764 a_DHA=168.890 symop: x,y,z a_YAH=167 4722 4662 " H ALA B 135 "<>" O SER B 131 " d_HA=2.202 d_AD=3.133 a_DHA=151.611 symop: x,y,z a_YAH=132 4689 4750 " H LEU B 137 "<>" O GLU B 133 " d_HA=1.906 d_AD=2.898 a_DHA=163.685 symop: x,y,z a_YAH=149 4720 4791 " H SER B 139 "<>" O ALA B 135 " d_HA=1.953 d_AD=2.934 a_DHA=161.283 symop: x,y,z a_YAH=141 4704 4775 " H TRP B 138 "<>" O VAL B 134 " d_HA=1.982 d_AD=2.975 a_DHA=164.907 symop: x,y,z a_YAH=144 4745 4821 " H PHE B 141 "<>" O LEU B 137 " d_HA=2.271 d_AD=3.286 a_DHA=174.551 symop: x,y,z a_YAH=154 2596 4795 " HG SER B 139 "<>" O GLN A 191 " d_HA=1.725 d_AD=2.696 a_DHA=173.520 symop: x,y,z a_YAH=135 4764 4838 " H MET B 142 "<>" O TRP B 138 " d_HA=1.957 d_AD=2.955 a_DHA=166.362 symop: x,y,z a_YAH=164 4788 4856 " H GLN B 143 "<>" O SER B 139 " d_HA=2.314 d_AD=3.189 a_DHA=143.582 symop: x,y,z a_YAH=143 4799 4856 " H GLN B 143 "<>" O THR B 140 " d_HA=2.406 d_AD=3.137 a_DHA=128.164 symop: x,y,z a_YAH=101 4799 4873 " H LYS B 144 "<>" O THR B 140 " d_HA=2.316 d_AD=3.258 a_DHA=153.374 symop: x,y,z a_YAH=145 2533 2575 " H GLY A 189 "<>" O SER A 186 " d_HA=2.185 d_AD=3.127 a_DHA=154.131 symop: x,y,z a_YAH=106 2581 2634 " HG SER A 193 "<>" O GLU A 190 " d_HA=1.687 d_AD=2.655 a_DHA=169.030 symop: x,y,z a_YAH=144 4833 4918 " H ILE B 146 "<>" O MET B 142 " d_HA=2.061 d_AD=3.014 a_DHA=155.729 symop: x,y,z a_YAH=133 4850 4934 " H ALA B 147 "<>" O GLN B 143 " d_HA=1.851 d_AD=2.816 a_DHA=157.537 symop: x,y,z a_YAH=152 4813 4900 " H TRP B 145 "<>" O PHE B 141 " d_HA=1.909 d_AD=2.924 a_DHA=174.928 symop: x,y,z a_YAH=170 4913 4979 " H ALA B 150 "<>" O ILE B 146 " d_HA=1.898 d_AD=2.904 a_DHA=169.470 symop: x,y,z a_YAH=146 4867 4951 " H TYR B 148 "<>" O LYS B 144 " d_HA=1.850 d_AD=2.865 a_DHA=173.845 symop: x,y,z a_YAH=155 4889 4967 " H THR B 149 "<>" O TRP B 145 " d_HA=1.934 d_AD=2.950 a_DHA=172.359 symop: x,y,z a_YAH=155 5251 5319 " HG1 THR B 173 "<>" O HIS B 169 " d_HA=1.709 d_AD=2.674 a_DHA=169.489 symop: x,y,z a_YAH=154 5251 5316 " H THR B 173 "<>" O HIS B 169 " d_HA=2.105 d_AD=2.946 a_DHA=139.070 symop: x,y,z a_YAH=133 5241 5304 " H ALA B 172 "<>" O ALA B 168 " d_HA=1.858 d_AD=2.843 a_DHA=163.331 symop: x,y,z a_YAH=149 4932 4989 " H ALA B 151 "<>" O ALA B 147 " d_HA=1.845 d_AD=2.801 a_DHA=155.560 symop: x,y,z a_YAH=154 4963 5018 " H ILE B 153 "<>" O THR B 149 " d_HA=2.016 d_AD=2.988 a_DHA=158.975 symop: x,y,z a_YAH=153 4977 5037 " H ASP B 154 "<>" O ALA B 150 " d_HA=2.099 d_AD=3.110 a_DHA=172.922 symop: x,y,z a_YAH=157 2709 5273 " HE ARG A 198 "<>" OE2 GLU B 170 " d_HA=1.968 d_AD=2.921 a_DHA=154.389 symop: x,y,z a_YAH=92 5227 5274 " H GLU B 170 "<>" O PRO B 167 " d_HA=2.292 d_AD=3.030 a_DHA=128.826 symop: x,y,z a_YAH=115 5227 5288 " H LEU B 171 "<>" O PRO B 167 " d_HA=2.139 d_AD=3.153 a_DHA=174.956 symop: x,y,z a_YAH=166 5087 5208 "HH12 ARG B 157 "<>" O LEU B 166 " d_HA=1.799 d_AD=2.741 a_DHA=153.180 symop: x,y,z a_YAH=163 5013 5077 " H ARG B 157 "<>" O ILE B 153 " d_HA=2.231 d_AD=2.955 a_DHA=126.786 symop: x,y,z a_YAH=133 5069 5130 " H GLY B 160 "<>" O ARG B 157 " d_HA=1.969 d_AD=2.869 a_DHA=146.564 symop: x,y,z a_YAH=105 4248 5929 " HE1 TRP B 103 "<>" OH TYR B 212 " d_HA=1.890 d_AD=2.901 a_DHA=170.845 symop: x,y,z a_YAH=95 a_YAH=134 5059 5938 " HH TYR B 212 "<>" OE2 GLU B 156 " d_HA=1.850 d_AD=2.741 a_DHA=150.596 symop: x,y,z a_YAH=102 5059 5124 "HH21 ARG B 159 "<>" OE2 GLU B 156 " d_HA=1.990 d_AD=2.990 a_DHA=163.086 symop: x,y,z a_YAH=100 4997 5060 " H GLU B 156 "<>" O VAL B 152 " d_HA=1.877 d_AD=2.886 a_DHA=170.578 symop: x,y,z a_YAH=158 4987 5046 " H ALA B 155 "<>" O ALA B 151 " d_HA=2.047 d_AD=3.012 a_DHA=158.253 symop: x,y,z a_YAH=139 3501 3554 " H THR B 60 "<>" O SER B 57 " d_HA=2.068 d_AD=2.847 a_DHA=132.138 symop: x,y,z a_YAH=121 3501 3572 " H PHE B 61 "<>" O SER B 57 " d_HA=2.865 d_AD=3.733 a_DHA=143.994 symop: x,y,z a_YAH=159 3512 3572 " H PHE B 61 "<>" O ARG B 58 " d_HA=2.868 d_AD=3.744 a_DHA=145.060 symop: x,y,z a_YAH=106 3536 3593 " H TYR B 62 "<>" O PRO B 59 " d_HA=2.286 d_AD=3.198 a_DHA=149.193 symop: x,y,z a_YAH=123 3503 3554 " H THR B 60 "<>" OG SER B 57 " d_HA=2.889 d_AD=3.760 a_DHA=144.687 symop: x,y,z a_YAH=118 a_YAH=130 3503 3557 " HG1 THR B 60 "<>" OG SER B 57 " d_HA=1.770 d_AD=2.709 a_DHA=162.030 symop: x,y,z a_YAH=143 a_YAH=97 3550 3613 " H PHE B 63 "<>" O THR B 60 " d_HA=2.209 d_AD=3.197 a_DHA=164.360 symop: x,y,z a_YAH=126 3564 3634 " H TYR B 64 "<>" O PHE B 61 " d_HA=1.967 d_AD=2.943 a_DHA=160.868 symop: x,y,z a_YAH=132 3564 3654 " H PHE B 65 "<>" O PHE B 61 " d_HA=2.230 d_AD=3.225 a_DHA=166.593 symop: x,y,z a_YAH=152 3024 3097 " H ILE B 29 "<>" O ARG B 25 " d_HA=2.370 d_AD=3.305 a_DHA=152.607 symop: x,y,z a_YAH=140 3000 3054 " H GLU B 26 "<>" O ASP B 23 " d_HA=1.935 d_AD=2.849 a_DHA=147.670 symop: x,y,z a_YAH=143 3000 3068 " H LEU B 27 "<>" O ASP B 23 " d_HA=2.662 d_AD=3.619 a_DHA=157.378 symop: x,y,z a_YAH=137 3012 3084 " H ALA B 28 "<>" O ASP B 24 " d_HA=2.140 d_AD=3.111 a_DHA=158.803 symop: x,y,z a_YAH=151 4614 4665 " H SER B 131 "<>" O ARG B 128 " d_HA=2.872 d_AD=3.820 a_DHA=156.646 symop: x,y,z a_YAH=93 4570 4606 " H ALA B 127 "<>" O GLY B 124 " d_HA=2.265 d_AD=3.178 a_DHA=149.469 symop: x,y,z a_YAH=100 1556 1486 " H ARG A 122 "<>" O LYS A 118 " d_HA=1.817 d_AD=2.813 a_DHA=165.183 symop: x,y,z a_YAH=155 2465 5424 "HH21 ARG A 181 "<>" OE2 GLU B 180 " d_HA=2.853 d_AD=3.813 a_DHA=159.906 symop: x,y,z a_YAH=98 2466 2585 "HH22 ARG A 181 "<>" OE1 GLU A 190 " d_HA=1.757 d_AD=2.724 a_DHA=154.769 symop: x,y,z a_YAH=147 4634 5424 "HH22 ARG B 128 "<>" OE2 GLU B 180 " d_HA=1.843 d_AD=2.809 a_DHA=155.643 symop: x,y,z a_YAH=109 4780 5424 " HE1 TRP B 138 "<>" OE2 GLU B 180 " d_HA=1.807 d_AD=2.739 a_DHA=149.756 symop: x,y,z a_YAH=121 2484 2552 " H PHE A 187 "<>" O LEU A 183 " d_HA=1.949 d_AD=2.966 a_DHA=176.073 symop: x,y,z a_YAH=161 2503 2566 " H ALA A 188 "<>" O PHE A 184 " d_HA=1.939 d_AD=2.904 a_DHA=157.710 symop: x,y,z a_YAH=159 2470 2536 " H SER A 186 "<>" O THR A 182 " d_HA=1.925 d_AD=2.929 a_DHA=169.129 symop: x,y,z a_YAH=156 2523 2587 " H GLU A 190 "<>" O ALA A 185 " d_HA=1.935 d_AD=2.919 a_DHA=162.328 symop: x,y,z a_YAH=158 2540 2638 " HG SER A 186 "<>" O VAL A 194 " d_HA=1.618 d_AD=2.596 a_DHA=179.696 symop: x,y,z a_YAH=143 5312 5374 " H LEU B 177 "<>" O THR B 173 " d_HA=1.933 d_AD=2.911 a_DHA=160.469 symop: x,y,z a_YAH=154 5302 5360 " H ASN B 176 "<>" O ALA B 172 " d_HA=1.971 d_AD=2.954 a_DHA=162.508 symop: x,y,z a_YAH=145 5302 5365 "HD22 ASN B 176 "<>" O ALA B 172 " d_HA=1.878 d_AD=2.850 a_DHA=160.490 symop: x,y,z a_YAH=127 4965 5364 "HD21 ASN B 176 "<>" OG1 THR B 149 " d_HA=2.051 d_AD=3.041 a_DHA=165.770 symop: x,y,z a_YAH=100 a_YAH=123 2654 2701 " H ARG A 198 "<>" O PRO A 195 " d_HA=2.044 d_AD=2.951 a_DHA=148.017 symop: x,y,z a_YAH=129 2654 2721 " H VAL A 199 "<>" O PRO A 195 " d_HA=2.200 d_AD=3.131 a_DHA=152.037 symop: x,y,z a_YAH=157 2668 2721 " H VAL A 199 "<>" O GLU A 196 " d_HA=2.997 d_AD=3.689 a_DHA=126.376 symop: x,y,z a_YAH=93 2693 2768 " H THR A 202 "<>" O ARG A 198 " d_HA=2.083 d_AD=3.089 a_DHA=170.191 symop: x,y,z a_YAH=148 2771 5272 " HG1 THR A 202 "<>" OE1 GLU B 170 " d_HA=2.941 d_AD=3.584 a_DHA=125.162 symop: x,y,z a_YAH=118 5268 5328 " H ALA B 174 "<>" O GLU B 170 " d_HA=2.118 d_AD=3.106 a_DHA=163.261 symop: x,y,z a_YAH=160 5283 5341 " H LEU B 175 "<>" O LEU B 171 " d_HA=2.156 d_AD=3.163 a_DHA=170.951 symop: x,y,z a_YAH=157 2711 2756 "HH12 ARG A 198 "<>" OD2 ASP A 201 " d_HA=1.734 d_AD=2.676 a_DHA=151.016 symop: x,y,z a_YAH=129 2712 5272 "HH21 ARG A 198 "<>" OE1 GLU B 170 " d_HA=1.774 d_AD=2.761 a_DHA=160.536 symop: x,y,z a_YAH=142 5089 5208 "HH22 ARG B 157 "<>" O LEU B 166 " d_HA=1.976 d_AD=2.850 a_DHA=143.397 symop: x,y,z a_YAH=128 5085 5156 " HE ARG B 157 "<>" O PRO B 163 " d_HA=2.248 d_AD=2.995 a_DHA=129.227 symop: x,y,z a_YAH=140 5088 5156 "HH21 ARG B 157 "<>" O PRO B 163 " d_HA=2.435 d_AD=3.141 a_DHA=126.028 symop: x,y,z a_YAH=152 5088 5196 "HH21 ARG B 157 "<>" OG1 THR B 165 " d_HA=2.723 d_AD=3.349 a_DHA=120.124 symop: x,y,z a_YAH=132 a_YAH=109 5054 5138 " H ALA B 161 "<>" O GLU B 156 " d_HA=2.146 d_AD=2.873 a_DHA=127.268 symop: x,y,z a_YAH=158 5077 5013 " H ARG B 157 "<>" O ILE B 153 " d_HA=2.231 d_AD=2.955 a_DHA=126.786 symop: x,y,z a_YAH=133 5044 5113 " H ARG B 159 "<>" O ALA B 155 " d_HA=2.029 d_AD=2.981 a_DHA=154.639 symop: x,y,z a_YAH=151 5058 5121 " HE ARG B 159 "<>" OE1 GLU B 156 " d_HA=1.784 d_AD=2.799 a_DHA=169.096 symop: x,y,z a_YAH=115 5032 5077 " H ARG B 157 "<>" O ASP B 154 " d_HA=2.249 d_AD=2.959 a_DHA=125.586 symop: x,y,z a_YAH=92 5032 5098 " H ASP B 158 "<>" O ASP B 154 " d_HA=1.742 d_AD=2.739 a_DHA=166.624 symop: x,y,z a_YAH=165 3367 3428 " H ALA B 51 "<>" O VAL B 47 " d_HA=2.350 d_AD=3.160 a_DHA=136.241 symop: x,y,z a_YAH=131 3407 3467 " H ALA B 54 "<>" O LEU B 50 " d_HA=2.023 d_AD=2.977 a_DHA=155.861 symop: x,y,z a_YAH=149 3426 3487 " H ILE B 56 "<>" O ALA B 51 " d_HA=2.129 d_AD=3.136 a_DHA=169.968 symop: x,y,z a_YAH=154 4577 4622 " H ARG B 128 "<>" O GLN B 125 " d_HA=2.098 d_AD=3.026 a_DHA=151.130 symop: x,y,z a_YAH=113 4596 4536 " H ALA B 126 "<>" O ARG B 122 " d_HA=1.979 d_AD=2.991 a_DHA=173.374 symop: x,y,z a_YAH=152 4506 4571 " H GLY B 124 "<>" O VAL B 120 " d_HA=1.840 d_AD=2.849 a_DHA=171.848 symop: x,y,z a_YAH=156 4526 4457 " H THR B 121 "<>" O HIS B 117 " d_HA=1.886 d_AD=2.869 a_DHA=162.057 symop: x,y,z a_YAH=153 1548 1608 " H ALA A 126 "<>" O ARG A 122 " d_HA=2.302 d_AD=3.294 a_DHA=165.651 symop: x,y,z a_YAH=146 1589 1634 " H ARG A 128 "<>" O GLN A 125 " d_HA=2.584 d_AD=3.353 a_DHA=132.502 symop: x,y,z a_YAH=104 4581 4630 " HE ARG B 128 "<>" OE1 GLN B 125 " d_HA=2.613 d_AD=3.607 a_DHA=167.919 symop: x,y,z a_YAH=135 4522 4583 " H GLN B 125 "<>" O THR B 121 " d_HA=2.042 d_AD=3.030 a_DHA=163.246 symop: x,y,z a_YAH=149 1534 1595 " H GLN A 125 "<>" O THR A 121 " d_HA=2.168 d_AD=3.129 a_DHA=156.889 symop: x,y,z a_YAH=147 1593 1645 "HH21 ARG A 128 "<>" OE1 GLN A 125 " d_HA=1.836 d_AD=2.737 a_DHA=145.495 symop: x,y,z a_YAH=126 2462 5423 " HE ARG A 181 "<>" OE1 GLU B 180 " d_HA=1.682 d_AD=2.679 a_DHA=164.787 symop: x,y,z a_YAH=133 5419 5499 " H PHE B 184 "<>" O GLU B 180 " d_HA=2.272 d_AD=3.223 a_DHA=155.671 symop: x,y,z a_YAH=141 2417 2489 " H LEU A 183 "<>" O ASN A 179 " d_HA=1.935 d_AD=2.919 a_DHA=162.252 symop: x,y,z a_YAH=147 2431 2511 " H PHE A 184 "<>" O GLU A 180 " d_HA=2.280 d_AD=3.234 a_DHA=156.295 symop: x,y,z a_YAH=140 2446 2525 " H ALA A 185 "<>" O ARG A 181 " d_HA=2.014 d_AD=2.980 a_DHA=159.064 symop: x,y,z a_YAH=136 5369 5442 " H ARG B 181 "<>" O LEU B 177 " d_HA=2.118 d_AD=3.134 a_DHA=175.916 symop: x,y,z a_YAH=151 5355 5425 " H GLU B 180 "<>" O ASN B 176 " d_HA=2.031 d_AD=3.040 a_DHA=170.941 symop: x,y,z a_YAH=147 2400 2474 " H THR A 182 "<>" O MET A 178 " d_HA=1.899 d_AD=2.864 a_DHA=158.029 symop: x,y,z a_YAH=156 2400 2477 " HG1 THR A 182 "<>" O MET A 178 " d_HA=1.792 d_AD=2.723 a_DHA=159.772 symop: x,y,z a_YAH=136 5326 5393 " H MET B 178 "<>" O ALA B 174 " d_HA=1.937 d_AD=2.880 a_DHA=153.537 symop: x,y,z a_YAH=147 5336 5410 " H ASN B 179 "<>" O LEU B 175 " d_HA=2.016 d_AD=3.013 a_DHA=166.530 symop: x,y,z a_YAH=151 5408 5853 " HE1 TRP B 207 "<>" OD1 ASN B 179 " d_HA=1.901 d_AD=2.815 a_DHA=147.348 symop: x,y,z a_YAH=133 2733 2801 " H VAL A 204 "<>" O LEU A 200 " d_HA=2.093 d_AD=3.082 a_DHA=163.650 symop: x,y,z a_YAH=153 2717 2783 " H LEU A 203 "<>" O VAL A 199 " d_HA=1.930 d_AD=2.919 a_DHA=163.189 symop: x,y,z a_YAH=154 2764 2835 " H ILE A 206 "<>" O THR A 202 " d_HA=2.591 d_AD=3.580 a_DHA=165.128 symop: x,y,z a_YAH=141 1287 2755 "HH21 ARG A 104 "<>" OD1 ASP A 201 " d_HA=1.819 d_AD=2.837 a_DHA=170.533 symop: x,y,z a_YAH=130 2752 2820 " H HIS A 205 "<>" O ASP A 201 " d_HA=2.182 d_AD=3.184 a_DHA=168.420 symop: x,y,z a_YAH=151 2826 5891 " HE2 HIS A 205 "<>" O SER B 210 " d_HA=2.153 d_AD=3.120 a_DHA=157.533 symop: x,y,z a_YAH=130 5837 5907 " H ILE B 211 "<>" O TRP B 207 " d_HA=1.900 d_AD=2.865 a_DHA=157.409 symop: x,y,z a_YAH=157 5837 5894 " H SER B 210 "<>" O TRP B 207 " d_HA=2.116 d_AD=2.885 a_DHA=131.274 symop: x,y,z a_YAH=120 1203 1286 "HH12 ARG A 104 "<>" OE2 GLU A 100 " d_HA=1.710 d_AD=2.703 a_DHA=160.603 symop: x,y,z a_YAH=124 5130 5069 " H GLY B 160 "<>" O ARG B 157 " d_HA=1.969 d_AD=2.869 a_DHA=146.564 symop: x,y,z a_YAH=105 3388 3358 " H ASP B 48 "<>" OG SER B 46 " d_HA=2.293 d_AD=3.199 a_DHA=148.490 symop: x,y,z a_YAH=118 a_YAH=108 3356 3412 " H LEU B 50 "<>" O SER B 46 " d_HA=2.698 d_AD=3.674 a_DHA=161.645 symop: x,y,z a_YAH=145 3383 3442 " H LYS B 52 "<>" O ASP B 48 " d_HA=2.085 d_AD=3.094 a_DHA=169.420 symop: x,y,z a_YAH=167 3395 3459 " H GLY B 53 "<>" O ASP B 49 " d_HA=2.474 d_AD=3.479 a_DHA=171.720 symop: x,y,z a_YAH=144 3436 3476 " H GLY B 55 "<>" O LYS B 52 " d_HA=1.979 d_AD=2.944 a_DHA=157.924 symop: x,y,z a_YAH=113 1075 1023 " H ALA A 91 "<>" O GLN A 88 " d_HA=1.906 d_AD=2.887 a_DHA=161.115 symop: x,y,z a_YAH=124 4474 4544 " H ARG B 122 "<>" O LYS B 118 " d_HA=1.853 d_AD=2.865 a_DHA=171.200 symop: x,y,z a_YAH=161 1582 1618 " H ALA A 127 "<>" O GLY A 124 " d_HA=2.124 d_AD=3.044 a_DHA=150.020 symop: x,y,z a_YAH=103 1582 1634 " H ARG A 128 "<>" O GLY A 124 " d_HA=2.233 d_AD=3.093 a_DHA=141.756 symop: x,y,z a_YAH=153 5491 5554 " H ALA B 188 "<>" O PHE B 184 " d_HA=1.879 d_AD=2.823 a_DHA=153.977 symop: x,y,z a_YAH=166 1644 2436 "HH12 ARG A 128 "<>" OE2 GLU A 180 " d_HA=1.789 d_AD=2.772 a_DHA=160.515 symop: x,y,z a_YAH=118 1646 2436 "HH22 ARG A 128 "<>" OE2 GLU A 180 " d_HA=2.036 d_AD=2.935 a_DHA=146.888 symop: x,y,z a_YAH=94 1792 2435 " HE1 TRP A 138 "<>" OE1 GLU A 180 " d_HA=1.805 d_AD=2.803 a_DHA=162.883 symop: x,y,z a_YAH=110 2436 5453 "HH21 ARG B 181 "<>" OE2 GLU A 180 " d_HA=2.695 d_AD=3.344 a_DHA=122.349 symop: x,y,z a_YAH=99 2436 5450 " HE ARG B 181 "<>" OE2 GLU A 180 " d_HA=1.818 d_AD=2.822 a_DHA=167.670 symop: x,y,z a_YAH=113 5454 5573 "HH22 ARG B 181 "<>" OE1 GLU B 190 " d_HA=1.748 d_AD=2.727 a_DHA=157.562 symop: x,y,z a_YAH=137 5434 5513 " H ALA B 185 "<>" O ARG B 181 " d_HA=2.045 d_AD=3.051 a_DHA=171.707 symop: x,y,z a_YAH=145 5472 5540 " H PHE B 187 "<>" O LEU B 183 " d_HA=2.172 d_AD=3.130 a_DHA=156.224 symop: x,y,z a_YAH=153 2367 2437 " H GLU A 180 "<>" O ASN A 176 " d_HA=1.948 d_AD=2.963 a_DHA=173.260 symop: x,y,z a_YAH=155 2381 2454 " H ARG A 181 "<>" O LEU A 177 " d_HA=2.198 d_AD=3.209 a_DHA=171.757 symop: x,y,z a_YAH=145 5388 5462 " H THR B 182 "<>" O MET B 178 " d_HA=1.941 d_AD=2.918 a_DHA=160.848 symop: x,y,z a_YAH=155 5405 5477 " H LEU B 183 "<>" O ASN B 179 " d_HA=1.900 d_AD=2.894 a_DHA=165.169 symop: x,y,z a_YAH=152 1362 1439 " H PHE A 114 "<>" O PHE A 110 " d_HA=1.940 d_AD=2.889 a_DHA=154.458 symop: x,y,z a_YAH=146 2348 2422 " H ASN A 179 "<>" O LEU A 175 " d_HA=2.114 d_AD=3.119 a_DHA=170.285 symop: x,y,z a_YAH=148 2348 2865 " HE1 TRP A 207 "<>" O LEU A 175 " d_HA=2.886 d_AD=3.511 a_DHA=120.040 symop: x,y,z a_YAH=116 2420 2865 " HE1 TRP A 207 "<>" OD1 ASN A 179 " d_HA=1.846 d_AD=2.806 a_DHA=155.320 symop: x,y,z a_YAH=110 2338 2405 " H MET A 178 "<>" O ALA A 174 " d_HA=1.939 d_AD=2.885 a_DHA=154.021 symop: x,y,z a_YAH=153 1292 1350 " H VAL A 109 "<>" O THR A 105 " d_HA=2.302 d_AD=3.216 a_DHA=149.481 symop: x,y,z a_YAH=149 1313 1370 " H PHE A 110 "<>" O ILE A 107 " d_HA=2.302 d_AD=3.114 a_DHA=136.392 symop: x,y,z a_YAH=117 1313 1390 " H PHE A 111 "<>" O ILE A 107 " d_HA=2.389 d_AD=3.378 a_DHA=164.652 symop: x,y,z a_YAH=149 2778 2860 " H TRP A 207 "<>" O LEU A 203 " d_HA=2.094 d_AD=3.072 a_DHA=160.850 symop: x,y,z a_YAH=157 5818 5898 " HG SER B 210 "<>" O ILE B 206 " d_HA=1.727 d_AD=2.699 a_DHA=171.776 symop: x,y,z a_YAH=154 5818 5894 " H SER B 210 "<>" O ILE B 206 " d_HA=2.727 d_AD=3.565 a_DHA=140.348 symop: x,y,z a_YAH=120 5766 5848 " H TRP B 207 "<>" O LEU B 203 " d_HA=1.952 d_AD=2.892 a_DHA=152.899 symop: x,y,z a_YAH=159 5785 5865 " H VAL B 208 "<>" O VAL B 204 " d_HA=1.855 d_AD=2.848 a_DHA=164.048 symop: x,y,z a_YAH=171 5801 5884 " HG1 THR B 209 "<>" O HIS B 205 " d_HA=1.716 d_AD=2.687 a_DHA=170.645 symop: x,y,z a_YAH=138 5801 5881 " H THR B 209 "<>" O HIS B 205 " d_HA=1.944 d_AD=2.934 a_DHA=164.599 symop: x,y,z a_YAH=153 1213 1296 " H THR A 105 "<>" O ASN A 101 " d_HA=1.977 d_AD=2.987 a_DHA=170.728 symop: x,y,z a_YAH=163 1244 1318 " H ILE A 107 "<>" O TRP A 103 " d_HA=1.820 d_AD=2.829 a_DHA=171.165 symop: x,y,z a_YAH=160 1268 1337 " H ASN A 108 "<>" O ARG A 104 " d_HA=1.882 d_AD=2.814 a_DHA=151.137 symop: x,y,z a_YAH=148 2797 2877 " H VAL A 208 "<>" O VAL A 204 " d_HA=1.939 d_AD=2.955 a_DHA=175.666 symop: x,y,z a_YAH=164 2813 2893 " H THR A 209 "<>" O HIS A 205 " d_HA=1.868 d_AD=2.850 a_DHA=162.231 symop: x,y,z a_YAH=159 2813 2896 " HG1 THR A 209 "<>" O HIS A 205 " d_HA=1.660 d_AD=2.637 a_DHA=175.910 symop: x,y,z a_YAH=131 2830 2910 " HG SER A 210 "<>" O ILE A 206 " d_HA=1.712 d_AD=2.688 a_DHA=173.694 symop: x,y,z a_YAH=143 2830 2906 " H SER A 210 "<>" O ILE A 206 " d_HA=2.169 d_AD=3.091 a_DHA=150.682 symop: x,y,z a_YAH=140 5877 5943 " H GLY B 213 "<>" O THR B 209 " d_HA=2.019 d_AD=2.815 a_DHA=133.771 symop: x,y,z a_YAH=117 5861 5930 " H TYR B 212 "<>" O VAL B 208 " d_HA=2.120 d_AD=3.103 a_DHA=163.296 symop: x,y,z a_YAH=150 1198 1276 " H ARG A 104 "<>" O GLU A 100 " d_HA=2.207 d_AD=3.140 a_DHA=151.547 symop: x,y,z a_YAH=139 1198 1255 " H TRP A 103 "<>" O GLU A 100 " d_HA=2.112 d_AD=2.925 a_DHA=135.798 symop: x,y,z a_YAH=119 1193 5964 "HH21 ARG A 99 "<>" O ASN B 215 " d_HA=1.675 d_AD=2.599 a_DHA=146.889 symop: x,y,z a_YAH=163 1165 1218 " H ASN A 101 "<>" OD1 ASP A 98 " d_HA=1.843 d_AD=2.862 a_DHA=171.426 symop: x,y,z a_YAH=141 3399 3278 "HH22 ARG B 40 "<>" OD2 ASP B 49 " d_HA=1.811 d_AD=2.760 a_DHA=151.630 symop: x,y,z a_YAH=151 1004 1059 " H LEU A 90 "<>" O LEU A 87 " d_HA=2.025 d_AD=3.001 a_DHA=160.316 symop: x,y,z a_YAH=115 1701 1762 " H LEU A 137 "<>" O GLU A 133 " d_HA=1.984 d_AD=2.959 a_DHA=159.234 symop: x,y,z a_YAH=145 1720 1676 " H VAL A 134 "<>" OG SER A 131 " d_HA=2.203 d_AD=3.201 a_DHA=167.420 symop: x,y,z a_YAH=116 a_YAH=124 1734 1674 " H ALA A 135 "<>" O SER A 131 " d_HA=2.170 d_AD=3.088 a_DHA=149.472 symop: x,y,z a_YAH=136 1748 1685 " H GLU A 136 "<>" O VAL A 132 " d_HA=1.810 d_AD=2.820 a_DHA=171.151 symop: x,y,z a_YAH=164 4553 5532 "HH11 ARG B 122 "<>" O PHE B 187 " d_HA=2.575 d_AD=3.543 a_DHA=162.026 symop: x,y,z a_YAH=158 4554 3236 "HH12 ARG B 122 "<>" OE2 GLU B 38 " d_HA=2.636 d_AD=3.417 a_DHA=133.878 symop: x,y,z a_YAH=150 1716 1787 " H TRP A 138 "<>" O VAL A 134 " d_HA=2.105 d_AD=3.117 a_DHA=172.482 symop: x,y,z a_YAH=146 1732 1803 " H SER A 139 "<>" O ALA A 135 " d_HA=2.144 d_AD=3.139 a_DHA=164.558 symop: x,y,z a_YAH=148 1757 1833 " H PHE A 141 "<>" O LEU A 137 " d_HA=2.170 d_AD=3.157 a_DHA=163.333 symop: x,y,z a_YAH=157 1776 1850 " H MET A 142 "<>" O TRP A 138 " d_HA=1.888 d_AD=2.890 a_DHA=168.003 symop: x,y,z a_YAH=158 5458 5524 " H SER B 186 "<>" O THR B 182 " d_HA=2.278 d_AD=3.223 a_DHA=155.395 symop: x,y,z a_YAH=141 5458 5528 " HG SER B 186 "<>" O THR B 182 " d_HA=1.819 d_AD=2.786 a_DHA=172.147 symop: x,y,z a_YAH=149 5511 5575 " H GLU B 190 "<>" O ALA B 185 " d_HA=2.073 d_AD=3.044 a_DHA=159.677 symop: x,y,z a_YAH=145 5709 5656 " H VAL B 199 "<>" O GLU B 196 " d_HA=2.966 d_AD=3.655 a_DHA=125.999 symop: x,y,z a_YAH=93 2295 2353 " H LEU A 175 "<>" O LEU A 171 " d_HA=2.096 d_AD=3.113 a_DHA=177.720 symop: x,y,z a_YAH=165 2314 2377 "HD22 ASN A 176 "<>" O ALA A 172 " d_HA=1.780 d_AD=2.774 a_DHA=167.757 symop: x,y,z a_YAH=123 2314 2372 " H ASN A 176 "<>" O ALA A 172 " d_HA=1.975 d_AD=2.939 a_DHA=157.953 symop: x,y,z a_YAH=151 2324 2386 " H LEU A 177 "<>" O THR A 173 " d_HA=1.849 d_AD=2.824 a_DHA=159.870 symop: x,y,z a_YAH=160 5681 5756 " H THR B 202 "<>" O ARG B 198 " d_HA=2.133 d_AD=3.136 a_DHA=169.507 symop: x,y,z a_YAH=163 5705 5771 " H LEU B 203 "<>" O VAL B 199 " d_HA=1.957 d_AD=2.866 a_DHA=147.264 symop: x,y,z a_YAH=146 5752 5823 " H ILE B 206 "<>" O THR B 202 " d_HA=2.588 d_AD=3.550 a_DHA=158.824 symop: x,y,z a_YAH=133 5771 5721 " H LEU B 203 "<>" O LEU B 200 " d_HA=2.312 d_AD=2.960 a_DHA=120.416 symop: x,y,z a_YAH=105 1306 1350 " H VAL A 109 "<>" O GLY A 106 " d_HA=2.726 d_AD=3.422 a_DHA=126.132 symop: x,y,z a_YAH=96 5740 5808 " H HIS B 205 "<>" O ASP B 201 " d_HA=2.007 d_AD=3.018 a_DHA=173.339 symop: x,y,z a_YAH=154 1227 1307 " H GLY A 106 "<>" O MET A 102 " d_HA=2.414 d_AD=3.389 a_DHA=160.272 symop: x,y,z a_YAH=130 1260 2941 " HE1 TRP A 103 "<>" OH TYR A 212 " d_HA=1.849 d_AD=2.836 a_DHA=162.459 symop: x,y,z a_YAH=113 a_YAH=128 2849 2906 " H SER A 210 "<>" O TRP A 207 " d_HA=2.731 d_AD=3.374 a_DHA=121.689 symop: x,y,z a_YAH=99 2849 2919 " H ILE A 211 "<>" O TRP A 207 " d_HA=1.948 d_AD=2.877 a_DHA=150.655 symop: x,y,z a_YAH=156 2873 2942 " H TYR A 212 "<>" O VAL A 208 " d_HA=1.942 d_AD=2.945 a_DHA=168.267 symop: x,y,z a_YAH=159 2903 5814 " HE2 HIS B 205 "<>" O SER A 210 " d_HA=1.867 d_AD=2.869 a_DHA=166.913 symop: x,y,z a_YAH=133 1150 1223 "HD22 ASN A 101 "<>" OG1 THR A 97 " d_HA=2.061 d_AD=3.056 a_DHA=165.991 symop: x,y,z a_YAH=122 a_YAH=128 1155 1162 " HG1 THR A 97 "<>" O ASP A 98 " d_HA=1.991 d_AD=2.963 a_DHA=174.408 symop: x,y,z a_YAH=123 1162 1232 " H MET A 102 "<>" O ASP A 98 " d_HA=2.815 d_AD=3.713 a_DHA=148.220 symop: x,y,z a_YAH=136 1174 1232 " H MET A 102 "<>" O ARG A 99 " d_HA=2.930 d_AD=3.635 a_DHA=127.453 symop: x,y,z a_YAH=95 1166 1204 " H GLU A 100 "<>" OD2 ASP A 98 " d_HA=1.830 d_AD=2.844 a_DHA=169.586 symop: x,y,z a_YAH=100 1341 1406 "HD21 ASN A 108 "<>" OE1 GLU A 112 " d_HA=1.759 d_AD=2.756 a_DHA=161.449 symop: x,y,z a_YAH=107 1332 1408 " H GLU A 112 "<>" O ASN A 108 " d_HA=1.776 d_AD=2.777 a_DHA=169.029 symop: x,y,z a_YAH=168 1742 1818 " HG1 THR A 140 "<>" O GLU A 136 " d_HA=1.688 d_AD=2.648 a_DHA=167.393 symop: x,y,z a_YAH=138 1742 1815 " H THR A 140 "<>" O GLU A 136 " d_HA=1.904 d_AD=2.885 a_DHA=160.884 symop: x,y,z a_YAH=150 1811 1885 " H LYS A 144 "<>" O THR A 140 " d_HA=2.361 d_AD=3.312 a_DHA=155.518 symop: x,y,z a_YAH=136 1800 1868 " H GLN A 143 "<>" O SER A 139 " d_HA=1.918 d_AD=2.903 a_DHA=161.985 symop: x,y,z a_YAH=157 1802 1874 "HE21 GLN A 143 "<>" OG SER A 139 " d_HA=2.169 d_AD=3.129 a_DHA=157.014 symop: x,y,z a_YAH=138 a_YAH=109 1807 5584 " HG SER A 139 "<>" O GLN B 191 " d_HA=1.713 d_AD=2.676 a_DHA=166.443 symop: x,y,z a_YAH=141 5569 5622 " HG SER B 193 "<>" O GLU B 190 " d_HA=1.690 d_AD=2.630 a_DHA=158.974 symop: x,y,z a_YAH=167 1917 968 " HE1 TRP A 145 "<>" OD1 ASP A 84 " d_HA=1.817 d_AD=2.767 a_DHA=152.414 symop: x,y,z a_YAH=127 1825 1912 " H TRP A 145 "<>" O PHE A 141 " d_HA=1.914 d_AD=2.909 a_DHA=165.659 symop: x,y,z a_YAH=164 1845 1930 " H ILE A 146 "<>" O MET A 142 " d_HA=1.943 d_AD=2.936 a_DHA=165.038 symop: x,y,z a_YAH=151 1862 1946 " H ALA A 147 "<>" O GLN A 143 " d_HA=1.857 d_AD=2.845 a_DHA=163.608 symop: x,y,z a_YAH=154 5642 5709 " H VAL B 199 "<>" O PRO B 195 " d_HA=2.160 d_AD=3.078 a_DHA=149.780 symop: x,y,z a_YAH=153 5642 5689 " H ARG B 198 "<>" O PRO B 195 " d_HA=1.912 d_AD=2.833 a_DHA=149.414 symop: x,y,z a_YAH=130 1879 1963 " H TYR A 148 "<>" O LYS A 144 " d_HA=1.988 d_AD=2.933 a_DHA=153.260 symop: x,y,z a_YAH=138 1901 1979 " H THR A 149 "<>" O TRP A 145 " d_HA=1.948 d_AD=2.966 a_DHA=175.338 symop: x,y,z a_YAH=154 1925 1991 " H ALA A 150 "<>" O ILE A 146 " d_HA=1.880 d_AD=2.882 a_DHA=167.614 symop: x,y,z a_YAH=158 1977 2376 "HD21 ASN A 176 "<>" OG1 THR A 149 " d_HA=2.044 d_AD=3.019 a_DHA=160.934 symop: x,y,z a_YAH=105 a_YAH=103 2263 2331 " HG1 THR A 173 "<>" O HIS A 169 " d_HA=1.813 d_AD=2.761 a_DHA=163.278 symop: x,y,z a_YAH=151 2263 2328 " H THR A 173 "<>" O HIS A 169 " d_HA=1.934 d_AD=2.872 a_DHA=152.101 symop: x,y,z a_YAH=136 2280 2340 " H ALA A 174 "<>" O GLU A 170 " d_HA=2.165 d_AD=3.173 a_DHA=170.220 symop: x,y,z a_YAH=159 2284 5697 " HE ARG B 198 "<>" OE1 GLU A 170 " d_HA=1.879 d_AD=2.887 a_DHA=166.609 symop: x,y,z a_YAH=117 2284 5700 "HH21 ARG B 198 "<>" OE1 GLU A 170 " d_HA=2.661 d_AD=3.463 a_DHA=136.236 symop: x,y,z a_YAH=169 1954 2013 " H VAL A 152 "<>" O TYR A 148 " d_HA=2.137 d_AD=3.121 a_DHA=162.150 symop: x,y,z a_YAH=158 1975 2030 " H ILE A 153 "<>" O THR A 149 " d_HA=1.928 d_AD=2.942 a_DHA=175.840 symop: x,y,z a_YAH=159 2253 2316 " H ALA A 172 "<>" O ALA A 168 " d_HA=1.920 d_AD=2.897 a_DHA=160.322 symop: x,y,z a_YAH=141 2101 2220 "HH22 ARG A 157 "<>" O LEU A 166 " d_HA=2.081 d_AD=2.951 a_DHA=143.401 symop: x,y,z a_YAH=125 2239 2286 " H GLU A 170 "<>" O PRO A 167 " d_HA=2.268 d_AD=2.984 a_DHA=127.045 symop: x,y,z a_YAH=110 2239 2300 " H LEU A 171 "<>" O PRO A 167 " d_HA=1.977 d_AD=2.989 a_DHA=173.232 symop: x,y,z a_YAH=170 2097 2168 " HE ARG A 157 "<>" O PRO A 163 " d_HA=1.865 d_AD=2.769 a_DHA=145.941 symop: x,y,z a_YAH=139 2100 2208 "HH21 ARG A 157 "<>" OG1 THR A 165 " d_HA=2.209 d_AD=2.966 a_DHA=130.021 symop: x,y,z a_YAH=129 a_YAH=119 2168 2210 " H THR A 165 "<>" O PRO A 163 " d_HA=2.074 d_AD=2.992 a_DHA=149.789 symop: x,y,z a_YAH=93 2070 2136 "HH21 ARG A 159 "<>" OE1 GLU A 156 " d_HA=1.676 d_AD=2.664 a_DHA=159.170 symop: x,y,z a_YAH=107 2070 2133 " HE ARG A 159 "<>" OE1 GLU A 156 " d_HA=2.293 d_AD=3.116 a_DHA=136.909 symop: x,y,z a_YAH=162 2071 2950 " HH TYR A 212 "<>" OE2 GLU A 156 " d_HA=1.650 d_AD=2.627 a_DHA=171.167 symop: x,y,z a_YAH=125 1402 1465 " HG SER A 116 "<>" O GLU A 112 " d_HA=1.623 d_AD=2.598 a_DHA=173.475 symop: x,y,z a_YAH=158 1402 1461 " H SER A 116 "<>" O GLU A 112 " d_HA=2.270 d_AD=3.070 a_DHA=134.887 symop: x,y,z a_YAH=129 1346 1421 " H THR A 113 "<>" O VAL A 109 " d_HA=2.029 d_AD=2.956 a_DHA=150.798 symop: x,y,z a_YAH=130 1346 1424 " HG1 THR A 113 "<>" O VAL A 109 " d_HA=1.944 d_AD=2.807 a_DHA=146.912 symop: x,y,z a_YAH=153 1382 1452 " H GLY A 115 "<>" O PHE A 111 " d_HA=2.071 d_AD=2.875 a_DHA=134.756 symop: x,y,z a_YAH=128 1439 1362 " H PHE A 114 "<>" O PHE A 110 " d_HA=1.940 d_AD=2.889 a_DHA=154.458 symop: x,y,z a_YAH=146 950 1419 "HE21 GLN A 82 "<>" OG1 THR A 113 " d_HA=2.768 d_AD=3.729 a_DHA=159.531 symop: x,y,z a_YAH=99 a_YAH=142 596 2276 " HE2 HIS A 169 "<>" O TYR A 62 " d_HA=2.525 d_AD=3.257 a_DHA=128.763 symop: -y+4/3,x-y-1/3,z-1/3 a_YAH=148 548 625 " H PHE A 63 "<>" O PRO A 59 " d_HA=2.619 d_AD=3.373 a_DHA=131.404 symop: x,y,z a_YAH=146 1944 2001 " H ALA A 151 "<>" O ALA A 147 " d_HA=1.989 d_AD=2.947 a_DHA=156.176 symop: x,y,z a_YAH=145 1989 2049 " H ASP A 154 "<>" O ALA A 150 " d_HA=1.972 d_AD=2.938 a_DHA=158.004 symop: x,y,z a_YAH=149 1999 2058 " H ALA A 155 "<>" O ALA A 151 " d_HA=2.089 d_AD=3.075 a_DHA=163.968 symop: x,y,z a_YAH=143 2099 2220 "HH12 ARG A 157 "<>" O LEU A 166 " d_HA=1.772 d_AD=2.744 a_DHA=159.387 symop: x,y,z a_YAH=159 2009 2072 " H GLU A 156 "<>" O VAL A 152 " d_HA=1.822 d_AD=2.792 a_DHA=158.997 symop: x,y,z a_YAH=164 2025 2089 " H ARG A 157 "<>" O ILE A 153 " d_HA=2.475 d_AD=3.274 a_DHA=135.126 symop: x,y,z a_YAH=132 2044 2089 " H ARG A 157 "<>" O ASP A 154 " d_HA=2.271 d_AD=3.021 a_DHA=129.529 symop: x,y,z a_YAH=102 2044 2110 " H ASP A 158 "<>" O ASP A 154 " d_HA=2.042 d_AD=2.987 a_DHA=154.000 symop: x,y,z a_YAH=150 2056 2125 " H ARG A 159 "<>" O ALA A 155 " d_HA=1.982 d_AD=2.932 a_DHA=154.218 symop: x,y,z a_YAH=147 2066 2150 " H ALA A 161 "<>" O GLU A 156 " d_HA=2.266 d_AD=3.025 a_DHA=130.927 symop: x,y,z a_YAH=171 2066 2160 " H ALA A 162 "<>" O GLU A 156 " d_HA=2.243 d_AD=3.195 a_DHA=156.462 symop: x,y,z a_YAH=119 2081 2142 " H GLY A 160 "<>" O ARG A 157 " d_HA=2.222 d_AD=3.134 a_DHA=149.409 symop: x,y,z a_YAH=96 1451 1503 " HZ2 LYS A 118 "<>" O GLY A 115 " d_HA=1.760 d_AD=2.753 a_DHA=166.047 symop: x,y,z a_YAH=150 1502 2673 " HZ1 LYS A 118 "<>" OE2 GLU A 196 " d_HA=1.848 d_AD=2.736 a_DHA=143.062 symop: x,y,z a_YAH=134 1417 1461 " H SER A 116 "<>" O THR A 113 " d_HA=2.284 d_AD=3.031 a_DHA=129.464 symop: x,y,z a_YAH=103 1431 1476 " H HIS A 117 "<>" O PHE A 114 " d_HA=2.158 d_AD=3.010 a_DHA=140.626 symop: x,y,z a_YAH=97 562 625 " H PHE A 63 "<>" O THR A 60 " d_HA=2.462 d_AD=3.327 a_DHA=143.259 symop: x,y,z a_YAH=102 562 646 " H TYR A 64 "<>" O THR A 60 " d_HA=2.893 d_AD=3.706 a_DHA=137.907 symop: x,y,z a_YAH=141 576 646 " H TYR A 64 "<>" O PHE A 61 " d_HA=2.058 d_AD=2.933 a_DHA=143.522 symop: x,y,z a_YAH=119 576 666 " H PHE A 65 "<>" O PHE A 61 " d_HA=1.950 d_AD=2.920 a_DHA=159.116 symop: x,y,z a_YAH=150 513 584 " H PHE A 61 "<>" O SER A 57 " d_HA=2.153 d_AD=3.078 a_DHA=150.994 symop: x,y,z a_YAH=153 524 605 " H TYR A 62 "<>" O ARG A 58 " d_HA=2.351 d_AD=3.350 a_DHA=167.884 symop: x,y,z a_YAH=159 692 754 " H VAL A 71 "<>" O SER A 67 " d_HA=2.766 d_AD=3.609 a_DHA=141.537 symop: x,y,z a_YAH=127 694 742 " H ALA A 70 "<>" OG SER A 67 " d_HA=2.051 d_AD=3.013 a_DHA=157.108 symop: x,y,z a_YAH=138 a_YAH=103 709 729 " H LYS A 68 "<>" OE1 GLU A 69 " d_HA=2.595 d_AD=3.278 a_DHA=124.300 symop: x,y,z a_YAH=138 542 2048 "HH12 ARG A 58 "<>" OD2 ASP A 154 " d_HA=1.939 d_AD=2.752 a_DHA=133.821 symop: -y+4/3,x-y-1/3,z-1/3 a_YAH=126 542 2109 "HH12 ARG A 58 "<>" OD2 ASP A 158 " d_HA=2.695 d_AD=3.398 a_DHA=125.638 symop: -y+4/3,x-y-1/3,z-1/3 a_YAH=148 544 2109 "HH22 ARG A 58 "<>" OD2 ASP A 158 " d_HA=1.639 d_AD=2.664 a_DHA=176.330 symop: -y+4/3,x-y-1/3,z-1/3 a_YAH=146 2047 2200 "HH12 ARG A 164 "<>" OD1 ASP A 154 " d_HA=2.528 d_AD=3.536 a_DHA=171.118 symop: x,y,z a_YAH=160 3 44 " H ARG A 25 "<>" O GLY A 22 " d_HA=2.333 d_AD=3.285 a_DHA=156.194 symop: x,y,z a_YAH=142 3 66 " H GLU A 26 "<>" O GLY A 22 " d_HA=2.940 d_AD=3.786 a_DHA=141.946 symop: x,y,z a_YAH=105 3 654 " HH TYR A 64 "<>" O GLY A 22 " d_HA=2.171 d_AD=3.132 a_DHA=173.684 symop: x,y,z a_YAH=116 65 887 "HH21 ARG A 78 "<>" OE2 GLU A 26 " d_HA=1.782 d_AD=2.663 a_DHA=140.927 symop: x,y,z a_YAH=153 785 861 " H ASP A 77 "<>" O LEU A 73 " d_HA=1.925 d_AD=2.921 a_DHA=165.920 symop: x,y,z a_YAH=156 36 109 " H ILE A 29 "<>" O ARG A 25 " d_HA=2.319 d_AD=3.210 a_DHA=145.964 symop: x,y,z a_YAH=133 725 790 " H LEU A 73 "<>" O GLU A 69 " d_HA=1.902 d_AD=2.894 a_DHA=164.627 symop: x,y,z a_YAH=155 740 808 " H THR A 74 "<>" O ALA A 70 " d_HA=2.101 d_AD=3.108 a_DHA=170.629 symop: x,y,z a_YAH=143 750 823 " H LEU A 75 "<>" O VAL A 71 " d_HA=1.883 d_AD=2.864 a_DHA=161.998 symop: x,y,z a_YAH=154 703 754 " H VAL A 71 "<>" O LYS A 68 " d_HA=2.373 d_AD=3.039 a_DHA=122.797 symop: x,y,z a_YAH=96 703 771 " H LEU A 72 "<>" O LYS A 68 " d_HA=2.093 d_AD=3.056 a_DHA=157.894 symop: x,y,z a_YAH=148 438 499 " H ILE A 56 "<>" O ALA A 51 " d_HA=2.013 d_AD=3.002 a_DHA=163.051 symop: x,y,z a_YAH=159 379 440 " H ALA A 51 "<>" O VAL A 47 " d_HA=2.043 d_AD=2.997 a_DHA=155.370 symop: x,y,z a_YAH=142 395 454 " H LYS A 52 "<>" O ASP A 48 " d_HA=1.770 d_AD=2.777 a_DHA=169.800 symop: x,y,z a_YAH=163 368 424 " H LEU A 50 "<>" O SER A 46 " d_HA=2.391 d_AD=3.383 a_DHA=166.306 symop: x,y,z a_YAH=144 308 720 " HZ2 LYS A 68 "<>" O LEU A 42 " d_HA=1.756 d_AD=2.759 a_DHA=167.402 symop: x,y,z a_YAH=139 308 354 " H ILE A 45 "<>" O LEU A 42 " d_HA=2.144 d_AD=3.102 a_DHA=157.665 symop: x,y,z a_YAH=106 349 721 " HZ3 LYS A 68 "<>" O ILE A 45 " d_HA=2.119 d_AD=2.841 a_DHA=126.485 symop: x,y,z a_YAH=154 398 540 " HE ARG A 58 "<>" OD1 ASP A 48 " d_HA=1.983 d_AD=2.864 a_DHA=143.143 symop: x,y,z a_YAH=140 371 411 " H SER A 46 "<>" OD2 ASP A 49 " d_HA=2.295 d_AD=3.309 a_DHA=176.939 symop: x,y,z a_YAH=91 375 410 " HG SER A 46 "<>" OD1 ASP A 49 " d_HA=1.629 d_AD=2.580 a_DHA=159.316 symop: x,y,z a_YAH=108 248 1566 "HH12 ARG A 122 "<>" OE2 GLU A 38 " d_HA=1.947 d_AD=2.878 a_DHA=148.633 symop: x,y,z a_YAH=149 856 929 " H ASN A 81 "<>" O ASP A 77 " d_HA=1.883 d_AD=2.894 a_DHA=171.165 symop: x,y,z a_YAH=156 856 934 "HD22 ASN A 81 "<>" O ASP A 77 " d_HA=2.131 d_AD=2.978 a_DHA=139.450 symop: x,y,z a_YAH=113 859 934 "HD22 ASN A 81 "<>" OD1 ASP A 77 " d_HA=2.300 d_AD=3.001 a_DHA=125.037 symop: x,y,z a_YAH=90 12 66 " H GLU A 26 "<>" O ASP A 23 " d_HA=2.078 d_AD=2.800 a_DHA=126.638 symop: x,y,z a_YAH=106 12 80 " H LEU A 27 "<>" O ASP A 23 " d_HA=1.715 d_AD=2.718 a_DHA=171.513 symop: x,y,z a_YAH=163 804 876 " H ARG A 78 "<>" O THR A 74 " d_HA=1.904 d_AD=2.892 a_DHA=162.997 symop: x,y,z a_YAH=157 818 896 " H VAL A 79 "<>" O LEU A 75 " d_HA=1.956 d_AD=2.955 a_DHA=167.110 symop: x,y,z a_YAH=159 837 912 " H VAL A 80 "<>" O LEU A 76 " d_HA=1.872 d_AD=2.865 a_DHA=164.074 symop: x,y,z a_YAH=154 24 96 " H ALA A 28 "<>" O ASP A 24 " d_HA=2.160 d_AD=3.092 a_DHA=152.031 symop: x,y,z a_YAH=129 60 128 " H LEU A 30 "<>" O GLU A 26 " d_HA=1.979 d_AD=2.983 a_DHA=168.161 symop: x,y,z a_YAH=151 75 144 " H ALA A 31 "<>" O LEU A 27 " d_HA=1.835 d_AD=2.846 a_DHA=175.615 symop: x,y,z a_YAH=163 94 156 " H THR A 32 "<>" O ALA A 28 " d_HA=2.161 d_AD=3.108 a_DHA=154.962 symop: x,y,z a_YAH=138 94 159 " HG1 THR A 32 "<>" O ALA A 28 " d_HA=2.073 d_AD=2.918 a_DHA=145.031 symop: x,y,z a_YAH=159 123 182 " H GLU A 34 "<>" O LEU A 30 " d_HA=1.883 d_AD=2.889 a_DHA=169.519 symop: x,y,z a_YAH=168 766 842 " H LEU A 76 "<>" O LEU A 72 " d_HA=1.867 d_AD=2.874 a_DHA=169.948 symop: x,y,z a_YAH=158 104 168 " H ALA A 33 "<>" O ILE A 29 " d_HA=1.921 d_AD=2.840 a_DHA=149.188 symop: x,y,z a_YAH=147 419 479 " H ALA A 54 "<>" O LEU A 50 " d_HA=2.193 d_AD=3.164 a_DHA=159.854 symop: x,y,z a_YAH=143 448 488 " H GLY A 55 "<>" O LYS A 52 " d_HA=2.007 d_AD=2.971 a_DHA=158.056 symop: x,y,z a_YAH=115 407 471 " H GLY A 53 "<>" O ASP A 49 " d_HA=1.905 d_AD=2.912 a_DHA=169.851 symop: x,y,z a_YAH=150 294 342 " H ASP A 44 "<>" O PRO A 41 " d_HA=2.325 d_AD=3.051 a_DHA=127.836 symop: x,y,z a_YAH=120 288 411 "HH12 ARG A 40 "<>" OD2 ASP A 49 " d_HA=2.859 d_AD=3.536 a_DHA=124.937 symop: x,y,z a_YAH=162 290 411 "HH22 ARG A 40 "<>" OD2 ASP A 49 " d_HA=1.746 d_AD=2.731 a_DHA=159.456 symop: x,y,z a_YAH=124 924 982 " H MET A 85 "<>" O ASN A 81 " d_HA=1.877 d_AD=2.891 a_DHA=174.440 symop: x,y,z a_YAH=158 868 944 " H GLN A 82 "<>" O ARG A 78 " d_HA=2.096 d_AD=3.022 a_DHA=150.608 symop: x,y,z a_YAH=142 892 957 " H ALA A 83 "<>" O VAL A 79 " d_HA=2.130 d_AD=3.103 a_DHA=160.130 symop: x,y,z a_YAH=156 908 970 " H ASP A 84 "<>" O VAL A 80 " d_HA=2.187 d_AD=3.154 a_DHA=158.517 symop: x,y,z a_YAH=146 181 1480 " HD1 HIS A 117 "<>" OE2 GLU A 34 " d_HA=1.759 d_AD=2.762 a_DHA=164.441 symop: x,y,z a_YAH=110 1518 1583 " H GLY A 124 "<>" O VAL A 120 " d_HA=1.797 d_AD=2.811 a_DHA=176.764 symop: x,y,z a_YAH=169 142 196 " H ASN A 35 "<>" O ALA A 31 " d_HA=2.097 d_AD=3.104 a_DHA=170.155 symop: x,y,z a_YAH=150 152 210 " H LEU A 36 "<>" O THR A 32 " d_HA=2.295 d_AD=3.134 a_DHA=139.454 symop: x,y,z a_YAH=136 166 210 " H LEU A 36 "<>" O ALA A 33 " d_HA=2.587 d_AD=3.292 a_DHA=126.543 symop: x,y,z a_YAH=96 166 229 " H LEU A 37 "<>" O ALA A 33 " d_HA=2.318 d_AD=3.132 a_DHA=136.219 symop: x,y,z a_YAH=146 176 229 " H LEU A 37 "<>" O GLU A 34 " d_HA=2.261 d_AD=3.047 a_DHA=132.968 symop: x,y,z a_YAH=105 176 249 " H GLU A 38 "<>" O GLU A 34 " d_HA=2.754 d_AD=3.524 a_DHA=133.294 symop: x,y,z a_YAH=149 1508 1574 " H ALA A 123 "<>" O ALA A 119 " d_HA=1.984 d_AD=2.963 a_DHA=161.349 symop: x,y,z a_YAH=147 191 249 " H GLU A 38 "<>" O ASN A 35 " d_HA=2.859 d_AD=3.738 a_DHA=145.778 symop: x,y,z a_YAH=91 205 278 " H ARG A 40 "<>" O LEU A 36 " d_HA=2.354 d_AD=3.245 a_DHA=146.189 symop: x,y,z a_YAH=141 224 1568 "HH22 ARG A 122 "<>" O LEU A 37 " d_HA=2.041 d_AD=2.779 a_DHA=126.967 symop: x,y,z a_YAH=143 938 996 " H ALA A 86 "<>" O GLN A 82 " d_HA=2.081 d_AD=3.040 a_DHA=156.303 symop: x,y,z a_YAH=146 955 1009 " H LEU A 87 "<>" O ALA A 83 " d_HA=1.984 d_AD=2.953 a_DHA=157.984 symop: x,y,z a_YAH=146 951 1475 "HE22 GLN A 82 "<>" NE2 HIS A 117 " d_HA=2.714 d_AD=3.603 a_DHA=146.759 symop: x,y,z a_YAH=99 a_YAH=154 1469 1538 " H THR A 121 "<>" O HIS A 117 " d_HA=1.960 d_AD=2.969 a_DHA=171.768 symop: x,y,z a_YAH=161 1469 1541 " HG1 THR A 121 "<>" O HIS A 117 " d_HA=1.920 d_AD=2.878 a_DHA=168.715 symop: x,y,z a_YAH=122 1486 1556 " H ARG A 122 "<>" O LYS A 118 " d_HA=1.817 d_AD=2.813 a_DHA=165.183 symop: x,y,z a_YAH=155 1566 248 "HH12 ARG A 122 "<>" OE2 GLU A 38 " d_HA=1.947 d_AD=2.878 a_DHA=148.633 symop: x,y,z a_YAH=149 243 1568 "HH22 ARG A 122 "<>" O GLU A 38 " d_HA=2.558 d_AD=3.395 a_DHA=138.897 symop: x,y,z a_YAH=106 ------------------------------------------------------------------------------- Total: 583 Symmetry: 0 Per residue: 1.5026 Mean SD Skew Kurtosis theta_1: 144.402 22.056 -0.476 1.932 theta_2: 130.983 24.573 -0.213 1.622 d_HA: 2.365 0.339 0.375 1.885 2404 3180 " H LEU A 209 "<>" O ASP A 156 " d_HA=2.267 d_AD=3.235 a_DHA=159.341 symop: x,y,z a_YAH=136 2147 3445 " H VAL A 225 "<>" O MET A 139 " d_HA=2.123 d_AD=3.102 a_DHA=161.070 symop: x,y,z a_YAH=164 2152 3441 " H MET A 139 "<>" O VAL A 225 " d_HA=2.173 d_AD=3.095 a_DHA=150.201 symop: x,y,z a_YAH=164 5705 6634 "HD21 ASN B 177 "<>" OE2 GLU B 115 " d_HA=2.928 d_AD=3.800 a_DHA=144.408 symop: -x+y+1,-x+2,z a_YAH=132 3165 3227 " H TYR A 211 "<>" O ALA A 208 " d_HA=2.469 d_AD=3.189 a_DHA=128.008 symop: x,y,z a_YAH=116 3165 3244 " H LEU A 212 "<>" O ALA A 208 " d_HA=2.336 d_AD=3.327 a_DHA=164.763 symop: x,y,z a_YAH=149 2426 3153 " H PHE A 207 "<>" O VAL A 158 " d_HA=1.979 d_AD=2.924 a_DHA=154.700 symop: x,y,z a_YAH=134 2430 3145 " H VAL A 158 "<>" O PHE A 207 " d_HA=1.924 d_AD=2.898 a_DHA=160.729 symop: x,y,z a_YAH=150 5220 5259 " H GLY B 83 "<>" OD2 ASP B 86 " d_HA=1.823 d_AD=2.839 a_DHA=171.626 symop: x,y,z a_YAH=100 3791 752 " H GLN A 49 "<>" O LYS A 248 " d_HA=1.812 d_AD=2.767 a_DHA=155.082 symop: x,y,z a_YAH=156 3616 3822 " H TYR A 249 "<>" O VAL A 237 " d_HA=1.819 d_AD=2.804 a_DHA=161.909 symop: x,y,z a_YAH=156 3464 3636 " HG1 THR A 226 "<>" OE1 GLU A 238 " d_HA=2.426 d_AD=3.261 a_DHA=144.108 symop: x,y,z a_YAH=120 6577 6619 " H GLY B 176 "<>" O GLY B 173 " d_HA=2.415 d_AD=3.407 a_DHA=165.644 symop: x,y,z a_YAH=120 6578 6618 " H GLY B 173 "<>" O GLY B 176 " d_HA=2.567 d_AD=3.565 a_DHA=168.777 symop: x,y,z a_YAH=153 5706 6625 " H GLU B 115 "<>" O ASN B 177 " d_HA=1.903 d_AD=2.884 a_DHA=162.694 symop: -x+y+1,-x+2,z a_YAH=169 6630 5700 " H ASN B 177 "<>" O GLU B 115 " d_HA=1.973 d_AD=2.941 a_DHA=157.471 symop: -y+2,x-y+1,z a_YAH=146 5513 5659 " H SER B 112 "<>" O PHE B 103 " d_HA=2.213 d_AD=3.092 a_DHA=143.488 symop: x,y,z a_YAH=145 5513 5663 " HG SER B 112 "<>" O PHE B 103 " d_HA=2.771 d_AD=3.627 a_DHA=147.867 symop: x,y,z a_YAH=141 5656 5521 " H PHE B 103 "<>" O SER B 112 " d_HA=1.966 d_AD=2.920 a_DHA=156.678 symop: x,y,z a_YAH=156 5550 5618 " H ALA B 105 "<>" O LYS B 110 " d_HA=2.385 d_AD=3.344 a_DHA=158.419 symop: x,y,z a_YAH=157 674 633 " H HIS A 44 "<>" O ASP A 41 " d_HA=2.307 d_AD=3.244 a_DHA=153.502 symop: x,y,z a_YAH=126 688 636 " H VAL A 45 "<>" OD1 ASP A 41 " d_HA=2.385 d_AD=3.220 a_DHA=139.011 symop: x,y,z a_YAH=131 700 638 " H ASP A 41 "<>" O SER A 46 " d_HA=2.481 d_AD=3.237 a_DHA=130.948 symop: x,y,z a_YAH=161 703 636 " H SER A 46 "<>" OD1 ASP A 41 " d_HA=2.520 d_AD=3.454 a_DHA=152.336 symop: x,y,z a_YAH=155 707 636 " HG SER A 46 "<>" OD1 ASP A 41 " d_HA=2.471 d_AD=3.375 a_DHA=154.539 symop: x,y,z a_YAH=110 711 3843 " H TYR A 250 "<>" O LEU A 47 " d_HA=1.730 d_AD=2.736 a_DHA=175.449 symop: x,y,z a_YAH=162 716 3834 " H LEU A 47 "<>" O TYR A 250 " d_HA=2.281 d_AD=3.216 a_DHA=153.334 symop: x,y,z a_YAH=125 3822 3616 " H TYR A 249 "<>" O VAL A 237 " d_HA=1.819 d_AD=2.804 a_DHA=161.909 symop: x,y,z a_YAH=156 3457 3638 " H GLU A 238 "<>" O THR A 226 " d_HA=2.399 d_AD=3.260 a_DHA=142.469 symop: x,y,z a_YAH=125 3461 3632 " H THR A 226 "<>" O GLU A 238 " d_HA=1.953 d_AD=2.939 a_DHA=162.262 symop: x,y,z a_YAH=146 5667 6651 " H ASN B 179 "<>" O ASP B 113 " d_HA=2.237 d_AD=3.232 a_DHA=166.844 symop: -x+y+1,-x+2,z a_YAH=149 5672 6646 " H ASP B 113 "<>" O ASN B 179 " d_HA=2.333 d_AD=3.214 a_DHA=145.368 symop: -x+y+1,-x+2,z a_YAH=136 684 3876 " H ALA A 252 "<>" O VAL A 45 " d_HA=1.889 d_AD=2.884 a_DHA=166.415 symop: x,y,z a_YAH=175 3620 3813 " H VAL A 237 "<>" O TYR A 249 " d_HA=1.863 d_AD=2.879 a_DHA=176.719 symop: x,y,z a_YAH=155 2109 3476 " H LEU A 227 "<>" O VAL A 137 " d_HA=2.156 d_AD=3.015 a_DHA=142.018 symop: x,y,z a_YAH=144 2131 2971 " H LYS A 138 "<>" O THR A 196 " d_HA=1.953 d_AD=2.903 a_DHA=154.681 symop: x,y,z a_YAH=156 3131 3904 " H LYS A 254 "<>" O THR A 206 " d_HA=2.029 d_AD=2.946 a_DHA=150.079 symop: x,y,z a_YAH=132 2463 3112 " H ILE A 160 "<>" O LEU A 205 " d_HA=1.850 d_AD=2.823 a_DHA=159.194 symop: x,y,z a_YAH=169 2458 3117 " H LEU A 205 "<>" O ILE A 160 " d_HA=2.157 d_AD=3.110 a_DHA=156.113 symop: x,y,z a_YAH=132 6196 5176 "HH12 ARG B 146 "<>" O LYS B 80 " d_HA=2.133 d_AD=2.979 a_DHA=140.588 symop: -y+2,x-y+1,z a_YAH=120 6198 5209 "HH22 ARG B 146 "<>" O ALA B 82 " d_HA=2.218 d_AD=3.215 a_DHA=167.828 symop: -y+2,x-y+1,z a_YAH=100 1912 1939 "HE21 GLN A 125 "<>" O GLU A 124 " d_HA=1.774 d_AD=2.682 a_DHA=146.660 symop: x,y,z a_YAH=123 750 3768 " HE2 HIS A 246 "<>" OE1 GLN A 49 " d_HA=1.814 d_AD=2.811 a_DHA=164.489 symop: x,y,z a_YAH=100 750 3808 " HZ2 LYS A 248 "<>" OE1 GLN A 49 " d_HA=2.179 d_AD=3.052 a_DHA=142.701 symop: x,y,z a_YAH=151 6256 6305 " H HIS B 153 "<>" O ASP B 150 " d_HA=2.115 d_AD=3.090 a_DHA=161.552 symop: x,y,z a_YAH=118 6195 6260 "HH11 ARG B 146 "<>" OD2 ASP B 150 " d_HA=1.614 d_AD=2.621 a_DHA=166.307 symop: x,y,z a_YAH=139 680 1917 " HE2 HIS A 44 "<>" OE2 GLU A 124 " d_HA=2.825 d_AD=3.770 a_DHA=154.642 symop: x,y,z a_YAH=92 6268 6320 " H ILE B 154 "<>" O LEU B 151 " d_HA=1.928 d_AD=2.868 a_DHA=152.986 symop: x,y,z a_YAH=116 6268 6335 " H GLY B 155 "<>" O LEU B 151 " d_HA=2.083 d_AD=3.047 a_DHA=158.464 symop: x,y,z a_YAH=162 5582 5586 "HD22 ASN B 107 "<>" O GLN B 108 " d_HA=2.185 d_AD=2.929 a_DHA=129.379 symop: x,y,z a_YAH=165 667 6791 " H VAL B 188 "<>" O HIS A 44 " d_HA=2.234 d_AD=3.011 a_DHA=132.556 symop: x-1,y-1,z-1 a_YAH=172 6783 6807 "HD22 ASN B 187 "<>" OD2 ASP B 189 " d_HA=2.886 d_AD=3.582 a_DHA=126.882 symop: x,y,z a_YAH=94 3493 3600 " H SER A 228 "<>" O VAL A 236 " d_HA=1.828 d_AD=2.807 a_DHA=160.643 symop: x,y,z a_YAH=154 6556 6640 " H GLY B 178 "<>" O ALA B 171 " d_HA=2.059 d_AD=3.060 a_DHA=168.389 symop: x,y,z a_YAH=154 6558 6639 " H ALA B 171 "<>" O GLY B 178 " d_HA=1.984 d_AD=2.962 a_DHA=161.186 symop: x,y,z a_YAH=158 6525 6665 " H ILE B 180 "<>" O PHE B 169 " d_HA=1.983 d_AD=2.926 a_DHA=153.402 symop: x,y,z a_YAH=148 6552 6649 " HG SER B 170 "<>" OD1 ASN B 179 " d_HA=2.195 d_AD=3.138 a_DHA=165.803 symop: x,y,z a_YAH=130 5640 6685 " H LYS B 181 "<>" O VAL B 111 " d_HA=1.732 d_AD=2.703 a_DHA=158.312 symop: -x+y+1,-x+2,z a_YAH=164 5624 6701 " H LYS B 110 "<>" O LEU B 182 " d_HA=2.410 d_AD=3.396 a_DHA=166.531 symop: -x+y+1,-x+2,z a_YAH=101 5644 6679 " H VAL B 111 "<>" O LYS B 181 " d_HA=2.097 d_AD=3.108 a_DHA=177.060 symop: -x+y+1,-x+2,z a_YAH=161 6701 6727 " HG SER B 183 "<>" O LEU B 182 " d_HA=1.593 d_AD=2.516 a_DHA=155.438 symop: x,y,z a_YAH=122 3581 3860 " H LEU A 251 "<>" O LEU A 235 " d_HA=1.755 d_AD=2.675 a_DHA=149.330 symop: x,y,z a_YAH=148 3586 3855 " H LEU A 235 "<>" O LEU A 251 " d_HA=2.002 d_AD=2.951 a_DHA=155.512 symop: x,y,z a_YAH=141 3490 3604 " H VAL A 236 "<>" O SER A 228 " d_HA=1.913 d_AD=2.922 a_DHA=172.382 symop: x,y,z a_YAH=165 2082 3506 " H MET A 229 "<>" O CYS A 135 " d_HA=2.272 d_AD=3.224 a_DHA=155.890 symop: x,y,z a_YAH=141 2097 3004 " H VAL A 136 "<>" O GLU A 198 " d_HA=2.859 d_AD=3.690 a_DHA=140.081 symop: x,y,z a_YAH=98 2113 3471 " H VAL A 137 "<>" O LEU A 227 " d_HA=1.967 d_AD=2.980 a_DHA=176.395 symop: x,y,z a_YAH=150 2093 3010 " H GLU A 198 "<>" O VAL A 136 " d_HA=1.941 d_AD=2.918 a_DHA=161.772 symop: x,y,z a_YAH=145 3083 2488 " H VAL A 203 "<>" O CYS A 162 " d_HA=2.717 d_AD=3.507 a_DHA=135.609 symop: x,y,z a_YAH=106 2084 2495 " HG CYS A 162 "<>" SG CYS A 135 " d_HA=2.141 d_AD=3.277 a_DHA=139.405 symop: x,y,z a_YAH=118 a_YAH=129 3079 2491 " H CYS A 162 "<>" O VAL A 203 " d_HA=2.098 d_AD=2.836 a_DHA=128.113 symop: x,y,z a_YAH=136 974 506 " HG SER A 31 "<>" O ASP A 63 " d_HA=2.077 d_AD=3.000 a_DHA=157.579 symop: -y,x-y,z a_YAH=145 955 977 " HE ARG A 61 "<>" OD1 ASP A 63 " d_HA=2.505 d_AD=3.509 a_DHA=168.477 symop: x,y,z a_YAH=113 1002 1454 " HE ARG A 64 "<>" OD2 ASP A 94 " d_HA=2.394 d_AD=3.243 a_DHA=140.421 symop: x,y,z a_YAH=109 10 978 " H3 MET A 1 "<>" OD2 ASP A 63 " d_HA=1.863 d_AD=2.757 a_DHA=145.720 symop: x,y,z a_YAH=108 958 978 "HH21 ARG A 61 "<>" OD2 ASP A 63 " d_HA=2.145 d_AD=3.162 a_DHA=171.364 symop: x,y,z a_YAH=120 6248 6259 " HE ARG B 149 "<>" OD1 ASP B 150 " d_HA=1.940 d_AD=2.970 a_DHA=176.148 symop: x,y,z a_YAH=143 6251 6259 "HH21 ARG B 149 "<>" OD1 ASP B 150 " d_HA=2.918 d_AD=3.703 a_DHA=134.658 symop: x,y,z a_YAH=111 6221 6290 " H SER B 152 "<>" O CYS B 148 " d_HA=2.255 d_AD=3.062 a_DHA=135.972 symop: x,y,z a_YAH=138 6221 6294 " HG SER B 152 "<>" O CYS B 148 " d_HA=1.612 d_AD=2.549 a_DHA=158.051 symop: x,y,z a_YAH=140 6289 7204 "HD21 ASN B 213 "<>" OG SER B 152 " d_HA=1.882 d_AD=2.868 a_DHA=162.427 symop: x,y,z a_YAH=124 a_YAH=122 6178 6261 " H ASP B 150 "<>" O ARG B 146 " d_HA=2.149 d_AD=3.017 a_DHA=142.312 symop: x,y,z a_YAH=141 6133 6207 " H ILE B 147 "<>" O GLU B 143 " d_HA=1.991 d_AD=2.924 a_DHA=152.258 symop: x,y,z a_YAH=153 6202 6261 " H ASP B 150 "<>" O ILE B 147 " d_HA=2.459 d_AD=3.206 a_DHA=129.852 symop: x,y,z a_YAH=102 6202 6273 " H LEU B 151 "<>" O ILE B 147 " d_HA=1.985 d_AD=2.998 a_DHA=174.587 symop: x,y,z a_YAH=166 6782 6841 "HD21 ASN B 187 "<>" OE1 GLU B 191 " d_HA=2.790 d_AD=3.765 a_DHA=161.874 symop: x,y,z a_YAH=119 6806 6843 " H GLU B 191 "<>" OD1 ASP B 189 " d_HA=2.757 d_AD=3.559 a_DHA=136.214 symop: x,y,z a_YAH=96 1989 2030 "HE21 GLN A 131 "<>" O PRO A 129 " d_HA=2.013 d_AD=3.000 a_DHA=162.905 symop: x,y,z a_YAH=144 6379 6548 " H SER B 170 "<>" O VAL B 159 " d_HA=2.159 d_AD=3.040 a_DHA=144.823 symop: x,y,z a_YAH=124 6383 6545 " H VAL B 159 "<>" O SER B 170 " d_HA=2.156 d_AD=3.124 a_DHA=158.581 symop: x,y,z a_YAH=154 6533 6660 " H PHE B 169 "<>" O ILE B 180 " d_HA=2.224 d_AD=3.213 a_DHA=168.390 symop: x,y,z a_YAH=138 6487 6706 " H LEU B 182 "<>" O VAL B 167 " d_HA=1.923 d_AD=2.924 a_DHA=170.276 symop: x,y,z a_YAH=145 5607 6752 " H THR B 185 "<>" OE1 GLU B 109 " d_HA=2.471 d_AD=3.483 a_DHA=171.368 symop: -x+y+1,-x+2,z a_YAH=131 6748 6778 " H ASN B 187 "<>" O THR B 185 " d_HA=2.746 d_AD=3.466 a_DHA=128.056 symop: x,y,z a_YAH=100 2085 3501 " H CYS A 135 "<>" O MET A 229 " d_HA=2.020 d_AD=2.926 a_DHA=148.159 symop: x,y,z a_YAH=153 6414 6509 " H LYS B 168 "<>" O SER B 161 " d_HA=2.133 d_AD=3.092 a_DHA=156.725 symop: x,y,z a_YAH=151 6417 6503 " H SER B 161 "<>" O LYS B 168 " d_HA=1.931 d_AD=2.937 a_DHA=169.504 symop: x,y,z a_YAH=166 3518 3555 " H VAL A 233 "<>" O SER A 230 " d_HA=2.377 d_AD=3.299 a_DHA=151.767 symop: x,y,z a_YAH=145 2071 3041 " H ASN A 200 "<>" O SER A 134 " d_HA=1.967 d_AD=2.964 a_DHA=166.776 symop: x,y,z a_YAH=168 6438 6480 " H ALA B 163 "<>" O GLY B 166 " d_HA=2.438 d_AD=3.331 a_DHA=147.084 symop: x,y,z a_YAH=129 6452 6471 " H LYS B 164 "<>" OD1 ASP B 165 " d_HA=2.542 d_AD=3.282 a_DHA=129.277 symop: x,y,z a_YAH=145 965 994 " H ARG A 64 "<>" SG CYS A 62 " d_HA=2.805 d_AD=3.456 a_DHA=122.510 symop: x,y,z a_YAH=120 a_YAH=128 3 979 " H ASP A 63 "<>" O MET A 1 " d_HA=2.145 d_AD=3.155 a_DHA=173.955 symop: x,y,z a_YAH=133 48 939 " H GLU A 3 "<>" O ARG A 61 " d_HA=1.927 d_AD=2.808 a_DHA=144.052 symop: x,y,z a_YAH=145 22 1427 " H ALA A 92 "<>" O PHE A 2 " d_HA=2.304 d_AD=3.118 a_DHA=137.131 symop: x,y,z a_YAH=125 30 1425 " H PHE A 2 "<>" O ALA A 92 " d_HA=1.857 d_AD=2.863 a_DHA=168.456 symop: x,y,z a_YAH=154 1435 1478 " H ALA A 96 "<>" O GLU A 93 " d_HA=2.511 d_AD=3.369 a_DHA=142.336 symop: x,y,z a_YAH=120 1425 30 " H PHE A 2 "<>" O ALA A 92 " d_HA=1.857 d_AD=2.863 a_DHA=168.456 symop: x,y,z a_YAH=154 1418 2007 "HH11 ARG A 91 "<>" OE1 GLU A 130 " d_HA=1.862 d_AD=2.666 a_DHA=132.626 symop: -y,x-y,z a_YAH=172 7112 7200 " H ASN B 213 "<>" O LEU B 209 " d_HA=2.004 d_AD=3.000 a_DHA=168.078 symop: x,y,z a_YAH=148 6148 6224 " H CYS B 148 "<>" O PHE B 144 " d_HA=2.049 d_AD=3.061 a_DHA=175.564 symop: x,y,z a_YAH=170 6168 6240 " H ARG B 149 "<>" O ALA B 145 " d_HA=1.963 d_AD=2.910 a_DHA=154.411 symop: x,y,z a_YAH=142 6115 6170 " H ALA B 145 "<>" O SER B 141 " d_HA=2.499 d_AD=3.442 a_DHA=155.129 symop: x,y,z a_YAH=142 6115 7302 " HG1 THR B 219 "<>" O SER B 141 " d_HA=2.452 d_AD=3.183 a_DHA=132.443 symop: x,y,z a_YAH=93 6126 6186 " H ARG B 146 "<>" O GLY B 142 " d_HA=2.345 d_AD=3.328 a_DHA=162.380 symop: x,y,z a_YAH=142 6341 7117 " H LEU B 209 "<>" O ASP B 156 " d_HA=2.172 d_AD=3.162 a_DHA=164.081 symop: x,y,z a_YAH=133 7102 7164 " H TYR B 211 "<>" O ALA B 208 " d_HA=2.588 d_AD=3.270 a_DHA=125.154 symop: x,y,z a_YAH=109 7102 7181 " H LEU B 212 "<>" O ALA B 208 " d_HA=2.469 d_AD=3.418 a_DHA=155.936 symop: x,y,z a_YAH=155 6101 6139 " H GLU B 143 "<>" O PRO B 140 " d_HA=2.680 d_AD=3.346 a_DHA=123.609 symop: x,y,z a_YAH=92 6101 6156 " H PHE B 144 "<>" O PRO B 140 " d_HA=2.256 d_AD=3.260 a_DHA=169.235 symop: x,y,z a_YAH=162 6367 7082 " H VAL B 158 "<>" O PHE B 207 " d_HA=1.903 d_AD=2.897 a_DHA=167.185 symop: x,y,z a_YAH=152 6363 7090 " H PHE B 207 "<>" O VAL B 158 " d_HA=2.081 d_AD=3.049 a_DHA=159.936 symop: x,y,z a_YAH=134 7068 7841 " H LYS B 254 "<>" O THR B 206 " d_HA=2.009 d_AD=2.991 a_DHA=164.751 symop: x,y,z a_YAH=139 6400 7049 " H ILE B 160 "<>" O LEU B 205 " d_HA=1.959 d_AD=2.941 a_DHA=162.088 symop: x,y,z a_YAH=176 6395 7054 " H LEU B 205 "<>" O ILE B 160 " d_HA=2.052 d_AD=3.017 a_DHA=158.154 symop: x,y,z a_YAH=158 6428 7016 " H CYS B 162 "<>" O VAL B 203 " d_HA=1.873 d_AD=2.831 a_DHA=156.612 symop: x,y,z a_YAH=156 6026 6987 " HG CYS B 135 "<>" O GLU B 201 " d_HA=2.603 d_AD=3.823 a_DHA=149.375 symop: x,y,z a_YAH=152 6425 7020 " H VAL B 203 "<>" O CYS B 162 " d_HA=2.141 d_AD=3.094 a_DHA=156.399 symop: x,y,z a_YAH=138 2515 2534 " H LYS A 164 "<>" OD1 ASP A 165 " d_HA=2.524 d_AD=3.305 a_DHA=133.375 symop: x,y,z a_YAH=148 501 524 " H SER A 33 "<>" OG SER A 31 " d_HA=2.331 d_AD=3.339 a_DHA=174.232 symop: x,y,z a_YAH=122 a_YAH=105 506 974 " HG SER A 31 "<>" O ASP A 63 " d_HA=2.077 d_AD=3.000 a_DHA=157.579 symop: -x+y,-x,z a_YAH=145 1005 558 "HH21 ARG A 64 "<>" OD1 ASN A 36 " d_HA=2.000 d_AD=2.928 a_DHA=150.519 symop: -y,x-y,z a_YAH=153 502 532 " H SER A 31 "<>" O GLY A 34 " d_HA=2.254 d_AD=3.259 a_DHA=170.929 symop: x,y,z a_YAH=156 499 935 " HH TYR A 60 "<>" O SER A 31 " d_HA=1.913 d_AD=2.833 a_DHA=157.817 symop: x,y,z a_YAH=156 510 846 " HG SER A 54 "<>" O SER A 32 " d_HA=1.925 d_AD=2.872 a_DHA=164.941 symop: x,y,z a_YAH=146 839 880 " H PHE A 57 "<>" O SER A 54 " d_HA=2.553 d_AD=3.496 a_DHA=155.814 symop: x,y,z a_YAH=108 480 1029 " H LEU A 66 "<>" O ILE A 30 " d_HA=1.966 d_AD=2.925 a_DHA=156.356 symop: x,y,z a_YAH=152 485 1024 " H ILE A 30 "<>" O LEU A 66 " d_HA=2.060 d_AD=2.992 a_DHA=151.270 symop: x,y,z a_YAH=123 4285 7281 " HZ3 LYS B 217 "<>" OD2 ASP B 21 " d_HA=1.752 d_AD=2.702 a_DHA=151.222 symop: x,y,z a_YAH=159 1856 1870 " H LEU A 121 "<>" OD1 ASP A 120 " d_HA=2.638 d_AD=3.401 a_DHA=131.732 symop: x,y,z a_YAH=110 1409 1531 " H ARG A 91 "<>" O ALA A 100 " d_HA=2.488 d_AD=3.344 a_DHA=142.225 symop: x,y,z a_YAH=156 42 947 " H ARG A 61 "<>" O GLU A 3 " d_HA=2.208 d_AD=2.937 a_DHA=127.384 symop: x,y,z a_YAH=161 59 1382 " H ALA A 4 "<>" O LEU A 90 " d_HA=2.066 d_AD=2.975 a_DHA=147.868 symop: x,y,z a_YAH=171 75 904 " H ARG A 5 "<>" O THR A 59 " d_HA=2.842 d_AD=3.666 a_DHA=139.656 symop: x,y,z a_YAH=97 83 895 " HE ARG A 5 "<>" OD1 ASP A 58 " d_HA=2.691 d_AD=3.505 a_DHA=137.489 symop: x,y,z a_YAH=146 892 911 " HG1 THR A 59 "<>" O ASP A 58 " d_HA=1.568 d_AD=2.540 a_DHA=171.163 symop: x,y,z a_YAH=99 7249 7299 " H THR B 219 "<>" O THR B 216 " d_HA=1.807 d_AD=2.785 a_DHA=162.037 symop: x,y,z a_YAH=118 7295 7345 " H SER B 222 "<>" O THR B 219 " d_HA=2.273 d_AD=3.273 a_DHA=169.074 symop: x,y,z a_YAH=144 1486 1822 " H LEU A 118 "<>" O ASP A 97 " d_HA=2.180 d_AD=3.147 a_DHA=158.864 symop: x,y,z a_YAH=145 1427 22 " H ALA A 92 "<>" O PHE A 2 " d_HA=2.304 d_AD=3.118 a_DHA=137.131 symop: x,y,z a_YAH=125 7131 7217 " H PHE B 214 "<>" O ARG B 210 " d_HA=2.536 d_AD=3.266 a_DHA=128.553 symop: x,y,z a_YAH=142 7155 7217 " H PHE B 214 "<>" O TYR B 211 " d_HA=1.734 d_AD=2.621 a_DHA=143.687 symop: x,y,z a_YAH=127 7155 7237 " H PHE B 215 "<>" O TYR B 211 " d_HA=2.354 d_AD=3.269 a_DHA=149.353 symop: x,y,z a_YAH=145 7176 7237 " H PHE B 215 "<>" O LEU B 212 " d_HA=2.078 d_AD=2.760 a_DHA=122.484 symop: x,y,z a_YAH=114 7176 7253 " H THR B 216 "<>" O LEU B 212 " d_HA=2.225 d_AD=3.197 a_DHA=160.610 symop: x,y,z a_YAH=161 7209 7269 " H LYS B 217 "<>" O PHE B 214 " d_HA=2.105 d_AD=3.076 a_DHA=159.386 symop: x,y,z a_YAH=114 7229 7287 " H ALA B 218 "<>" O PHE B 215 " d_HA=1.895 d_AD=2.854 a_DHA=156.717 symop: x,y,z a_YAH=142 6118 7353 " H SER B 141 "<>" O SER B 223 " d_HA=1.866 d_AD=2.865 a_DHA=165.444 symop: x,y,z a_YAH=128 6122 7342 " HG SER B 141 "<>" O SER B 222 " d_HA=1.768 d_AD=2.740 a_DHA=171.681 symop: x,y,z a_YAH=145 1517 1778 " H LEU A 99 "<>" O MET A 116 " d_HA=2.202 d_AD=3.167 a_DHA=159.779 symop: x,y,z a_YAH=141 1401 1533 " H ALA A 100 "<>" O ARG A 91 " d_HA=2.674 d_AD=3.663 a_DHA=166.972 symop: x,y,z a_YAH=124 1531 1409 " H ARG A 91 "<>" O ALA A 100 " d_HA=2.488 d_AD=3.344 a_DHA=142.225 symop: x,y,z a_YAH=156 6084 7382 " H VAL B 225 "<>" O MET B 139 " d_HA=2.041 d_AD=2.996 a_DHA=155.391 symop: x,y,z a_YAH=162 6089 7378 " H MET B 139 "<>" O VAL B 225 " d_HA=2.017 d_AD=2.983 a_DHA=158.040 symop: x,y,z a_YAH=164 1767 2697 "HD21 ASN A 177 "<>" OE1 GLU A 115 " d_HA=2.734 d_AD=3.638 a_DHA=148.038 symop: -x+y+1,-x+1,z a_YAH=162 6046 7413 " H LEU B 227 "<>" O VAL B 137 " d_HA=1.960 d_AD=2.916 a_DHA=156.125 symop: x,y,z a_YAH=151 6068 6908 " H LYS B 138 "<>" O THR B 196 " d_HA=2.046 d_AD=2.986 a_DHA=152.461 symop: x,y,z a_YAH=144 2832 7821 " HG SER A 186 "<>" O PRO B 253 " d_HA=1.828 d_AD=2.759 a_DHA=159.221 symop: -x+y+1,-x+1,z a_YAH=157 7523 7792 " H LEU B 235 "<>" O LEU B 251 " d_HA=2.215 d_AD=3.069 a_DHA=141.455 symop: x,y,z a_YAH=152 6019 7443 " H MET B 229 "<>" O CYS B 135 " d_HA=2.334 d_AD=3.300 a_DHA=158.279 symop: x,y,z a_YAH=141 6050 7408 " H VAL B 137 "<>" O LEU B 227 " d_HA=2.011 d_AD=2.984 a_DHA=160.292 symop: x,y,z a_YAH=161 6030 6947 " H GLU B 198 "<>" O VAL B 136 " d_HA=2.352 d_AD=3.341 a_DHA=166.457 symop: x,y,z a_YAH=138 2615 2712 " HG SER A 170 "<>" OD1 ASN A 179 " d_HA=2.119 d_AD=3.055 a_DHA=162.698 symop: x,y,z a_YAH=150 2543 2760 " HZ3 LYS A 181 "<>" O GLY A 166 " d_HA=2.375 d_AD=3.203 a_DHA=137.980 symop: x,y,z a_YAH=113 6008 6978 " H ASN B 200 "<>" O SER B 134 " d_HA=2.262 d_AD=2.951 a_DHA=124.050 symop: x,y,z a_YAH=172 6008 6993 " H GLU B 201 "<>" O SER B 134 " d_HA=2.679 d_AD=3.646 a_DHA=160.211 symop: x,y,z a_YAH=107 6022 7438 " H CYS B 135 "<>" O MET B 229 " d_HA=1.994 d_AD=3.000 a_DHA=169.330 symop: x,y,z a_YAH=174 2484 3099 " HG SER A 161 "<>" OE1 GLN A 204 " d_HA=2.534 d_AD=3.425 a_DHA=153.043 symop: x,y,z a_YAH=123 2488 3083 " H VAL A 203 "<>" O CYS A 162 " d_HA=2.717 d_AD=3.507 a_DHA=135.609 symop: x,y,z a_YAH=106 2491 3079 " H CYS A 162 "<>" O VAL A 203 " d_HA=2.098 d_AD=2.836 a_DHA=128.113 symop: x,y,z a_YAH=136 558 1005 "HH21 ARG A 64 "<>" OD1 ASN A 36 " d_HA=2.000 d_AD=2.928 a_DHA=150.519 symop: -x+y,-x,z a_YAH=153 539 801 " H LEU A 52 "<>" O VAL A 35 " d_HA=1.899 d_AD=2.891 a_DHA=163.803 symop: x,y,z a_YAH=153 521 842 " H SER A 54 "<>" O SER A 33 " d_HA=1.784 d_AD=2.792 a_DHA=171.747 symop: x,y,z a_YAH=133 543 796 " H VAL A 35 "<>" O LEU A 52 " d_HA=1.918 d_AD=2.821 a_DHA=146.596 symop: x,y,z a_YAH=156 815 866 " H GLY A 56 "<>" O ARG A 53 " d_HA=1.938 d_AD=2.920 a_DHA=161.831 symop: x,y,z a_YAH=119 1865 1900 " H VAL A 123 "<>" O LEU A 121 " d_HA=1.981 d_AD=2.840 a_DHA=140.485 symop: x,y,z a_YAH=109 440 471 " HG CYS A 27 "<>" OD1 ASP A 29 " d_HA=1.833 d_AD=3.094 a_DHA=151.826 symop: x,y,z a_YAH=166 444 1058 " H MET A 68 "<>" O TRP A 28 " d_HA=2.036 d_AD=3.037 a_DHA=167.936 symop: x,y,z a_YAH=144 468 1006 "HH22 ARG A 64 "<>" O ASP A 29 " d_HA=2.576 d_AD=3.375 a_DHA=136.133 symop: -x+y,-x,z a_YAH=94 468 560 " H ASN A 36 "<>" O ASP A 29 " d_HA=2.090 d_AD=3.083 a_DHA=164.302 symop: x,y,z a_YAH=133 473 555 " H ASP A 29 "<>" O ASN A 36 " d_HA=2.067 d_AD=2.917 a_DHA=140.093 symop: x,y,z a_YAH=127 872 927 " H TYR A 60 "<>" O PHE A 57 " d_HA=2.914 d_AD=3.611 a_DHA=127.047 symop: x,y,z a_YAH=134 4276 4284 " HZ2 LYS B 20 "<>" OD1 ASP B 21 " d_HA=1.951 d_AD=2.870 a_DHA=147.151 symop: x,y,z a_YAH=117 4176 7309 " HZ3 LYS B 14 "<>" O PRO B 220 " d_HA=2.061 d_AD=3.029 a_DHA=156.745 symop: x,y,z a_YAH=139 423 1081 " H VAL A 70 "<>" O ALA A 26 " d_HA=1.899 d_AD=2.873 a_DHA=159.176 symop: x,y,z a_YAH=168 455 1053 " H TRP A 28 "<>" O MET A 68 " d_HA=2.054 d_AD=3.030 a_DHA=161.113 symop: x,y,z a_YAH=119 57 1387 " H LEU A 90 "<>" O ALA A 4 " d_HA=1.889 d_AD=2.839 a_DHA=155.327 symop: x,y,z a_YAH=155 96 1349 " H LEU A 6 "<>" O ILE A 88 " d_HA=1.730 d_AD=2.733 a_DHA=170.386 symop: x,y,z a_YAH=173 7285 7328 " H LEU B 221 "<>" O ALA B 218 " d_HA=2.047 d_AD=3.040 a_DHA=164.664 symop: x,y,z a_YAH=133 1070 1841 " H MET A 119 "<>" O GLY A 69 " d_HA=1.936 d_AD=2.822 a_DHA=143.964 symop: x,y,z a_YAH=148 1368 1564 " H VAL A 102 "<>" O THR A 89 " d_HA=1.853 d_AD=2.862 a_DHA=174.673 symop: x,y,z a_YAH=162 1372 1560 " H THR A 89 "<>" O VAL A 102 " d_HA=2.023 d_AD=2.956 a_DHA=151.921 symop: x,y,z a_YAH=140 1330 1375 " HG1 THR A 89 "<>" O ILE A 87 " d_HA=2.967 d_AD=3.785 a_DHA=143.186 symop: x,y,z a_YAH=114 1330 1602 " H GLU A 104 "<>" O ILE A 87 " d_HA=2.178 d_AD=3.162 a_DHA=162.504 symop: x,y,z a_YAH=124 86 895 "HH21 ARG A 5 "<>" OD1 ASP A 58 " d_HA=1.839 d_AD=2.866 a_DHA=175.501 symop: x,y,z a_YAH=139 7349 7605 " HG SER B 222 "<>" O LYS B 240 " d_HA=1.761 d_AD=2.711 a_DHA=163.513 symop: x,y,z a_YAH=124 1512 1783 " H MET A 116 "<>" O LEU A 99 " d_HA=1.939 d_AD=2.950 a_DHA=174.253 symop: x,y,z a_YAH=140 1546 1742 " H LEU A 101 "<>" O TYR A 114 " d_HA=1.944 d_AD=2.925 a_DHA=161.286 symop: x,y,z a_YAH=125 1541 1751 " H TYR A 114 "<>" O LEU A 101 " d_HA=1.858 d_AD=2.867 a_DHA=178.086 symop: x,y,z a_YAH=158 1576 1722 " H SER A 112 "<>" O PHE A 103 " d_HA=2.296 d_AD=3.101 a_DHA=135.371 symop: x,y,z a_YAH=136 1576 1726 " HG SER A 112 "<>" O PHE A 103 " d_HA=2.481 d_AD=3.368 a_DHA=152.313 symop: x,y,z a_YAH=144 1584 1719 " H PHE A 103 "<>" O SER A 112 " d_HA=1.814 d_AD=2.828 a_DHA=178.898 symop: x,y,z a_YAH=160 4574 4596 " H SER B 43 "<>" OD2 ASP B 41 " d_HA=2.396 d_AD=3.248 a_DHA=141.430 symop: x,y,z a_YAH=112 4574 7172 " HH TYR B 211 "<>" OD2 ASP B 41 " d_HA=1.760 d_AD=2.735 a_DHA=168.901 symop: x,y,z a_YAH=144 4573 4625 " H VAL B 45 "<>" OD1 ASP B 41 " d_HA=2.388 d_AD=3.092 a_DHA=125.974 symop: x,y,z a_YAH=113 4573 4640 " H SER B 46 "<>" OD1 ASP B 41 " d_HA=1.916 d_AD=2.875 a_DHA=154.971 symop: x,y,z a_YAH=170 4573 4644 " HG SER B 46 "<>" OD1 ASP B 41 " d_HA=2.219 d_AD=3.182 a_DHA=168.301 symop: x,y,z a_YAH=110 7553 7759 " H TYR B 249 "<>" O VAL B 237 " d_HA=1.898 d_AD=2.898 a_DHA=166.829 symop: x,y,z a_YAH=165 7398 7569 " H THR B 226 "<>" O GLU B 238 " d_HA=1.959 d_AD=2.963 a_DHA=168.341 symop: x,y,z a_YAH=143 7593 7709 " H TYR B 239 "<>" O LEU B 247 " d_HA=2.081 d_AD=3.045 a_DHA=158.233 symop: x,y,z a_YAH=159 2640 2682 " H GLY A 176 "<>" O GLY A 173 " d_HA=2.015 d_AD=3.031 a_DHA=176.588 symop: x,y,z a_YAH=148 1763 2693 " H ASN A 177 "<>" O GLU A 115 " d_HA=1.901 d_AD=2.880 a_DHA=159.816 symop: -x+y+1,-x+1,z a_YAH=159 1769 2688 " H GLU A 115 "<>" O ASN A 177 " d_HA=2.038 d_AD=3.011 a_DHA=161.512 symop: -x+y+1,-x+1,z a_YAH=157 1730 2714 " H ASN A 179 "<>" O ASP A 113 " d_HA=2.216 d_AD=3.219 a_DHA=170.138 symop: -x+y+1,-x+1,z a_YAH=133 1751 1541 " H TYR A 114 "<>" O LEU A 101 " d_HA=1.858 d_AD=2.867 a_DHA=178.086 symop: x,y,z a_YAH=158 1735 2709 " H ASP A 113 "<>" O ASN A 179 " d_HA=2.056 d_AD=3.005 a_DHA=155.371 symop: -x+y+1,-x+1,z a_YAH=146 1703 2748 " H LYS A 181 "<>" O VAL A 111 " d_HA=1.886 d_AD=2.781 a_DHA=145.171 symop: -x+y+1,-x+1,z a_YAH=160 1707 2742 " H VAL A 111 "<>" O LYS A 181 " d_HA=2.028 d_AD=3.008 a_DHA=161.659 symop: -x+y+1,-x+1,z a_YAH=166 1635 2818 " HG1 THR A 185 "<>" O ASN A 107 " d_HA=2.219 d_AD=3.184 a_DHA=173.604 symop: -x+y+1,-x+1,z a_YAH=155 4621 7813 " H ALA B 252 "<>" O VAL B 45 " d_HA=2.013 d_AD=3.026 a_DHA=176.790 symop: x,y,z a_YAH=169 7518 7797 " H LEU B 251 "<>" O LEU B 235 " d_HA=1.752 d_AD=2.729 a_DHA=161.007 symop: x,y,z a_YAH=153 7430 7537 " H SER B 228 "<>" O VAL B 236 " d_HA=1.868 d_AD=2.869 a_DHA=168.228 symop: x,y,z a_YAH=157 7557 7750 " H VAL B 237 "<>" O TYR B 249 " d_HA=1.834 d_AD=2.845 a_DHA=172.344 symop: x,y,z a_YAH=164 7394 7575 " H GLU B 238 "<>" O THR B 226 " d_HA=1.801 d_AD=2.772 a_DHA=159.047 symop: x,y,z a_YAH=151 7401 7573 " HG1 THR B 226 "<>" OE1 GLU B 238 " d_HA=2.927 d_AD=3.599 a_DHA=127.619 symop: x,y,z a_YAH=113 2641 2681 " H GLY A 173 "<>" O GLY A 176 " d_HA=2.522 d_AD=3.527 a_DHA=171.544 symop: x,y,z a_YAH=150 2619 2703 " H GLY A 178 "<>" O ALA A 171 " d_HA=1.970 d_AD=2.918 a_DHA=153.342 symop: x,y,z a_YAH=170 2621 2702 " H ALA A 171 "<>" O GLY A 178 " d_HA=2.019 d_AD=2.983 a_DHA=157.645 symop: x,y,z a_YAH=165 2596 2723 " H PHE A 169 "<>" O ILE A 180 " d_HA=2.393 d_AD=3.348 a_DHA=158.735 symop: x,y,z a_YAH=114 1666 2786 " H SER A 183 "<>" O GLU A 109 " d_HA=2.370 d_AD=3.257 a_DHA=145.223 symop: -x+y+1,-x+1,z a_YAH=136 7427 7541 " H VAL B 236 "<>" O SER B 228 " d_HA=1.859 d_AD=2.855 a_DHA=166.693 symop: x,y,z a_YAH=160 2446 2608 " H VAL A 159 "<>" O SER A 170 " d_HA=2.350 d_AD=3.306 a_DHA=157.136 symop: x,y,z a_YAH=135 2588 2728 " H ILE A 180 "<>" O PHE A 169 " d_HA=2.093 d_AD=3.048 a_DHA=156.012 symop: x,y,z a_YAH=137 2477 2572 " H LYS A 168 "<>" O SER A 161 " d_HA=2.058 d_AD=3.067 a_DHA=170.570 symop: x,y,z a_YAH=148 2550 2769 " H LEU A 182 "<>" O VAL A 167 " d_HA=2.000 d_AD=2.978 a_DHA=162.095 symop: x,y,z a_YAH=166 2554 2764 " H VAL A 167 "<>" O LEU A 182 " d_HA=2.598 d_AD=3.269 a_DHA=123.738 symop: x,y,z a_YAH=135 6011 7457 " H SER B 134 "<>" OG SER B 230 " d_HA=2.140 d_AD=3.131 a_DHA=165.176 symop: x,y,z a_YAH=106 a_YAH=106 2442 2611 " H SER A 170 "<>" O VAL A 159 " d_HA=1.997 d_AD=2.964 a_DHA=158.653 symop: x,y,z a_YAH=139 2442 2480 " H SER A 161 "<>" O VAL A 159 " d_HA=2.929 d_AD=3.548 a_DHA=120.007 symop: x,y,z a_YAH=96 2480 2566 " H SER A 161 "<>" O LYS A 168 " d_HA=2.117 d_AD=3.009 a_DHA=145.368 symop: x,y,z a_YAH=167 5116 5182 " H LYS B 80 "<>" O LYS B 77 " d_HA=2.224 d_AD=3.160 a_DHA=152.023 symop: x,y,z a_YAH=107 5176 6196 "HH12 ARG B 146 "<>" O LYS B 80 " d_HA=2.133 d_AD=2.979 a_DHA=140.588 symop: -x+y+1,-x+2,z a_YAH=120 5209 6198 "HH22 ARG B 146 "<>" O ALA B 82 " d_HA=2.218 d_AD=3.215 a_DHA=167.828 symop: -x+y+1,-x+2,z a_YAH=100 608 730 " H SER A 39 "<>" O VAL A 48 " d_HA=2.482 d_AD=3.394 a_DHA=149.987 symop: x,y,z a_YAH=137 569 768 " H LEU A 50 "<>" O LEU A 37 " d_HA=2.170 d_AD=3.043 a_DHA=143.164 symop: x,y,z a_YAH=130 782 3762 " H HIS A 246 "<>" O THR A 51 " d_HA=2.129 d_AD=3.002 a_DHA=143.243 symop: x,y,z a_YAH=145 786 3755 " H THR A 51 "<>" O HIS A 246 " d_HA=2.151 d_AD=3.157 a_DHA=168.869 symop: x,y,z a_YAH=163 823 3731 " H ARG A 53 "<>" O MET A 244 " d_HA=1.624 d_AD=2.609 a_DHA=166.025 symop: x,y,z a_YAH=152 5063 5133 " HZ2 LYS B 77 "<>" O THR B 73 " d_HA=2.995 d_AD=3.988 a_DHA=166.115 symop: x,y,z a_YAH=102 5063 5122 " H LYS B 77 "<>" O THR B 73 " d_HA=2.523 d_AD=3.430 a_DHA=148.066 symop: x,y,z a_YAH=136 5063 5112 " HG SER B 76 "<>" O THR B 73 " d_HA=2.143 d_AD=2.834 a_DHA=127.031 symop: x,y,z a_YAH=101 4153 5157 " HZ2 LYS B 13 "<>" O LEU B 79 " d_HA=2.216 d_AD=3.116 a_DHA=146.878 symop: x,y,z a_YAH=162 4154 5209 " HZ3 LYS B 13 "<>" O ALA B 82 " d_HA=1.736 d_AD=2.723 a_DHA=162.896 symop: x,y,z a_YAH=144 4090 5226 " H SER B 10 "<>" O ASN B 84 " d_HA=2.209 d_AD=2.995 a_DHA=132.584 symop: x,y,z a_YAH=159 574 763 " H LEU A 37 "<>" O LEU A 50 " d_HA=1.865 d_AD=2.750 a_DHA=143.556 symop: x,y,z a_YAH=145 5044 5112 " HG SER B 76 "<>" O LEU B 72 " d_HA=2.607 d_AD=3.381 a_DHA=137.008 symop: x,y,z a_YAH=132 5044 5108 " H SER B 76 "<>" O LEU B 72 " d_HA=2.097 d_AD=3.099 a_DHA=172.189 symop: x,y,z a_YAH=149 4117 4201 " H LEU B 16 "<>" O LEU B 12 " d_HA=2.290 d_AD=3.184 a_DHA=146.665 symop: x,y,z a_YAH=141 4136 4221 " H GLU B 17 "<>" O LYS B 13 " d_HA=2.317 d_AD=3.086 a_DHA=132.069 symop: x,y,z a_YAH=137 4087 4164 " H LYS B 14 "<>" O SER B 10 " d_HA=2.325 d_AD=3.227 a_DHA=147.711 symop: x,y,z a_YAH=146 4098 4164 " H LYS B 14 "<>" O ILE B 11 " d_HA=2.360 d_AD=3.002 a_DHA=120.284 symop: x,y,z a_YAH=96 4098 4184 " H VAL B 15 "<>" O ILE B 11 " d_HA=1.958 d_AD=2.923 a_DHA=157.523 symop: x,y,z a_YAH=157 408 612 " HG SER A 39 "<>" O GLU A 25 " d_HA=2.506 d_AD=3.455 a_DHA=167.205 symop: x,y,z a_YAH=151 425 1077 " H ALA A 26 "<>" O VAL A 70 " d_HA=2.327 d_AD=3.264 a_DHA=153.544 symop: x,y,z a_YAH=128 91 1354 " H ILE A 88 "<>" O LEU A 6 " d_HA=2.324 d_AD=3.201 a_DHA=144.746 symop: x,y,z a_YAH=157 126 166 " H ILE A 11 "<>" O GLN A 8 " d_HA=2.627 d_AD=3.580 a_DHA=157.346 symop: x,y,z a_YAH=107 4240 4298 " H LEU B 22 "<>" O LEU B 19 " d_HA=2.151 d_AD=3.135 a_DHA=163.803 symop: x,y,z a_YAH=128 4240 4317 " H ILE B 23 "<>" O LEU B 19 " d_HA=2.400 d_AD=3.399 a_DHA=170.715 symop: x,y,z a_YAH=168 4158 4232 " H ALA B 18 "<>" O LYS B 14 " d_HA=2.638 d_AD=3.387 a_DHA=130.960 symop: x,y,z a_YAH=128 4180 4245 " H LEU B 19 "<>" O VAL B 15 " d_HA=2.479 d_AD=3.431 a_DHA=157.374 symop: x,y,z a_YAH=139 1093 1156 " H MET A 75 "<>" O ASN A 71 " d_HA=1.881 d_AD=2.890 a_DHA=170.577 symop: x,y,z a_YAH=160 1096 1143 " H SER A 74 "<>" OD1 ASN A 71 " d_HA=1.945 d_AD=2.939 a_DHA=165.792 symop: x,y,z a_YAH=116 7584 7714 " H LEU B 247 "<>" O TYR B 239 " d_HA=1.845 d_AD=2.781 a_DHA=151.543 symop: x,y,z a_YAH=150 7627 7686 " H GLY B 245 "<>" O ILE B 241 " d_HA=2.000 d_AD=2.938 a_DHA=151.618 symop: x,y,z a_YAH=160 7632 7685 " H ILE B 241 "<>" O GLY B 245 " d_HA=2.000 d_AD=2.799 a_DHA=134.837 symop: x,y,z a_YAH=113 7646 7673 " H MET B 244 "<>" O ALA B 242 " d_HA=2.135 d_AD=3.064 a_DHA=151.385 symop: x,y,z a_YAH=98 1140 1206 " H ILE A 78 "<>" O SER A 74 " d_HA=2.183 d_AD=3.158 a_DHA=160.129 symop: x,y,z a_YAH=156 1140 1185 " H LYS A 77 "<>" O SER A 74 " d_HA=2.034 d_AD=2.837 a_DHA=133.889 symop: x,y,z a_YAH=112 1151 1225 " H LEU A 79 "<>" O MET A 75 " d_HA=1.966 d_AD=2.956 a_DHA=164.866 symop: x,y,z a_YAH=147 1322 1697 " HZ1 LYS A 110 "<>" OD2 ASP A 86 " d_HA=1.842 d_AD=2.824 a_DHA=159.110 symop: x,y,z a_YAH=123 1335 1596 " H ILE A 87 "<>" O GLU A 104 " d_HA=1.834 d_AD=2.840 a_DHA=170.836 symop: x,y,z a_YAH=139 1611 1655 " H GLN A 108 "<>" O ALA A 105 " d_HA=2.070 d_AD=2.925 a_DHA=141.320 symop: x,y,z a_YAH=114 1613 1681 " H ALA A 105 "<>" O LYS A 110 " d_HA=2.103 d_AD=3.105 a_DHA=170.671 symop: x,y,z a_YAH=173 4570 4611 " H HIS B 44 "<>" O ASP B 41 " d_HA=2.351 d_AD=3.295 a_DHA=154.430 symop: x,y,z a_YAH=121 4542 4671 " H VAL B 48 "<>" O SER B 39 " d_HA=2.062 d_AD=3.052 a_DHA=164.566 symop: x,y,z a_YAH=139 4575 4637 " H ASP B 41 "<>" O SER B 46 " d_HA=2.366 d_AD=3.194 a_DHA=138.401 symop: x,y,z a_YAH=160 4648 7780 " H TYR B 250 "<>" O LEU B 47 " d_HA=1.743 d_AD=2.734 a_DHA=165.991 symop: x,y,z a_YAH=148 4653 7771 " H LEU B 47 "<>" O TYR B 250 " d_HA=2.234 d_AD=3.196 a_DHA=158.393 symop: x,y,z a_YAH=129 4683 7734 " H LYS B 248 "<>" O GLN B 49 " d_HA=1.911 d_AD=2.912 a_DHA=171.014 symop: x,y,z a_YAH=156 4689 7728 " H GLN B 49 "<>" O LYS B 248 " d_HA=1.738 d_AD=2.676 a_DHA=152.539 symop: x,y,z a_YAH=168 1201 1264 " H CYS A 81 "<>" O ILE A 78 " d_HA=1.821 d_AD=2.774 a_DHA=155.490 symop: x,y,z a_YAH=122 1638 1672 " H GLU A 109 "<>" OD1 ASN A 107 " d_HA=2.511 d_AD=3.495 a_DHA=164.737 symop: x,y,z a_YAH=96 2854 4604 " H VAL A 188 "<>" O HIS B 44 " d_HA=2.250 d_AD=3.204 a_DHA=156.003 symop: -x+y+1,-x+1,z a_YAH=177 7746 7779 " HZ3 LYS B 248 "<>" OH TYR B 250 " d_HA=2.606 d_AD=3.480 a_DHA=144.141 symop: x,y,z a_YAH=127 a_YAH=107 2331 2398 " H GLY A 155 "<>" O LEU A 151 " d_HA=2.270 d_AD=3.169 a_DHA=147.531 symop: x,y,z a_YAH=153 2331 2383 " H ILE A 154 "<>" O LEU A 151 " d_HA=2.011 d_AD=2.970 a_DHA=157.186 symop: x,y,z a_YAH=117 1670 2815 " H THR A 185 "<>" OE1 GLU A 109 " d_HA=2.893 d_AD=3.805 a_DHA=149.889 symop: -x+y+1,-x+1,z a_YAH=134 2845 2869 "HD21 ASN A 187 "<>" OD1 ASP A 189 " d_HA=2.132 d_AD=2.958 a_DHA=136.980 symop: x,y,z a_YAH=91 5967 5926 "HE21 GLN B 131 "<>" O PRO B 129 " d_HA=1.864 d_AD=2.839 a_DHA=158.769 symop: x,y,z a_YAH=157 3797 746 " H LYS A 248 "<>" O GLN A 49 " d_HA=2.245 d_AD=3.248 a_DHA=172.157 symop: x,y,z a_YAH=131 5138 5201 " H CYS B 81 "<>" O ILE B 78 " d_HA=1.881 d_AD=2.830 a_DHA=154.595 symop: x,y,z a_YAH=127 5272 5533 " H ILE B 87 "<>" O GLU B 104 " d_HA=1.758 d_AD=2.770 a_DHA=174.709 symop: x,y,z a_YAH=147 633 674 " H HIS A 44 "<>" O ASP A 41 " d_HA=2.307 d_AD=3.244 a_DHA=153.502 symop: x,y,z a_YAH=126 605 734 " H VAL A 48 "<>" O SER A 39 " d_HA=2.066 d_AD=3.058 a_DHA=165.572 symop: x,y,z a_YAH=159 746 3797 " H LYS A 248 "<>" O GLN A 49 " d_HA=2.245 d_AD=3.248 a_DHA=172.157 symop: x,y,z a_YAH=131 752 3791 " H GLN A 49 "<>" O LYS A 248 " d_HA=1.812 d_AD=2.767 a_DHA=155.082 symop: x,y,z a_YAH=156 3690 3749 " H GLY A 245 "<>" O ILE A 241 " d_HA=2.043 d_AD=2.995 a_DHA=154.437 symop: x,y,z a_YAH=158 3695 3748 " H ILE A 241 "<>" O GLY A 245 " d_HA=1.807 d_AD=2.702 a_DHA=146.325 symop: x,y,z a_YAH=120 3709 3736 " H MET A 244 "<>" O ALA A 242 " d_HA=2.242 d_AD=3.008 a_DHA=131.110 symop: x,y,z a_YAH=107 5077 5122 " H LYS B 77 "<>" O SER B 74 " d_HA=1.969 d_AD=2.689 a_DHA=125.246 symop: x,y,z a_YAH=119 5077 5143 " H ILE B 78 "<>" O SER B 74 " d_HA=2.397 d_AD=3.354 a_DHA=157.112 symop: x,y,z a_YAH=152 5088 5162 " H LEU B 79 "<>" O MET B 75 " d_HA=1.890 d_AD=2.891 a_DHA=168.891 symop: x,y,z a_YAH=150 161 247 " H VAL A 15 "<>" O ILE A 11 " d_HA=1.836 d_AD=2.810 a_DHA=159.055 symop: x,y,z a_YAH=153 5030 5080 " H SER B 74 "<>" O ASN B 71 " d_HA=2.290 d_AD=3.051 a_DHA=130.804 symop: x,y,z a_YAH=102 5030 5093 " H MET B 75 "<>" O ASN B 71 " d_HA=1.944 d_AD=2.944 a_DHA=165.727 symop: x,y,z a_YAH=166 5033 5067 " H THR B 73 "<>" OD1 ASN B 71 " d_HA=1.904 d_AD=2.728 a_DHA=135.829 symop: x,y,z a_YAH=165 5033 5080 " H SER B 74 "<>" OD1 ASN B 71 " d_HA=2.112 d_AD=2.986 a_DHA=143.007 symop: x,y,z a_YAH=109 4080 4142 " H LYS B 13 "<>" O GLY B 9 " d_HA=2.637 d_AD=3.586 a_DHA=156.264 symop: x,y,z a_YAH=140 4080 4122 " H LEU B 12 "<>" O GLY B 9 " d_HA=1.924 d_AD=2.794 a_DHA=141.444 symop: x,y,z a_YAH=130 4063 4103 " H ILE B 11 "<>" O GLN B 8 " d_HA=2.636 d_AD=3.484 a_DHA=141.677 symop: x,y,z a_YAH=102 394 1112 " H LEU A 72 "<>" O ASN A 24 " d_HA=2.727 d_AD=3.602 a_DHA=145.214 symop: x,y,z a_YAH=91 243 308 " H LEU A 19 "<>" O VAL A 15 " d_HA=2.994 d_AD=3.737 a_DHA=131.517 symop: x,y,z a_YAH=125 180 264 " H LEU A 16 "<>" O LEU A 12 " d_HA=2.451 d_AD=3.276 a_DHA=138.662 symop: x,y,z a_YAH=144 199 264 " H LEU A 16 "<>" O LYS A 13 " d_HA=2.275 d_AD=3.064 a_DHA=134.318 symop: x,y,z a_YAH=99 199 284 " H GLU A 17 "<>" O LYS A 13 " d_HA=2.218 d_AD=3.026 a_DHA=136.084 symop: x,y,z a_YAH=147 143 185 " H LEU A 12 "<>" O GLY A 9 " d_HA=1.996 d_AD=2.894 a_DHA=145.937 symop: x,y,z a_YAH=129 143 205 " H LYS A 13 "<>" O GLY A 9 " d_HA=2.527 d_AD=3.499 a_DHA=160.128 symop: x,y,z a_YAH=143 150 227 " H LYS A 14 "<>" O SER A 10 " d_HA=2.267 d_AD=3.204 a_DHA=153.535 symop: x,y,z a_YAH=138 4331 5049 " H LEU B 72 "<>" O ASN B 24 " d_HA=2.465 d_AD=3.318 a_DHA=141.338 symop: x,y,z a_YAH=112 4345 4549 " HG SER B 39 "<>" O GLU B 25 " d_HA=2.877 d_AD=3.812 a_DHA=163.646 symop: x,y,z a_YAH=133 4362 5014 " H ALA B 26 "<>" O VAL B 70 " d_HA=2.520 d_AD=3.402 a_DHA=144.972 symop: x,y,z a_YAH=132 1107 1171 " H SER A 76 "<>" O LEU A 72 " d_HA=1.835 d_AD=2.845 a_DHA=175.373 symop: x,y,z a_YAH=162 259 328 " H LYS A 20 "<>" O LEU A 16 " d_HA=2.787 d_AD=3.713 a_DHA=152.918 symop: x,y,z a_YAH=128 1220 1274 " H ALA A 82 "<>" O LEU A 79 " d_HA=2.982 d_AD=3.710 a_DHA=130.506 symop: x,y,z a_YAH=96 216 1220 " HZ2 LYS A 13 "<>" O LEU A 79 " d_HA=2.287 d_AD=3.209 a_DHA=150.596 symop: x,y,z a_YAH=155 217 1272 " HZ3 LYS A 13 "<>" O ALA A 82 " d_HA=1.800 d_AD=2.813 a_DHA=171.817 symop: x,y,z a_YAH=145 153 1289 " H SER A 10 "<>" O ASN A 84 " d_HA=2.299 d_AD=3.015 a_DHA=126.251 symop: x,y,z a_YAH=163 4511 4700 " H LEU B 37 "<>" O LEU B 50 " d_HA=2.023 d_AD=2.890 a_DHA=141.473 symop: x,y,z a_YAH=136 4719 7699 " H HIS B 246 "<>" O THR B 51 " d_HA=1.988 d_AD=2.951 a_DHA=157.624 symop: x,y,z a_YAH=154 4723 7692 " H THR B 51 "<>" O HIS B 246 " d_HA=2.182 d_AD=3.178 a_DHA=166.352 symop: x,y,z a_YAH=156 1126 1175 " HG SER A 76 "<>" O THR A 73 " d_HA=1.834 d_AD=2.786 a_DHA=164.980 symop: x,y,z a_YAH=125 1126 1185 " H LYS A 77 "<>" O THR A 73 " d_HA=2.293 d_AD=3.093 a_DHA=134.499 symop: x,y,z a_YAH=147 1168 1245 " H LYS A 80 "<>" O SER A 76 " d_HA=2.213 d_AD=2.968 a_DHA=129.585 symop: x,y,z a_YAH=138 1239 2259 "HH12 ARG A 146 "<>" O LYS A 80 " d_HA=2.129 d_AD=3.031 a_DHA=148.575 symop: -x+y+1,-x+1,z a_YAH=127 2258 2323 "HH11 ARG A 146 "<>" OD2 ASP A 150 " d_HA=1.637 d_AD=2.653 a_DHA=170.022 symop: x,y,z a_YAH=119 1272 2261 "HH22 ARG A 146 "<>" O ALA A 82 " d_HA=2.005 d_AD=2.958 a_DHA=155.839 symop: -x+y+1,-x+1,z a_YAH=101 1294 1308 " H ASN A 84 "<>" OE2 GLU A 85 " d_HA=2.664 d_AD=3.342 a_DHA=124.440 symop: x,y,z a_YAH=125 4617 5853 " HE2 HIS B 44 "<>" OE1 GLU B 124 " d_HA=2.329 d_AD=3.299 a_DHA=158.002 symop: x,y,z a_YAH=148 4506 4705 " H LEU B 50 "<>" O LEU B 37 " d_HA=1.923 d_AD=2.918 a_DHA=164.684 symop: x,y,z a_YAH=137 4545 4667 " H SER B 39 "<>" O VAL B 48 " d_HA=2.331 d_AD=3.279 a_DHA=156.204 symop: x,y,z a_YAH=135 4687 4726 " HG1 THR B 51 "<>" OE1 GLN B 49 " d_HA=1.958 d_AD=2.861 a_DHA=153.439 symop: x,y,z a_YAH=151 4696 7698 "HE22 GLN B 49 "<>" NE2 HIS B 246 " d_HA=2.012 d_AD=2.876 a_DHA=141.452 symop: x,y,z a_YAH=151 a_YAH=102 4769 7656 "HH11 ARG B 53 "<>" O ASP B 243 " d_HA=1.996 d_AD=2.776 a_DHA=131.150 symop: x,y,z a_YAH=150 1179 1245 " H LYS A 80 "<>" O LYS A 77 " d_HA=2.339 d_AD=3.209 a_DHA=142.595 symop: x,y,z a_YAH=104 2894 5854 " HZ1 LYS A 190 "<>" OE2 GLU B 124 " d_HA=1.843 d_AD=2.800 a_DHA=152.991 symop: -x+y+1,-x+1,z a_YAH=130 5881 5912 " H ILE B 128 "<>" O LEU B 126 " d_HA=2.160 d_AD=2.860 a_DHA=124.635 symop: x,y,z a_YAH=104 2319 2368 " H HIS A 153 "<>" O ASP A 150 " d_HA=1.938 d_AD=2.924 a_DHA=163.588 symop: x,y,z a_YAH=129 2241 2324 " H ASP A 150 "<>" O ARG A 146 " d_HA=2.097 d_AD=2.978 a_DHA=143.825 symop: x,y,z a_YAH=153 2196 2270 " H ILE A 147 "<>" O GLU A 143 " d_HA=1.901 d_AD=2.889 a_DHA=164.194 symop: x,y,z a_YAH=157 2196 2249 " H ARG A 146 "<>" O GLU A 143 " d_HA=2.288 d_AD=2.998 a_DHA=125.740 symop: x,y,z a_YAH=115 2284 2353 " H SER A 152 "<>" O CYS A 148 " d_HA=2.172 d_AD=3.063 a_DHA=146.245 symop: x,y,z a_YAH=141 2284 2357 " HG SER A 152 "<>" O CYS A 148 " d_HA=1.903 d_AD=2.830 a_DHA=158.189 symop: x,y,z a_YAH=147 2352 3267 "HD21 ASN A 213 "<>" OG SER A 152 " d_HA=1.988 d_AD=2.891 a_DHA=147.434 symop: x,y,z a_YAH=145 a_YAH=100 2265 2324 " H ASP A 150 "<>" O ILE A 147 " d_HA=2.335 d_AD=3.102 a_DHA=131.402 symop: x,y,z a_YAH=105 2265 2336 " H LEU A 151 "<>" O ILE A 147 " d_HA=2.005 d_AD=3.020 a_DHA=178.554 symop: x,y,z a_YAH=168 2303 2231 " H ARG A 149 "<>" O ALA A 145 " d_HA=2.161 d_AD=3.089 a_DHA=151.340 symop: x,y,z a_YAH=135 3656 3772 " H TYR A 239 "<>" O LEU A 247 " d_HA=1.924 d_AD=2.938 a_DHA=177.371 symop: x,y,z a_YAH=151 5700 6630 " H ASN B 177 "<>" O GLU B 115 " d_HA=1.973 d_AD=2.941 a_DHA=157.471 symop: -x+y+1,-x+2,z a_YAH=146 5478 5688 " H TYR B 114 "<>" O LEU B 101 " d_HA=1.892 d_AD=2.853 a_DHA=157.568 symop: x,y,z a_YAH=140 5521 5656 " H PHE B 103 "<>" O SER B 112 " d_HA=1.966 d_AD=2.920 a_DHA=156.678 symop: x,y,z a_YAH=156 637 659 " H SER A 43 "<>" OD2 ASP A 41 " d_HA=2.619 d_AD=3.463 a_DHA=141.618 symop: x,y,z a_YAH=97 637 663 " HG SER A 43 "<>" OD2 ASP A 41 " d_HA=1.710 d_AD=2.621 a_DHA=153.245 symop: x,y,z a_YAH=111 637 3235 " HH TYR A 211 "<>" OD2 ASP A 41 " d_HA=1.876 d_AD=2.849 a_DHA=171.058 symop: x,y,z a_YAH=144 636 688 " H VAL A 45 "<>" OD1 ASP A 41 " d_HA=2.385 d_AD=3.220 a_DHA=139.011 symop: x,y,z a_YAH=131 636 703 " H SER A 46 "<>" OD1 ASP A 41 " d_HA=2.520 d_AD=3.454 a_DHA=152.336 symop: x,y,z a_YAH=155 636 707 " HG SER A 46 "<>" OD1 ASP A 41 " d_HA=2.471 d_AD=3.375 a_DHA=154.539 symop: x,y,z a_YAH=110 638 700 " H ASP A 41 "<>" O SER A 46 " d_HA=2.481 d_AD=3.237 a_DHA=130.948 symop: x,y,z a_YAH=161 3348 3391 " H LEU A 221 "<>" O ALA A 218 " d_HA=2.189 d_AD=3.194 a_DHA=170.086 symop: x,y,z a_YAH=128 3647 3777 " H LEU A 247 "<>" O TYR A 239 " d_HA=1.772 d_AD=2.689 a_DHA=148.103 symop: x,y,z a_YAH=146 3412 3668 " HG SER A 222 "<>" O LYS A 240 " d_HA=1.608 d_AD=2.567 a_DHA=164.096 symop: x,y,z a_YAH=123 3668 3711 " H ALA A 242 "<>" O LYS A 240 " d_HA=2.170 d_AD=2.832 a_DHA=121.131 symop: x,y,z a_YAH=111 5305 5501 " H VAL B 102 "<>" O THR B 89 " d_HA=1.852 d_AD=2.862 a_DHA=173.966 symop: x,y,z a_YAH=156 5309 5497 " H THR B 89 "<>" O VAL B 102 " d_HA=2.000 d_AD=2.916 a_DHA=149.462 symop: x,y,z a_YAH=128 5267 5539 " H GLU B 104 "<>" O ILE B 87 " d_HA=2.323 d_AD=3.240 a_DHA=149.899 symop: x,y,z a_YAH=111 5267 5312 " HG1 THR B 89 "<>" O ILE B 87 " d_HA=2.636 d_AD=3.400 a_DHA=135.916 symop: x,y,z a_YAH=122 5312 5497 " HG1 THR B 89 "<>" O VAL B 102 " d_HA=2.700 d_AD=3.599 a_DHA=154.415 symop: x,y,z a_YAH=141 221 295 " H ALA A 18 "<>" O LYS A 14 " d_HA=2.344 d_AD=3.323 a_DHA=162.298 symop: x,y,z a_YAH=147 221 284 " H GLU A 17 "<>" O LYS A 14 " d_HA=2.579 d_AD=3.331 a_DHA=131.232 symop: x,y,z a_YAH=93 5007 5778 " H MET B 119 "<>" O GLY B 69 " d_HA=1.869 d_AD=2.830 a_DHA=156.810 symop: x,y,z a_YAH=152 4004 4834 " H ASP B 58 "<>" O ARG B 5 " d_HA=2.368 d_AD=3.037 a_DHA=123.203 symop: x,y,z a_YAH=158 4004 4845 " H THR B 59 "<>" O ARG B 5 " d_HA=2.851 d_AD=3.548 a_DHA=126.905 symop: x,y,z a_YAH=133 4028 5291 " H ILE B 88 "<>" O LEU B 6 " d_HA=2.355 d_AD=3.103 a_DHA=130.389 symop: x,y,z a_YAH=169 4033 5286 " H LEU B 6 "<>" O ILE B 88 " d_HA=1.750 d_AD=2.757 a_DHA=171.808 symop: x,y,z a_YAH=169 303 380 " H ILE A 23 "<>" O LEU A 19 " d_HA=2.267 d_AD=3.259 a_DHA=166.657 symop: x,y,z a_YAH=166 303 361 " H LEU A 22 "<>" O LEU A 19 " d_HA=2.028 d_AD=3.000 a_DHA=160.743 symop: x,y,z a_YAH=129 295 221 " H ALA A 18 "<>" O LYS A 14 " d_HA=2.344 d_AD=3.323 a_DHA=162.298 symop: x,y,z a_YAH=147 238 3372 " HZ2 LYS A 14 "<>" O PRO A 220 " d_HA=2.137 d_AD=3.137 a_DHA=165.669 symop: x,y,z a_YAH=133 4360 5018 " H VAL B 70 "<>" O ALA B 26 " d_HA=1.997 d_AD=2.953 a_DHA=155.061 symop: x,y,z a_YAH=157 4392 4990 " H TRP B 28 "<>" O MET B 68 " d_HA=1.759 d_AD=2.760 a_DHA=170.733 symop: x,y,z a_YAH=126 339 347 " HZ2 LYS A 20 "<>" OD1 ASP A 21 " d_HA=1.803 d_AD=2.699 a_DHA=143.509 symop: x,y,z a_YAH=111 284 199 " H GLU A 17 "<>" O LYS A 13 " d_HA=2.218 d_AD=3.026 a_DHA=136.084 symop: x,y,z a_YAH=147 284 221 " H GLU A 17 "<>" O LYS A 14 " d_HA=2.579 d_AD=3.331 a_DHA=131.232 symop: x,y,z a_YAH=93 4377 4408 " HG CYS B 27 "<>" OD1 ASP B 29 " d_HA=1.975 d_AD=3.317 a_DHA=168.874 symop: x,y,z a_YAH=152 4410 4492 " H ASP B 29 "<>" O ASN B 36 " d_HA=1.853 d_AD=2.811 a_DHA=156.146 symop: x,y,z a_YAH=134 4476 4738 " H LEU B 52 "<>" O VAL B 35 " d_HA=2.016 d_AD=3.027 a_DHA=171.996 symop: x,y,z a_YAH=156 4476 4502 "HD22 ASN B 36 "<>" O VAL B 35 " d_HA=1.967 d_AD=2.744 a_DHA=132.081 symop: x,y,z a_YAH=101 4480 4733 " H VAL B 35 "<>" O LEU B 52 " d_HA=1.794 d_AD=2.797 a_DHA=167.934 symop: x,y,z a_YAH=164 4752 4803 " H GLY B 56 "<>" O ARG B 53 " d_HA=2.068 d_AD=3.073 a_DHA=169.758 symop: x,y,z a_YAH=125 4760 7668 " H ARG B 53 "<>" O MET B 244 " d_HA=1.625 d_AD=2.598 a_DHA=162.129 symop: x,y,z a_YAH=154 5849 5876 "HE21 GLN B 125 "<>" O GLU B 124 " d_HA=1.816 d_AD=2.680 a_DHA=140.615 symop: x,y,z a_YAH=123 4495 4942 "HH21 ARG B 64 "<>" OD1 ASN B 36 " d_HA=2.007 d_AD=2.955 a_DHA=154.191 symop: -x+y+1,-x+1,z a_YAH=148 5409 5881 "HD22 ASN B 95 "<>" O LEU B 126 " d_HA=2.120 d_AD=3.110 a_DHA=165.256 symop: -y+1,x-y,z a_YAH=102 4895 4914 "HH21 ARG B 61 "<>" OD1 ASP B 63 " d_HA=1.974 d_AD=2.990 a_DHA=168.839 symop: x,y,z a_YAH=133 2311 2322 " HE ARG A 149 "<>" OD1 ASP A 150 " d_HA=2.347 d_AD=3.363 a_DHA=171.838 symop: x,y,z a_YAH=139 2905 5750 " HZ3 LYS B 117 "<>" OE2 GLU A 191 " d_HA=2.548 d_AD=3.201 a_DHA=121.452 symop: -y+1,x-y,z a_YAH=174 2185 3405 " HG SER A 141 "<>" O SER A 222 " d_HA=1.790 d_AD=2.766 a_DHA=176.710 symop: x,y,z a_YAH=140 5449 5720 " H MET B 116 "<>" O LEU B 99 " d_HA=1.865 d_AD=2.861 a_DHA=165.937 symop: x,y,z a_YAH=136 5454 5715 " H LEU B 99 "<>" O MET B 116 " d_HA=2.096 d_AD=3.076 a_DHA=163.130 symop: x,y,z a_YAH=135 5483 5679 " H LEU B 101 "<>" O TYR B 114 " d_HA=1.863 d_AD=2.745 a_DHA=142.978 symop: x,y,z a_YAH=157 4023 4832 "HH21 ARG B 5 "<>" OD1 ASP B 58 " d_HA=1.783 d_AD=2.810 a_DHA=174.513 symop: x,y,z a_YAH=139 3218 3280 " H PHE A 214 "<>" O TYR A 211 " d_HA=1.823 d_AD=2.742 a_DHA=148.838 symop: x,y,z a_YAH=117 3218 3300 " H PHE A 215 "<>" O TYR A 211 " d_HA=1.998 d_AD=2.989 a_DHA=164.585 symop: x,y,z a_YAH=163 3239 3316 " H THR A 216 "<>" O LEU A 212 " d_HA=1.951 d_AD=2.943 a_DHA=164.720 symop: x,y,z a_YAH=168 3272 3332 " H LYS A 217 "<>" O PHE A 214 " d_HA=2.300 d_AD=3.225 a_DHA=150.817 symop: x,y,z a_YAH=101 3292 3350 " H ALA A 218 "<>" O PHE A 215 " d_HA=2.069 d_AD=3.025 a_DHA=156.425 symop: x,y,z a_YAH=137 3312 3365 " HG1 THR A 219 "<>" O THR A 216 " d_HA=2.122 d_AD=3.024 a_DHA=155.076 symop: x,y,z a_YAH=130 3312 3362 " H THR A 219 "<>" O THR A 216 " d_HA=1.994 d_AD=2.935 a_DHA=154.225 symop: x,y,z a_YAH=120 3358 3408 " H SER A 222 "<>" O THR A 219 " d_HA=2.419 d_AD=3.425 a_DHA=171.803 symop: x,y,z a_YAH=142 5423 5759 " H LEU B 118 "<>" O ASP B 97 " d_HA=2.563 d_AD=3.536 a_DHA=161.334 symop: x,y,z a_YAH=138 5346 5468 " H ARG B 91 "<>" O ALA B 100 " d_HA=2.612 d_AD=3.557 a_DHA=155.812 symop: x,y,z a_YAH=134 3979 4884 " H ARG B 61 "<>" O GLU B 3 " d_HA=2.228 d_AD=2.952 a_DHA=127.049 symop: x,y,z a_YAH=147 3994 5324 " H LEU B 90 "<>" O ALA B 4 " d_HA=1.960 d_AD=2.919 a_DHA=156.807 symop: x,y,z a_YAH=151 3996 5319 " H ALA B 4 "<>" O LEU B 90 " d_HA=1.942 d_AD=2.897 a_DHA=155.298 symop: x,y,z a_YAH=169 4012 4841 " H ARG B 5 "<>" O THR B 59 " d_HA=2.949 d_AD=3.750 a_DHA=137.404 symop: x,y,z a_YAH=93 4020 4832 " HE ARG B 5 "<>" OD1 ASP B 58 " d_HA=2.686 d_AD=3.474 a_DHA=134.744 symop: x,y,z a_YAH=137 4829 4848 " HG1 THR B 59 "<>" O ASP B 58 " d_HA=1.523 d_AD=2.495 a_DHA=170.394 symop: x,y,z a_YAH=98 5793 5807 " H LEU B 121 "<>" OD1 ASP B 120 " d_HA=2.298 d_AD=3.154 a_DHA=140.652 symop: x,y,z a_YAH=109 348 3343 " HZ2 LYS A 217 "<>" OD2 ASP A 21 " d_HA=1.668 d_AD=2.608 a_DHA=149.541 symop: x,y,z a_YAH=150 5802 5837 " H VAL B 123 "<>" O LEU B 121 " d_HA=2.398 d_AD=3.206 a_DHA=136.131 symop: x,y,z a_YAH=101 4381 4995 " H MET B 68 "<>" O TRP B 28 " d_HA=1.803 d_AD=2.782 a_DHA=160.938 symop: x,y,z a_YAH=150 4405 4497 " H ASN B 36 "<>" O ASP B 29 " d_HA=1.884 d_AD=2.827 a_DHA=152.626 symop: x,y,z a_YAH=133 4405 4943 "HH22 ARG B 64 "<>" O ASP B 29 " d_HA=2.469 d_AD=3.277 a_DHA=136.976 symop: -x+y+1,-x+1,z a_YAH=90 4417 4941 "HH12 ARG B 64 "<>" O ILE B 30 " d_HA=2.923 d_AD=3.875 a_DHA=158.157 symop: -x+y+1,-x+1,z a_YAH=94 4417 4966 " H LEU B 66 "<>" O ILE B 30 " d_HA=1.978 d_AD=2.987 a_DHA=171.294 symop: x,y,z a_YAH=143 4422 4961 " H ILE B 30 "<>" O LEU B 66 " d_HA=1.862 d_AD=2.851 a_DHA=162.330 symop: x,y,z a_YAH=137 4439 4469 " H SER B 31 "<>" O GLY B 34 " d_HA=1.995 d_AD=3.008 a_DHA=179.478 symop: x,y,z a_YAH=169 4436 4470 " H GLY B 34 "<>" O SER B 31 " d_HA=2.037 d_AD=2.967 a_DHA=151.436 symop: x,y,z a_YAH=127 4458 4779 " H SER B 54 "<>" O SER B 33 " d_HA=1.658 d_AD=2.632 a_DHA=161.178 symop: x,y,z a_YAH=133 4469 4872 " HH TYR B 60 "<>" O GLY B 34 " d_HA=2.223 d_AD=3.021 a_DHA=139.606 symop: x,y,z a_YAH=106 4447 4783 " HG SER B 54 "<>" O SER B 32 " d_HA=1.689 d_AD=2.610 a_DHA=155.875 symop: x,y,z a_YAH=159 4776 4817 " H PHE B 57 "<>" O SER B 54 " d_HA=2.239 d_AD=3.210 a_DHA=160.779 symop: x,y,z a_YAH=122 4939 5391 " HE ARG B 64 "<>" OD2 ASP B 94 " d_HA=2.383 d_AD=3.217 a_DHA=138.812 symop: x,y,z a_YAH=114 4465 4915 " HG SER B 33 "<>" OD2 ASP B 63 " d_HA=1.579 d_AD=2.538 a_DHA=161.129 symop: -x+y+1,-x+1,z a_YAH=149 3946 5390 " H2 MET B 1 "<>" OD1 ASP B 94 " d_HA=1.713 d_AD=2.608 a_DHA=144.685 symop: x,y,z a_YAH=97 3947 4914 " H3 MET B 1 "<>" OD1 ASP B 63 " d_HA=2.018 d_AD=3.028 a_DHA=176.547 symop: x,y,z a_YAH=97 4892 4914 " HE ARG B 61 "<>" OD1 ASP B 63 " d_HA=2.674 d_AD=3.540 a_DHA=143.413 symop: x,y,z a_YAH=129 2164 2219 " H PHE A 144 "<>" O PRO A 140 " d_HA=2.096 d_AD=3.092 a_DHA=165.568 symop: x,y,z a_YAH=169 2164 2202 " H GLU A 143 "<>" O PRO A 140 " d_HA=2.490 d_AD=3.149 a_DHA=122.648 symop: x,y,z a_YAH=94 3227 3165 " H TYR A 211 "<>" O ALA A 208 " d_HA=2.469 d_AD=3.189 a_DHA=128.008 symop: x,y,z a_YAH=116 3244 3165 " H LEU A 212 "<>" O ALA A 208 " d_HA=2.336 d_AD=3.327 a_DHA=164.763 symop: x,y,z a_YAH=149 2211 2287 " H CYS A 148 "<>" O PHE A 144 " d_HA=2.253 d_AD=3.261 a_DHA=173.455 symop: x,y,z a_YAH=150 2178 2233 " H ALA A 145 "<>" O SER A 141 " d_HA=2.667 d_AD=3.494 a_DHA=139.193 symop: x,y,z a_YAH=128 2181 3416 " H SER A 141 "<>" O SER A 223 " d_HA=1.894 d_AD=2.902 a_DHA=168.792 symop: x,y,z a_YAH=131 2906 5427 " H GLU A 191 "<>" OD2 ASP B 97 " d_HA=2.669 d_AD=3.654 a_DHA=163.568 symop: -y+1,x-y,z a_YAH=123 5338 5470 " H ALA B 100 "<>" O ARG B 91 " d_HA=2.823 d_AD=3.788 a_DHA=160.748 symop: x,y,z a_YAH=129 3175 3263 " H ASN A 213 "<>" O LEU A 209 " d_HA=2.105 d_AD=3.075 a_DHA=160.864 symop: x,y,z a_YAH=137 5372 5415 " H ALA B 96 "<>" O GLU B 93 " d_HA=2.001 d_AD=2.917 a_DHA=149.528 symop: x,y,z a_YAH=111 3967 5362 " H PHE B 2 "<>" O ALA B 92 " d_HA=1.757 d_AD=2.709 a_DHA=154.252 symop: x,y,z a_YAH=146 3959 5364 " H ALA B 92 "<>" O PHE B 2 " d_HA=2.248 d_AD=3.061 a_DHA=136.909 symop: x,y,z a_YAH=116 3940 4916 " H ASP B 63 "<>" O MET B 1 " d_HA=1.982 d_AD=2.985 a_DHA=168.784 symop: x,y,z a_YAH=156 3985 4876 " H GLU B 3 "<>" O ARG B 61 " d_HA=1.944 d_AD=2.759 a_DHA=136.039 symop: x,y,z a_YAH=140 4907 4923 " HG CYS B 62 "<>" O ARG B 64 " d_HA=1.719 d_AD=2.663 a_DHA=120.586 symop: x,y,z a_YAH=134 2878 2936 " H GLU A 193 "<>" O LYS A 190 " d_HA=2.989 d_AD=3.913 a_DHA=153.387 symop: x,y,z a_YAH=131 5926 5967 "HE21 GLN B 131 "<>" O PRO B 129 " d_HA=1.864 d_AD=2.839 a_DHA=158.769 symop: x,y,z a_YAH=157 2189 2249 " H ARG A 146 "<>" O GLY A 142 " d_HA=2.494 d_AD=3.400 a_DHA=148.063 symop: x,y,z a_YAH=138 2249 2196 " H ARG A 146 "<>" O GLU A 143 " d_HA=2.288 d_AD=2.998 a_DHA=125.740 symop: x,y,z a_YAH=115 3267 2352 "HD21 ASN A 213 "<>" OG SER A 152 " d_HA=1.988 d_AD=2.891 a_DHA=147.434 symop: x,y,z a_YAH=145 a_YAH=100 2231 2303 " H ARG A 149 "<>" O ALA A 145 " d_HA=2.161 d_AD=3.089 a_DHA=151.340 symop: x,y,z a_YAH=135 2287 2211 " H CYS A 148 "<>" O PHE A 144 " d_HA=2.253 d_AD=3.261 a_DHA=173.455 symop: x,y,z a_YAH=150 5390 3946 " H2 MET B 1 "<>" OD1 ASP B 94 " d_HA=1.713 d_AD=2.608 a_DHA=144.685 symop: x,y,z a_YAH=97 ------------------------------------------------------------------------------- Total: 452 Symmetry: 0 Per residue: 0.8863 Mean SD Skew Kurtosis theta_1: 145.901 20.038 -0.560 2.569 theta_2: 135.914 21.438 -0.290 2.042 d_HA: 2.332 0.280 0.248 2.417 1759 1809 " H GLY A 124 "<>" O GLU A 121 " d_HA=2.053 d_AD=2.900 a_DHA=139.286 symop: x,y,z a_YAH=101 1712 1765 " H GLU A 121 "<>" O HIS A 118 " d_HA=2.408 d_AD=3.058 a_DHA=121.051 symop: x,y,z a_YAH=102 1712 1780 " H GLU A 122 "<>" O HIS A 118 " d_HA=1.993 d_AD=2.997 a_DHA=169.888 symop: x,y,z a_YAH=171 1692 1765 " H GLU A 121 "<>" O PHE A 117 " d_HA=2.082 d_AD=2.941 a_DHA=140.892 symop: x,y,z a_YAH=139 1655 1719 " H HIS A 118 "<>" O VAL A 114 " d_HA=1.849 d_AD=2.839 a_DHA=164.003 symop: x,y,z a_YAH=158 1636 1700 " H PHE A 117 "<>" O LEU A 113 " d_HA=1.961 d_AD=2.972 a_DHA=171.959 symop: x,y,z a_YAH=156 1601 1674 " H SER A 115 "<>" O LEU A 111 " d_HA=2.085 d_AD=3.056 a_DHA=159.190 symop: x,y,z a_YAH=142 1659 1589 " H VAL A 114 "<>" O ASP A 110 " d_HA=1.872 d_AD=2.854 a_DHA=161.096 symop: x,y,z a_YAH=152 1572 1624 " H VAL A 112 "<>" O ALA A 108 " d_HA=1.920 d_AD=2.866 a_DHA=152.999 symop: x,y,z a_YAH=147 1583 1546 " H GLY A 109 "<>" O VAL A 106 " d_HA=2.210 d_AD=2.861 a_DHA=120.349 symop: x,y,z a_YAH=107 1536 1583 " H GLY A 109 "<>" O ALA A 105 " d_HA=2.120 d_AD=2.999 a_DHA=143.624 symop: x,y,z a_YAH=136 5946 6006 " H ALA B 107 "<>" O LYS B 103 " d_HA=2.001 d_AD=2.985 a_DHA=163.896 symop: x,y,z a_YAH=148 5970 5927 " H ALA B 104 "<>" O GLY B 101 " d_HA=2.175 d_AD=2.967 a_DHA=133.985 symop: x,y,z a_YAH=105 2244 5906 "HH11 ARG A 150 "<>" O TYR B 100 " d_HA=1.977 d_AD=2.852 a_DHA=142.967 symop: x,y,z a_YAH=113 1808 1839 "HD22 ASN A 126 "<>" O GLY A 124 " d_HA=1.978 d_AD=2.845 a_DHA=141.764 symop: x,y,z a_YAH=149 1815 1892 " H ARG A 129 "<>" O ASN A 125 " d_HA=1.882 d_AD=2.898 a_DHA=175.749 symop: x,y,z a_YAH=162 1818 1849 " H LYS A 127 "<>" OD1 ASN A 125 " d_HA=2.121 d_AD=2.940 a_DHA=136.398 symop: x,y,z a_YAH=158 1818 1870 " H LEU A 128 "<>" OD1 ASN A 125 " d_HA=1.937 d_AD=2.950 a_DHA=175.348 symop: x,y,z a_YAH=118 1829 1916 " H ARG A 130 "<>" O ASN A 126 " d_HA=2.273 d_AD=3.248 a_DHA=161.168 symop: x,y,z a_YAH=130 1729 1794 " H ILE A 123 "<>" O THR A 119 " d_HA=2.692 d_AD=3.578 a_DHA=146.453 symop: x,y,z a_YAH=129 1843 1934 " H ALA A 131 "<>" O LYS A 127 " d_HA=1.999 d_AD=2.927 a_DHA=151.110 symop: x,y,z a_YAH=149 1865 1950 " H PHE A 132 "<>" O LEU A 128 " d_HA=2.002 d_AD=3.011 a_DHA=173.288 symop: x,y,z a_YAH=163 1884 1967 " H LEU A 133 "<>" O ARG A 129 " d_HA=2.021 d_AD=3.031 a_DHA=173.561 symop: x,y,z a_YAH=152 1682 1747 " H VAL A 120 "<>" O ALA A 116 " d_HA=2.098 d_AD=3.057 a_DHA=156.856 symop: x,y,z a_YAH=156 1942 2016 " H ILE A 136 "<>" O PHE A 132 " d_HA=1.876 d_AD=2.880 a_DHA=169.350 symop: x,y,z a_YAH=165 1908 1986 " H ASN A 134 "<>" O ARG A 130 " d_HA=1.938 d_AD=2.905 a_DHA=158.388 symop: x,y,z a_YAH=144 1962 2031 " H GLY A 137 "<>" O LEU A 133 " d_HA=2.078 d_AD=3.053 a_DHA=160.846 symop: x,y,z a_YAH=146 1984 2054 " HZ2 LYS A 138 "<>" OD1 ASN A 134 " d_HA=1.804 d_AD=2.775 a_DHA=157.587 symop: x,y,z a_YAH=162 208 280 " H GLN A 26 "<>" O GLN A 22 " d_HA=2.597 d_AD=3.350 a_DHA=130.998 symop: x,y,z a_YAH=135 225 299 " H PHE A 27 "<>" O ILE A 23 " d_HA=2.746 d_AD=3.550 a_DHA=136.624 symop: x,y,z a_YAH=140 225 280 " H GLN A 26 "<>" O ILE A 23 " d_HA=2.290 d_AD=3.131 a_DHA=139.644 symop: x,y,z a_YAH=104 1620 1678 " HG SER A 115 "<>" O VAL A 112 " d_HA=1.669 d_AD=2.642 a_DHA=173.412 symop: x,y,z a_YAH=124 1620 1684 " H ALA A 116 "<>" O VAL A 112 " d_HA=2.111 d_AD=3.018 a_DHA=147.877 symop: x,y,z a_YAH=150 1671 1733 " H THR A 119 "<>" O SER A 115 " d_HA=2.046 d_AD=3.039 a_DHA=166.350 symop: x,y,z a_YAH=140 1671 1736 " HG1 THR A 119 "<>" O SER A 115 " d_HA=1.745 d_AD=2.712 a_DHA=170.698 symop: x,y,z a_YAH=154 1981 2043 " H LYS A 138 "<>" O ASN A 134 " d_HA=2.265 d_AD=3.250 a_DHA=163.955 symop: x,y,z a_YAH=136 1995 2064 " H MET A 139 "<>" O VAL A 135 " d_HA=2.113 d_AD=3.001 a_DHA=145.442 symop: x,y,z a_YAH=150 2011 2064 " H MET A 139 "<>" O ILE A 136 " d_HA=2.741 d_AD=3.410 a_DHA=123.932 symop: x,y,z a_YAH=91 2011 2079 " H SER A 140 "<>" O ILE A 136 " d_HA=2.245 d_AD=3.241 a_DHA=167.033 symop: x,y,z a_YAH=161 244 299 " H PHE A 27 "<>" O LEU A 24 " d_HA=2.124 d_AD=2.934 a_DHA=135.672 symop: x,y,z a_YAH=110 244 319 " H PHE A 28 "<>" O LEU A 24 " d_HA=1.836 d_AD=2.779 a_DHA=153.318 symop: x,y,z a_YAH=172 1582 1641 " H LEU A 113 "<>" O GLY A 109 " d_HA=2.026 d_AD=3.004 a_DHA=160.378 symop: x,y,z a_YAH=147 2030 2093 " H GLU A 141 "<>" O GLY A 137 " d_HA=1.882 d_AD=2.864 a_DHA=162.188 symop: x,y,z a_YAH=165 2059 2118 " H GLU A 143 "<>" O MET A 139 " d_HA=1.870 d_AD=2.861 a_DHA=163.851 symop: x,y,z a_YAH=157 2037 2104 " H ALA A 142 "<>" O LYS A 138 " d_HA=2.277 d_AD=3.249 a_DHA=159.890 symop: x,y,z a_YAH=127 377 440 " H ASP A 35 "<>" O ILE A 32 " d_HA=2.008 d_AD=2.930 a_DHA=150.155 symop: x,y,z a_YAH=119 377 452 " H LEU A 36 "<>" O ILE A 32 " d_HA=2.594 d_AD=3.310 a_DHA=127.422 symop: x,y,z a_YAH=150 1094 1139 " H LEU A 79 "<>" O ALA A 76 " d_HA=2.201 d_AD=3.034 a_DHA=138.269 symop: x,y,z a_YAH=111 1094 1160 " H HIS A 80 "<>" O ALA A 76 " d_HA=2.379 d_AD=3.321 a_DHA=154.330 symop: x,y,z a_YAH=153 2076 2132 " H LEU A 144 "<>" O SER A 140 " d_HA=2.166 d_AD=3.052 a_DHA=144.680 symop: x,y,z a_YAH=137 2112 5964 " HZ3 LYS B 103 "<>" O GLU A 143 " d_HA=2.401 d_AD=3.214 a_DHA=137.171 symop: x,y,z a_YAH=136 2087 2132 " H LEU A 144 "<>" O GLU A 141 " d_HA=2.688 d_AD=3.368 a_DHA=124.422 symop: x,y,z a_YAH=96 2087 2151 " H ILE A 145 "<>" O GLU A 141 " d_HA=1.968 d_AD=2.965 a_DHA=165.334 symop: x,y,z a_YAH=152 2102 2171 " H GLU A 146 "<>" O ALA A 142 " d_HA=1.914 d_AD=2.915 a_DHA=166.388 symop: x,y,z a_YAH=157 2127 2186 " H GLN A 147 "<>" O LEU A 144 " d_HA=2.280 d_AD=2.969 a_DHA=123.978 symop: x,y,z a_YAH=105 2127 2202 " H LEU A 148 "<>" O LEU A 144 " d_HA=2.245 d_AD=3.024 a_DHA=132.437 symop: x,y,z a_YAH=143 1134 1198 " H VAL A 83 "<>" O LEU A 79 " d_HA=2.675 d_AD=3.458 a_DHA=133.886 symop: x,y,z a_YAH=128 1153 1198 " H VAL A 83 "<>" O HIS A 80 " d_HA=2.529 d_AD=3.344 a_DHA=136.964 symop: x,y,z a_YAH=103 1153 1215 " H ILE A 84 "<>" O HIS A 80 " d_HA=2.158 d_AD=3.109 a_DHA=154.673 symop: x,y,z a_YAH=156 2165 2219 " H SER A 149 "<>" O GLU A 146 " d_HA=2.595 d_AD=3.254 a_DHA=122.289 symop: x,y,z a_YAH=93 2165 2235 " H ARG A 150 "<>" O GLU A 146 " d_HA=1.861 d_AD=2.872 a_DHA=170.283 symop: x,y,z a_YAH=159 2146 2202 " H LEU A 148 "<>" O ILE A 145 " d_HA=2.391 d_AD=3.137 a_DHA=129.574 symop: x,y,z a_YAH=94 2146 2219 " H SER A 149 "<>" O ILE A 145 " d_HA=2.217 d_AD=3.128 a_DHA=148.139 symop: x,y,z a_YAH=148 1380 1452 " H MET A 99 "<>" O THR A 95 " d_HA=2.098 d_AD=3.098 a_DHA=167.979 symop: x,y,z a_YAH=154 1394 1486 " H GLY A 101 "<>" O ILE A 96 " d_HA=2.353 d_AD=3.315 a_DHA=158.493 symop: x,y,z a_YAH=134 1394 1473 " H TYR A 100 "<>" O ILE A 96 " d_HA=1.899 d_AD=2.875 a_DHA=160.650 symop: x,y,z a_YAH=153 1182 1422 "HD21 ASN A 97 "<>" O ASP A 82 " d_HA=1.940 d_AD=2.782 a_DHA=138.024 symop: x,y,z a_YAH=101 1182 1250 " H ALA A 87 "<>" O ASP A 82 " d_HA=2.215 d_AD=3.064 a_DHA=140.164 symop: x,y,z a_YAH=149 2260 2216 " H TYR A 151 "<>" O SER A 149 " d_HA=2.061 d_AD=2.770 a_DHA=125.437 symop: x,y,z a_YAH=112 1241 7691 " HZ3 LYS B 214 "<>" O GLY A 86 " d_HA=1.727 d_AD=2.626 a_DHA=144.493 symop: y+1/2,-x+1/2,z a_YAH=157 2268 3305 " HH TYR A 151 "<>" OD2 ASP A 218 " d_HA=2.283 d_AD=3.232 a_DHA=165.511 symop: x,y,z a_YAH=128 1860 2771 " HZ2 LYS A 127 "<>" O GLY A 183 " d_HA=2.886 d_AD=3.627 a_DHA=130.126 symop: x,y,z a_YAH=166 1824 2718 "HD21 ASN A 125 "<>" O LEU A 180 " d_HA=1.898 d_AD=2.819 a_DHA=148.883 symop: x,y,z a_YAH=147 166 930 " HE ARG A 19 "<>" OG SER A 65 " d_HA=1.937 d_AD=2.893 a_DHA=156.143 symop: x,y,z a_YAH=120 a_YAH=117 169 930 "HH21 ARG A 19 "<>" OG SER A 65 " d_HA=2.004 d_AD=2.925 a_DHA=149.552 symop: x,y,z a_YAH=106 a_YAH=137 872 935 " HG SER A 65 "<>" O GLU A 61 " d_HA=1.826 d_AD=2.776 a_DHA=162.101 symop: x,y,z a_YAH=132 872 931 " H SER A 65 "<>" O GLU A 61 " d_HA=1.881 d_AD=2.836 a_DHA=155.283 symop: x,y,z a_YAH=145 887 942 " H SER A 66 "<>" O ASP A 62 " d_HA=1.848 d_AD=2.814 a_DHA=158.105 symop: x,y,z a_YAH=137 887 946 " HG SER A 66 "<>" O ASP A 62 " d_HA=1.788 d_AD=2.739 a_DHA=164.032 symop: x,y,z a_YAH=146 167 212 "HH11 ARG A 19 "<>" OE1 GLN A 22 " d_HA=1.837 d_AD=2.821 a_DHA=161.311 symop: x,y,z a_YAH=151 928 981 " H ALA A 69 "<>" O SER A 65 " d_HA=1.887 d_AD=2.903 a_DHA=177.851 symop: x,y,z a_YAH=158 939 994 " H LEU A 70 "<>" O SER A 66 " d_HA=1.962 d_AD=2.908 a_DHA=154.034 symop: x,y,z a_YAH=145 1932 1999 " H VAL A 135 "<>" O ALA A 131 " d_HA=2.106 d_AD=3.046 a_DHA=153.137 symop: x,y,z a_YAH=150 2055 2873 " HZ3 LYS A 138 "<>" OH TYR A 190 " d_HA=2.536 d_AD=3.515 a_DHA=162.507 symop: x,y,z a_YAH=114 a_YAH=103 135 214 " H GLN A 22 "<>" O GLU A 18 " d_HA=2.050 d_AD=3.041 a_DHA=164.578 symop: x,y,z a_YAH=146 193 266 " H SER A 25 "<>" O GLU A 21 " d_HA=1.948 d_AD=2.917 a_DHA=158.658 symop: x,y,z a_YAH=146 150 230 " H ILE A 23 "<>" O ARG A 19 " d_HA=1.916 d_AD=2.889 a_DHA=159.450 symop: x,y,z a_YAH=147 174 249 " H LEU A 24 "<>" O ILE A 20 " d_HA=1.925 d_AD=2.931 a_DHA=170.624 symop: x,y,z a_YAH=153 969 1028 " H LEU A 72 "<>" O ALA A 68 " d_HA=1.949 d_AD=2.903 a_DHA=154.947 symop: x,y,z a_YAH=156 969 1014 " H GLU A 71 "<>" O ALA A 68 " d_HA=2.517 d_AD=3.162 a_DHA=121.086 symop: x,y,z a_YAH=110 979 1046 " H VAL A 73 "<>" O ALA A 69 " d_HA=1.967 d_AD=2.948 a_DHA=161.375 symop: x,y,z a_YAH=151 989 1065 " H HIS A 74 "<>" O LEU A 70 " d_HA=2.620 d_AD=3.510 a_DHA=146.840 symop: x,y,z a_YAH=130 1008 1080 " H LEU A 75 "<>" O GLU A 71 " d_HA=1.841 d_AD=2.817 a_DHA=160.652 symop: x,y,z a_YAH=147 1023 1096 " H ALA A 76 "<>" O LEU A 72 " d_HA=2.001 d_AD=2.961 a_DHA=157.070 symop: x,y,z a_YAH=157 1042 1107 " H SER A 77 "<>" O VAL A 73 " d_HA=2.580 d_AD=3.589 a_DHA=175.048 symop: x,y,z a_YAH=144 1058 1111 " HG SER A 77 "<>" O HIS A 74 " d_HA=1.734 d_AD=2.667 a_DHA=159.260 symop: x,y,z a_YAH=130 1058 1120 " H LEU A 78 "<>" O HIS A 74 " d_HA=2.189 d_AD=3.143 a_DHA=156.687 symop: x,y,z a_YAH=155 2433 2508 " H GLY A 165 "<>" O ARG A 161 " d_HA=2.444 d_AD=3.397 a_DHA=155.959 symop: x,y,z a_YAH=139 2457 2520 " H LYS A 166 "<>" O ILE A 162 " d_HA=1.864 d_AD=2.861 a_DHA=165.721 symop: x,y,z a_YAH=172 396 452 " H LEU A 36 "<>" O MET A 33 " d_HA=2.391 d_AD=3.302 a_DHA=148.996 symop: x,y,z a_YAH=107 8406 413 "HH21 ARG B 259 "<>" O LYS A 34 " d_HA=1.720 d_AD=2.716 a_DHA=164.770 symop: -y+1/2,x-1/2,z a_YAH=125 447 485 " H LEU A 38 "<>" O LEU A 36 " d_HA=1.868 d_AD=2.797 a_DHA=151.125 symop: x,y,z a_YAH=99 447 8407 "HH22 ARG B 259 "<>" O LEU A 36 " d_HA=1.843 d_AD=2.779 a_DHA=151.804 symop: y+1/2,-x+1/2,z a_YAH=159 1075 1139 " H LEU A 79 "<>" O LEU A 75 " d_HA=2.489 d_AD=3.269 a_DHA=133.255 symop: x,y,z a_YAH=140 1104 1175 " H ASP A 81 "<>" O SER A 77 " d_HA=1.946 d_AD=2.960 a_DHA=177.750 symop: x,y,z a_YAH=160 2117 5962 " HZ1 LYS B 103 "<>" OE2 GLU A 143 " d_HA=1.683 d_AD=2.665 a_DHA=160.393 symop: x,y,z a_YAH=130 2117 2531 " HZ2 LYS A 166 "<>" OE2 GLU A 143 " d_HA=1.698 d_AD=2.686 a_DHA=161.907 symop: x,y,z a_YAH=142 2462 2378 " H ILE A 162 "<>" O GLU A 158 " d_HA=2.127 d_AD=3.113 a_DHA=163.456 symop: x,y,z a_YAH=152 435 1360 " HZ2 LYS A 93 "<>" O ASP A 35 " d_HA=1.816 d_AD=2.707 a_DHA=143.392 symop: x,y,z a_YAH=168 1359 1365 " HZ1 LYS A 93 "<>" O GLU A 94 " d_HA=1.706 d_AD=2.683 a_DHA=159.135 symop: x,y,z a_YAH=156 1115 1187 " H ASP A 82 "<>" O LEU A 78 " d_HA=1.968 d_AD=2.952 a_DHA=162.528 symop: x,y,z a_YAH=137 1170 1234 " H ASP A 85 "<>" O ASP A 81 " d_HA=2.083 d_AD=3.087 a_DHA=168.384 symop: x,y,z a_YAH=169 1185 1318 " HE ARG A 90 "<>" OD1 ASP A 82 " d_HA=1.725 d_AD=2.690 a_DHA=155.215 symop: x,y,z a_YAH=130 1185 1321 "HH21 ARG A 90 "<>" OD1 ASP A 82 " d_HA=1.794 d_AD=2.721 a_DHA=147.793 symop: x,y,z a_YAH=146 2170 5963 " HZ2 LYS B 103 "<>" OE2 GLU A 146 " d_HA=1.855 d_AD=2.728 a_DHA=141.137 symop: x,y,z a_YAH=143 2169 2532 " HZ3 LYS A 166 "<>" OE1 GLU A 146 " d_HA=1.728 d_AD=2.746 a_DHA=172.798 symop: x,y,z a_YAH=101 3412 3451 " H ALA A 228 "<>" O ASN A 225 " d_HA=2.066 d_AD=2.994 a_DHA=150.755 symop: x,y,z a_YAH=146 1248 1387 " HG1 THR A 95 "<>" O ALA A 87 " d_HA=1.756 d_AD=2.672 a_DHA=154.067 symop: x,y,z a_YAH=152 1258 1384 " H THR A 95 "<>" O ARG A 88 " d_HA=1.958 d_AD=2.890 a_DHA=151.202 symop: x,y,z a_YAH=132 1290 7658 " H PHE A 89 "<>" O GLU B 213 " d_HA=2.322 d_AD=3.247 a_DHA=151.532 symop: y+1/2,-x+1/2,z a_YAH=121 1382 1435 " H PHE A 98 "<>" OG1 THR A 95 " d_HA=2.205 d_AD=3.178 a_DHA=159.891 symop: x,y,z a_YAH=126 a_YAH=101 3390 3422 "HD22 ASN A 225 "<>" O LYS A 224 " d_HA=1.978 d_AD=2.872 a_DHA=145.368 symop: x,y,z a_YAH=105 1369 8292 " HG SER B 252 "<>" OE1 GLU A 94 " d_HA=1.610 d_AD=2.601 a_DHA=171.840 symop: y+1/2,-x+1/2,z a_YAH=108 1274 1370 " HE ARG A 88 "<>" OE2 GLU A 94 " d_HA=1.820 d_AD=2.763 a_DHA=151.256 symop: x,y,z a_YAH=144 1277 1370 "HH21 ARG A 88 "<>" OE2 GLU A 94 " d_HA=1.772 d_AD=2.721 a_DHA=151.093 symop: x,y,z a_YAH=137 1266 7658 " H ARG A 88 "<>" O GLU B 213 " d_HA=1.883 d_AD=2.865 a_DHA=160.408 symop: y+1/2,-x+1/2,z a_YAH=177 3304 3328 " H PHE A 220 "<>" OD1 ASP A 218 " d_HA=1.937 d_AD=2.937 a_DHA=165.671 symop: x,y,z a_YAH=127 3272 3314 " H GLY A 219 "<>" O GLY A 216 " d_HA=1.979 d_AD=2.903 a_DHA=150.381 symop: x,y,z a_YAH=108 3313 3835 " HE1 TRP A 251 "<>" O GLY A 219 " d_HA=1.795 d_AD=2.785 a_DHA=161.566 symop: x,y,z a_YAH=156 2783 2798 " H LEU A 185 "<>" OE2 GLU A 184 " d_HA=1.791 d_AD=2.744 a_DHA=153.836 symop: x,y,z a_YAH=95 2694 2762 " H GLU A 182 "<>" O PRO A 178 " d_HA=2.307 d_AD=3.315 a_DHA=173.021 symop: x,y,z a_YAH=146 2708 2784 " H GLU A 184 "<>" O ALA A 179 " d_HA=2.223 d_AD=2.955 a_DHA=127.783 symop: x,y,z a_YAH=150 2708 2772 " H GLY A 183 "<>" O ALA A 179 " d_HA=2.172 d_AD=2.883 a_DHA=125.768 symop: x,y,z a_YAH=141 865 901 " H ALA A 63 "<>" O GLY A 60 " d_HA=2.257 d_AD=2.982 a_DHA=127.536 symop: x,y,z a_YAH=104 865 914 " H ILE A 64 "<>" O GLY A 60 " d_HA=1.891 d_AD=2.894 a_DHA=167.585 symop: x,y,z a_YAH=164 899 955 " H LEU A 67 "<>" O ALA A 63 " d_HA=1.839 d_AD=2.820 a_DHA=161.341 symop: x,y,z a_YAH=153 2675 2742 " H LEU A 181 "<>" O LEU A 177 " d_HA=2.155 d_AD=3.085 a_DHA=151.754 symop: x,y,z a_YAH=151 2658 2723 " H LEU A 180 "<>" O GLN A 176 " d_HA=2.151 d_AD=3.155 a_DHA=171.517 symop: x,y,z a_YAH=156 2658 2710 " H ALA A 179 "<>" O GLN A 176 " d_HA=2.217 d_AD=3.004 a_DHA=133.615 symop: x,y,z a_YAH=124 2670 2793 "HE21 GLN A 176 "<>" O LEU A 185 " d_HA=1.794 d_AD=2.798 a_DHA=167.264 symop: x,y,z a_YAH=164 2812 2874 " H TYR A 190 "<>" O GLY A 186 " d_HA=2.022 d_AD=2.989 a_DHA=157.881 symop: x,y,z a_YAH=151 75 158 " H ARG A 19 "<>" O LYS A 15 " d_HA=1.907 d_AD=2.877 a_DHA=158.722 symop: x,y,z a_YAH=142 909 971 " H ALA A 68 "<>" O ILE A 64 " d_HA=2.013 d_AD=2.908 a_DHA=146.070 symop: x,y,z a_YAH=138 2610 2680 " H LEU A 177 "<>" O LEU A 173 " d_HA=2.055 d_AD=2.930 a_DHA=143.051 symop: x,y,z a_YAH=157 2603 2664 " H GLN A 176 "<>" O GLY A 172 " d_HA=1.964 d_AD=2.933 a_DHA=158.755 symop: x,y,z a_YAH=153 2865 2930 " H VAL A 194 "<>" O TYR A 190 " d_HA=1.924 d_AD=2.861 a_DHA=151.827 symop: x,y,z a_YAH=150 97 179 " H ILE A 20 "<>" O VAL A 16 " d_HA=2.096 d_AD=3.015 a_DHA=150.081 symop: x,y,z a_YAH=140 113 199 " H GLU A 21 "<>" O LYS A 17 " d_HA=1.833 d_AD=2.834 a_DHA=167.575 symop: x,y,z a_YAH=164 950 1014 " H GLU A 71 "<>" O LEU A 67 " d_HA=2.488 d_AD=3.437 a_DHA=155.540 symop: x,y,z a_YAH=138 2564 2631 " H ALA A 174 "<>" O LEU A 170 " d_HA=2.084 d_AD=3.005 a_DHA=150.130 symop: x,y,z a_YAH=132 2547 2591 " H PHE A 171 "<>" O GLY A 168 " d_HA=2.392 d_AD=3.098 a_DHA=125.935 symop: x,y,z a_YAH=109 2547 2604 " H GLY A 172 "<>" O GLY A 168 " d_HA=1.817 d_AD=2.798 a_DHA=161.050 symop: x,y,z a_YAH=160 2554 2615 " H LEU A 173 "<>" O ALA A 169 " d_HA=1.940 d_AD=2.951 a_DHA=174.430 symop: x,y,z a_YAH=152 2492 2556 " H ALA A 169 "<>" O GLU A 164 " d_HA=1.872 d_AD=2.778 a_DHA=146.270 symop: x,y,z a_YAH=155 516 197 " HH TYR A 39 "<>" OE1 GLU A 21 " d_HA=1.575 d_AD=2.563 a_DHA=174.284 symop: x,y,z a_YAH=121 2536 2569 " H LEU A 170 "<>" O SER A 167 " d_HA=2.730 d_AD=3.443 a_DHA=127.615 symop: x,y,z a_YAH=112 2536 2591 " H PHE A 171 "<>" O SER A 167 " d_HA=2.559 d_AD=3.480 a_DHA=150.999 symop: x,y,z a_YAH=150 2476 2539 " H SER A 167 "<>" O VAL A 163 " d_HA=1.990 d_AD=2.898 a_DHA=147.761 symop: x,y,z a_YAH=130 2476 2548 " H GLY A 168 "<>" O VAL A 163 " d_HA=1.859 d_AD=2.870 a_DHA=173.451 symop: x,y,z a_YAH=150 2414 2498 " H GLU A 164 "<>" O LEU A 160 " d_HA=1.883 d_AD=2.874 a_DHA=163.431 symop: x,y,z a_YAH=165 2393 2480 " H VAL A 163 "<>" O TYR A 159 " d_HA=2.022 d_AD=3.034 a_DHA=173.612 symop: x,y,z a_YAH=157 1302 1349 " H LYS A 93 "<>" O ARG A 90 " d_HA=2.486 d_AD=3.317 a_DHA=138.927 symop: x,y,z a_YAH=108 3433 3462 " H SER A 229 "<>" O VAL A 227 " d_HA=1.916 d_AD=2.828 a_DHA=148.010 symop: x,y,z a_YAH=101 1310 1343 " H ARG A 90 "<>" O LYS A 93 " d_HA=1.833 d_AD=2.822 a_DHA=164.305 symop: x,y,z a_YAH=164 3371 3427 " H GLY A 226 "<>" O LEU A 223 " d_HA=2.072 d_AD=3.038 a_DHA=158.568 symop: x,y,z a_YAH=111 3296 3362 " HZ2 LYS A 217 "<>" OD1 ASP A 222 " d_HA=1.947 d_AD=2.720 a_DHA=129.721 symop: x,y,z a_YAH=102 7715 7762 " H GLY B 216 "<>" O PHE B 220 " d_HA=1.787 d_AD=2.744 a_DHA=155.896 symop: x,y,z a_YAH=155 7738 7804 " HZ2 LYS B 217 "<>" OD1 ASP B 222 " d_HA=1.743 d_AD=2.703 a_DHA=153.320 symop: x,y,z a_YAH=90 3273 3320 " H GLY A 216 "<>" O PHE A 220 " d_HA=1.834 d_AD=2.778 a_DHA=153.426 symop: x,y,z a_YAH=148 7755 8244 "HH21 ARG B 249 "<>" O GLY B 219 " d_HA=1.847 d_AD=2.818 a_DHA=158.873 symop: x,y,z a_YAH=98 7714 7756 " H GLY B 219 "<>" O GLY B 216 " d_HA=2.098 d_AD=2.923 a_DHA=137.257 symop: x,y,z a_YAH=95 7746 7770 " H PHE B 220 "<>" OD1 ASP B 218 " d_HA=1.888 d_AD=2.893 a_DHA=167.372 symop: x,y,z a_YAH=112 7743 8245 "HH22 ARG B 249 "<>" O ASP B 218 " d_HA=1.884 d_AD=2.856 a_DHA=158.668 symop: x,y,z a_YAH=139 831 866 " H GLY A 60 "<>" O GLU A 58 " d_HA=2.176 d_AD=3.048 a_DHA=142.976 symop: x,y,z a_YAH=100 802 2782 "HH12 ARG A 55 "<>" OE1 GLU A 184 " d_HA=2.786 d_AD=3.467 a_DHA=124.873 symop: x,y,z a_YAH=169 804 2782 "HH22 ARG A 55 "<>" OE1 GLU A 184 " d_HA=1.702 d_AD=2.695 a_DHA=161.600 symop: x,y,z a_YAH=120 2782 2813 " H GLY A 186 "<>" OE1 GLU A 184 " d_HA=2.205 d_AD=3.073 a_DHA=142.211 symop: x,y,z a_YAH=95 724 2639 " HG SER A 51 "<>" O LEU A 175 " d_HA=1.707 d_AD=2.685 a_DHA=178.515 symop: x,y,z a_YAH=133 2837 2851 " H LEU A 189 "<>" OD1 ASP A 188 " d_HA=1.712 d_AD=2.617 a_DHA=145.552 symop: x,y,z a_YAH=120 2819 2891 " H ASN A 191 "<>" O GLU A 187 " d_HA=1.911 d_AD=2.919 a_DHA=170.251 symop: x,y,z a_YAH=149 2834 2905 " H LEU A 192 "<>" O ASP A 188 " d_HA=1.906 d_AD=2.900 a_DHA=164.478 symop: x,y,z a_YAH=152 26 101 " H VAL A 16 "<>" O GLU A 12 " d_HA=2.034 d_AD=2.971 a_DHA=152.950 symop: x,y,z a_YAH=152 609 684 " H ILE A 49 "<>" O VAL A 45 " d_HA=1.934 d_AD=2.945 a_DHA=173.358 symop: x,y,z a_YAH=153 668 736 " H PHE A 52 "<>" O SER A 48 " d_HA=1.852 d_AD=2.847 a_DHA=165.993 symop: x,y,z a_YAH=160 675 2629 " HG SER A 48 "<>" O ALA A 174 " d_HA=1.800 d_AD=2.714 a_DHA=154.550 symop: x,y,z a_YAH=144 2583 2644 " H LEU A 175 "<>" O PHE A 171 " d_HA=2.119 d_AD=3.098 a_DHA=160.580 symop: x,y,z a_YAH=151 2629 2680 " H LEU A 177 "<>" O ALA A 174 " d_HA=2.948 d_AD=3.770 a_DHA=138.666 symop: x,y,z a_YAH=96 2846 2920 " H GLY A 193 "<>" O LEU A 189 " d_HA=1.970 d_AD=2.926 a_DHA=155.564 symop: x,y,z a_YAH=142 2886 2946 " H THR A 195 "<>" O ASN A 191 " d_HA=1.964 d_AD=2.977 a_DHA=173.174 symop: x,y,z a_YAH=157 60 141 " H GLU A 18 "<>" O GLU A 14 " d_HA=1.959 d_AD=2.967 a_DHA=173.225 symop: x,y,z a_YAH=153 60 119 " H LYS A 17 "<>" O GLU A 14 " d_HA=2.429 d_AD=3.084 a_DHA=121.782 symop: x,y,z a_YAH=98 65 131 " HZ3 LYS A 17 "<>" OE2 GLU A 14 " d_HA=1.974 d_AD=2.702 a_DHA=125.911 symop: x,y,z a_YAH=111 41 119 " H LYS A 17 "<>" O LEU A 13 " d_HA=2.393 d_AD=3.246 a_DHA=141.478 symop: x,y,z a_YAH=132 64 130 " HZ2 LYS A 17 "<>" OE1 GLU A 14 " d_HA=1.730 d_AD=2.708 a_DHA=158.354 symop: x,y,z a_YAH=101 549 633 " H ARG A 46 "<>" O MET A 42 " d_HA=2.046 d_AD=3.004 a_DHA=156.522 symop: x,y,z a_YAH=149 566 654 " H LEU A 47 "<>" O LEU A 43 " d_HA=1.939 d_AD=2.951 a_DHA=175.833 symop: x,y,z a_YAH=157 585 671 " H SER A 48 "<>" O ARG A 44 " d_HA=1.962 d_AD=2.914 a_DHA=155.547 symop: x,y,z a_YAH=153 613 1012 " H VAL A 45 "<>" OE1 GLU A 71 " d_HA=2.556 d_AD=3.549 a_DHA=166.361 symop: x,y,z a_YAH=159 2900 2961 " H ILE A 196 "<>" O LEU A 192 " d_HA=1.937 d_AD=2.923 a_DHA=162.518 symop: x,y,z a_YAH=150 2919 2976 " H GLY A 197 "<>" O GLY A 193 " d_HA=1.918 d_AD=2.883 a_DHA=157.163 symop: x,y,z a_YAH=147 2926 2986 " H THR A 198 "<>" O VAL A 194 " d_HA=1.863 d_AD=2.858 a_DHA=164.872 symop: x,y,z a_YAH=162 2942 3001 " H ILE A 199 "<>" O THR A 195 " d_HA=1.953 d_AD=2.962 a_DHA=170.695 symop: x,y,z a_YAH=153 2543 2975 " HG SER A 167 "<>" O GLY A 197 " d_HA=1.809 d_AD=2.768 a_DHA=166.776 symop: x,y,z a_YAH=118 2956 3024 " H TYR A 200 "<>" O ILE A 196 " d_HA=1.875 d_AD=2.838 a_DHA=157.319 symop: x,y,z a_YAH=148 2975 3042 " H GLN A 201 "<>" O GLY A 197 " d_HA=2.092 d_AD=3.070 a_DHA=161.137 symop: x,y,z a_YAH=142 2982 3058 " H MET A 202 "<>" O THR A 198 " d_HA=1.941 d_AD=2.951 a_DHA=174.760 symop: x,y,z a_YAH=163 3015 3095 " H ASP A 204 "<>" O TYR A 200 " d_HA=2.053 d_AD=3.049 a_DHA=166.205 symop: x,y,z a_YAH=154 3015 3078 " H PHE A 203 "<>" O TYR A 200 " d_HA=2.395 d_AD=3.150 a_DHA=130.517 symop: x,y,z a_YAH=97 3036 3107 " H ASP A 205 "<>" O GLN A 201 " d_HA=1.791 d_AD=2.805 a_DHA=175.798 symop: x,y,z a_YAH=174 2410 3106 " HH TYR A 159 "<>" OD2 ASP A 205 " d_HA=1.591 d_AD=2.564 a_DHA=166.904 symop: x,y,z a_YAH=143 3090 3155 " H ASP A 208 "<>" O ASP A 204 " d_HA=1.848 d_AD=2.806 a_DHA=155.540 symop: x,y,z a_YAH=154 3106 3478 " H PHE A 230 "<>" OD2 ASP A 205 " d_HA=1.874 d_AD=2.878 a_DHA=167.317 symop: x,y,z a_YAH=108 3459 3527 " H VAL A 233 "<>" O SER A 229 " d_HA=1.951 d_AD=2.967 a_DHA=174.568 symop: x,y,z a_YAH=167 3150 3204 " H MET A 212 "<>" O ASP A 208 " d_HA=1.971 d_AD=2.925 a_DHA=155.635 symop: x,y,z a_YAH=171 3150 3193 " H GLY A 211 "<>" O ASP A 208 " d_HA=2.095 d_AD=2.992 a_DHA=146.300 symop: x,y,z a_YAH=105 3102 3170 " H PHE A 209 "<>" O ASP A 205 " d_HA=2.117 d_AD=3.122 a_DHA=170.064 symop: x,y,z a_YAH=141 7592 7635 " H GLY B 211 "<>" O ASP B 208 " d_HA=2.114 d_AD=3.006 a_DHA=145.422 symop: x,y,z a_YAH=104 3216 5708 " H ARG B 88 "<>" O GLU A 213 " d_HA=1.959 d_AD=2.836 a_DHA=143.253 symop: y+1/2,-x+1/2,z a_YAH=162 3216 5732 " H PHE B 89 "<>" O GLU A 213 " d_HA=1.925 d_AD=2.899 a_DHA=160.303 symop: y+1/2,-x+1/2,z a_YAH=126 3247 5671 " HZ1 LYS A 214 "<>" O ASP B 85 " d_HA=1.734 d_AD=2.713 a_DHA=158.890 symop: y+1/2,-x+1/2,z a_YAH=158 3249 5683 " HZ3 LYS A 214 "<>" O GLY B 86 " d_HA=1.926 d_AD=2.780 a_DHA=139.538 symop: y+1/2,-x+1/2,z a_YAH=119 5716 5812 " HE ARG B 88 "<>" OE2 GLU B 94 " d_HA=1.878 d_AD=2.807 a_DHA=149.489 symop: x,y,z a_YAH=141 5719 5812 "HH21 ARG B 88 "<>" OE2 GLU B 94 " d_HA=1.732 d_AD=2.700 a_DHA=155.066 symop: x,y,z a_YAH=130 3850 5811 " HG SER A 252 "<>" OE1 GLU B 94 " d_HA=1.616 d_AD=2.601 a_DHA=170.224 symop: y+1/2,-x+1/2,z a_YAH=114 93 140 " HZ3 LYS A 15 "<>" OE2 GLU A 18 " d_HA=2.007 d_AD=2.708 a_DHA=123.758 symop: x,y,z a_YAH=94 728 819 " H VAL A 57 "<>" O PHE A 52 " d_HA=2.285 d_AD=3.056 a_DHA=132.356 symop: x,y,z a_YAH=152 748 809 " H GLY A 56 "<>" O LYS A 53 " d_HA=2.205 d_AD=3.113 a_DHA=148.721 symop: x,y,z a_YAH=100 31 764 " HZ1 LYS A 53 "<>" OE2 GLU A 12 " d_HA=1.726 d_AD=2.675 a_DHA=151.859 symop: x,y,z a_YAH=153 679 754 " H LYS A 53 "<>" O ILE A 49 " d_HA=2.018 d_AD=3.008 a_DHA=164.016 symop: x,y,z a_YAH=152 698 775 " H ASN A 54 "<>" O LEU A 50 " d_HA=1.971 d_AD=2.962 a_DHA=165.350 symop: x,y,z a_YAH=149 717 792 " H ARG A 55 "<>" O SER A 51 " d_HA=1.931 d_AD=2.902 a_DHA=158.838 symop: x,y,z a_YAH=157 4343 4381 " HE1 TRP A 284 "<>" OD1 ASN A 282 " d_HA=1.820 d_AD=2.774 a_DHA=153.500 symop: x,y,z a_YAH=125 3 66 " H GLU A 14 "<>" O TYR A 11 " d_HA=2.301 d_AD=3.296 a_DHA=168.401 symop: x,y,z a_YAH=131 14 30 " H3 TYR A 11 "<>" OE1 GLU A 12 " d_HA=1.743 d_AD=2.739 a_DHA=165.477 symop: x,y,z a_YAH=142 625 703 " H LEU A 50 "<>" O ARG A 46 " d_HA=1.992 d_AD=2.960 a_DHA=159.418 symop: x,y,z a_YAH=150 649 720 " H SER A 51 "<>" O LEU A 47 " d_HA=1.927 d_AD=2.876 a_DHA=154.657 symop: x,y,z a_YAH=143 2996 3078 " H PHE A 203 "<>" O ILE A 199 " d_HA=2.181 d_AD=2.970 a_DHA=133.261 symop: x,y,z a_YAH=142 8499 8448 " H LYS B 265 "<>" O GLY B 262 " d_HA=2.007 d_AD=2.924 a_DHA=149.227 symop: x,y,z a_YAH=131 8474 8547 " H GLU B 268 "<>" O LEU B 264 " d_HA=2.003 d_AD=2.994 a_DHA=164.961 symop: x,y,z a_YAH=136 3070 3119 " H ILE A 206 "<>" O PHE A 203 " d_HA=2.517 d_AD=3.196 a_DHA=124.044 symop: x,y,z a_YAH=100 3070 3138 " H MET A 207 "<>" O PHE A 203 " d_HA=2.023 d_AD=2.993 a_DHA=158.572 symop: x,y,z a_YAH=153 3053 3119 " H ILE A 206 "<>" O MET A 202 " d_HA=2.536 d_AD=3.383 a_DHA=140.856 symop: x,y,z a_YAH=123 7556 7626 " H ALA B 210 "<>" O ILE B 206 " d_HA=2.162 d_AD=3.004 a_DHA=139.322 symop: x,y,z a_YAH=129 3114 3184 " H ALA A 210 "<>" O ILE A 206 " d_HA=2.052 d_AD=2.930 a_DHA=143.552 symop: x,y,z a_YAH=139 7901 7951 " H LEU B 232 "<>" O SER B 229 " d_HA=2.310 d_AD=3.023 a_DHA=126.609 symop: x,y,z a_YAH=119 7901 7969 " H VAL B 233 "<>" O SER B 229 " d_HA=2.232 d_AD=3.238 a_DHA=169.782 symop: x,y,z a_YAH=161 7544 7612 " H PHE B 209 "<>" O ASP B 205 " d_HA=2.021 d_AD=3.023 a_DHA=168.906 symop: x,y,z a_YAH=141 7595 7838 " H LYS B 224 "<>" OD1 ASP B 208 " d_HA=1.900 d_AD=2.922 a_DHA=173.682 symop: x,y,z a_YAH=103 7596 7859 " H ASN B 225 "<>" OD2 ASP B 208 " d_HA=2.991 d_AD=3.985 a_DHA=167.870 symop: x,y,z a_YAH=127 7875 7904 " H SER B 229 "<>" O VAL B 227 " d_HA=1.881 d_AD=2.805 a_DHA=150.014 symop: x,y,z a_YAH=103 7854 7893 " H ALA B 228 "<>" O ASN B 225 " d_HA=2.160 d_AD=3.085 a_DHA=150.573 symop: x,y,z a_YAH=136 7813 7869 " H GLY B 226 "<>" O LEU B 223 " d_HA=2.071 d_AD=3.005 a_DHA=152.196 symop: x,y,z a_YAH=106 3220 7848 " HZ1 LYS B 224 "<>" OE1 GLU A 213 " d_HA=1.803 d_AD=2.748 a_DHA=151.179 symop: y+1/2,-x+1/2,z a_YAH=90 5752 5785 " H ARG B 90 "<>" O LYS B 93 " d_HA=1.932 d_AD=2.876 a_DHA=153.478 symop: x,y,z a_YAH=142 5675 7849 " HZ2 LYS B 224 "<>" OD2 ASP B 85 " d_HA=1.841 d_AD=2.628 a_DHA=131.147 symop: x,y,z a_YAH=151 5624 5692 " H ALA B 87 "<>" O ASP B 82 " d_HA=1.970 d_AD=2.928 a_DHA=155.635 symop: x,y,z a_YAH=147 5690 5829 " HG1 THR B 95 "<>" O ALA B 87 " d_HA=1.780 d_AD=2.692 a_DHA=153.572 symop: x,y,z a_YAH=155 5700 5826 " H THR B 95 "<>" O ARG B 88 " d_HA=1.990 d_AD=2.903 a_DHA=148.455 symop: x,y,z a_YAH=137 5824 5877 " H PHE B 98 "<>" OG1 THR B 95 " d_HA=2.266 d_AD=3.236 a_DHA=159.493 symop: x,y,z a_YAH=123 a_YAH=97 5822 5894 " H MET B 99 "<>" O THR B 95 " d_HA=1.894 d_AD=2.902 a_DHA=170.631 symop: x,y,z a_YAH=160 5855 5928 " H GLY B 101 "<>" O ASN B 97 " d_HA=2.176 d_AD=2.862 a_DHA=123.368 symop: x,y,z a_YAH=108 1464 6686 "HH11 ARG B 150 "<>" O TYR A 100 " d_HA=2.076 d_AD=2.952 a_DHA=143.397 symop: x,y,z a_YAH=120 1495 6689 "HH22 ARG B 150 "<>" OD1 ASP A 102 " d_HA=1.934 d_AD=2.856 a_DHA=147.642 symop: x,y,z a_YAH=168 5906 2244 "HH11 ARG A 150 "<>" O TYR B 100 " d_HA=1.977 d_AD=2.852 a_DHA=142.967 symop: x,y,z a_YAH=113 4365 4416 " H ARG A 286 "<>" O TRP A 284 " d_HA=2.089 d_AD=2.983 a_DHA=145.796 symop: x,y,z a_YAH=93 4271 4345 " H ASN A 282 "<>" O VAL A 278 " d_HA=1.921 d_AD=2.837 a_DHA=148.605 symop: x,y,z a_YAH=138 4340 4394 " H LEU A 285 "<>" O ASN A 282 " d_HA=1.995 d_AD=3.004 a_DHA=171.663 symop: x,y,z a_YAH=137 4266 4330 "HD21 ASN A 277 "<>" OE2 GLU A 281 " d_HA=1.851 d_AD=2.730 a_DHA=141.064 symop: x,y,z a_YAH=105 4200 4275 " H VAL A 278 "<>" O LEU A 274 " d_HA=1.988 d_AD=3.003 a_DHA=176.278 symop: x,y,z a_YAH=166 4219 4292 " H ILE A 279 "<>" O VAL A 275 " d_HA=2.487 d_AD=3.415 a_DHA=152.275 symop: x,y,z a_YAH=140 4257 4331 " H GLU A 281 "<>" O ASN A 277 " d_HA=1.993 d_AD=2.990 a_DHA=166.529 symop: x,y,z a_YAH=168 4257 4311 " H ILE A 280 "<>" O ASN A 277 " d_HA=2.192 d_AD=2.901 a_DHA=125.598 symop: x,y,z a_YAH=101 4143 4223 " H VAL A 275 "<>" O LEU A 271 " d_HA=1.943 d_AD=2.949 a_DHA=171.554 symop: x,y,z a_YAH=160 4184 4262 " H ASN A 277 "<>" O VAL A 273 " d_HA=1.933 d_AD=2.930 a_DHA=167.254 symop: x,y,z a_YAH=152 8493 8562 " H GLU B 269 "<>" O LYS B 265 " d_HA=1.884 d_AD=2.894 a_DHA=171.558 symop: x,y,z a_YAH=151 8545 8622 " HZ3 LYS B 272 "<>" OE1 GLU B 268 " d_HA=2.079 d_AD=3.070 a_DHA=161.191 symop: x,y,z a_YAH=157 4088 4148 " H LEU A 271 "<>" O CYS A 267 " d_HA=1.888 d_AD=2.875 a_DHA=162.938 symop: x,y,z a_YAH=153 4099 4168 " H LYS A 272 "<>" O GLU A 268 " d_HA=2.332 d_AD=3.252 a_DHA=150.017 symop: x,y,z a_YAH=134 4114 4188 " H VAL A 273 "<>" O GLU A 269 " d_HA=1.850 d_AD=2.782 a_DHA=150.654 symop: x,y,z a_YAH=151 4129 4205 " H LEU A 274 "<>" O THR A 270 " d_HA=2.198 d_AD=3.198 a_DHA=168.567 symop: x,y,z a_YAH=153 4133 4073 " H THR A 270 "<>" O GLU A 266 " d_HA=1.913 d_AD=2.853 a_DHA=152.674 symop: x,y,z a_YAH=142 8530 8590 " H LEU B 271 "<>" O CYS B 267 " d_HA=1.999 d_AD=3.007 a_DHA=170.689 symop: x,y,z a_YAH=155 8541 8610 " H LYS B 272 "<>" O GLU B 268 " d_HA=1.949 d_AD=2.886 a_DHA=151.723 symop: x,y,z a_YAH=146 4032 4105 " H GLU A 268 "<>" O LEU A 264 " d_HA=2.034 d_AD=2.968 a_DHA=152.235 symop: x,y,z a_YAH=127 4051 4120 " H GLU A 269 "<>" O LYS A 265 " d_HA=1.997 d_AD=3.010 a_DHA=174.235 symop: x,y,z a_YAH=149 7495 7561 " H ILE B 206 "<>" O MET B 202 " d_HA=2.528 d_AD=3.359 a_DHA=138.998 symop: x,y,z a_YAH=123 7512 7561 " H ILE B 206 "<>" O PHE B 203 " d_HA=2.380 d_AD=3.081 a_DHA=125.469 symop: x,y,z a_YAH=101 7512 7580 " H MET B 207 "<>" O PHE B 203 " d_HA=2.163 d_AD=3.050 a_DHA=144.921 symop: x,y,z a_YAH=146 6852 7548 " HH TYR B 159 "<>" OD2 ASP B 205 " d_HA=1.579 d_AD=2.556 a_DHA=168.999 symop: x,y,z a_YAH=144 7548 7920 " H PHE B 230 "<>" OD2 ASP B 205 " d_HA=1.900 d_AD=2.895 a_DHA=163.942 symop: x,y,z a_YAH=109 7478 7549 " H ASP B 205 "<>" O GLN B 201 " d_HA=1.829 d_AD=2.841 a_DHA=174.299 symop: x,y,z a_YAH=167 7490 7547 "HE21 GLN B 201 "<>" OD1 ASP B 205 " d_HA=1.791 d_AD=2.813 a_DHA=170.490 symop: x,y,z a_YAH=141 7532 7597 " H ASP B 208 "<>" O ASP B 204 " d_HA=1.829 d_AD=2.827 a_DHA=166.167 symop: x,y,z a_YAH=157 7547 7864 "HD22 ASN B 225 "<>" OD1 ASP B 205 " d_HA=2.089 d_AD=2.807 a_DHA=125.895 symop: x,y,z a_YAH=126 6972 7857 " HZ1 LYS B 166 "<>" OD1 ASN B 225 " d_HA=1.893 d_AD=2.775 a_DHA=143.583 symop: x,y,z a_YAH=136 5744 5791 " H LYS B 93 "<>" O ARG B 90 " d_HA=2.347 d_AD=3.150 a_DHA=135.450 symop: x,y,z a_YAH=104 6612 6974 " HZ3 LYS B 166 "<>" OE2 GLU B 146 " d_HA=1.795 d_AD=2.671 a_DHA=141.439 symop: x,y,z a_YAH=110 1520 6558 " HZ1 LYS A 103 "<>" OE1 GLU B 143 " d_HA=1.842 d_AD=2.682 a_DHA=136.797 symop: x,y,z a_YAH=100 6611 6973 " HZ2 LYS B 166 "<>" OE1 GLU B 146 " d_HA=1.871 d_AD=2.727 a_DHA=139.270 symop: x,y,z a_YAH=108 1521 6559 " HZ2 LYS A 103 "<>" OE2 GLU B 143 " d_HA=2.074 d_AD=2.843 a_DHA=130.585 symop: x,y,z a_YAH=94 1522 5615 " HZ3 LYS A 103 "<>" OD1 ASP B 81 " d_HA=1.741 d_AD=2.699 a_DHA=154.435 symop: x,y,z a_YAH=168 5557 5629 " H ASP B 82 "<>" O LEU B 78 " d_HA=2.014 d_AD=2.994 a_DHA=161.442 symop: x,y,z a_YAH=142 5612 5676 " H ASP B 85 "<>" O ASP B 81 " d_HA=1.908 d_AD=2.914 a_DHA=168.933 symop: x,y,z a_YAH=162 5627 5761 "HH11 ARG B 90 "<>" OD1 ASP B 82 " d_HA=1.702 d_AD=2.720 a_DHA=168.510 symop: x,y,z a_YAH=131 4877 5802 " HZ2 LYS B 93 "<>" O ASP B 35 " d_HA=1.849 d_AD=2.798 a_DHA=153.086 symop: x,y,z a_YAH=91 6588 6661 " H SER B 149 "<>" O ILE B 145 " d_HA=2.083 d_AD=3.058 a_DHA=159.211 symop: x,y,z a_YAH=151 6588 6644 " H LEU B 148 "<>" O ILE B 145 " d_HA=2.333 d_AD=3.079 a_DHA=129.472 symop: x,y,z a_YAH=93 1504 1564 " H ALA A 107 "<>" O LYS A 103 " d_HA=2.005 d_AD=2.991 a_DHA=163.752 symop: x,y,z a_YAH=145 5576 5640 " H VAL B 83 "<>" O LEU B 79 " d_HA=2.709 d_AD=3.492 a_DHA=134.039 symop: x,y,z a_YAH=133 5595 5640 " H VAL B 83 "<>" O HIS B 80 " d_HA=2.216 d_AD=3.037 a_DHA=136.759 symop: x,y,z a_YAH=108 5595 5657 " H ILE B 84 "<>" O HIS B 80 " d_HA=2.160 d_AD=3.155 a_DHA=165.727 symop: x,y,z a_YAH=156 5836 5915 " H TYR B 100 "<>" O ILE B 96 " d_HA=1.921 d_AD=2.872 a_DHA=155.042 symop: x,y,z a_YAH=144 5836 5928 " H GLY B 101 "<>" O ILE B 96 " d_HA=2.569 d_AD=3.420 a_DHA=141.387 symop: x,y,z a_YAH=135 1485 1528 " H ALA A 104 "<>" O GLY A 101 " d_HA=2.329 d_AD=3.051 a_DHA=127.895 symop: x,y,z a_YAH=92 1485 1538 " H ALA A 105 "<>" O GLY A 101 " d_HA=2.059 d_AD=2.953 a_DHA=145.741 symop: x,y,z a_YAH=148 1492 1538 " H ALA A 105 "<>" O ASP A 102 " d_HA=2.433 d_AD=3.094 a_DHA=122.167 symop: x,y,z a_YAH=107 1492 1550 " H VAL A 106 "<>" O ASP A 102 " d_HA=2.087 d_AD=3.084 a_DHA=167.393 symop: x,y,z a_YAH=159 5927 5970 " H ALA B 104 "<>" O GLY B 101 " d_HA=2.175 d_AD=2.967 a_DHA=133.985 symop: x,y,z a_YAH=105 5927 5980 " H ALA B 105 "<>" O GLY B 101 " d_HA=2.307 d_AD=3.160 a_DHA=141.007 symop: x,y,z a_YAH=147 5934 5980 " H ALA B 105 "<>" O ASP B 102 " d_HA=2.231 d_AD=2.976 a_DHA=129.024 symop: x,y,z a_YAH=110 5934 5992 " H VAL B 106 "<>" O ASP B 102 " d_HA=2.054 d_AD=3.024 a_DHA=159.512 symop: x,y,z a_YAH=155 2368 2453 "HH22 ARG A 161 "<>" OE2 GLU A 157 " d_HA=1.736 d_AD=2.683 a_DHA=150.960 symop: x,y,z a_YAH=103 197 516 " HH TYR A 39 "<>" OE1 GLU A 21 " d_HA=1.575 d_AD=2.563 a_DHA=174.284 symop: x,y,z a_YAH=121 2363 2441 " H ARG A 161 "<>" O GLU A 157 " d_HA=2.036 d_AD=3.042 a_DHA=169.696 symop: x,y,z a_YAH=151 4424 4435 " HE ARG A 286 "<>" OD1 ASP A 287 " d_HA=2.382 d_AD=3.213 a_DHA=137.858 symop: x,y,z a_YAH=104 4235 4292 " H ILE A 279 "<>" O LYS A 276 " d_HA=2.447 d_AD=3.113 a_DHA=122.779 symop: x,y,z a_YAH=105 4235 4311 " H ILE A 280 "<>" O LYS A 276 " d_HA=2.149 d_AD=2.967 a_DHA=136.510 symop: x,y,z a_YAH=145 4162 4241 " H LYS A 276 "<>" O LYS A 272 " d_HA=1.887 d_AD=2.825 a_DHA=152.432 symop: x,y,z a_YAH=143 8556 8630 " H VAL B 273 "<>" O GLU B 269 " d_HA=2.158 d_AD=2.920 a_DHA=130.301 symop: x,y,z a_YAH=145 8604 8683 " H LYS B 276 "<>" O LYS B 272 " d_HA=2.803 d_AD=3.652 a_DHA=141.750 symop: x,y,z a_YAH=114 8571 8630 " H VAL B 273 "<>" O THR B 270 " d_HA=2.312 d_AD=3.106 a_DHA=134.090 symop: x,y,z a_YAH=100 8571 8647 " H LEU B 274 "<>" O THR B 270 " d_HA=2.164 d_AD=3.169 a_DHA=170.399 symop: x,y,z a_YAH=157 8585 8665 " H VAL B 275 "<>" O LEU B 271 " d_HA=2.011 d_AD=3.022 a_DHA=173.867 symop: x,y,z a_YAH=163 7438 7520 " H PHE B 203 "<>" O ILE B 199 " d_HA=2.228 d_AD=3.032 a_DHA=135.071 symop: x,y,z a_YAH=139 7457 7537 " H ASP B 204 "<>" O TYR B 200 " d_HA=2.061 d_AD=3.064 a_DHA=169.678 symop: x,y,z a_YAH=158 7457 7520 " H PHE B 203 "<>" O TYR B 200 " d_HA=2.427 d_AD=3.161 a_DHA=128.618 symop: x,y,z a_YAH=96 7424 7500 " H MET B 202 "<>" O THR B 198 " d_HA=1.947 d_AD=2.960 a_DHA=177.100 symop: x,y,z a_YAH=165 7474 7536 " HH TYR B 200 "<>" OD2 ASP B 204 " d_HA=1.605 d_AD=2.583 a_DHA=166.941 symop: x,y,z a_YAH=142 6835 6922 " H VAL B 163 "<>" O TYR B 159 " d_HA=1.861 d_AD=2.872 a_DHA=172.111 symop: x,y,z a_YAH=160 6904 6820 " H ILE B 162 "<>" O GLU B 158 " d_HA=2.161 d_AD=3.074 a_DHA=149.017 symop: x,y,z a_YAH=145 6899 6950 " H GLY B 165 "<>" O ILE B 162 " d_HA=2.522 d_AD=3.299 a_DHA=133.085 symop: x,y,z a_YAH=105 6899 6962 " H LYS B 166 "<>" O ILE B 162 " d_HA=1.889 d_AD=2.876 a_DHA=162.989 symop: x,y,z a_YAH=172 4889 4927 " H LEU B 38 "<>" O LEU B 36 " d_HA=1.889 d_AD=2.842 a_DHA=155.816 symop: x,y,z a_YAH=93 4889 5801 " HZ1 LYS B 93 "<>" O LEU B 36 " d_HA=1.906 d_AD=2.812 a_DHA=146.484 symop: x,y,z a_YAH=137 5803 4855 " HZ3 LYS B 93 "<>" O LYS B 34 " d_HA=1.806 d_AD=2.755 a_DHA=152.656 symop: x,y,z a_YAH=136 6544 6613 " H GLU B 146 "<>" O ALA B 142 " d_HA=1.920 d_AD=2.905 a_DHA=161.843 symop: x,y,z a_YAH=150 5517 5581 " H LEU B 79 "<>" O LEU B 75 " d_HA=2.148 d_AD=3.029 a_DHA=144.128 symop: x,y,z a_YAH=143 5536 5581 " H LEU B 79 "<>" O ALA B 76 " d_HA=2.344 d_AD=3.045 a_DHA=125.352 symop: x,y,z a_YAH=106 5536 5602 " H HIS B 80 "<>" O ALA B 76 " d_HA=2.129 d_AD=3.125 a_DHA=166.536 symop: x,y,z a_YAH=160 5546 5617 " H ASP B 81 "<>" O SER B 77 " d_HA=1.916 d_AD=2.927 a_DHA=173.458 symop: x,y,z a_YAH=154 4838 4894 " H LEU B 36 "<>" O MET B 33 " d_HA=2.575 d_AD=3.416 a_DHA=139.859 symop: x,y,z a_YAH=108 6529 6593 " H ILE B 145 "<>" O GLU B 141 " d_HA=1.976 d_AD=2.967 a_DHA=163.546 symop: x,y,z a_YAH=152 6554 6628 " H GLN B 147 "<>" O GLU B 143 " d_HA=2.185 d_AD=3.179 a_DHA=164.732 symop: x,y,z a_YAH=146 6569 6644 " H LEU B 148 "<>" O LEU B 144 " d_HA=2.201 d_AD=2.927 a_DHA=127.113 symop: x,y,z a_YAH=138 5978 6025 " H GLY B 109 "<>" O ALA B 105 " d_HA=2.184 d_AD=3.038 a_DHA=140.659 symop: x,y,z a_YAH=133 4819 4894 " H LEU B 36 "<>" O ILE B 32 " d_HA=2.262 d_AD=3.089 a_DHA=137.486 symop: x,y,z a_YAH=159 4819 4882 " H ASP B 35 "<>" O ILE B 32 " d_HA=1.925 d_AD=2.793 a_DHA=141.552 symop: x,y,z a_YAH=106 1526 1574 " H ALA A 108 "<>" O ALA A 104 " d_HA=1.947 d_AD=2.879 a_DHA=151.408 symop: x,y,z a_YAH=138 1562 1606 " H LEU A 111 "<>" O ALA A 107 " d_HA=1.956 d_AD=2.902 a_DHA=153.733 symop: x,y,z a_YAH=144 1166 1546 " HE2 HIS A 80 "<>" O VAL A 106 " d_HA=2.935 d_AD=3.659 a_DHA=127.942 symop: x,y,z a_YAH=120 1166 1592 " HE2 HIS A 80 "<>" OD1 ASP A 110 " d_HA=1.889 d_AD=2.831 a_DHA=150.720 symop: x,y,z a_YAH=138 1546 1583 " H GLY A 109 "<>" O VAL A 106 " d_HA=2.210 d_AD=2.861 a_DHA=120.349 symop: x,y,z a_YAH=107 1546 1594 " H ASP A 110 "<>" O VAL A 106 " d_HA=2.188 d_AD=3.158 a_DHA=157.754 symop: x,y,z a_YAH=165 5608 5988 " HE2 HIS B 80 "<>" O VAL B 106 " d_HA=2.684 d_AD=3.447 a_DHA=130.963 symop: x,y,z a_YAH=118 5608 6034 " HE2 HIS B 80 "<>" OD1 ASP B 110 " d_HA=1.917 d_AD=2.851 a_DHA=149.318 symop: x,y,z a_YAH=151 5988 6025 " H GLY B 109 "<>" O VAL B 106 " d_HA=2.102 d_AD=2.820 a_DHA=126.022 symop: x,y,z a_YAH=114 5988 6036 " H ASP B 110 "<>" O VAL B 106 " d_HA=2.084 d_AD=3.065 a_DHA=160.685 symop: x,y,z a_YAH=160 5968 6016 " H ALA B 108 "<>" O ALA B 104 " d_HA=2.008 d_AD=2.899 a_DHA=145.566 symop: x,y,z a_YAH=133 6004 6048 " H LEU B 111 "<>" O ALA B 107 " d_HA=1.957 d_AD=2.928 a_DHA=158.936 symop: x,y,z a_YAH=142 331 382 " H ILE A 32 "<>" O PRO A 29 " d_HA=2.046 d_AD=2.874 a_DHA=137.212 symop: x,y,z a_YAH=126 331 401 " H MET A 33 "<>" O PRO A 29 " d_HA=2.109 d_AD=3.086 a_DHA=160.756 symop: x,y,z a_YAH=153 2334 2367 " HG1 THR A 155 "<>" OE1 GLU A 157 " d_HA=1.704 d_AD=2.605 a_DHA=150.221 symop: x,y,z a_YAH=124 2367 2451 "HH12 ARG A 161 "<>" OE1 GLU A 157 " d_HA=1.736 d_AD=2.717 a_DHA=158.607 symop: x,y,z a_YAH=107 2378 2462 " H ILE A 162 "<>" O GLU A 158 " d_HA=2.127 d_AD=3.113 a_DHA=163.456 symop: x,y,z a_YAH=152 2327 2402 " H TYR A 159 "<>" O THR A 155 " d_HA=2.073 d_AD=3.065 a_DHA=164.789 symop: x,y,z a_YAH=142 2329 2384 " H GLU A 158 "<>" OG1 THR A 155 " d_HA=1.842 d_AD=2.844 a_DHA=168.343 symop: x,y,z a_YAH=150 a_YAH=96 2341 2419 " H LEU A 160 "<>" O LYS A 156 " d_HA=2.106 d_AD=3.040 a_DHA=152.512 symop: x,y,z a_YAH=139 2347 3585 " H LYS A 156 "<>" OE2 GLU A 237 " d_HA=1.772 d_AD=2.787 a_DHA=171.669 symop: x,y,z a_YAH=114 8626 8683 " H LYS B 276 "<>" O VAL B 273 " d_HA=2.387 d_AD=3.050 a_DHA=122.274 symop: x,y,z a_YAH=103 8626 8704 " H ASN B 277 "<>" O VAL B 273 " d_HA=2.068 d_AD=3.013 a_DHA=154.389 symop: x,y,z a_YAH=157 8661 8734 " H ILE B 279 "<>" O VAL B 275 " d_HA=2.306 d_AD=3.239 a_DHA=152.732 symop: x,y,z a_YAH=143 8642 8717 " H VAL B 278 "<>" O LEU B 274 " d_HA=2.132 d_AD=3.140 a_DHA=171.368 symop: x,y,z a_YAH=166 7384 7443 " H ILE B 199 "<>" O THR B 195 " d_HA=1.904 d_AD=2.915 a_DHA=172.626 symop: x,y,z a_YAH=154 7398 7466 " H TYR B 200 "<>" O ILE B 196 " d_HA=1.883 d_AD=2.823 a_DHA=152.692 symop: x,y,z a_YAH=145 4969 5084 "HH11 ARG B 46 "<>" O LYS B 41 " d_HA=1.899 d_AD=2.841 a_DHA=152.561 symop: x,y,z a_YAH=147 6939 7431 " HG1 THR B 198 "<>" OE2 GLU B 164 " d_HA=2.955 d_AD=3.885 a_DHA=161.491 symop: x,y,z a_YAH=98 6985 7417 " HG SER B 167 "<>" O GLY B 197 " d_HA=1.835 d_AD=2.775 a_DHA=161.092 symop: x,y,z a_YAH=120 7417 7484 " H GLN B 201 "<>" O GLY B 197 " d_HA=2.039 d_AD=3.009 a_DHA=159.425 symop: x,y,z a_YAH=141 4996 5455 " H MET B 42 "<>" OE2 GLU B 71 " d_HA=2.687 d_AD=3.344 a_DHA=122.647 symop: x,y,z a_YAH=138 6856 6940 " H GLU B 164 "<>" O LEU B 160 " d_HA=1.786 d_AD=2.791 a_DHA=168.257 symop: x,y,z a_YAH=168 6918 6981 " H SER B 167 "<>" O VAL B 163 " d_HA=1.891 d_AD=2.845 a_DHA=155.537 symop: x,y,z a_YAH=139 6918 6990 " H GLY B 168 "<>" O VAL B 163 " d_HA=1.890 d_AD=2.903 a_DHA=173.916 symop: x,y,z a_YAH=147 6934 6998 " H ALA B 169 "<>" O GLU B 164 " d_HA=1.967 d_AD=2.821 a_DHA=139.902 symop: x,y,z a_YAH=136 6978 7033 " H PHE B 171 "<>" O SER B 167 " d_HA=2.814 d_AD=3.695 a_DHA=145.488 symop: x,y,z a_YAH=144 5450 5522 " H LEU B 75 "<>" O GLU B 71 " d_HA=1.838 d_AD=2.831 a_DHA=165.125 symop: x,y,z a_YAH=156 6875 6950 " H GLY B 165 "<>" O ARG B 161 " d_HA=2.741 d_AD=3.601 a_DHA=142.736 symop: x,y,z a_YAH=128 6479 6546 " H ALA B 142 "<>" O LYS B 138 " d_HA=2.239 d_AD=3.200 a_DHA=157.860 symop: x,y,z a_YAH=129 6501 6560 " H GLU B 143 "<>" O MET B 139 " d_HA=1.967 d_AD=2.960 a_DHA=164.653 symop: x,y,z a_YAH=155 5465 5538 " H ALA B 76 "<>" O LEU B 72 " d_HA=1.998 d_AD=2.944 a_DHA=154.210 symop: x,y,z a_YAH=159 5484 5549 " H SER B 77 "<>" O VAL B 73 " d_HA=2.580 d_AD=3.587 a_DHA=173.712 symop: x,y,z a_YAH=146 5500 5553 " HG SER B 77 "<>" O HIS B 74 " d_HA=1.766 d_AD=2.703 a_DHA=160.752 symop: x,y,z a_YAH=130 5500 5562 " H LEU B 78 "<>" O HIS B 74 " d_HA=2.045 d_AD=2.991 a_DHA=154.943 symop: x,y,z a_YAH=153 6472 6535 " H GLU B 141 "<>" O GLY B 137 " d_HA=1.853 d_AD=2.842 a_DHA=163.326 symop: x,y,z a_YAH=165 6518 6574 " H LEU B 144 "<>" O SER B 140 " d_HA=2.029 d_AD=3.004 a_DHA=159.815 symop: x,y,z a_YAH=141 6024 6083 " H LEU B 113 "<>" O GLY B 109 " d_HA=2.059 d_AD=3.037 a_DHA=160.004 symop: x,y,z a_YAH=151 6014 6066 " H VAL B 112 "<>" O ALA B 108 " d_HA=1.970 d_AD=2.905 a_DHA=151.293 symop: x,y,z a_YAH=142 1589 1659 " H VAL A 114 "<>" O ASP A 110 " d_HA=1.872 d_AD=2.854 a_DHA=161.096 symop: x,y,z a_YAH=152 6031 6101 " H VAL B 114 "<>" O ASP B 110 " d_HA=1.876 d_AD=2.855 a_DHA=159.853 symop: x,y,z a_YAH=152 439 1481 " HH TYR A 100 "<>" OD2 ASP A 35 " d_HA=1.606 d_AD=2.595 a_DHA=177.906 symop: x,y,z a_YAH=170 360 431 " HZ3 LYS A 34 "<>" O GLN A 31 " d_HA=2.025 d_AD=2.744 a_DHA=125.483 symop: x,y,z a_YAH=119 2197 2288 " HZ1 LYS A 152 "<>" O LEU A 148 " d_HA=1.970 d_AD=2.669 a_DHA=123.367 symop: x,y,z a_YAH=130 413 8406 "HH21 ARG B 259 "<>" O LYS A 34 " d_HA=1.720 d_AD=2.716 a_DHA=164.770 symop: y+1/2,-x+1/2,z a_YAH=125 413 8403 " HE ARG B 259 "<>" O LYS A 34 " d_HA=2.408 d_AD=3.231 a_DHA=137.482 symop: y+1/2,-x+1/2,z a_YAH=174 2331 2382 " H THR A 155 "<>" OE1 GLU A 158 " d_HA=1.832 d_AD=2.841 a_DHA=167.497 symop: x,y,z a_YAH=138 8387 8449 " H GLY B 262 "<>" O ARG B 259 " d_HA=2.582 d_AD=3.473 a_DHA=147.032 symop: x,y,z a_YAH=91 8370 8460 " H ILE B 263 "<>" O MET B 258 " d_HA=2.130 d_AD=2.956 a_DHA=137.273 symop: x,y,z a_YAH=153 3523 3586 " H GLU A 237 "<>" O VAL A 233 " d_HA=2.009 d_AD=3.008 a_DHA=167.458 symop: x,y,z a_YAH=162 3539 3601 " H LYS A 238 "<>" O THR A 234 " d_HA=2.471 d_AD=3.409 a_DHA=153.648 symop: x,y,z a_YAH=128 3470 3543 " H THR A 234 "<>" O PHE A 230 " d_HA=2.029 d_AD=2.991 a_DHA=157.317 symop: x,y,z a_YAH=147 3470 3546 " HG1 THR A 234 "<>" O PHE A 230 " d_HA=1.752 d_AD=2.718 a_DHA=170.561 symop: x,y,z a_YAH=142 3527 3459 " H VAL A 233 "<>" O SER A 229 " d_HA=1.951 d_AD=2.967 a_DHA=174.568 symop: x,y,z a_YAH=167 8448 8499 " H LYS B 265 "<>" O GLY B 262 " d_HA=2.007 d_AD=2.924 a_DHA=149.227 symop: x,y,z a_YAH=131 8448 8521 " H GLU B 266 "<>" O GLY B 262 " d_HA=2.377 d_AD=3.290 a_DHA=149.831 symop: x,y,z a_YAH=140 8455 8533 " H CYS B 267 "<>" O ILE B 263 " d_HA=1.849 d_AD=2.851 a_DHA=168.371 symop: x,y,z a_YAH=163 8515 8575 " H THR B 270 "<>" O GLU B 266 " d_HA=2.000 d_AD=2.961 a_DHA=157.149 symop: x,y,z a_YAH=143 8515 8578 " HG1 THR B 270 "<>" O GLU B 266 " d_HA=1.695 d_AD=2.652 a_DHA=166.017 symop: x,y,z a_YAH=143 8054 8520 " HZ2 LYS B 238 "<>" OE2 GLU B 266 " d_HA=1.772 d_AD=2.687 a_DHA=146.502 symop: x,y,z a_YAH=108 3612 4077 " HZ2 LYS A 238 "<>" OE1 GLU A 266 " d_HA=1.809 d_AD=2.667 a_DHA=138.934 symop: x,y,z a_YAH=107 3613 4078 " HZ3 LYS A 238 "<>" OE2 GLU A 266 " d_HA=1.804 d_AD=2.645 a_DHA=136.741 symop: x,y,z a_YAH=110 4073 4133 " H THR A 270 "<>" O GLU A 266 " d_HA=1.913 d_AD=2.853 a_DHA=152.674 symop: x,y,z a_YAH=142 4073 4136 " HG1 THR A 270 "<>" O GLU A 266 " d_HA=1.738 d_AD=2.686 a_DHA=163.271 symop: x,y,z a_YAH=141 8677 8753 " H ILE B 280 "<>" O LYS B 276 " d_HA=2.369 d_AD=3.011 a_DHA=120.321 symop: x,y,z a_YAH=136 8699 8753 " H ILE B 280 "<>" O ASN B 277 " d_HA=2.036 d_AD=2.902 a_DHA=141.782 symop: x,y,z a_YAH=108 8699 8773 " H GLU B 281 "<>" O ASN B 277 " d_HA=1.992 d_AD=3.000 a_DHA=171.747 symop: x,y,z a_YAH=174 8713 8787 " H ASN B 282 "<>" O VAL B 278 " d_HA=2.057 d_AD=2.861 a_DHA=134.521 symop: x,y,z a_YAH=134 8831 8895 " H PHE B 288 "<>" O LEU B 285 " d_HA=2.837 d_AD=3.706 a_DHA=145.100 symop: x,y,z a_YAH=127 8708 8772 "HD21 ASN B 277 "<>" OE2 GLU B 281 " d_HA=1.890 d_AD=2.754 a_DHA=139.382 symop: x,y,z a_YAH=108 7342 7403 " H ILE B 196 "<>" O LEU B 192 " d_HA=1.996 d_AD=2.957 a_DHA=156.596 symop: x,y,z a_YAH=148 4991 5075 " H ARG B 46 "<>" O MET B 42 " d_HA=1.954 d_AD=2.933 a_DHA=161.510 symop: x,y,z a_YAH=154 5008 5096 " H LEU B 47 "<>" O LEU B 43 " d_HA=2.014 d_AD=3.014 a_DHA=168.753 symop: x,y,z a_YAH=146 5067 5145 " H LEU B 50 "<>" O ARG B 46 " d_HA=2.093 d_AD=3.052 a_DHA=157.245 symop: x,y,z a_YAH=146 7328 7388 " H THR B 195 "<>" O ASN B 191 " d_HA=2.030 d_AD=3.046 a_DHA=175.191 symop: x,y,z a_YAH=159 7368 7428 " H THR B 198 "<>" O VAL B 194 " d_HA=1.885 d_AD=2.853 a_DHA=157.621 symop: x,y,z a_YAH=156 6989 7046 " H GLY B 172 "<>" O GLY B 168 " d_HA=1.840 d_AD=2.829 a_DHA=164.039 symop: x,y,z a_YAH=156 6989 7033 " H PHE B 171 "<>" O GLY B 168 " d_HA=2.183 d_AD=2.952 a_DHA=131.262 symop: x,y,z a_YAH=115 7025 7086 " H LEU B 175 "<>" O PHE B 171 " d_HA=2.151 d_AD=3.139 a_DHA=163.772 symop: x,y,z a_YAH=155 7361 7418 " H GLY B 197 "<>" O GLY B 193 " d_HA=2.003 d_AD=2.937 a_DHA=151.322 symop: x,y,z a_YAH=146 5027 5113 " H SER B 48 "<>" O ARG B 44 " d_HA=1.994 d_AD=2.960 a_DHA=158.454 symop: x,y,z a_YAH=151 5055 5454 " H VAL B 45 "<>" OE1 GLU B 71 " d_HA=2.932 d_AD=3.929 a_DHA=168.461 symop: x,y,z a_YAH=152 4483 4561 " H LYS B 17 "<>" O LEU B 13 " d_HA=1.965 d_AD=2.893 a_DHA=150.927 symop: x,y,z a_YAH=146 4502 4583 " H GLU B 18 "<>" O GLU B 14 " d_HA=1.946 d_AD=2.951 a_DHA=171.541 symop: x,y,z a_YAH=149 6996 7057 " H LEU B 173 "<>" O ALA B 169 " d_HA=1.921 d_AD=2.932 a_DHA=174.074 symop: x,y,z a_YAH=150 7006 7073 " H ALA B 174 "<>" O LEU B 170 " d_HA=2.074 d_AD=2.989 a_DHA=149.189 symop: x,y,z a_YAH=129 5431 5507 " H HIS B 74 "<>" O LEU B 70 " d_HA=2.667 d_AD=3.557 a_DHA=147.077 symop: x,y,z a_YAH=130 5392 5456 " H GLU B 71 "<>" O LEU B 67 " d_HA=2.597 d_AD=3.520 a_DHA=151.139 symop: x,y,z a_YAH=139 5411 5456 " H GLU B 71 "<>" O ALA B 68 " d_HA=2.443 d_AD=3.156 a_DHA=126.662 symop: x,y,z a_YAH=114 5411 5470 " H LEU B 72 "<>" O ALA B 68 " d_HA=2.030 d_AD=3.005 a_DHA=160.604 symop: x,y,z a_YAH=155 4539 4621 " H ILE B 20 "<>" O VAL B 16 " d_HA=1.950 d_AD=2.862 a_DHA=148.509 symop: x,y,z a_YAH=143 4555 4641 " H GLU B 21 "<>" O LYS B 17 " d_HA=1.959 d_AD=2.961 a_DHA=168.480 symop: x,y,z a_YAH=169 4577 4656 " H GLN B 22 "<>" O GLU B 18 " d_HA=2.088 d_AD=3.065 a_DHA=161.225 symop: x,y,z a_YAH=155 6423 6485 " H LYS B 138 "<>" O ASN B 134 " d_HA=2.004 d_AD=2.987 a_DHA=162.656 symop: x,y,z a_YAH=142 6437 6506 " H MET B 139 "<>" O VAL B 135 " d_HA=2.099 d_AD=3.009 a_DHA=148.461 symop: x,y,z a_YAH=149 5421 5488 " H VAL B 73 "<>" O ALA B 69 " d_HA=1.948 d_AD=2.941 a_DHA=164.825 symop: x,y,z a_YAH=154 4616 4691 " H LEU B 24 "<>" O ILE B 20 " d_HA=2.094 d_AD=3.098 a_DHA=170.212 symop: x,y,z a_YAH=148 4635 4708 " H SER B 25 "<>" O GLU B 21 " d_HA=1.889 d_AD=2.904 a_DHA=175.515 symop: x,y,z a_YAH=172 4650 4728 "HE21 GLN B 26 "<>" O GLN B 22 " d_HA=1.853 d_AD=2.844 a_DHA=164.551 symop: x,y,z a_YAH=155 6453 6521 " H SER B 140 "<>" O ILE B 136 " d_HA=2.034 d_AD=3.043 a_DHA=171.227 symop: x,y,z a_YAH=169 6453 6506 " H MET B 139 "<>" O ILE B 136 " d_HA=2.481 d_AD=3.124 a_DHA=120.910 symop: x,y,z a_YAH=99 6078 6142 " H PHE B 117 "<>" O LEU B 113 " d_HA=1.961 d_AD=2.967 a_DHA=169.752 symop: x,y,z a_YAH=155 6043 6116 " H SER B 115 "<>" O LEU B 111 " d_HA=1.991 d_AD=2.987 a_DHA=165.947 symop: x,y,z a_YAH=148 6062 6120 " HG SER B 115 "<>" O VAL B 112 " d_HA=1.776 d_AD=2.722 a_DHA=163.191 symop: x,y,z a_YAH=119 6062 6126 " H ALA B 116 "<>" O VAL B 112 " d_HA=2.155 d_AD=3.064 a_DHA=148.304 symop: x,y,z a_YAH=145 6097 6161 " H HIS B 118 "<>" O VAL B 114 " d_HA=1.859 d_AD=2.863 a_DHA=168.625 symop: x,y,z a_YAH=163 4667 4722 " H GLN B 26 "<>" O ILE B 23 " d_HA=2.058 d_AD=3.015 a_DHA=156.419 symop: x,y,z a_YAH=113 4686 4761 " H PHE B 28 "<>" O LEU B 24 " d_HA=1.788 d_AD=2.766 a_DHA=161.369 symop: x,y,z a_YAH=164 4686 4741 " H PHE B 27 "<>" O LEU B 24 " d_HA=1.874 d_AD=2.835 a_DHA=157.650 symop: x,y,z a_YAH=122 2216 2290 " HZ3 LYS A 152 "<>" O SER A 149 " d_HA=2.031 d_AD=2.980 a_DHA=154.570 symop: x,y,z a_YAH=118 2216 2260 " H TYR A 151 "<>" O SER A 149 " d_HA=2.061 d_AD=2.770 a_DHA=125.437 symop: x,y,z a_YAH=112 2216 2278 " H LYS A 152 "<>" O SER A 149 " d_HA=2.124 d_AD=3.076 a_DHA=155.452 symop: x,y,z a_YAH=128 8322 8395 " H ARG B 259 "<>" O MET B 255 " d_HA=2.086 d_AD=3.036 a_DHA=154.490 symop: x,y,z a_YAH=139 8296 8358 " H PHE B 257 "<>" O GLY B 253 " d_HA=1.801 d_AD=2.789 a_DHA=163.595 symop: x,y,z a_YAH=160 8303 8375 " H MET B 258 "<>" O LEU B 254 " d_HA=1.818 d_AD=2.815 a_DHA=165.817 symop: x,y,z a_YAH=156 8339 8417 " H GLU B 260 "<>" O SER B 256 " d_HA=1.901 d_AD=2.849 a_DHA=153.810 symop: x,y,z a_YAH=144 8350 8432 " H LYS B 261 "<>" O PHE B 257 " d_HA=1.849 d_AD=2.857 a_DHA=170.115 symop: x,y,z a_YAH=161 3553 3625 " H PHE A 239 "<>" O ALA A 235 " d_HA=2.062 d_AD=2.977 a_DHA=148.891 symop: x,y,z a_YAH=155 3617 3668 " H ALA A 242 "<>" O PHE A 239 " d_HA=2.563 d_AD=3.202 a_DHA=121.279 symop: x,y,z a_YAH=108 3617 3684 " H ARG A 243 "<>" O PHE A 239 " d_HA=2.508 d_AD=3.453 a_DHA=154.909 symop: x,y,z a_YAH=147 3504 3555 " H ALA A 235 "<>" O LEU A 232 " d_HA=2.530 d_AD=3.240 a_DHA=126.714 symop: x,y,z a_YAH=99 3504 3568 " H MET A 236 "<>" O LEU A 232 " d_HA=2.140 d_AD=3.136 a_DHA=166.848 symop: x,y,z a_YAH=153 3490 3555 " H ALA A 235 "<>" O PRO A 231 " d_HA=2.308 d_AD=3.177 a_DHA=143.076 symop: x,y,z a_YAH=140 7932 7997 " H ALA B 235 "<>" O PRO B 231 " d_HA=2.234 d_AD=3.164 a_DHA=151.535 symop: x,y,z a_YAH=142 7981 8043 " H LYS B 238 "<>" O THR B 234 " d_HA=2.418 d_AD=3.374 a_DHA=156.956 symop: x,y,z a_YAH=133 4013 4079 " H GLU A 266 "<>" O ILE A 263 " d_HA=2.225 d_AD=2.957 a_DHA=128.014 symop: x,y,z a_YAH=107 4013 4091 " H CYS A 267 "<>" O ILE A 263 " d_HA=2.029 d_AD=3.025 a_DHA=166.143 symop: x,y,z a_YAH=161 4006 4079 " H GLU A 266 "<>" O GLY A 262 " d_HA=2.646 d_AD=3.512 a_DHA=143.573 symop: x,y,z a_YAH=134 4006 4057 " H LYS A 265 "<>" O GLY A 262 " d_HA=1.913 d_AD=2.869 a_DHA=155.905 symop: x,y,z a_YAH=138 8767 8799 " H SER B 283 "<>" O GLU B 281 " d_HA=2.134 d_AD=3.038 a_DHA=147.162 symop: x,y,z a_YAH=99 8782 8836 " H LEU B 285 "<>" O ASN B 282 " d_HA=1.933 d_AD=2.923 a_DHA=164.064 symop: x,y,z a_YAH=130 8796 8858 " H ARG B 286 "<>" O SER B 283 " d_HA=2.451 d_AD=3.389 a_DHA=153.796 symop: x,y,z a_YAH=104 8785 8823 " HE1 TRP B 284 "<>" OD1 ASN B 282 " d_HA=2.045 d_AD=2.903 a_DHA=139.774 symop: x,y,z a_YAH=131 4473 5206 " HZ1 LYS B 53 "<>" OE2 GLU B 12 " d_HA=1.738 d_AD=2.669 a_DHA=148.680 symop: x,y,z a_YAH=129 4456 4472 " H3 TYR B 11 "<>" OE1 GLU B 12 " d_HA=1.886 d_AD=2.602 a_DHA=124.588 symop: x,y,z a_YAH=139 7276 7347 " H LEU B 192 "<>" O ASP B 188 " d_HA=2.004 d_AD=3.012 a_DHA=170.567 symop: x,y,z a_YAH=151 5091 5162 " H SER B 51 "<>" O LEU B 47 " d_HA=2.006 d_AD=2.970 a_DHA=157.840 symop: x,y,z a_YAH=148 5051 5126 " H ILE B 49 "<>" O VAL B 45 " d_HA=1.850 d_AD=2.856 a_DHA=170.662 symop: x,y,z a_YAH=156 5110 5178 " H PHE B 52 "<>" O SER B 48 " d_HA=1.870 d_AD=2.865 a_DHA=166.374 symop: x,y,z a_YAH=162 5121 5196 " H LYS B 53 "<>" O ILE B 49 " d_HA=2.061 d_AD=3.072 a_DHA=172.966 symop: x,y,z a_YAH=149 4445 4508 " H GLU B 14 "<>" O TYR B 11 " d_HA=2.703 d_AD=3.671 a_DHA=160.992 symop: x,y,z a_YAH=114 4445 4488 " H LEU B 13 "<>" O TYR B 11 " d_HA=1.787 d_AD=2.694 a_DHA=147.687 symop: x,y,z a_YAH=111 4468 4543 " H VAL B 16 "<>" O GLU B 12 " d_HA=2.646 d_AD=3.526 a_DHA=145.812 symop: x,y,z a_YAH=125 7307 7372 " H VAL B 194 "<>" O TYR B 190 " d_HA=1.888 d_AD=2.850 a_DHA=156.457 symop: x,y,z a_YAH=155 7045 7106 " H GLN B 176 "<>" O GLY B 172 " d_HA=1.916 d_AD=2.905 a_DHA=163.578 symop: x,y,z a_YAH=157 7288 7362 " H GLY B 193 "<>" O LEU B 189 " d_HA=2.009 d_AD=2.951 a_DHA=152.999 symop: x,y,z a_YAH=139 7052 7122 " H LEU B 177 "<>" O LEU B 173 " d_HA=1.937 d_AD=2.836 a_DHA=146.293 symop: x,y,z a_YAH=155 7071 7122 " H LEU B 177 "<>" O ALA B 174 " d_HA=2.953 d_AD=3.711 a_DHA=132.242 symop: x,y,z a_YAH=92 5117 7071 " HG SER B 48 "<>" O ALA B 174 " d_HA=1.679 d_AD=2.612 a_DHA=158.050 symop: x,y,z a_YAH=146 4517 4600 " H ARG B 19 "<>" O LYS B 15 " d_HA=2.031 d_AD=3.035 a_DHA=169.780 symop: x,y,z a_YAH=147 5381 5436 " H LEU B 70 "<>" O SER B 66 " d_HA=1.995 d_AD=2.930 a_DHA=152.134 symop: x,y,z a_YAH=145 5351 5413 " H ALA B 68 "<>" O ILE B 64 " d_HA=2.010 d_AD=2.892 a_DHA=143.927 symop: x,y,z a_YAH=136 5370 5423 " H ALA B 69 "<>" O SER B 65 " d_HA=1.954 d_AD=2.968 a_DHA=177.513 symop: x,y,z a_YAH=159 6426 6497 " HZ3 LYS B 138 "<>" OD1 ASN B 134 " d_HA=1.795 d_AD=2.759 a_DHA=155.954 symop: x,y,z a_YAH=152 6350 6428 " H ASN B 134 "<>" O ARG B 130 " d_HA=1.961 d_AD=2.939 a_DHA=160.768 symop: x,y,z a_YAH=148 6374 6441 " H VAL B 135 "<>" O ALA B 131 " d_HA=2.165 d_AD=3.105 a_DHA=153.085 symop: x,y,z a_YAH=152 6384 6458 " H ILE B 136 "<>" O PHE B 132 " d_HA=1.967 d_AD=2.953 a_DHA=163.145 symop: x,y,z a_YAH=162 4592 4672 " H ILE B 23 "<>" O ARG B 19 " d_HA=1.944 d_AD=2.882 a_DHA=152.638 symop: x,y,z a_YAH=142 4609 4654 "HH11 ARG B 19 "<>" OE1 GLN B 22 " d_HA=1.893 d_AD=2.853 a_DHA=155.867 symop: x,y,z a_YAH=145 6404 6473 " H GLY B 137 "<>" O LEU B 133 " d_HA=2.151 d_AD=3.153 a_DHA=170.504 symop: x,y,z a_YAH=148 6124 6189 " H VAL B 120 "<>" O ALA B 116 " d_HA=2.179 d_AD=3.108 a_DHA=151.472 symop: x,y,z a_YAH=151 6134 6189 " H VAL B 120 "<>" O PHE B 117 " d_HA=2.774 d_AD=3.399 a_DHA=120.130 symop: x,y,z a_YAH=91 6134 6207 " H GLU B 121 "<>" O PHE B 117 " d_HA=2.273 d_AD=3.016 a_DHA=128.943 symop: x,y,z a_YAH=137 6113 6175 " H THR B 119 "<>" O SER B 115 " d_HA=1.991 d_AD=2.979 a_DHA=164.555 symop: x,y,z a_YAH=141 6113 6178 " HG1 THR B 119 "<>" O SER B 115 " d_HA=1.785 d_AD=2.749 a_DHA=169.969 symop: x,y,z a_YAH=149 8285 8346 " HG SER B 256 "<>" O SER B 252 " d_HA=1.722 d_AD=2.685 a_DHA=167.966 symop: x,y,z a_YAH=156 8285 8342 " H SER B 256 "<>" O SER B 252 " d_HA=2.276 d_AD=3.202 a_DHA=151.524 symop: x,y,z a_YAH=134 8252 8288 " H SER B 252 "<>" OD1 ASP B 250 " d_HA=2.522 d_AD=3.306 a_DHA=134.027 symop: x,y,z a_YAH=145 8252 8297 " H GLY B 253 "<>" OD1 ASP B 250 " d_HA=1.833 d_AD=2.845 a_DHA=170.762 symop: x,y,z a_YAH=105 2251 3801 "HH12 ARG A 249 "<>" O TYR A 151 " d_HA=2.660 d_AD=3.389 a_DHA=129.433 symop: x,y,z a_YAH=161 2251 3803 "HH22 ARG A 249 "<>" O TYR A 151 " d_HA=1.798 d_AD=2.791 a_DHA=164.740 symop: x,y,z a_YAH=144 3734 3800 "HH11 ARG A 249 "<>" O PHE A 246 " d_HA=1.824 d_AD=2.796 a_DHA=159.166 symop: x,y,z a_YAH=136 3734 3791 " H ARG A 249 "<>" O PHE A 246 " d_HA=2.110 d_AD=2.987 a_DHA=143.468 symop: x,y,z a_YAH=99 8261 8327 " H MET B 255 "<>" O TRP B 251 " d_HA=1.974 d_AD=2.954 a_DHA=161.430 symop: x,y,z a_YAH=131 8249 8308 " H LEU B 254 "<>" O ASP B 250 " d_HA=1.827 d_AD=2.835 a_DHA=170.729 symop: x,y,z a_YAH=151 3637 3706 " H GLN A 244 "<>" O PRO A 240 " d_HA=1.888 d_AD=2.850 a_DHA=157.473 symop: x,y,z a_YAH=149 3676 3760 " H GLU A 247 "<>" O ARG A 243 " d_HA=1.874 d_AD=2.869 a_DHA=165.202 symop: x,y,z a_YAH=156 3666 3742 " H PHE A 246 "<>" O ALA A 242 " d_HA=2.104 d_AD=3.049 a_DHA=154.555 symop: x,y,z a_YAH=137 8108 8184 " H PHE B 246 "<>" O ALA B 242 " d_HA=2.112 d_AD=3.067 a_DHA=156.142 symop: x,y,z a_YAH=147 8079 8148 " H GLN B 244 "<>" O PRO B 240 " d_HA=2.007 d_AD=3.014 a_DHA=172.524 symop: x,y,z a_YAH=157 8093 8164 " H MET B 245 "<>" O GLU B 241 " d_HA=1.943 d_AD=2.920 a_DHA=160.445 symop: x,y,z a_YAH=149 3651 3722 " H MET A 245 "<>" O GLU A 241 " d_HA=1.836 d_AD=2.849 a_DHA=172.621 symop: x,y,z a_YAH=169 3861 3933 " H MET A 258 "<>" O LEU A 254 " d_HA=1.882 d_AD=2.876 a_DHA=164.626 symop: x,y,z a_YAH=154 7969 7901 " H VAL B 233 "<>" O SER B 229 " d_HA=2.232 d_AD=3.238 a_DHA=169.782 symop: x,y,z a_YAH=161 7946 8010 " H MET B 236 "<>" O LEU B 232 " d_HA=1.932 d_AD=2.941 a_DHA=171.569 symop: x,y,z a_YAH=160 7995 8067 " H PHE B 239 "<>" O ALA B 235 " d_HA=2.053 d_AD=2.988 a_DHA=152.478 symop: x,y,z a_YAH=154 8059 8110 " H ALA B 242 "<>" O PHE B 239 " d_HA=2.364 d_AD=3.105 a_DHA=129.252 symop: x,y,z a_YAH=108 8059 8126 " H ARG B 243 "<>" O PHE B 239 " d_HA=2.324 d_AD=3.286 a_DHA=157.735 symop: x,y,z a_YAH=149 3908 3990 " H LYS A 261 "<>" O PHE A 257 " d_HA=1.842 d_AD=2.857 a_DHA=173.817 symop: x,y,z a_YAH=157 3928 4018 " H ILE A 263 "<>" O MET A 258 " d_HA=2.259 d_AD=2.951 a_DHA=124.490 symop: x,y,z a_YAH=150 7912 7988 " HG1 THR B 234 "<>" O PHE B 230 " d_HA=1.801 d_AD=2.764 a_DHA=169.968 symop: x,y,z a_YAH=140 7912 7985 " H THR B 234 "<>" O PHE B 230 " d_HA=2.069 d_AD=3.038 a_DHA=159.154 symop: x,y,z a_YAH=152 6789 8026 " H LYS B 156 "<>" OE1 GLU B 237 " d_HA=1.841 d_AD=2.857 a_DHA=170.298 symop: x,y,z a_YAH=120 7965 8028 " H GLU B 237 "<>" O VAL B 233 " d_HA=1.904 d_AD=2.889 a_DHA=162.153 symop: x,y,z a_YAH=153 8022 8138 "HH22 ARG B 243 "<>" O GLU B 237 " d_HA=2.908 d_AD=3.692 a_DHA=135.321 symop: x,y,z a_YAH=115 6783 6861 " H LEU B 160 "<>" O LYS B 156 " d_HA=1.936 d_AD=2.940 a_DHA=169.564 symop: x,y,z a_YAH=148 6800 6810 " HZ2 LYS B 156 "<>" OE2 GLU B 157 " d_HA=1.868 d_AD=2.635 a_DHA=128.817 symop: x,y,z a_YAH=130 5140 5217 " H ASN B 54 "<>" O LEU B 50 " d_HA=1.843 d_AD=2.809 a_DHA=157.958 symop: x,y,z a_YAH=151 5190 5251 " H GLY B 56 "<>" O LYS B 53 " d_HA=2.411 d_AD=3.290 a_DHA=145.275 symop: x,y,z a_YAH=91 5159 5234 " H ARG B 55 "<>" O SER B 51 " d_HA=1.914 d_AD=2.910 a_DHA=165.468 symop: x,y,z a_YAH=154 5166 7081 " HG SER B 51 "<>" O LEU B 175 " d_HA=1.698 d_AD=2.675 a_DHA=179.147 symop: x,y,z a_YAH=129 5170 5261 " H VAL B 57 "<>" O PHE B 52 " d_HA=2.107 d_AD=2.960 a_DHA=140.743 symop: x,y,z a_YAH=153 4534 4582 " HZ2 LYS B 15 "<>" OE2 GLU B 18 " d_HA=1.714 d_AD=2.687 a_DHA=156.233 symop: -y+1,-x+1,-z+1 a_YAH=115 4535 5288 " HZ3 LYS B 15 "<>" O ILE B 59 " d_HA=2.841 d_AD=3.783 a_DHA=155.144 symop: x,y,z a_YAH=165 4464 4581 " HH TYR B 11 "<>" OE1 GLU B 18 " d_HA=1.566 d_AD=2.560 a_DHA=178.703 symop: -y+1,-x+1,-z+1 a_YAH=138 7261 7333 " H ASN B 191 "<>" O GLU B 187 " d_HA=1.911 d_AD=2.928 a_DHA=175.331 symop: x,y,z a_YAH=167 7254 7316 " H TYR B 190 "<>" O GLY B 186 " d_HA=2.119 d_AD=2.968 a_DHA=139.866 symop: x,y,z a_YAH=135 7100 7152 " H ALA B 179 "<>" O GLN B 176 " d_HA=2.279 d_AD=3.011 a_DHA=128.263 symop: x,y,z a_YAH=125 7100 7165 " H LEU B 180 "<>" O GLN B 176 " d_HA=2.303 d_AD=3.274 a_DHA=160.288 symop: x,y,z a_YAH=151 7117 7184 " H LEU B 181 "<>" O LEU B 177 " d_HA=2.332 d_AD=3.201 a_DHA=143.228 symop: x,y,z a_YAH=151 5307 5356 " H ILE B 64 "<>" O GLY B 60 " d_HA=1.908 d_AD=2.922 a_DHA=172.770 symop: x,y,z a_YAH=163 5307 5343 " H ALA B 63 "<>" O GLY B 60 " d_HA=2.528 d_AD=3.177 a_DHA=121.751 symop: x,y,z a_YAH=98 7112 7254 "HE21 GLN B 176 "<>" O GLY B 186 " d_HA=2.306 d_AD=3.208 a_DHA=147.914 symop: x,y,z a_YAH=96 5314 5373 " H SER B 65 "<>" O GLU B 61 " d_HA=1.857 d_AD=2.801 a_DHA=153.213 symop: x,y,z a_YAH=145 5314 5377 " HG SER B 65 "<>" O GLU B 61 " d_HA=1.797 d_AD=2.747 a_DHA=161.886 symop: x,y,z a_YAH=131 5329 5388 " HG SER B 66 "<>" O ASP B 62 " d_HA=1.781 d_AD=2.733 a_DHA=164.247 symop: x,y,z a_YAH=147 5329 5384 " H SER B 66 "<>" O ASP B 62 " d_HA=1.867 d_AD=2.833 a_DHA=158.143 symop: x,y,z a_YAH=138 5341 5397 " H LEU B 67 "<>" O ALA B 63 " d_HA=1.832 d_AD=2.819 a_DHA=163.014 symop: x,y,z a_YAH=157 4608 5372 " HE ARG B 19 "<>" OG SER B 65 " d_HA=1.872 d_AD=2.863 a_DHA=165.162 symop: x,y,z a_YAH=124 a_YAH=114 6285 6376 " H ALA B 131 "<>" O LYS B 127 " d_HA=2.030 d_AD=2.965 a_DHA=152.663 symop: x,y,z a_YAH=151 6285 6358 " H ARG B 130 "<>" O LYS B 127 " d_HA=2.647 d_AD=3.283 a_DHA=121.025 symop: x,y,z a_YAH=103 6307 6392 " H PHE B 132 "<>" O LEU B 128 " d_HA=1.967 d_AD=2.978 a_DHA=174.786 symop: x,y,z a_YAH=167 6171 6236 " H ILE B 123 "<>" O THR B 119 " d_HA=2.802 d_AD=3.728 a_DHA=152.733 symop: x,y,z a_YAH=133 4611 5372 "HH21 ARG B 19 "<>" OG SER B 65 " d_HA=2.297 d_AD=3.158 a_DHA=142.295 symop: x,y,z a_YAH=107 a_YAH=140 6326 6409 " H LEU B 133 "<>" O ARG B 129 " d_HA=2.100 d_AD=3.096 a_DHA=167.321 symop: x,y,z a_YAH=141 6154 6207 " H GLU B 121 "<>" O HIS B 118 " d_HA=2.200 d_AD=2.979 a_DHA=132.322 symop: x,y,z a_YAH=104 6154 6222 " H GLU B 122 "<>" O HIS B 118 " d_HA=2.140 d_AD=3.140 a_DHA=168.025 symop: x,y,z a_YAH=170 1725 1779 " HE2 HIS A 118 "<>" OE2 GLU A 122 " d_HA=1.968 d_AD=2.903 a_DHA=149.736 symop: x,y,z a_YAH=99 1763 6342 " HE ARG B 129 "<>" OE1 GLU A 121 " d_HA=1.926 d_AD=2.875 a_DHA=153.562 symop: x,y,z a_YAH=105 1763 1901 "HH11 ARG A 129 "<>" OE1 GLU A 121 " d_HA=1.834 d_AD=2.757 a_DHA=147.976 symop: x,y,z a_YAH=138 1900 6205 " HE ARG A 129 "<>" OE1 GLU B 121 " d_HA=1.849 d_AD=2.795 a_DHA=152.349 symop: x,y,z a_YAH=112 6167 6221 " HE2 HIS B 118 "<>" OE2 GLU B 122 " d_HA=1.850 d_AD=2.792 a_DHA=150.803 symop: x,y,z a_YAH=103 8225 8272 " H TRP B 251 "<>" O ARG B 249 " d_HA=2.253 d_AD=3.054 a_DHA=135.094 symop: x,y,z a_YAH=106 8159 8254 " H ASP B 250 "<>" O MET B 245 " d_HA=2.019 d_AD=2.936 a_DHA=149.397 symop: x,y,z a_YAH=164 8142 8216 " H ASN B 248 "<>" O GLN B 244 " d_HA=1.834 d_AD=2.837 a_DHA=169.232 symop: x,y,z a_YAH=158 3700 3774 " H ASN A 248 "<>" O GLN A 244 " d_HA=1.935 d_AD=2.893 a_DHA=155.620 symop: x,y,z a_YAH=150 3712 3772 "HE21 GLN A 244 "<>" OD1 ASN A 248 " d_HA=1.823 d_AD=2.823 a_DHA=166.777 symop: x,y,z a_YAH=113 3717 3812 " H ASP A 250 "<>" O MET A 245 " d_HA=2.017 d_AD=2.972 a_DHA=156.266 symop: x,y,z a_YAH=155 3783 3830 " H TRP A 251 "<>" O ARG A 249 " d_HA=2.233 d_AD=3.017 a_DHA=133.023 symop: x,y,z a_YAH=107 8176 8233 " H ARG B 249 "<>" O PHE B 246 " d_HA=2.077 d_AD=2.970 a_DHA=145.438 symop: x,y,z a_YAH=102 8118 8202 " H GLU B 247 "<>" O ARG B 243 " d_HA=2.116 d_AD=3.117 a_DHA=167.508 symop: x,y,z a_YAH=153 3807 3866 " H LEU A 254 "<>" O ASP A 250 " d_HA=1.877 d_AD=2.868 a_DHA=163.911 symop: x,y,z a_YAH=150 3854 3916 " H PHE A 257 "<>" O GLY A 253 " d_HA=1.816 d_AD=2.826 a_DHA=172.478 symop: x,y,z a_YAH=161 3819 3885 " H MET A 255 "<>" O TRP A 251 " d_HA=1.933 d_AD=2.920 a_DHA=162.872 symop: x,y,z a_YAH=140 3843 3900 " H SER A 256 "<>" O SER A 252 " d_HA=2.092 d_AD=3.066 a_DHA=159.856 symop: x,y,z a_YAH=143 3897 3975 " H GLU A 260 "<>" O SER A 256 " d_HA=1.862 d_AD=2.834 a_DHA=158.490 symop: x,y,z a_YAH=155 3880 3953 " H ARG A 259 "<>" O MET A 255 " d_HA=2.121 d_AD=3.044 a_DHA=149.442 symop: x,y,z a_YAH=143 6769 6826 " H GLU B 158 "<>" O THR B 155 " d_HA=2.539 d_AD=3.256 a_DHA=127.117 symop: x,y,z a_YAH=94 6769 6844 " H TYR B 159 "<>" O THR B 155 " d_HA=1.986 d_AD=2.983 a_DHA=167.279 symop: x,y,z a_YAH=153 6773 6824 " H THR B 155 "<>" OE1 GLU B 158 " d_HA=1.923 d_AD=2.917 a_DHA=163.521 symop: x,y,z a_YAH=133 3973 4002 " HZ3 LYS A 261 "<>" OE1 GLU A 260 " d_HA=1.751 d_AD=2.598 a_DHA=136.745 symop: x,y,z a_YAH=152 6820 6904 " H ILE B 162 "<>" O GLU B 158 " d_HA=2.161 d_AD=3.074 a_DHA=149.017 symop: x,y,z a_YAH=145 6805 6883 " H ARG B 161 "<>" O GLU B 157 " d_HA=2.335 d_AD=3.304 a_DHA=160.335 symop: x,y,z a_YAH=126 6805 6891 " HE ARG B 161 "<>" O GLU B 157 " d_HA=2.014 d_AD=2.843 a_DHA=137.411 symop: x,y,z a_YAH=121 6771 6826 " H GLU B 158 "<>" OG1 THR B 155 " d_HA=2.325 d_AD=3.221 a_DHA=146.192 symop: x,y,z a_YAH=128 a_YAH=113 6776 6809 " HG1 THR B 155 "<>" OE1 GLU B 157 " d_HA=1.687 d_AD=2.657 a_DHA=166.644 symop: x,y,z a_YAH=147 5277 5293 " H ILE B 59 "<>" OE1 GLU B 58 " d_HA=1.736 d_AD=2.718 a_DHA=160.005 symop: x,y,z a_YAH=140 7235 7267 " H GLU B 187 "<>" O LEU B 185 " d_HA=2.080 d_AD=2.952 a_DHA=142.454 symop: x,y,z a_YAH=93 5246 7224 "HH22 ARG B 55 "<>" OE1 GLU B 184 " d_HA=1.703 d_AD=2.672 a_DHA=154.452 symop: x,y,z a_YAH=126 7136 7204 " H GLU B 182 "<>" O PRO B 178 " d_HA=2.131 d_AD=3.140 a_DHA=174.240 symop: x,y,z a_YAH=159 7136 7184 " H LEU B 181 "<>" O PRO B 178 " d_HA=2.560 d_AD=3.285 a_DHA=128.197 symop: x,y,z a_YAH=96 7150 7226 " H GLU B 184 "<>" O ALA B 179 " d_HA=1.930 d_AD=2.795 a_DHA=141.227 symop: x,y,z a_YAH=163 5273 5308 " H GLY B 60 "<>" O GLU B 58 " d_HA=2.456 d_AD=3.335 a_DHA=144.692 symop: x,y,z a_YAH=90 7220 7255 " H GLY B 186 "<>" O GLU B 184 " d_HA=2.793 d_AD=3.445 a_DHA=122.784 symop: x,y,z a_YAH=101 6266 7160 "HD21 ASN B 125 "<>" O LEU B 180 " d_HA=1.867 d_AD=2.834 a_DHA=157.476 symop: x,y,z a_YAH=137 7160 7214 " H GLY B 183 "<>" O LEU B 180 " d_HA=2.492 d_AD=3.310 a_DHA=137.768 symop: x,y,z a_YAH=93 6257 6334 " H ARG B 129 "<>" O ASN B 125 " d_HA=1.908 d_AD=2.926 a_DHA=178.479 symop: x,y,z a_YAH=172 6260 6291 " H LYS B 127 "<>" OD1 ASN B 125 " d_HA=2.137 d_AD=3.015 a_DHA=143.690 symop: x,y,z a_YAH=156 6260 6312 " H LEU B 128 "<>" OD1 ASN B 125 " d_HA=1.972 d_AD=2.984 a_DHA=176.277 symop: x,y,z a_YAH=116 1764 6367 "HH11 ARG B 130 "<>" OE2 GLU A 121 " d_HA=1.782 d_AD=2.747 a_DHA=154.740 symop: x,y,z a_YAH=146 1764 6345 "HH21 ARG B 129 "<>" OE2 GLU A 121 " d_HA=1.795 d_AD=2.793 a_DHA=162.893 symop: x,y,z a_YAH=99 6271 6358 " H ARG B 130 "<>" O ASN B 126 " d_HA=2.932 d_AD=3.836 a_DHA=149.538 symop: x,y,z a_YAH=113 6274 6346 "HH22 ARG B 129 "<>" OD1 ASN B 126 " d_HA=1.759 d_AD=2.745 a_DHA=165.434 symop: x,y,z a_YAH=135 6274 6344 "HH12 ARG B 129 "<>" OD1 ASN B 126 " d_HA=2.513 d_AD=3.269 a_DHA=131.374 symop: x,y,z a_YAH=133 6201 6251 " H GLY B 124 "<>" O GLU B 121 " d_HA=2.006 d_AD=2.901 a_DHA=145.395 symop: x,y,z a_YAH=107 6250 6344 "HH12 ARG B 129 "<>" O GLY B 124 " d_HA=2.425 d_AD=3.247 a_DHA=138.118 symop: x,y,z a_YAH=122 1903 6206 "HH21 ARG A 129 "<>" OE2 GLU B 121 " d_HA=1.771 d_AD=2.788 a_DHA=168.158 symop: x,y,z a_YAH=101 1925 6206 "HH11 ARG A 130 "<>" OE2 GLU B 121 " d_HA=1.748 d_AD=2.727 a_DHA=157.262 symop: x,y,z a_YAH=143 3810 3855 " H GLY A 253 "<>" OD1 ASP A 250 " d_HA=1.859 d_AD=2.875 a_DHA=172.446 symop: x,y,z a_YAH=105 3810 3846 " H SER A 252 "<>" OD1 ASP A 250 " d_HA=2.651 d_AD=3.294 a_DHA=121.479 symop: x,y,z a_YAH=147 6658 6720 " H LYS B 152 "<>" O SER B 149 " d_HA=2.404 d_AD=3.082 a_DHA=123.091 symop: x,y,z a_YAH=157 4855 5803 " HZ3 LYS B 93 "<>" O LYS B 34 " d_HA=1.806 d_AD=2.755 a_DHA=152.656 symop: x,y,z a_YAH=136 4882 4819 " H ASP B 35 "<>" O ILE B 32 " d_HA=1.925 d_AD=2.793 a_DHA=141.552 symop: x,y,z a_YAH=106 4640 4712 " HG SER B 25 "<>" OE2 GLU B 21 " d_HA=1.601 d_AD=2.586 a_DHA=170.644 symop: x,y,z a_YAH=143 7225 7240 " H LEU B 185 "<>" OE2 GLU B 184 " d_HA=1.789 d_AD=2.801 a_DHA=169.868 symop: x,y,z a_YAH=96 6302 7213 " HZ2 LYS B 127 "<>" O GLY B 183 " d_HA=1.720 d_AD=2.741 a_DHA=176.411 symop: x,y,z a_YAH=149 4881 5923 " HH TYR B 100 "<>" OD2 ASP B 35 " d_HA=1.670 d_AD=2.647 a_DHA=172.413 symop: x,y,z a_YAH=149 4787 4861 " H LYS B 34 "<>" O GLU B 30 " d_HA=2.379 d_AD=3.369 a_DHA=163.376 symop: x,y,z a_YAH=159 4773 4824 " H ILE B 32 "<>" O PRO B 29 " d_HA=2.066 d_AD=2.972 a_DHA=147.661 symop: x,y,z a_YAH=131 4773 4843 " H MET B 33 "<>" O PRO B 29 " d_HA=2.039 d_AD=2.986 a_DHA=154.324 symop: x,y,z a_YAH=146 4728 4650 "HE21 GLN B 26 "<>" O GLN B 22 " d_HA=1.853 d_AD=2.844 a_DHA=164.551 symop: x,y,z a_YAH=155 ------------------------------------------------------------------------------- Total: 798 Symmetry: 0 Per residue: 1.4378 Mean SD Skew Kurtosis theta_1: 143.192 22.042 -0.466 1.940 theta_2: 130.772 24.551 -0.203 1.588 d_HA: 2.342 0.323 0.495 2.024 2926 3008 " HZ1 LYS B 39 "<>" OE2 GLU B 35 " d_HA=1.860 d_AD=2.629 a_DHA=128.306 symop: x,y,z a_YAH=142 2921 2998 " H LYS B 39 "<>" O GLU B 35 " d_HA=2.277 d_AD=3.249 a_DHA=159.726 symop: x,y,z a_YAH=142 2846 2927 " H GLU B 35 "<>" O ASN B 31 " d_HA=2.144 d_AD=3.119 a_DHA=160.630 symop: x,y,z a_YAH=137 2860 2942 " H GLU B 36 "<>" O LYS B 32 " d_HA=1.817 d_AD=2.787 a_DHA=158.242 symop: x,y,z a_YAH=157 2866 2813 " H LYS B 32 "<>" O THR B 29 " d_HA=2.316 d_AD=3.012 a_DHA=124.973 symop: x,y,z a_YAH=119 446 528 " HZ1 LYS A 39 "<>" OE2 GLU A 35 " d_HA=1.816 d_AD=2.544 a_DHA=124.511 symop: x,y,z a_YAH=153 2033 2082 " H GLY A 139 "<>" O ARG A 137 " d_HA=1.852 d_AD=2.732 a_DHA=143.598 symop: x,y,z a_YAH=110 2121 2171 " H GLN A 145 "<>" OD1 ASN A 142 " d_HA=1.778 d_AD=2.789 a_DHA=174.124 symop: x,y,z a_YAH=158 2123 2169 " H ASN A 142 "<>" OE1 GLN A 145 " d_HA=1.866 d_AD=2.859 a_DHA=165.080 symop: x,y,z a_YAH=132 3338 3348 " HZ2 LYS B 60 "<>" OE2 GLU B 61 " d_HA=2.855 d_AD=3.795 a_DHA=152.923 symop: x,y,z a_YAH=162 2988 3343 " HZ3 LYS B 38 "<>" O GLU B 61 " d_HA=1.849 d_AD=2.710 a_DHA=139.536 symop: x,y,z a_YAH=132 3271 3349 " H GLU B 61 "<>" O LEU B 57 " d_HA=2.967 d_AD=3.690 a_DHA=129.077 symop: x,y,z a_YAH=121 366 447 " H GLU A 35 "<>" O ASN A 31 " d_HA=2.095 d_AD=3.102 a_DHA=171.349 symop: x,y,z a_YAH=143 380 462 " H GLU A 36 "<>" O LYS A 32 " d_HA=1.825 d_AD=2.769 a_DHA=152.698 symop: x,y,z a_YAH=149 441 518 " H LYS A 39 "<>" O GLU A 35 " d_HA=2.408 d_AD=3.295 a_DHA=145.351 symop: x,y,z a_YAH=127 1970 2065 " H ARG A 138 "<>" O ARG A 134 " d_HA=1.836 d_AD=2.752 a_DHA=148.518 symop: x,y,z a_YAH=120 1970 2041 " H ARG A 137 "<>" O ARG A 134 " d_HA=2.495 d_AD=3.173 a_DHA=123.987 symop: x,y,z a_YAH=92 1951 2017 " H LYS A 136 "<>" O ILE A 133 " d_HA=1.999 d_AD=2.942 a_DHA=153.612 symop: x,y,z a_YAH=116 1951 2041 " H ARG A 137 "<>" O ILE A 133 " d_HA=2.216 d_AD=3.056 a_DHA=139.459 symop: x,y,z a_YAH=143 1986 2088 " HE ARG A 134 "<>" O ALA A 140 " d_HA=1.759 d_AD=2.734 a_DHA=160.351 symop: x,y,z a_YAH=150 1989 2088 "HH21 ARG A 134 "<>" O ALA A 140 " d_HA=2.160 d_AD=2.983 a_DHA=136.631 symop: x,y,z a_YAH=137 1989 2098 "HH21 ARG A 134 "<>" O PHE A 141 " d_HA=2.050 d_AD=2.844 a_DHA=133.080 symop: x,y,z a_YAH=131 2118 2187 " H LEU A 146 "<>" O ASN A 142 " d_HA=1.875 d_AD=2.851 a_DHA=159.970 symop: x,y,z a_YAH=155 2132 2206 " H LEU A 147 "<>" O SER A 143 " d_HA=2.202 d_AD=3.172 a_DHA=159.876 symop: x,y,z a_YAH=144 2143 2229 " H TYR A 148 "<>" O LYS A 144 " d_HA=2.189 d_AD=3.150 a_DHA=157.379 symop: x,y,z a_YAH=149 2182 2266 " H GLU A 150 "<>" O LEU A 146 " d_HA=1.914 d_AD=2.875 a_DHA=156.901 symop: x,y,z a_YAH=150 2165 2246 " H LEU A 149 "<>" O GLN A 145 " d_HA=2.184 d_AD=3.192 a_DHA=172.746 symop: x,y,z a_YAH=162 2306 2220 " H TYR A 152 "<>" O TYR A 148 " d_HA=2.148 d_AD=2.924 a_DHA=131.879 symop: x,y,z a_YAH=147 2201 2281 " H LYS A 151 "<>" O LEU A 147 " d_HA=2.224 d_AD=3.097 a_DHA=142.853 symop: x,y,z a_YAH=147 297 340 " HG1 THR A 29 "<>" OG1 THR A 26 " d_HA=1.739 d_AD=2.695 a_DHA=165.954 symop: x,y,z a_YAH=120 a_YAH=98 333 386 " H LYS A 32 "<>" O THR A 29 " d_HA=2.208 d_AD=2.926 a_DHA=126.672 symop: x,y,z a_YAH=123 333 410 " H PHE A 33 "<>" O THR A 29 " d_HA=1.901 d_AD=2.834 a_DHA=151.833 symop: x,y,z a_YAH=146 347 427 " H ILE A 34 "<>" O LEU A 30 " d_HA=1.956 d_AD=2.968 a_DHA=173.611 symop: x,y,z a_YAH=165 402 476 " H LEU A 37 "<>" O PHE A 33 " d_HA=1.824 d_AD=2.842 a_DHA=178.482 symop: x,y,z a_YAH=169 422 496 " H LYS A 38 "<>" O ILE A 34 " d_HA=1.837 d_AD=2.843 a_DHA=167.822 symop: x,y,z a_YAH=163 456 543 " H TYR A 40 "<>" O GLU A 36 " d_HA=2.129 d_AD=3.041 a_DHA=148.343 symop: x,y,z a_YAH=150 40 171 "HH11 ARG A 18 "<>" OE2 GLU A 11 " d_HA=1.707 d_AD=2.725 a_DHA=171.000 symop: x,y,z a_YAH=176 1998 2027 " HZ1 LYS A 136 "<>" OE1 GLN A 135 " d_HA=2.419 d_AD=3.316 a_DHA=146.825 symop: -y+1/2,-z+1,x+1/2 a_YAH=116 858 868 " HZ2 LYS A 60 "<>" OE2 GLU A 61 " d_HA=1.980 d_AD=2.998 a_DHA=169.263 symop: x,y,z a_YAH=166 471 566 " H VAL A 42 "<>" O LEU A 37 " d_HA=2.167 d_AD=3.178 a_DHA=175.159 symop: x,y,z a_YAH=146 490 556 " H GLY A 41 "<>" O LYS A 38 " d_HA=2.067 d_AD=3.010 a_DHA=153.665 symop: x,y,z a_YAH=108 172 534 "HH12 ARG A 18 "<>" O TYR A 40 " d_HA=1.798 d_AD=2.767 a_DHA=159.494 symop: x,y,z a_YAH=140 174 534 "HH22 ARG A 18 "<>" O TYR A 40 " d_HA=2.304 d_AD=3.149 a_DHA=140.837 symop: x,y,z a_YAH=138 170 1918 " HE ARG A 18 "<>" OE1 GLN A 131 " d_HA=1.855 d_AD=2.847 a_DHA=163.803 symop: z-1/2,-x+1/2,-y+1 a_YAH=139 1914 2000 " H GLN A 135 "<>" O GLN A 131 " d_HA=1.952 d_AD=2.900 a_DHA=154.379 symop: x,y,z a_YAH=154 508 863 " HZ3 LYS A 38 "<>" O GLU A 61 " d_HA=1.802 d_AD=2.763 a_DHA=154.854 symop: x,y,z a_YAH=147 555 1457 " H CYS A 99 "<>" O GLY A 41 " d_HA=2.225 d_AD=2.980 a_DHA=129.819 symop: x,y,z a_YAH=134 173 1436 "HH21 ARG A 18 "<>" O GLY A 97 " d_HA=1.957 d_AD=2.914 a_DHA=155.603 symop: x,y,z a_YAH=129 1436 1987 "HH11 ARG A 134 "<>" O GLY A 97 " d_HA=1.804 d_AD=2.732 a_DHA=150.436 symop: z-1/2,-x+1/2,-y+1 a_YAH=123 1861 1920 " H GLN A 131 "<>" O GLU A 127 " d_HA=1.900 d_AD=2.907 a_DHA=168.795 symop: x,y,z a_YAH=156 1888 1956 " H ILE A 133 "<>" O ALA A 129 " d_HA=1.931 d_AD=2.876 a_DHA=153.222 symop: x,y,z a_YAH=151 1898 1978 " H ARG A 134 "<>" O VAL A 130 " d_HA=1.853 d_AD=2.832 a_DHA=160.075 symop: x,y,z a_YAH=151 1876 1939 " H PHE A 132 "<>" O ASP A 128 " d_HA=1.879 d_AD=2.880 a_DHA=166.404 symop: x,y,z a_YAH=150 1840 1902 " H VAL A 130 "<>" O TYR A 126 " d_HA=1.938 d_AD=2.954 a_DHA=174.701 symop: x,y,z a_YAH=166 1818 1890 " H ALA A 129 "<>" O LYS A 125 " d_HA=2.019 d_AD=2.953 a_DHA=151.984 symop: x,y,z a_YAH=153 3530 4640 " HZ2 LYS B 144 "<>" O GLY B 73 " d_HA=1.883 d_AD=2.757 a_DHA=141.490 symop: x,y,z a_YAH=172 2265 3591 " H ASN B 78 "<>" OE2 GLU A 150 " d_HA=2.257 d_AD=3.158 a_DHA=146.832 symop: -x+1/2,y,-z+1 a_YAH=98 2281 2220 " H LYS A 151 "<>" O TYR A 148 " d_HA=2.478 d_AD=3.221 a_DHA=129.368 symop: x,y,z a_YAH=103 4612 4686 " H LEU B 147 "<>" O SER B 143 " d_HA=2.181 d_AD=3.172 a_DHA=165.339 symop: x,y,z a_YAH=145 4623 4709 " H TYR B 148 "<>" O LYS B 144 " d_HA=2.180 d_AD=3.099 a_DHA=150.144 symop: x,y,z a_YAH=150 4681 4761 " H LYS B 151 "<>" O LEU B 147 " d_HA=2.453 d_AD=3.391 a_DHA=153.596 symop: x,y,z a_YAH=140 295 337 " H THR A 29 "<>" O THR A 26 " d_HA=1.915 d_AD=2.894 a_DHA=161.918 symop: x,y,z a_YAH=123 295 352 " H LEU A 30 "<>" O THR A 26 " d_HA=2.179 d_AD=3.051 a_DHA=143.290 symop: x,y,z a_YAH=167 23 217 " H VAL A 10 "<>" O ILE A 21 " d_HA=2.042 d_AD=3.008 a_DHA=157.719 symop: x,y,z a_YAH=149 240 1494 " H THR A 22 "<>" O VAL A 102 " d_HA=2.168 d_AD=3.134 a_DHA=157.612 symop: x,y,z a_YAH=139 19 222 " H ILE A 21 "<>" O VAL A 10 " d_HA=1.783 d_AD=2.788 a_DHA=171.317 symop: x,y,z a_YAH=158 198 1498 " H VAL A 102 "<>" O LEU A 20 " d_HA=1.904 d_AD=2.866 a_DHA=156.821 symop: x,y,z a_YAH=164 203 1465 " H LEU A 20 "<>" O ILE A 100 " d_HA=1.978 d_AD=2.958 a_DHA=161.064 symop: x,y,z a_YAH=139 54 178 " H VAL A 12 "<>" O PHE A 19 " d_HA=1.930 d_AD=2.917 a_DHA=161.669 symop: x,y,z a_YAH=152 50 186 " H PHE A 19 "<>" O VAL A 12 " d_HA=1.878 d_AD=2.891 a_DHA=179.341 symop: x,y,z a_YAH=162 777 847 " H LYS A 60 "<>" O THR A 56 " d_HA=2.421 d_AD=3.320 a_DHA=147.393 symop: x,y,z a_YAH=135 810 869 " H GLU A 61 "<>" O VAL A 58 " d_HA=1.946 d_AD=2.873 a_DHA=150.535 symop: x,y,z a_YAH=113 810 890 " H ILE A 63 "<>" O VAL A 58 " d_HA=2.470 d_AD=3.443 a_DHA=161.310 symop: x,y,z a_YAH=129 582 1454 " H THR A 43 "<>" O CYS A 99 " d_HA=2.456 d_AD=3.358 a_DHA=148.012 symop: x,y,z a_YAH=170 154 1470 " H ILE A 100 "<>" O ARG A 18 " d_HA=1.972 d_AD=2.943 a_DHA=159.388 symop: x,y,z a_YAH=155 89 137 " H TYR A 14 "<>" O MET A 17 " d_HA=2.216 d_AD=3.186 a_DHA=158.730 symop: x,y,z a_YAH=143 826 879 " H GLY A 62 "<>" O GLU A 59 " d_HA=2.098 d_AD=3.034 a_DHA=152.301 symop: x,y,z a_YAH=107 878 911 " H HIS A 64 "<>" O GLY A 62 " d_HA=2.905 d_AD=3.580 a_DHA=124.767 symop: x,y,z a_YAH=96 578 911 " H HIS A 64 "<>" O THR A 43 " d_HA=2.449 d_AD=3.221 a_DHA=132.587 symop: x,y,z a_YAH=137 578 599 " HG1 THR A 44 "<>" O THR A 43 " d_HA=2.237 d_AD=3.050 a_DHA=140.947 symop: x,y,z a_YAH=95 585 1411 " HG1 THR A 43 "<>" OE1 GLU A 95 " d_HA=1.643 d_AD=2.623 a_DHA=169.463 symop: x,y,z a_YAH=127 1443 1927 "HE22 GLN A 131 "<>" O CYS A 98 " d_HA=1.825 d_AD=2.836 a_DHA=171.263 symop: z-1/2,-x+1/2,-y+1 a_YAH=157 123 1926 "HE21 GLN A 131 "<>" O ASN A 16 " d_HA=2.069 d_AD=3.061 a_DHA=165.355 symop: z-1/2,-x+1/2,-y+1 a_YAH=120 3509 3523 " H ASP B 72 "<>" OD1 ASP B 71 " d_HA=2.166 d_AD=2.865 a_DHA=124.003 symop: x,y,z a_YAH=119 1407 1446 " H CYS A 98 "<>" O GLU A 95 " d_HA=2.163 d_AD=3.140 a_DHA=160.076 symop: x,y,z a_YAH=147 1865 4893 "HH12 ARG B 157 "<>" OE1 GLU A 127 " d_HA=1.862 d_AD=2.861 a_DHA=163.304 symop: x,y,z a_YAH=120 1866 4895 "HH22 ARG B 157 "<>" OE2 GLU A 127 " d_HA=1.721 d_AD=2.723 a_DHA=164.120 symop: x,y,z a_YAH=95 1866 4936 "HH12 ARG B 159 "<>" OE2 GLU A 127 " d_HA=2.507 d_AD=3.428 a_DHA=150.234 symop: x,y,z a_YAH=174 3521 3531 " H GLY B 73 "<>" OD1 ASP B 72 " d_HA=1.960 d_AD=2.723 a_DHA=129.831 symop: x,y,z a_YAH=122 3521 4607 "HD21 ASN B 142 "<>" OD1 ASP B 72 " d_HA=2.662 d_AD=3.465 a_DHA=136.200 symop: x,y,z a_YAH=143 3521 4657 "HE21 GLN B 145 "<>" OD1 ASP B 72 " d_HA=2.096 d_AD=3.061 a_DHA=156.332 symop: x,y,z a_YAH=122 4601 4629 " H LYS B 144 "<>" OD1 ASN B 142 " d_HA=2.161 d_AD=2.847 a_DHA=123.226 symop: x,y,z a_YAH=130 4601 4651 " H GLN B 145 "<>" OD1 ASN B 142 " d_HA=1.889 d_AD=2.900 a_DHA=172.576 symop: x,y,z a_YAH=147 4603 4649 " H ASN B 142 "<>" OE1 GLN B 145 " d_HA=2.253 d_AD=3.204 a_DHA=155.914 symop: x,y,z a_YAH=107 3547 3578 " H SER B 77 "<>" O PRO B 75 " d_HA=1.865 d_AD=2.777 a_DHA=147.657 symop: x,y,z a_YAH=105 3561 3582 " HG SER B 77 "<>" O PRO B 76 " d_HA=1.668 d_AD=2.613 a_DHA=160.444 symop: x,y,z a_YAH=105 3561 3640 " H VAL B 81 "<>" O PRO B 76 " d_HA=2.854 d_AD=3.660 a_DHA=137.232 symop: x,y,z a_YAH=168 4256 4794 " HH TYR B 152 "<>" OE1 GLU B 121 " d_HA=1.765 d_AD=2.740 a_DHA=170.923 symop: x,y,z a_YAH=155 4257 4883 " H ARG B 157 "<>" OE2 GLU B 121 " d_HA=2.725 d_AD=3.628 a_DHA=148.232 symop: x,y,z a_YAH=142 4257 4863 " H MET B 156 "<>" OE2 GLU B 121 " d_HA=1.705 d_AD=2.590 a_DHA=143.157 symop: x,y,z a_YAH=146 4598 4667 " H LEU B 146 "<>" O ASN B 142 " d_HA=2.146 d_AD=3.111 a_DHA=158.073 symop: x,y,z a_YAH=150 4645 4726 " H LEU B 149 "<>" O GLN B 145 " d_HA=2.223 d_AD=3.209 a_DHA=163.816 symop: x,y,z a_YAH=154 3586 3657 " H ASP B 82 "<>" O ASN B 78 " d_HA=2.012 d_AD=3.010 a_DHA=167.197 symop: x,y,z a_YAH=147 1563 1590 " H GLY A 109 "<>" O GLY A 107 " d_HA=1.972 d_AD=2.806 a_DHA=137.598 symop: x,y,z a_YAH=115 277 1527 "HD22 ASN A 24 "<>" O CYS A 104 " d_HA=2.318 d_AD=3.243 a_DHA=151.177 symop: x,y,z a_YAH=143 1537 1564 " H GLY A 107 "<>" O VAL A 105 " d_HA=1.862 d_AD=2.756 a_DHA=145.478 symop: x,y,z a_YAH=91 1570 1622 " H ALA A 111 "<>" O LEU A 108 " d_HA=1.916 d_AD=2.875 a_DHA=156.933 symop: x,y,z a_YAH=157 276 718 "HD21 ASN A 24 "<>" OG1 THR A 52 " d_HA=2.243 d_AD=3.078 a_DHA=138.627 symop: x,y,z a_YAH=121 a_YAH=130 754 781 " H THR A 56 "<>" OD1 ASP A 54 " d_HA=1.917 d_AD=2.873 a_DHA=154.979 symop: x,y,z a_YAH=141 754 784 " HG1 THR A 56 "<>" OD1 ASP A 54 " d_HA=1.753 d_AD=2.710 a_DHA=162.920 symop: x,y,z a_YAH=96 659 730 "HH12 ARG A 47 "<>" O TYR A 53 " d_HA=1.998 d_AD=2.969 a_DHA=159.020 symop: x,y,z a_YAH=147 625 1517 " H HIS A 103 "<>" O VAL A 46 " d_HA=2.330 d_AD=3.308 a_DHA=160.492 symop: x,y,z a_YAH=159 629 1484 " H VAL A 46 "<>" O ALA A 101 " d_HA=1.904 d_AD=2.896 a_DHA=165.013 symop: x,y,z a_YAH=149 763 814 " H VAL A 58 "<>" O THR A 55 " d_HA=2.072 d_AD=2.860 a_DHA=133.021 symop: x,y,z a_YAH=104 763 832 " H GLU A 59 "<>" O THR A 55 " d_HA=1.877 d_AD=2.888 a_DHA=172.780 symop: x,y,z a_YAH=177 831 925 " H VAL A 65 "<>" OE2 GLU A 59 " d_HA=1.996 d_AD=2.999 a_DHA=166.324 symop: x,y,z a_YAH=118 592 1486 " H ALA A 101 "<>" O THR A 44 " d_HA=2.017 d_AD=3.034 a_DHA=174.570 symop: x,y,z a_YAH=145 606 942 " H LEU A 66 "<>" O ILE A 45 " d_HA=1.796 d_AD=2.771 a_DHA=160.495 symop: x,y,z a_YAH=163 611 904 " H ILE A 45 "<>" O HIS A 64 " d_HA=2.007 d_AD=2.942 a_DHA=150.719 symop: x,y,z a_YAH=166 80 142 " H MET A 17 "<>" O TYR A 14 " d_HA=2.005 d_AD=2.967 a_DHA=157.620 symop: x,y,z a_YAH=148 1342 3176 " HZ1 LYS A 91 "<>" OE2 GLU B 50 " d_HA=2.724 d_AD=3.414 a_DHA=125.694 symop: -z+1/2,x,-y+1 a_YAH=146 1344 1396 " HZ3 LYS A 91 "<>" OE1 GLU A 94 " d_HA=1.813 d_AD=2.679 a_DHA=140.119 symop: x,y,z a_YAH=127 1326 1450 " HG CYS A 98 "<>" O LYS A 91 " d_HA=2.638 d_AD=3.572 a_DHA=123.952 symop: x,y,z a_YAH=110 1326 1413 " H GLU A 95 "<>" O LYS A 91 " d_HA=1.952 d_AD=2.921 a_DHA=159.149 symop: x,y,z a_YAH=143 1397 4096 "HH22 ARG B 110 "<>" OE2 GLU A 94 " d_HA=2.622 d_AD=3.596 a_DHA=159.657 symop: -z+1/2,x,-y+1 a_YAH=139 1307 1376 " H ARG A 93 "<>" O ILE A 90 " d_HA=1.971 d_AD=2.874 a_DHA=146.528 symop: x,y,z a_YAH=122 1307 1398 " H GLU A 94 "<>" O ILE A 90 " d_HA=1.875 d_AD=2.875 a_DHA=168.782 symop: x,y,z a_YAH=158 133 1348 "HD22 ASN A 16 "<>" O PHE A 92 " d_HA=2.933 d_AD=3.629 a_DHA=127.064 symop: x,y,z a_YAH=103 1834 4899 " HZ1 LYS A 125 "<>" O LEU B 158 " d_HA=1.902 d_AD=2.799 a_DHA=145.889 symop: x,y,z a_YAH=152 4214 4286 " H MET B 124 "<>" O LEU B 119 " d_HA=2.136 d_AD=3.088 a_DHA=155.529 symop: x,y,z a_YAH=142 4275 4233 " H GLY B 123 "<>" O ILE B 120 " d_HA=1.942 d_AD=2.861 a_DHA=149.076 symop: x,y,z a_YAH=116 4069 4658 "HE22 GLN B 145 "<>" O GLY B 109 " d_HA=2.810 d_AD=3.653 a_DHA=141.731 symop: x,y,z a_YAH=91 4076 4128 " H VAL B 113 "<>" O ARG B 110 " d_HA=1.969 d_AD=2.905 a_DHA=152.340 symop: x,y,z a_YAH=121 3600 3669 " H ASP B 83 "<>" O GLN B 79 " d_HA=2.070 d_AD=3.069 a_DHA=167.125 symop: x,y,z a_YAH=150 3668 3782 " HZ2 LYS B 89 "<>" OD2 ASP B 83 " d_HA=1.709 d_AD=2.677 a_DHA=154.249 symop: -x+1/2,y,-z+1 a_YAH=102 4185 4258 " H GLU B 121 "<>" O LEU B 117 " d_HA=1.910 d_AD=2.908 a_DHA=166.467 symop: x,y,z a_YAH=152 4204 4268 " H GLY B 122 "<>" O ALA B 118 " d_HA=2.211 d_AD=2.956 a_DHA=129.176 symop: x,y,z a_YAH=128 2970 3036 " H GLY B 41 "<>" O LYS B 38 " d_HA=1.950 d_AD=2.873 a_DHA=149.992 symop: x,y,z a_YAH=111 4469 4568 "HH21 ARG B 134 "<>" O ALA B 140 " d_HA=2.225 d_AD=3.075 a_DHA=139.659 symop: x,y,z a_YAH=140 4469 4578 "HH21 ARG B 134 "<>" O PHE B 141 " d_HA=2.067 d_AD=2.901 a_DHA=137.264 symop: x,y,z a_YAH=135 4568 4466 " HE ARG B 134 "<>" O ALA B 140 " d_HA=1.859 d_AD=2.845 a_DHA=163.452 symop: x,y,z a_YAH=140 4124 4190 " H LEU B 117 "<>" O VAL B 113 " d_HA=2.131 d_AD=3.070 a_DHA=153.165 symop: x,y,z a_YAH=141 3617 3687 " H TRP B 84 "<>" O ILE B 80 " d_HA=1.942 d_AD=2.947 a_DHA=169.127 symop: x,y,z a_YAH=159 3636 3705 " H LEU B 85 "<>" O VAL B 81 " d_HA=2.084 d_AD=3.074 a_DHA=163.639 symop: x,y,z a_YAH=154 3652 3722 " H SER B 86 "<>" O ASP B 82 " d_HA=2.152 d_AD=3.056 a_DHA=146.996 symop: x,y,z a_YAH=143 3722 3652 " H SER B 86 "<>" O ASP B 82 " d_HA=2.152 d_AD=3.056 a_DHA=146.996 symop: x,y,z a_YAH=143 3705 3636 " H LEU B 85 "<>" O VAL B 81 " d_HA=2.084 d_AD=3.074 a_DHA=163.639 symop: x,y,z a_YAH=154 4140 4206 " H ALA B 118 "<>" O LEU B 114 " d_HA=1.977 d_AD=2.910 a_DHA=151.646 symop: x,y,z a_YAH=150 1589 2178 "HE22 GLN A 145 "<>" O GLY A 109 " d_HA=2.217 d_AD=3.172 a_DHA=156.541 symop: x,y,z a_YAH=115 669 1510 " H VAL A 48 "<>" O HIS A 103 " d_HA=2.290 d_AD=3.301 a_DHA=178.462 symop: x,y,z a_YAH=166 1596 1648 " H VAL A 113 "<>" O ARG A 110 " d_HA=1.848 d_AD=2.819 a_DHA=158.897 symop: x,y,z a_YAH=132 1620 1665 " H LEU A 114 "<>" O ALA A 111 " d_HA=2.540 d_AD=3.330 a_DHA=134.696 symop: x,y,z a_YAH=128 1620 1683 " H VAL A 115 "<>" O ALA A 111 " d_HA=2.791 d_AD=3.751 a_DHA=158.687 symop: x,y,z a_YAH=142 1630 1697 " H ALA A 116 "<>" O PRO A 112 " d_HA=1.883 d_AD=2.871 a_DHA=164.189 symop: x,y,z a_YAH=158 1644 1710 " H LEU A 117 "<>" O VAL A 113 " d_HA=2.045 d_AD=3.015 a_DHA=158.969 symop: x,y,z a_YAH=146 657 959 " HE ARG A 47 "<>" OD1 ASP A 67 " d_HA=1.698 d_AD=2.702 a_DHA=165.359 symop: x,y,z a_YAH=128 660 960 "HH21 ARG A 47 "<>" OD2 ASP A 67 " d_HA=1.744 d_AD=2.761 a_DHA=166.808 symop: x,y,z a_YAH=105 641 979 " H TRP A 68 "<>" O ARG A 47 " d_HA=2.084 d_AD=2.938 a_DHA=140.436 symop: x,y,z a_YAH=149 649 937 " H ARG A 47 "<>" O LEU A 66 " d_HA=1.767 d_AD=2.769 a_DHA=166.421 symop: x,y,z a_YAH=164 937 979 " H TRP A 68 "<>" O LEU A 66 " d_HA=2.975 d_AD=3.592 a_DHA=120.083 symop: x,y,z a_YAH=97 1212 1660 " HE1 TRP A 84 "<>" O LEU A 114 " d_HA=2.000 d_AD=2.789 a_DHA=132.689 symop: x,y,z a_YAH=131 1660 1726 " H ALA A 118 "<>" O LEU A 114 " d_HA=1.910 d_AD=2.880 a_DHA=158.900 symop: x,y,z a_YAH=150 1679 1739 " H LEU A 119 "<>" O VAL A 115 " d_HA=1.983 d_AD=2.956 a_DHA=159.507 symop: x,y,z a_YAH=158 1695 1758 " H ILE A 120 "<>" O ALA A 116 " d_HA=1.899 d_AD=2.907 a_DHA=170.906 symop: x,y,z a_YAH=161 1705 1778 " H GLU A 121 "<>" O LEU A 117 " d_HA=1.923 d_AD=2.929 a_DHA=168.483 symop: x,y,z a_YAH=163 1196 1273 " H VAL A 88 "<>" O TRP A 84 " d_HA=1.892 d_AD=2.898 a_DHA=168.738 symop: x,y,z a_YAH=157 1724 1788 " H GLY A 122 "<>" O ALA A 118 " d_HA=1.988 d_AD=2.821 a_DHA=137.488 symop: x,y,z a_YAH=138 1734 1806 " H MET A 124 "<>" O LEU A 119 " d_HA=2.187 d_AD=3.061 a_DHA=142.973 symop: x,y,z a_YAH=129 1753 1795 " H GLY A 123 "<>" O ILE A 120 " d_HA=1.820 d_AD=2.731 a_DHA=147.340 symop: x,y,z a_YAH=112 1753 1806 " H MET A 124 "<>" O ILE A 120 " d_HA=2.486 d_AD=3.224 a_DHA=128.902 symop: x,y,z a_YAH=98 1250 1332 " H LYS A 91 "<>" O LEU A 87 " d_HA=1.914 d_AD=2.862 a_DHA=153.145 symop: x,y,z a_YAH=169 1250 1312 " H ILE A 90 "<>" O LEU A 87 " d_HA=2.507 d_AD=3.211 a_DHA=125.899 symop: x,y,z a_YAH=98 1220 1291 " H LYS A 89 "<>" O LEU A 85 " d_HA=2.003 d_AD=2.938 a_DHA=151.298 symop: x,y,z a_YAH=143 1239 1312 " H ILE A 90 "<>" O SER A 86 " d_HA=2.172 d_AD=3.075 a_DHA=146.817 symop: x,y,z a_YAH=153 2419 4314 " HZ1 LYS B 125 "<>" O LEU A 158 " d_HA=2.100 d_AD=2.868 a_DHA=131.039 symop: x,y,z a_YAH=149 1387 2438 "HH21 ARG A 93 "<>" O ARG A 159 " d_HA=2.382 d_AD=3.195 a_DHA=135.970 symop: x,y,z a_YAH=141 3145 3494 " H PHE B 70 "<>" O VAL B 48 " d_HA=2.759 d_AD=3.742 a_DHA=162.991 symop: x,y,z a_YAH=119 3121 3459 " H TRP B 68 "<>" O ARG B 47 " d_HA=2.139 d_AD=3.027 a_DHA=144.653 symop: x,y,z a_YAH=135 3149 3990 " H VAL B 48 "<>" O HIS B 103 " d_HA=2.150 d_AD=3.146 a_DHA=166.678 symop: x,y,z a_YAH=164 4043 4070 " H GLY B 109 "<>" O GLY B 107 " d_HA=1.968 d_AD=2.765 a_DHA=133.360 symop: x,y,z a_YAH=121 4050 4102 " H ALA B 111 "<>" O LEU B 108 " d_HA=1.829 d_AD=2.810 a_DHA=162.232 symop: x,y,z a_YAH=156 4513 4562 " H GLY B 139 "<>" O ARG B 137 " d_HA=1.825 d_AD=2.736 a_DHA=148.365 symop: x,y,z a_YAH=109 4100 4145 " H LEU B 114 "<>" O ALA B 111 " d_HA=2.258 d_AD=3.095 a_DHA=138.887 symop: x,y,z a_YAH=132 4100 4163 " H VAL B 115 "<>" O ALA B 111 " d_HA=2.773 d_AD=3.755 a_DHA=164.412 symop: x,y,z a_YAH=144 3664 3726 " HG SER B 86 "<>" O ASP B 83 " d_HA=2.972 d_AD=3.755 a_DHA=139.492 symop: -x+1/2,y,-z+1 a_YAH=103 3664 3735 " H LEU B 87 "<>" O ASP B 83 " d_HA=1.772 d_AD=2.734 a_DHA=157.049 symop: x,y,z a_YAH=147 3700 3771 " H LYS B 89 "<>" O LEU B 85 " d_HA=2.057 d_AD=3.024 a_DHA=157.807 symop: x,y,z a_YAH=135 3719 3792 " H ILE B 90 "<>" O SER B 86 " d_HA=2.094 d_AD=3.041 a_DHA=154.414 symop: x,y,z a_YAH=159 3735 3664 " H LEU B 87 "<>" O ASP B 83 " d_HA=1.772 d_AD=2.734 a_DHA=157.049 symop: x,y,z a_YAH=147 3676 3753 " H VAL B 88 "<>" O TRP B 84 " d_HA=1.888 d_AD=2.878 a_DHA=163.545 symop: x,y,z a_YAH=153 3692 4140 " HE1 TRP B 84 "<>" O LEU B 114 " d_HA=2.048 d_AD=2.835 a_DHA=132.842 symop: x,y,z a_YAH=128 4159 4219 " H LEU B 119 "<>" O VAL B 115 " d_HA=1.942 d_AD=2.891 a_DHA=154.490 symop: x,y,z a_YAH=159 1041 1051 " H GLY A 73 "<>" OD1 ASP A 72 " d_HA=1.784 d_AD=2.658 a_DHA=141.536 symop: x,y,z a_YAH=120 1006 1614 "HH12 ARG A 110 "<>" O PHE A 70 " d_HA=1.709 d_AD=2.703 a_DHA=167.223 symop: x,y,z a_YAH=104 1006 1616 "HH22 ARG A 110 "<>" O PHE A 70 " d_HA=2.312 d_AD=3.137 a_DHA=137.978 symop: x,y,z a_YAH=159 665 1014 " H PHE A 70 "<>" O VAL A 48 " d_HA=2.273 d_AD=3.242 a_DHA=159.251 symop: x,y,z a_YAH=130 1137 1207 " H TRP A 84 "<>" O ILE A 80 " d_HA=1.926 d_AD=2.924 a_DHA=166.186 symop: x,y,z a_YAH=154 1184 1255 " H LEU A 87 "<>" O ASP A 83 " d_HA=1.805 d_AD=2.793 a_DHA=162.730 symop: x,y,z a_YAH=156 1156 1225 " H LEU A 85 "<>" O VAL A 81 " d_HA=1.979 d_AD=2.964 a_DHA=161.970 symop: x,y,z a_YAH=154 1776 2314 " HH TYR A 152 "<>" OE1 GLU A 121 " d_HA=1.674 d_AD=2.650 a_DHA=169.877 symop: x,y,z a_YAH=164 1777 2383 " H MET A 156 "<>" OE2 GLU A 121 " d_HA=1.688 d_AD=2.631 a_DHA=152.473 symop: x,y,z a_YAH=162 1246 3186 " HG SER A 86 "<>" O ALA B 51 " d_HA=1.993 d_AD=2.931 a_DHA=160.726 symop: -z+1/2,x,-y+1 a_YAH=141 1172 1242 " H SER A 86 "<>" O ASP A 82 " d_HA=2.037 d_AD=2.982 a_DHA=152.957 symop: x,y,z a_YAH=143 4286 4214 " H MET B 124 "<>" O LEU B 119 " d_HA=2.136 d_AD=3.088 a_DHA=155.529 symop: x,y,z a_YAH=142 2756 3198 "HD21 ASN B 24 "<>" OG1 THR B 52 " d_HA=1.958 d_AD=2.879 a_DHA=149.693 symop: x,y,z a_YAH=128 a_YAH=122 2757 4007 "HD22 ASN B 24 "<>" O CYS B 104 " d_HA=2.926 d_AD=3.563 a_DHA=122.211 symop: x,y,z a_YAH=130 4315 4942 " HZ2 LYS B 125 "<>" O PHE B 160 " d_HA=1.705 d_AD=2.608 a_DHA=144.451 symop: z-1/2,-x+1/2,-y+1 a_YAH=132 3137 3439 " HE ARG B 47 "<>" OD1 ASP B 67 " d_HA=1.784 d_AD=2.743 a_DHA=155.251 symop: x,y,z a_YAH=127 3140 3439 "HH21 ARG B 47 "<>" OD1 ASP B 67 " d_HA=2.024 d_AD=2.920 a_DHA=144.892 symop: x,y,z a_YAH=94 2603 4406 "HE21 GLN B 131 "<>" O ASN B 16 " d_HA=1.831 d_AD=2.845 a_DHA=174.433 symop: -y+1/2,-z+1,x+1/2 a_YAH=116 2560 2622 " H MET B 17 "<>" O TYR B 14 " d_HA=1.888 d_AD=2.851 a_DHA=157.714 symop: x,y,z a_YAH=146 2569 2617 " H TYR B 14 "<>" O MET B 17 " d_HA=2.025 d_AD=3.017 a_DHA=164.292 symop: x,y,z a_YAH=147 2720 3974 " H THR B 22 "<>" O VAL B 102 " d_HA=2.238 d_AD=3.191 a_DHA=155.520 symop: x,y,z a_YAH=145 3105 3997 " H HIS B 103 "<>" O VAL B 46 " d_HA=2.168 d_AD=3.147 a_DHA=160.563 symop: x,y,z a_YAH=153 3109 3964 " H VAL B 46 "<>" O ALA B 101 " d_HA=1.923 d_AD=2.902 a_DHA=160.499 symop: x,y,z a_YAH=139 3129 3417 " H ARG B 47 "<>" O LEU B 66 " d_HA=1.817 d_AD=2.819 a_DHA=167.161 symop: x,y,z a_YAH=164 3086 3422 " H LEU B 66 "<>" O ILE B 45 " d_HA=1.931 d_AD=2.933 a_DHA=168.909 symop: x,y,z a_YAH=170 3749 3836 " H PHE B 92 "<>" O VAL B 88 " d_HA=2.549 d_AD=3.505 a_DHA=157.544 symop: x,y,z a_YAH=141 3787 3856 " H ARG B 93 "<>" O ILE B 90 " d_HA=1.955 d_AD=2.851 a_DHA=145.288 symop: x,y,z a_YAH=125 3787 3878 " H GLU B 94 "<>" O ILE B 90 " d_HA=1.857 d_AD=2.834 a_DHA=161.444 symop: x,y,z a_YAH=150 2530 2666 " H PHE B 19 "<>" O VAL B 12 " d_HA=1.882 d_AD=2.896 a_DHA=178.086 symop: x,y,z a_YAH=163 2534 2658 " H VAL B 12 "<>" O PHE B 19 " d_HA=1.966 d_AD=2.954 a_DHA=161.770 symop: x,y,z a_YAH=153 2515 4487 "HE22 GLN B 135 "<>" O GLU B 11 " d_HA=2.118 d_AD=2.876 a_DHA=130.389 symop: -y+1/2,-z+1,x+1/2 a_YAH=99 2678 3978 " H VAL B 102 "<>" O LEU B 20 " d_HA=1.875 d_AD=2.829 a_DHA=154.730 symop: x,y,z a_YAH=169 2702 2499 " H ILE B 21 "<>" O VAL B 10 " d_HA=1.811 d_AD=2.825 a_DHA=176.948 symop: x,y,z a_YAH=150 3730 3792 " H ILE B 90 "<>" O LEU B 87 " d_HA=2.897 d_AD=3.525 a_DHA=120.729 symop: x,y,z a_YAH=90 3730 3812 " H LYS B 91 "<>" O LEU B 87 " d_HA=1.938 d_AD=2.864 a_DHA=150.159 symop: x,y,z a_YAH=155 2683 3945 " H LEU B 20 "<>" O ILE B 100 " d_HA=1.856 d_AD=2.845 a_DHA=163.390 symop: x,y,z a_YAH=139 2499 2702 " H ILE B 21 "<>" O VAL B 10 " d_HA=1.811 d_AD=2.825 a_DHA=176.948 symop: x,y,z a_YAH=150 1029 1043 " H ASP A 72 "<>" OD1 ASP A 71 " d_HA=1.927 d_AD=2.755 a_DHA=135.677 symop: x,y,z a_YAH=116 1050 2160 " HZ2 LYS A 144 "<>" O GLY A 73 " d_HA=1.926 d_AD=2.729 a_DHA=133.330 symop: x,y,z a_YAH=154 1067 1098 " H SER A 77 "<>" O PRO A 75 " d_HA=1.909 d_AD=2.822 a_DHA=147.914 symop: x,y,z a_YAH=109 2220 2281 " H LYS A 151 "<>" O TYR A 148 " d_HA=2.478 d_AD=3.221 a_DHA=129.368 symop: x,y,z a_YAH=103 2220 2306 " H TYR A 152 "<>" O TYR A 148 " d_HA=2.148 d_AD=2.924 a_DHA=131.879 symop: x,y,z a_YAH=147 1081 1102 " HG SER A 77 "<>" O PRO A 76 " d_HA=1.796 d_AD=2.708 a_DHA=153.709 symop: x,y,z a_YAH=108 1081 1160 " H VAL A 81 "<>" O PRO A 76 " d_HA=2.910 d_AD=3.599 a_DHA=126.350 symop: x,y,z a_YAH=168 1097 1142 " H ILE A 80 "<>" OG SER A 77 " d_HA=1.926 d_AD=2.849 a_DHA=150.117 symop: x,y,z a_YAH=156 a_YAH=95 1132 1188 "HE21 GLN A 79 "<>" OD2 ASP A 83 " d_HA=1.766 d_AD=2.792 a_DHA=172.734 symop: x,y,z a_YAH=103 1106 1177 " H ASP A 82 "<>" O ASN A 78 " d_HA=1.875 d_AD=2.884 a_DHA=171.859 symop: x,y,z a_YAH=152 1120 1189 " H ASP A 83 "<>" O GLN A 79 " d_HA=1.844 d_AD=2.854 a_DHA=171.824 symop: x,y,z a_YAH=165 4233 4286 " H MET B 124 "<>" O ILE B 120 " d_HA=2.977 d_AD=3.637 a_DHA=123.480 symop: x,y,z a_YAH=97 4233 4275 " H GLY B 123 "<>" O ILE B 120 " d_HA=1.942 d_AD=2.861 a_DHA=149.076 symop: x,y,z a_YAH=116 3139 3210 "HH12 ARG B 47 "<>" O TYR B 53 " d_HA=2.034 d_AD=3.005 a_DHA=159.391 symop: x,y,z a_YAH=144 2413 4345 "HH12 ARG A 157 "<>" OE1 GLU B 127 " d_HA=2.010 d_AD=3.012 a_DHA=165.486 symop: x,y,z a_YAH=112 2415 4346 "HH22 ARG A 157 "<>" OE2 GLU B 127 " d_HA=1.731 d_AD=2.746 a_DHA=170.154 symop: x,y,z a_YAH=102 4298 4370 " H ALA B 129 "<>" O LYS B 125 " d_HA=1.966 d_AD=2.913 a_DHA=154.383 symop: x,y,z a_YAH=152 4320 4382 " H VAL B 130 "<>" O TYR B 126 " d_HA=1.982 d_AD=2.980 a_DHA=165.676 symop: x,y,z a_YAH=155 4356 4419 " H PHE B 132 "<>" O ASP B 128 " d_HA=1.984 d_AD=2.981 a_DHA=164.835 symop: x,y,z a_YAH=150 4368 4436 " H ILE B 133 "<>" O ALA B 129 " d_HA=2.053 d_AD=3.003 a_DHA=154.305 symop: x,y,z a_YAH=144 3218 4003 " HE2 HIS B 103 "<>" OH TYR B 53 " d_HA=1.797 d_AD=2.726 a_DHA=150.932 symop: x,y,z a_YAH=124 a_YAH=104 3311 3405 " H VAL B 65 "<>" OE2 GLU B 59 " d_HA=1.835 d_AD=2.845 a_DHA=168.029 symop: x,y,z a_YAH=116 4341 4400 " H GLN B 131 "<>" O GLU B 127 " d_HA=1.949 d_AD=2.939 a_DHA=163.590 symop: x,y,z a_YAH=157 4394 4480 " H GLN B 135 "<>" O GLN B 131 " d_HA=1.957 d_AD=2.896 a_DHA=152.628 symop: x,y,z a_YAH=151 3091 3384 " H ILE B 45 "<>" O HIS B 64 " d_HA=2.187 d_AD=3.071 a_DHA=144.097 symop: x,y,z a_YAH=168 3806 3893 " H GLU B 95 "<>" O LYS B 91 " d_HA=1.784 d_AD=2.766 a_DHA=162.995 symop: x,y,z a_YAH=158 3887 3926 " H CYS B 98 "<>" O GLU B 95 " d_HA=2.132 d_AD=3.033 a_DHA=146.750 symop: x,y,z a_YAH=149 3887 3930 " HG CYS B 98 "<>" O GLU B 95 " d_HA=1.959 d_AD=3.078 a_DHA=136.344 symop: x,y,z a_YAH=125 2650 4398 " HE ARG B 18 "<>" OE1 GLN B 131 " d_HA=1.841 d_AD=2.817 a_DHA=159.834 symop: -y+1/2,-z+1,x+1/2 a_YAH=152 3923 4407 "HE22 GLN B 131 "<>" O CYS B 98 " d_HA=2.057 d_AD=3.046 a_DHA=163.576 symop: -y+1/2,-z+1,x+1/2 a_YAH=166 2520 2651 "HH11 ARG B 18 "<>" OE2 GLU B 11 " d_HA=1.760 d_AD=2.777 a_DHA=168.980 symop: x,y,z a_YAH=170 4478 4508 " HZ2 LYS B 136 "<>" OE1 GLN B 135 " d_HA=2.940 d_AD=3.593 a_DHA=122.983 symop: z-1/2,-x+1/2,-y+1 a_YAH=120 2503 2697 " H VAL B 10 "<>" O ILE B 21 " d_HA=1.948 d_AD=2.953 a_DHA=168.530 symop: x,y,z a_YAH=145 3072 3966 " H ALA B 101 "<>" O THR B 44 " d_HA=1.961 d_AD=2.973 a_DHA=171.485 symop: x,y,z a_YAH=147 3058 3391 " H HIS B 64 "<>" O THR B 43 " d_HA=2.573 d_AD=3.475 a_DHA=148.337 symop: x,y,z a_YAH=128 3058 3079 " HG1 THR B 44 "<>" O THR B 43 " d_HA=1.828 d_AD=2.737 a_DHA=154.722 symop: x,y,z a_YAH=96 3824 3892 " HZ3 LYS B 91 "<>" OE2 GLU B 95 " d_HA=1.886 d_AD=2.628 a_DHA=126.753 symop: x,y,z a_YAH=152 3062 3934 " H THR B 43 "<>" O CYS B 99 " d_HA=2.230 d_AD=3.145 a_DHA=149.084 symop: x,y,z a_YAH=168 3065 3892 " HG1 THR B 43 "<>" OE2 GLU B 95 " d_HA=2.665 d_AD=3.565 a_DHA=154.651 symop: x,y,z a_YAH=101 2634 3950 " H ILE B 100 "<>" O ARG B 18 " d_HA=2.026 d_AD=2.980 a_DHA=155.255 symop: x,y,z a_YAH=147 4761 4681 " H LYS B 151 "<>" O LEU B 147 " d_HA=2.453 d_AD=3.391 a_DHA=153.596 symop: x,y,z a_YAH=140 4175 4238 " H ILE B 120 "<>" O ALA B 116 " d_HA=1.814 d_AD=2.810 a_DHA=165.626 symop: x,y,z a_YAH=154 4190 4124 " H LEU B 117 "<>" O VAL B 113 " d_HA=2.131 d_AD=3.070 a_DHA=153.165 symop: x,y,z a_YAH=141 2777 2820 " HG1 THR B 29 "<>" OG1 THR B 26 " d_HA=1.949 d_AD=2.918 a_DHA=175.819 symop: x,y,z a_YAH=109 a_YAH=133 2775 2817 " H THR B 29 "<>" O THR B 26 " d_HA=2.007 d_AD=2.906 a_DHA=146.255 symop: x,y,z a_YAH=112 2775 2832 " H LEU B 30 "<>" O THR B 26 " d_HA=2.205 d_AD=3.058 a_DHA=140.736 symop: x,y,z a_YAH=167 2789 2832 " H LEU B 30 "<>" O ASN B 27 " d_HA=2.927 d_AD=3.779 a_DHA=142.097 symop: x,y,z a_YAH=95 3234 3261 " H THR B 56 "<>" OD1 ASP B 54 " d_HA=1.854 d_AD=2.842 a_DHA=162.590 symop: x,y,z a_YAH=146 3234 3264 " HG1 THR B 56 "<>" OD1 ASP B 54 " d_HA=1.738 d_AD=2.718 a_DHA=173.129 symop: x,y,z a_YAH=109 3259 4773 " HZ3 LYS B 151 "<>" OG1 THR B 56 " d_HA=2.360 d_AD=3.312 a_DHA=154.800 symop: y,-z+1,-x+1/2 a_YAH=94 a_YAH=102 3243 3294 " H VAL B 58 "<>" O THR B 55 " d_HA=2.086 d_AD=2.857 a_DHA=131.327 symop: x,y,z a_YAH=104 3243 3312 " H GLU B 59 "<>" O THR B 55 " d_HA=1.837 d_AD=2.848 a_DHA=174.922 symop: x,y,z a_YAH=172 3257 3327 " H LYS B 60 "<>" O THR B 56 " d_HA=2.285 d_AD=3.152 a_DHA=143.041 symop: x,y,z a_YAH=127 4378 4458 " H ARG B 134 "<>" O VAL B 130 " d_HA=1.850 d_AD=2.829 a_DHA=160.111 symop: x,y,z a_YAH=146 4466 4568 " HE ARG B 134 "<>" O ALA B 140 " d_HA=1.859 d_AD=2.845 a_DHA=163.452 symop: x,y,z a_YAH=140 4431 4497 " H LYS B 136 "<>" O ILE B 133 " d_HA=1.911 d_AD=2.841 a_DHA=151.475 symop: x,y,z a_YAH=116 4431 4521 " H ARG B 137 "<>" O ILE B 133 " d_HA=1.990 d_AD=2.889 a_DHA=146.498 symop: x,y,z a_YAH=148 2882 2956 " H LEU B 37 "<>" O PHE B 33 " d_HA=1.879 d_AD=2.892 a_DHA=172.945 symop: x,y,z a_YAH=159 3290 3370 " H ILE B 63 "<>" O VAL B 58 " d_HA=2.555 d_AD=3.507 a_DHA=156.731 symop: x,y,z a_YAH=131 3290 3349 " H GLU B 61 "<>" O VAL B 58 " d_HA=2.047 d_AD=2.903 a_DHA=140.712 symop: x,y,z a_YAH=107 3306 3359 " H GLY B 62 "<>" O GLU B 59 " d_HA=1.981 d_AD=2.920 a_DHA=152.438 symop: x,y,z a_YAH=114 2653 3916 "HH21 ARG B 18 "<>" O GLY B 97 " d_HA=1.876 d_AD=2.846 a_DHA=158.629 symop: x,y,z a_YAH=132 2654 3014 "HH22 ARG B 18 "<>" O TYR B 40 " d_HA=1.998 d_AD=2.912 a_DHA=148.825 symop: x,y,z a_YAH=160 3916 4467 "HH11 ARG B 134 "<>" O GLY B 97 " d_HA=1.817 d_AD=2.739 a_DHA=149.870 symop: -y+1/2,-z+1,x+1/2 a_YAH=113 4450 4545 " H ARG B 138 "<>" O ARG B 134 " d_HA=1.852 d_AD=2.748 a_DHA=145.604 symop: x,y,z a_YAH=115 2936 3023 " H TYR B 40 "<>" O GLU B 36 " d_HA=2.309 d_AD=3.193 a_DHA=144.657 symop: x,y,z a_YAH=149 2951 3023 " H TYR B 40 "<>" O LEU B 37 " d_HA=2.446 d_AD=3.140 a_DHA=124.850 symop: x,y,z a_YAH=98 2951 3046 " H VAL B 42 "<>" O LEU B 37 " d_HA=2.142 d_AD=3.144 a_DHA=168.887 symop: x,y,z a_YAH=143 2652 3014 "HH12 ARG B 18 "<>" O TYR B 40 " d_HA=2.013 d_AD=2.916 a_DHA=148.209 symop: x,y,z a_YAH=134 3035 3937 " H CYS B 99 "<>" O GLY B 41 " d_HA=1.920 d_AD=2.841 a_DHA=148.970 symop: x,y,z a_YAH=133 3036 2970 " H GLY B 41 "<>" O LYS B 38 " d_HA=1.950 d_AD=2.873 a_DHA=149.992 symop: x,y,z a_YAH=111 3023 2951 " H TYR B 40 "<>" O LEU B 37 " d_HA=2.446 d_AD=3.140 a_DHA=124.850 symop: x,y,z a_YAH=98 3023 2936 " H TYR B 40 "<>" O GLU B 36 " d_HA=2.309 d_AD=3.193 a_DHA=144.657 symop: x,y,z a_YAH=149 4700 4761 " H LYS B 151 "<>" O TYR B 148 " d_HA=2.536 d_AD=3.197 a_DHA=122.446 symop: x,y,z a_YAH=103 4700 4786 " H TYR B 152 "<>" O TYR B 148 " d_HA=2.144 d_AD=2.867 a_DHA=126.729 symop: x,y,z a_YAH=146 4662 4746 " H GLU B 150 "<>" O LEU B 146 " d_HA=1.983 d_AD=2.945 a_DHA=157.004 symop: x,y,z a_YAH=157 4110 4177 " H ALA B 116 "<>" O PRO B 112 " d_HA=1.763 d_AD=2.764 a_DHA=168.934 symop: x,y,z a_YAH=159 2813 2866 " H LYS B 32 "<>" O THR B 29 " d_HA=2.316 d_AD=3.012 a_DHA=124.973 symop: x,y,z a_YAH=119 2813 2890 " H PHE B 33 "<>" O THR B 29 " d_HA=1.908 d_AD=2.895 a_DHA=163.730 symop: x,y,z a_YAH=154 2827 2907 " H ILE B 34 "<>" O LEU B 30 " d_HA=1.965 d_AD=2.978 a_DHA=173.221 symop: x,y,z a_YAH=166 2902 2976 " H LYS B 38 "<>" O ILE B 34 " d_HA=1.916 d_AD=2.922 a_DHA=167.483 symop: x,y,z a_YAH=160 3349 3271 " H GLU B 61 "<>" O LEU B 57 " d_HA=2.967 d_AD=3.690 a_DHA=129.077 symop: x,y,z a_YAH=121 ------------------------------------------------------------------------------- Total: 348 Symmetry: 0 Per residue: 1.1447 Mean SD Skew Kurtosis theta_1: 143.441 21.440 -0.529 2.150 theta_2: 132.112 24.817 -0.195 1.696 d_HA: 2.320 0.316 0.538 2.194 222 4710 " HZ3 LYS A 14 "<>" OE1 GLU A 295 " d_HA=1.860 d_AD=2.837 a_DHA=157.001 symop: x,y,z a_YAH=126 2852 4600 " HZ3 LYS A 287 "<>" OE2 GLU A 180 " d_HA=2.115 d_AD=3.041 a_DHA=149.660 symop: x,y,z a_YAH=152 1642 1686 " H ASP A 105 "<>" SD MET A 108 " d_HA=2.774 d_AD=3.737 a_DHA=159.925 symop: x,y,z a_YAH=100 a_YAH=125 1704 2221 " HE ARG A 142 "<>" OE1 GLU A 109 " d_HA=1.745 d_AD=2.771 a_DHA=171.477 symop: x,y,z a_YAH=144 282 4706 "HH12 ARG A 17 "<>" O GLU A 295 " d_HA=2.231 d_AD=3.098 a_DHA=141.873 symop: x,y,z a_YAH=161 284 4706 "HH22 ARG A 17 "<>" O GLU A 295 " d_HA=1.810 d_AD=2.796 a_DHA=159.881 symop: x,y,z a_YAH=104 1762 2225 "HH22 ARG A 142 "<>" OE2 GLU A 113 " d_HA=1.755 d_AD=2.687 a_DHA=148.733 symop: x,y,z a_YAH=121 1762 2223 "HH12 ARG A 142 "<>" OE2 GLU A 113 " d_HA=2.414 d_AD=3.152 a_DHA=128.712 symop: x,y,z a_YAH=142 221 4706 " HZ2 LYS A 14 "<>" O GLU A 295 " d_HA=2.485 d_AD=3.479 a_DHA=165.695 symop: x,y,z a_YAH=116 4713 4678 " H GLU A 295 "<>" O THR A 293 " d_HA=2.320 d_AD=3.167 a_DHA=140.337 symop: x,y,z a_YAH=92 4571 4598 " HZ1 LYS A 287 "<>" OE1 GLU A 286 " d_HA=2.541 d_AD=3.532 a_DHA=163.871 symop: x,y,z a_YAH=120 1856 1911 "HH22 ARG A 123 "<>" OG SER A 120 " d_HA=2.129 d_AD=3.061 a_DHA=151.602 symop: -x+1,-y,z a_YAH=92 a_YAH=121 1910 4604 "HH21 ARG A 123 "<>" O ASP A 288 " d_HA=1.909 d_AD=2.654 a_DHA=126.862 symop: x,y,z a_YAH=128 4623 4627 " HG SER A 289 "<>" O VAL A 290 " d_HA=2.864 d_AD=3.467 a_DHA=121.627 symop: -x+1,-y,z a_YAH=114 1169 1218 " H ASP A 77 "<>" O LYS A 74 " d_HA=2.287 d_AD=3.217 a_DHA=152.345 symop: x,y,z a_YAH=118 1207 1567 " H GLY A 76 "<>" O VAL A 100 " d_HA=1.860 d_AD=2.774 a_DHA=147.442 symop: x,y,z a_YAH=150 1543 1595 " H MET A 102 "<>" O ARG A 99 " d_HA=2.943 d_AD=3.780 a_DHA=141.364 symop: x,y,z a_YAH=98 1242 1641 " HH TYR A 78 "<>" OD2 ASP A 105 " d_HA=1.691 d_AD=2.671 a_DHA=171.237 symop: x,y,z a_YAH=124 1637 1706 " H GLU A 109 "<>" O ASP A 105 " d_HA=2.159 d_AD=3.165 a_DHA=168.133 symop: x,y,z a_YAH=157 1640 1688 " H MET A 108 "<>" OD1 ASP A 105 " d_HA=2.333 d_AD=3.310 a_DHA=159.796 symop: x,y,z a_YAH=130 1664 1727 " H ALA A 111 "<>" O LEU A 107 " d_HA=2.211 d_AD=3.138 a_DHA=150.929 symop: x,y,z a_YAH=150 1683 1727 " H ALA A 111 "<>" O MET A 108 " d_HA=2.879 d_AD=3.567 a_DHA=125.585 symop: x,y,z a_YAH=103 1683 1741 " H LYS A 112 "<>" O MET A 108 " d_HA=2.036 d_AD=3.003 a_DHA=157.377 symop: x,y,z a_YAH=155 1700 1763 " H GLU A 113 "<>" O GLU A 109 " d_HA=1.660 d_AD=2.642 a_DHA=164.751 symop: x,y,z a_YAH=155 1649 1717 " H ALA A 110 "<>" O GLU A 106 " d_HA=1.950 d_AD=2.952 a_DHA=168.287 symop: x,y,z a_YAH=134 1480 4467 " HG1 THR A 94 "<>" O GLU A 280 " d_HA=1.806 d_AD=2.743 a_DHA=160.096 symop: x,y,z a_YAH=169 1487 4473 " H GLU A 280 "<>" O ALA A 95 " d_HA=1.808 d_AD=2.810 a_DHA=169.257 symop: x,y,z a_YAH=126 1752 4488 " HZ2 LYS A 112 "<>" NE2 HIS A 281 " d_HA=2.294 d_AD=3.089 a_DHA=134.027 symop: x,y,z a_YAH=125 a_YAH=114 1715 1774 " H ALA A 114 "<>" O ALA A 110 " d_HA=2.116 d_AD=2.960 a_DHA=139.612 symop: x,y,z a_YAH=118 1725 1787 " H LEU A 115 "<>" O ALA A 111 " d_HA=2.114 d_AD=3.090 a_DHA=160.965 symop: x,y,z a_YAH=145 1735 1806 " H ASN A 116 "<>" O LYS A 112 " d_HA=1.884 d_AD=2.894 a_DHA=173.595 symop: x,y,z a_YAH=166 1757 1817 " H ALA A 117 "<>" O GLU A 113 " d_HA=1.692 d_AD=2.694 a_DHA=174.060 symop: x,y,z a_YAH=172 2125 2213 " H ARG A 142 "<>" O GLU A 138 " d_HA=2.364 d_AD=3.372 a_DHA=173.288 symop: x,y,z a_YAH=125 2129 2201 " HZ3 LYS A 141 "<>" OE1 GLU A 138 " d_HA=1.644 d_AD=2.611 a_DHA=155.549 symop: x,y,z a_YAH=112 4503 4694 " H THR A 282 "<>" OG1 THR A 294 " d_HA=2.144 d_AD=3.089 a_DHA=154.471 symop: x,y,z a_YAH=120 a_YAH=132 1772 1827 " H ALA A 118 "<>" O ALA A 114 " d_HA=1.909 d_AD=2.881 a_DHA=158.946 symop: x,y,z a_YAH=148 1782 1840 " H ILE A 119 "<>" O LEU A 115 " d_HA=2.285 d_AD=3.147 a_DHA=141.572 symop: x,y,z a_YAH=143 1801 1861 " HG SER A 120 "<>" O ASN A 116 " d_HA=1.959 d_AD=2.915 a_DHA=165.105 symop: x,y,z a_YAH=128 1801 1840 " H ILE A 119 "<>" O ASN A 116 " d_HA=2.084 d_AD=2.841 a_DHA=129.352 symop: x,y,z a_YAH=110 1801 1857 " H SER A 120 "<>" O ASN A 116 " d_HA=2.337 d_AD=3.159 a_DHA=137.482 symop: x,y,z a_YAH=153 4499 4696 " H THR A 294 "<>" O THR A 282 " d_HA=2.778 d_AD=3.738 a_DHA=158.638 symop: x,y,z a_YAH=149 4499 4682 " H THR A 293 "<>" O THR A 282 " d_HA=2.196 d_AD=3.009 a_DHA=136.094 symop: x,y,z a_YAH=149 4499 4685 " HG1 THR A 293 "<>" O THR A 282 " d_HA=1.910 d_AD=2.846 a_DHA=160.925 symop: x,y,z a_YAH=126 1815 1857 " H SER A 120 "<>" O ALA A 117 " d_HA=2.057 d_AD=2.880 a_DHA=136.637 symop: x,y,z a_YAH=113 1815 1869 " H VAL A 121 "<>" O ALA A 117 " d_HA=2.432 d_AD=3.421 a_DHA=163.461 symop: x,y,z a_YAH=163 1825 1883 " H ALA A 122 "<>" O ALA A 118 " d_HA=2.290 d_AD=2.967 a_DHA=123.173 symop: x,y,z a_YAH=128 4532 4648 " H ILE A 291 "<>" O ILE A 284 " d_HA=2.288 d_AD=3.229 a_DHA=154.970 symop: x,y,z a_YAH=141 4537 4643 " H ILE A 284 "<>" O ILE A 291 " d_HA=2.557 d_AD=3.464 a_DHA=148.672 symop: x,y,z a_YAH=132 1917 4582 " H ALA A 124 "<>" O LYS A 287 " d_HA=2.163 d_AD=2.945 a_DHA=132.684 symop: x,y,z a_YAH=139 4573 4616 " H GLU A 286 "<>" O SER A 289 " d_HA=2.499 d_AD=3.432 a_DHA=152.962 symop: x,y,z a_YAH=147 4588 4616 " H LYS A 287 "<>" O SER A 289 " d_HA=2.301 d_AD=3.286 a_DHA=161.742 symop: x,y,z a_YAH=130 1150 444 " H GLY A 27 "<>" O LEU A 73 " d_HA=2.392 d_AD=3.334 a_DHA=153.552 symop: x,y,z a_YAH=139 1175 1217 " H LYS A 74 "<>" OD2 ASP A 77 " d_HA=1.948 d_AD=2.929 a_DHA=159.951 symop: x,y,z a_YAH=94 1213 1571 " H VAL A 100 "<>" O ASP A 77 " d_HA=2.010 d_AD=2.968 a_DHA=156.540 symop: x,y,z a_YAH=127 1213 1251 " H LEU A 79 "<>" O ASP A 77 " d_HA=2.033 d_AD=2.862 a_DHA=136.825 symop: x,y,z a_YAH=104 913 1234 " H TYR A 78 "<>" OD1 ASN A 57 " d_HA=2.015 d_AD=2.754 a_DHA=127.938 symop: x,y,z a_YAH=162 1246 1531 " H VAL A 98 "<>" O LEU A 79 " d_HA=1.758 d_AD=2.771 a_DHA=174.899 symop: x,y,z a_YAH=163 1292 1497 " H ILE A 81 "<>" O VAL A 96 " d_HA=2.053 d_AD=3.058 a_DHA=166.722 symop: x,y,z a_YAH=171 1287 1501 " H VAL A 96 "<>" O ILE A 81 " d_HA=1.841 d_AD=2.855 a_DHA=174.058 symop: x,y,z a_YAH=171 1515 4436 " H GLN A 278 "<>" OG1 THR A 97 " d_HA=1.912 d_AD=2.876 a_DHA=157.645 symop: x,y,z a_YAH=142 a_YAH=92 1520 4430 " HG1 THR A 97 "<>" O GLN A 278 " d_HA=1.615 d_AD=2.484 a_DHA=145.223 symop: x,y,z a_YAH=124 1473 1322 " H VAL A 83 "<>" O THR A 94 " d_HA=2.080 d_AD=2.924 a_DHA=138.582 symop: x,y,z a_YAH=127 1489 4467 " H ALA A 95 "<>" O GLU A 280 " d_HA=1.908 d_AD=2.836 a_DHA=151.102 symop: x,y,z a_YAH=109 2961 4455 " H PHE A 279 "<>" O PRO A 188 " d_HA=2.020 d_AD=2.902 a_DHA=143.995 symop: x,y,z a_YAH=123 2077 2145 " H ILE A 139 "<>" O ILE A 135 " d_HA=2.368 d_AD=3.251 a_DHA=144.365 symop: x,y,z a_YAH=144 1461 4506 " HG1 THR A 282 "<>" O ASP A 93 " d_HA=2.004 d_AD=2.938 a_DHA=160.744 symop: x,y,z a_YAH=126 2932 4482 " H ILE A 186 "<>" O HIS A 281 " d_HA=1.793 d_AD=2.717 a_DHA=149.742 symop: x,y,z a_YAH=155 2927 4489 " H HIS A 281 "<>" O ILE A 186 " d_HA=2.243 d_AD=3.175 a_DHA=151.964 symop: x,y,z a_YAH=136 2045 2116 " H ASN A 137 "<>" O LYS A 133 " d_HA=2.145 d_AD=3.034 a_DHA=144.606 symop: x,y,z a_YAH=148 2067 2131 " H GLU A 138 "<>" O ALA A 134 " d_HA=1.880 d_AD=2.832 a_DHA=154.464 symop: x,y,z a_YAH=151 2067 2116 " H ASN A 137 "<>" O ALA A 134 " d_HA=1.954 d_AD=2.658 a_DHA=123.656 symop: x,y,z a_YAH=109 2897 4518 " H ILE A 283 "<>" O PHE A 184 " d_HA=1.942 d_AD=2.957 a_DHA=174.173 symop: x,y,z a_YAH=152 2905 4513 " H PHE A 184 "<>" O ILE A 283 " d_HA=2.012 d_AD=2.782 a_DHA=130.720 symop: x,y,z a_YAH=136 2004 2069 " H ALA A 134 "<>" O GLU A 130 " d_HA=2.681 d_AD=3.658 a_DHA=160.292 symop: x,y,z a_YAH=134 2019 2082 " H ILE A 135 "<>" O LEU A 131 " d_HA=2.472 d_AD=3.461 a_DHA=164.267 symop: x,y,z a_YAH=151 2019 2069 " H ALA A 134 "<>" O LEU A 131 " d_HA=1.930 d_AD=2.640 a_DHA=123.972 symop: x,y,z a_YAH=131 2869 4555 " H VAL A 285 "<>" O ASP A 182 " d_HA=2.198 d_AD=3.208 a_DHA=172.823 symop: x,y,z a_YAH=132 2825 2874 " H ASP A 182 "<>" O LYS A 179 " d_HA=1.825 d_AD=2.802 a_DHA=159.186 symop: x,y,z a_YAH=140 2863 4551 " H GLY A 181 "<>" O VAL A 285 " d_HA=2.213 d_AD=3.184 a_DHA=159.793 symop: x,y,z a_YAH=152 1926 2806 " H GLY A 125 "<>" O LEU A 178 " d_HA=1.875 d_AD=2.763 a_DHA=145.214 symop: x,y,z a_YAH=107 891 944 " H ILE A 59 "<>" O ILE A 56 " d_HA=1.897 d_AD=2.895 a_DHA=165.070 symop: x,y,z a_YAH=136 915 1225 " H ASN A 57 "<>" O TYR A 78 " d_HA=1.703 d_AD=2.674 a_DHA=159.466 symop: x,y,z a_YAH=134 880 1271 " H LYS A 80 "<>" O SER A 55 " d_HA=2.052 d_AD=2.808 a_DHA=129.745 symop: x,y,z a_YAH=140 880 1283 " HZ3 LYS A 80 "<>" O SER A 55 " d_HA=1.925 d_AD=2.699 a_DHA=130.661 symop: x,y,z a_YAH=110 939 1281 " HZ1 LYS A 80 "<>" O ILE A 59 " d_HA=1.790 d_AD=2.780 a_DHA=165.083 symop: x,y,z a_YAH=157 3007 3024 " H ILE A 192 "<>" OG1 THR A 191 " d_HA=2.019 d_AD=2.731 a_DHA=125.109 symop: x,y,z a_YAH=95 a_YAH=112 3007 3039 " H GLY A 193 "<>" OG1 THR A 191 " d_HA=2.142 d_AD=3.103 a_DHA=156.968 symop: x,y,z a_YAH=115 a_YAH=139 4378 4408 " H VAL A 276 "<>" O GLY A 274 " d_HA=2.031 d_AD=2.873 a_DHA=138.980 symop: x,y,z a_YAH=111 3019 2273 " HZ2 LYS A 145 "<>" O ILE A 192 " d_HA=2.317 d_AD=2.998 a_DHA=123.249 symop: x,y,z a_YAH=117 3019 3047 " H ALA A 194 "<>" O ILE A 192 " d_HA=1.747 d_AD=2.689 a_DHA=153.451 symop: x,y,z a_YAH=101 958 4443 "HE22 GLN A 278 "<>" O ALA A 60 " d_HA=1.967 d_AD=2.766 a_DHA=134.122 symop: x,y,z a_YAH=151 2297 2975 " H ILE A 147 "<>" O PHE A 189 " d_HA=1.963 d_AD=2.824 a_DHA=139.774 symop: x,y,z a_YAH=159 2995 4422 " H ALA A 277 "<>" O ALA A 190 " d_HA=1.826 d_AD=2.800 a_DHA=159.629 symop: x,y,z a_YAH=122 2997 4420 " H ALA A 190 "<>" O ALA A 277 " d_HA=2.264 d_AD=3.069 a_DHA=135.453 symop: x,y,z a_YAH=90 2262 3005 " H LYS A 145 "<>" O THR A 191 " d_HA=1.938 d_AD=2.700 a_DHA=129.131 symop: x,y,z a_YAH=151 2643 2946 "HD21 ASN A 168 "<>" O GLU A 187 " d_HA=1.817 d_AD=2.839 a_DHA=175.850 symop: x,y,z a_YAH=125 2637 2983 " H PHE A 189 "<>" OD1 ASN A 168 " d_HA=1.766 d_AD=2.743 a_DHA=160.646 symop: x,y,z a_YAH=132 2385 2917 " H HIS A 153 "<>" O ALA A 185 " d_HA=2.757 d_AD=3.503 a_DHA=130.386 symop: x,y,z a_YAH=115 2391 2951 " HE2 HIS A 153 "<>" OE2 GLU A 187 " d_HA=2.230 d_AD=3.099 a_DHA=140.340 symop: x,y,z a_YAH=110 2038 2102 " H GLU A 136 "<>" O GLY A 132 " d_HA=2.108 d_AD=3.104 a_DHA=165.126 symop: x,y,z a_YAH=152 2676 2101 " H TYR A 170 "<>" OE2 GLU A 136 " d_HA=1.801 d_AD=2.737 a_DHA=151.298 symop: x,y,z a_YAH=112 2378 2919 " H ALA A 185 "<>" O HIS A 153 " d_HA=2.006 d_AD=2.972 a_DHA=158.398 symop: x,y,z a_YAH=166 2422 2881 " H ILE A 155 "<>" O VAL A 183 " d_HA=2.513 d_AD=3.523 a_DHA=175.752 symop: x,y,z a_YAH=158 1963 2024 " H LEU A 131 "<>" O ILE A 128 " d_HA=1.993 d_AD=2.827 a_DHA=137.458 symop: x,y,z a_YAH=114 1963 2039 " H GLY A 132 "<>" O ILE A 128 " d_HA=1.999 d_AD=2.999 a_DHA=167.254 symop: x,y,z a_YAH=147 1982 2051 " H LYS A 133 "<>" O LYS A 129 " d_HA=1.967 d_AD=2.900 a_DHA=150.432 symop: x,y,z a_YAH=147 2411 2441 " HZ1 LYS A 154 "<>" OE2 GLU A 156 " d_HA=1.862 d_AD=2.708 a_DHA=137.436 symop: x,y,z a_YAH=126 2413 2872 " HZ3 LYS A 154 "<>" OD1 ASP A 182 " d_HA=2.074 d_AD=3.088 a_DHA=171.789 symop: x,y,z a_YAH=137 1948 2024 " H LEU A 131 "<>" O GLU A 127 " d_HA=2.898 d_AD=3.719 a_DHA=138.244 symop: x,y,z a_YAH=140 1948 2010 " H GLU A 130 "<>" O GLU A 127 " d_HA=1.748 d_AD=2.707 a_DHA=156.941 symop: x,y,z a_YAH=127 1968 2769 " H ILE A 128 "<>" O TYR A 176 " d_HA=1.880 d_AD=2.842 a_DHA=157.553 symop: x,y,z a_YAH=145 1988 2743 " H LYS A 129 "<>" O ASP A 174 " d_HA=2.043 d_AD=3.027 a_DHA=163.098 symop: x,y,z a_YAH=126 1952 1999 " HZ2 LYS A 129 "<>" OE1 GLU A 127 " d_HA=1.867 d_AD=2.724 a_DHA=138.617 symop: x,y,z a_YAH=138 2786 2873 " HH TYR A 176 "<>" OD2 ASP A 182 " d_HA=1.954 d_AD=2.895 a_DHA=160.606 symop: x,y,z a_YAH=106 2790 2842 " HZ2 LYS A 179 "<>" O VAL A 177 " d_HA=1.781 d_AD=2.760 a_DHA=159.984 symop: x,y,z a_YAH=108 1932 2811 " H LEU A 178 "<>" O VAL A 126 " d_HA=2.426 d_AD=3.283 a_DHA=142.072 symop: x,y,z a_YAH=131 924 4312 " H GLU A 270 "<>" O GLU A 58 " d_HA=1.765 d_AD=2.682 a_DHA=147.996 symop: x,y,z a_YAH=143 1004 850 " H TYR A 63 "<>" OD1 ASN A 53 " d_HA=2.124 d_AD=2.940 a_DHA=136.366 symop: x,y,z a_YAH=138 960 4265 " H ALA A 60 "<>" O LEU A 268 " d_HA=1.957 d_AD=2.969 a_DHA=174.229 symop: x,y,z a_YAH=135 968 4270 " H LEU A 268 "<>" O ALA A 61 " d_HA=2.391 d_AD=3.324 a_DHA=152.037 symop: x,y,z a_YAH=154 3062 4326 " H ILE A 271 "<>" O GLN A 196 " d_HA=1.801 d_AD=2.796 a_DHA=164.439 symop: x,y,z a_YAH=147 4306 4369 " H ASN A 273 "<>" O GLU A 270 " d_HA=2.211 d_AD=3.178 a_DHA=160.368 symop: x,y,z a_YAH=122 4310 4379 " H GLY A 274 "<>" OE1 GLU A 270 " d_HA=2.234 d_AD=3.189 a_DHA=156.139 symop: x,y,z a_YAH=113 4310 4348 " H ARG A 272 "<>" OE1 GLU A 270 " d_HA=1.811 d_AD=2.812 a_DHA=163.865 symop: x,y,z a_YAH=138 3056 4311 " H GLY A 195 "<>" OE2 GLU A 270 " d_HA=2.590 d_AD=3.371 a_DHA=133.475 symop: x,y,z a_YAH=139 2315 3055 " H VAL A 148 "<>" O GLY A 195 " d_HA=2.691 d_AD=3.651 a_DHA=159.671 symop: x,y,z a_YAH=113 3068 4311 " H GLN A 196 "<>" OE2 GLU A 270 " d_HA=2.599 d_AD=3.581 a_DHA=161.260 symop: x,y,z a_YAH=142 2367 2371 " HG SER A 151 "<>" O GLY A 152 " d_HA=2.867 d_AD=3.736 a_DHA=149.345 symop: x,y,z a_YAH=127 2371 2606 " H ILE A 166 "<>" O GLY A 152 " d_HA=2.031 d_AD=2.781 a_DHA=129.011 symop: x,y,z a_YAH=94 2518 2556 " H ALA A 162 "<>" O LEU A 160 " d_HA=1.826 d_AD=2.759 a_DHA=150.371 symop: x,y,z a_YAH=103 2395 2565 " H GLY A 163 "<>" O LYS A 154 " d_HA=2.144 d_AD=3.002 a_DHA=140.312 symop: x,y,z a_YAH=135 2401 2571 " H LYS A 154 "<>" O ILE A 164 " d_HA=2.493 d_AD=3.323 a_DHA=140.149 symop: x,y,z a_YAH=103 2688 2748 " H ASP A 174 "<>" O ARG A 171 " d_HA=2.330 d_AD=3.319 a_DHA=163.811 symop: x,y,z a_YAH=126 2743 2778 " H TYR A 176 "<>" O ASP A 174 " d_HA=1.842 d_AD=2.795 a_DHA=155.462 symop: x,y,z a_YAH=92 1999 1952 " HZ2 LYS A 129 "<>" OE1 GLU A 127 " d_HA=1.867 d_AD=2.724 a_DHA=138.617 symop: x,y,z a_YAH=138 2000 2675 " HZ3 LYS A 129 "<>" OH TYR A 170 " d_HA=2.820 d_AD=3.687 a_DHA=144.792 symop: x,y,z a_YAH=134 a_YAH=101 4300 4306 " HZ1 LYS A 269 "<>" O GLU A 270 " d_HA=1.690 d_AD=2.626 a_DHA=151.128 symop: x,y,z a_YAH=164 4301 4367 " HZ2 LYS A 269 "<>" OD1 ASN A 273 " d_HA=1.695 d_AD=2.669 a_DHA=159.021 symop: x,y,z a_YAH=167 4302 4321 " HZ3 LYS A 269 "<>" O ILE A 271 " d_HA=1.934 d_AD=2.899 a_DHA=157.904 symop: x,y,z a_YAH=107 3129 4253 " H VAL A 267 "<>" O VAL A 200 " d_HA=1.848 d_AD=2.760 a_DHA=148.766 symop: x,y,z a_YAH=141 3133 4249 " H VAL A 200 "<>" O VAL A 267 " d_HA=1.826 d_AD=2.696 a_DHA=140.722 symop: x,y,z a_YAH=140 3095 4290 " H LYS A 269 "<>" O ILE A 198 " d_HA=1.964 d_AD=2.908 a_DHA=154.197 symop: x,y,z a_YAH=134 3100 4284 " H ILE A 198 "<>" O LYS A 269 " d_HA=1.804 d_AD=2.806 a_DHA=167.385 symop: x,y,z a_YAH=133 2330 3083 " H VAL A 197 "<>" OD1 ASN A 149 " d_HA=2.318 d_AD=3.240 a_DHA=151.542 symop: x,y,z a_YAH=110 2336 3079 "HD21 ASN A 149 "<>" O VAL A 197 " d_HA=2.219 d_AD=3.173 a_DHA=155.838 symop: x,y,z a_YAH=138 3954 4194 "HE21 GLN A 248 "<>" OH TYR A 263 " d_HA=1.840 d_AD=2.773 a_DHA=152.328 symop: -y+1,x-y,z-1/3 a_YAH=125 a_YAH=115 3906 3948 " H GLN A 248 "<>" O PRO A 245 " d_HA=2.937 d_AD=3.875 a_DHA=154.993 symop: x,y,z a_YAH=107 3436 3451 " H ALA A 219 "<>" OE1 GLN A 218 " d_HA=2.212 d_AD=2.967 a_DHA=130.141 symop: x,y,z a_YAH=116 3119 3445 "HE22 GLN A 218 "<>" OE2 GLU A 199 " d_HA=2.285 d_AD=3.116 a_DHA=137.704 symop: -x+y+1,-x+1,z+1/3 a_YAH=101 3119 4203 " HH TYR A 263 "<>" OE2 GLU A 199 " d_HA=2.071 d_AD=2.913 a_DHA=143.694 symop: x,y,z a_YAH=165 4000 4074 " H THR A 255 "<>" O LEU A 251 " d_HA=1.814 d_AD=2.759 a_DHA=153.289 symop: x,y,z a_YAH=154 4000 4077 " HG1 THR A 255 "<>" O LEU A 251 " d_HA=2.091 d_AD=2.898 a_DHA=139.070 symop: x,y,z a_YAH=121 3942 4021 " H ALA A 252 "<>" O GLN A 248 " d_HA=1.849 d_AD=2.798 a_DHA=155.194 symop: x,y,z a_YAH=146 3935 4005 " H LEU A 251 "<>" O GLY A 247 " d_HA=2.039 d_AD=3.043 a_DHA=170.223 symop: x,y,z a_YAH=159 3978 4054 " H LYS A 254 "<>" O LYS A 250 " d_HA=1.806 d_AD=2.781 a_DHA=158.812 symop: x,y,z a_YAH=160 3889 3926 " H GLU A 246 "<>" O MET A 244 " d_HA=1.838 d_AD=2.822 a_DHA=161.610 symop: x,y,z a_YAH=107 3920 3964 " H LEU A 249 "<>" O GLU A 246 " d_HA=1.944 d_AD=2.815 a_DHA=142.229 symop: x,y,z a_YAH=124 3920 3984 " H LYS A 250 "<>" O GLU A 246 " d_HA=2.762 d_AD=3.725 a_DHA=158.556 symop: x,y,z a_YAH=152 3775 3924 " HH TYR A 237 "<>" OE1 GLU A 246 " d_HA=1.972 d_AD=2.952 a_DHA=174.950 symop: x,y,z a_YAH=159 3858 3925 "HE21 GLN A 241 "<>" OE2 GLU A 246 " d_HA=2.360 d_AD=3.320 a_DHA=156.455 symop: x,y,z a_YAH=114 1065 3859 "HE22 GLN A 241 "<>" O LYS A 67 " d_HA=1.975 d_AD=2.958 a_DHA=161.659 symop: x,y,z a_YAH=147 1061 1087 " HH TYR A 66 "<>" O GLY A 68 " d_HA=2.920 d_AD=3.750 a_DHA=145.097 symop: x,y,z a_YAH=99 2101 2676 " H TYR A 170 "<>" OE2 GLU A 136 " d_HA=1.801 d_AD=2.737 a_DHA=151.298 symop: x,y,z a_YAH=112 3382 3479 "HH22 ARG A 220 "<>" O ARG A 215 " d_HA=1.905 d_AD=2.771 a_DHA=141.432 symop: x,y,z a_YAH=110 3422 3475 " HE ARG A 220 "<>" O ALA A 217 " d_HA=2.762 d_AD=3.735 a_DHA=162.088 symop: x,y,z a_YAH=132 3422 3478 "HH21 ARG A 220 "<>" O ALA A 217 " d_HA=2.842 d_AD=3.771 a_DHA=152.864 symop: x,y,z a_YAH=91 3422 3467 " H ARG A 220 "<>" O ALA A 217 " d_HA=2.026 d_AD=2.891 a_DHA=141.334 symop: x,y,z a_YAH=138 3422 3491 " H PHE A 221 "<>" O ALA A 217 " d_HA=2.669 d_AD=3.626 a_DHA=160.191 symop: x,y,z a_YAH=130 3406 3467 " H ARG A 220 "<>" O VAL A 216 " d_HA=2.338 d_AD=3.237 a_DHA=146.809 symop: x,y,z a_YAH=153 4070 4142 " H ALA A 259 "<>" O THR A 255 " d_HA=2.589 d_AD=3.446 a_DHA=142.211 symop: x,y,z a_YAH=139 3432 3508 " H LEU A 222 "<>" O GLN A 218 " d_HA=1.776 d_AD=2.675 a_DHA=146.465 symop: x,y,z a_YAH=138 4019 4074 " H THR A 255 "<>" O ALA A 252 " d_HA=2.139 d_AD=2.789 a_DHA=120.090 symop: x,y,z a_YAH=114 4019 4077 " HG1 THR A 255 "<>" O ALA A 252 " d_HA=2.055 d_AD=2.808 a_DHA=132.559 symop: x,y,z a_YAH=114 4019 4089 " H LEU A 256 "<>" O ALA A 252 " d_HA=2.214 d_AD=3.150 a_DHA=153.429 symop: x,y,z a_YAH=141 4029 4109 " H GLU A 257 "<>" O LEU A 253 " d_HA=1.803 d_AD=2.653 a_DHA=139.336 symop: x,y,z a_YAH=159 4048 4124 " H LYS A 258 "<>" O LYS A 254 " d_HA=2.583 d_AD=3.537 a_DHA=156.920 symop: x,y,z a_YAH=167 4048 4109 " H GLU A 257 "<>" O LYS A 254 " d_HA=2.418 d_AD=3.147 a_DHA=128.329 symop: x,y,z a_YAH=97 3959 4034 " H LEU A 253 "<>" O LEU A 249 " d_HA=2.174 d_AD=3.160 a_DHA=162.274 symop: x,y,z a_YAH=160 3180 3233 " HG1 THR A 203 "<>" OH TYR A 206 " d_HA=2.440 d_AD=3.367 a_DHA=159.450 symop: x,y,z a_YAH=101 a_YAH=92 3827 3882 " H ASP A 243 "<>" O LEU A 240 " d_HA=2.003 d_AD=2.902 a_DHA=146.562 symop: x,y,z a_YAH=138 3758 3852 " H GLN A 241 "<>" O TYR A 237 " d_HA=2.036 d_AD=2.890 a_DHA=140.312 symop: x,y,z a_YAH=146 3758 3832 " H LEU A 240 "<>" O TYR A 237 " d_HA=2.142 d_AD=3.057 a_DHA=149.825 symop: x,y,z a_YAH=113 1071 3850 " H LYS A 67 "<>" OE1 GLN A 241 " d_HA=1.894 d_AD=2.835 a_DHA=152.212 symop: x,y,z a_YAH=135 1044 1099 " H ASP A 69 "<>" O TYR A 66 " d_HA=1.901 d_AD=2.875 a_DHA=159.939 symop: x,y,z a_YAH=134 1097 1110 " H THR A 70 "<>" OD1 ASP A 69 " d_HA=1.940 d_AD=2.727 a_DHA=132.118 symop: x,y,z a_YAH=108 1097 1124 " H THR A 71 "<>" OD1 ASP A 69 " d_HA=1.953 d_AD=2.894 a_DHA=152.961 symop: x,y,z a_YAH=110 1097 1127 " HG1 THR A 71 "<>" OD1 ASP A 69 " d_HA=1.879 d_AD=2.696 a_DHA=139.455 symop: x,y,z a_YAH=116 467 530 " H GLU A 32 "<>" O LEU A 29 " d_HA=2.188 d_AD=2.882 a_DHA=124.143 symop: x,y,z a_YAH=128 467 544 " H LEU A 33 "<>" O LEU A 29 " d_HA=1.931 d_AD=2.943 a_DHA=174.918 symop: x,y,z a_YAH=150 491 1120 " H LEU A 30 "<>" O THR A 71 " d_HA=1.875 d_AD=2.879 a_DHA=169.155 symop: x,y,z a_YAH=144 444 1150 " H GLY A 27 "<>" O LEU A 73 " d_HA=2.392 d_AD=3.334 a_DHA=153.552 symop: x,y,z a_YAH=139 450 1155 " H LEU A 73 "<>" O MET A 28 " d_HA=2.064 d_AD=3.061 a_DHA=167.087 symop: x,y,z a_YAH=154 2096 2167 " H ARG A 140 "<>" O GLU A 136 " d_HA=1.759 d_AD=2.625 a_DHA=140.401 symop: x,y,z a_YAH=135 2116 2067 " H ASN A 137 "<>" O ALA A 134 " d_HA=1.954 d_AD=2.658 a_DHA=123.656 symop: x,y,z a_YAH=109 2116 2045 " H ASN A 137 "<>" O LYS A 133 " d_HA=2.145 d_AD=3.034 a_DHA=144.606 symop: x,y,z a_YAH=148 2100 2178 "HH21 ARG A 140 "<>" OE1 GLU A 136 " d_HA=2.907 d_AD=3.908 a_DHA=167.445 symop: x,y,z a_YAH=174 4084 4151 " H GLY A 260 "<>" O LEU A 256 " d_HA=2.141 d_AD=3.056 a_DHA=149.127 symop: x,y,z a_YAH=140 4084 4159 " H ALA A 261 "<>" O LEU A 256 " d_HA=2.457 d_AD=3.408 a_DHA=157.469 symop: x,y,z a_YAH=165 4103 4151 " H GLY A 260 "<>" O GLU A 257 " d_HA=2.063 d_AD=2.728 a_DHA=120.999 symop: x,y,z a_YAH=119 3483 3557 " H LYS A 225 "<>" O PHE A 221 " d_HA=2.060 d_AD=2.983 a_DHA=149.038 symop: x,y,z a_YAH=144 3449 3527 " H LEU A 223 "<>" O ALA A 219 " d_HA=2.003 d_AD=2.983 a_DHA=161.972 symop: x,y,z a_YAH=164 3459 3543 " H ALA A 224 "<>" O ARG A 220 " d_HA=1.887 d_AD=2.825 a_DHA=152.661 symop: x,y,z a_YAH=165 3503 3557 " H LYS A 225 "<>" O LEU A 222 " d_HA=2.278 d_AD=2.940 a_DHA=121.138 symop: x,y,z a_YAH=109 3503 3578 " H ILE A 226 "<>" O LEU A 222 " d_HA=1.912 d_AD=2.923 a_DHA=174.233 symop: x,y,z a_YAH=172 3206 4223 " H TYR A 265 "<>" O ILE A 205 " d_HA=2.265 d_AD=2.931 a_DHA=122.177 symop: x,y,z a_YAH=143 3187 3767 " H TYR A 237 "<>" O LEU A 204 " d_HA=2.122 d_AD=2.817 a_DHA=124.244 symop: x,y,z a_YAH=147 3234 3728 " H TYR A 206 "<>" O PHE A 235 " d_HA=2.207 d_AD=3.181 a_DHA=161.312 symop: x,y,z a_YAH=157 3211 4214 " H ILE A 205 "<>" O TYR A 265 " d_HA=2.872 d_AD=3.788 a_DHA=150.836 symop: x,y,z a_YAH=169 3779 3872 "HD21 ASN A 242 "<>" O ARG A 238 " d_HA=2.693 d_AD=3.448 a_DHA=131.809 symop: x,y,z a_YAH=154 572 646 " HZ3 LYS A 39 "<>" OE1 GLU A 35 " d_HA=2.872 d_AD=3.795 a_DHA=152.002 symop: x,y,z a_YAH=143 866 995 " H LEU A 54 "<>" O TYR A 63 " d_HA=2.108 d_AD=2.930 a_DHA=137.029 symop: x,y,z a_YAH=145 524 590 " HG SER A 36 "<>" O GLU A 32 " d_HA=1.792 d_AD=2.745 a_DHA=165.037 symop: x,y,z a_YAH=116 524 586 " H SER A 36 "<>" O GLU A 32 " d_HA=1.747 d_AD=2.706 a_DHA=156.254 symop: x,y,z a_YAH=158 573 1081 " HZ1 LYS A 67 "<>" OE2 GLU A 35 " d_HA=1.738 d_AD=2.739 a_DHA=161.402 symop: x,y,z a_YAH=123 486 560 " H ALA A 34 "<>" O LEU A 30 " d_HA=1.792 d_AD=2.802 a_DHA=175.345 symop: x,y,z a_YAH=150 505 574 " H GLU A 35 "<>" O LEU A 31 " d_HA=1.909 d_AD=2.902 a_DHA=163.654 symop: x,y,z a_YAH=155 376 413 " H ARG A 25 "<>" O LEU A 23 " d_HA=2.023 d_AD=2.790 a_DHA=130.248 symop: x,y,z a_YAH=108 376 421 " HE ARG A 25 "<>" O LEU A 23 " d_HA=2.126 d_AD=2.986 a_DHA=141.339 symop: x,y,z a_YAH=124 405 455 " H MET A 28 "<>" O ARG A 25 " d_HA=2.043 d_AD=2.955 a_DHA=148.186 symop: x,y,z a_YAH=149 2111 2189 " H LYS A 141 "<>" O ASN A 137 " d_HA=1.768 d_AD=2.703 a_DHA=151.628 symop: x,y,z a_YAH=147 2140 2244 " H PHE A 144 "<>" O ILE A 139 " d_HA=1.796 d_AD=2.758 a_DHA=157.615 symop: x,y,z a_YAH=160 2213 2125 " H ARG A 142 "<>" O GLU A 138 " d_HA=2.364 d_AD=3.372 a_DHA=173.288 symop: x,y,z a_YAH=125 2273 3019 " HZ2 LYS A 145 "<>" O ILE A 192 " d_HA=2.317 d_AD=2.998 a_DHA=123.249 symop: x,y,z a_YAH=117 3320 3880 "HH22 ARG A 210 "<>" OD1 ASP A 243 " d_HA=2.328 d_AD=3.289 a_DHA=156.686 symop: -x+y+1,-x+1,z+1/3 a_YAH=124 3327 3609 " HZ2 LYS A 227 "<>" OD1 ASP A 211 " d_HA=2.635 d_AD=3.377 a_DHA=130.030 symop: x,y,z a_YAH=118 3280 3321 " HH TYR A 208 "<>" N ASP A 211 " d_HA=1.945 d_AD=2.841 a_DHA=153.482 symop: x,y,z a_YAH=93 a_YAH=94 a_YAH=104 3308 4157 " H ARG A 210 "<>" O ALA A 261 " d_HA=2.838 d_AD=3.795 a_DHA=158.110 symop: x,y,z a_YAH=107 3316 4150 " HE ARG A 210 "<>" O GLY A 260 " d_HA=2.665 d_AD=3.423 a_DHA=131.877 symop: x,y,z a_YAH=142 3541 3622 " H ARG A 228 "<>" O ALA A 224 " d_HA=2.228 d_AD=3.153 a_DHA=151.929 symop: x,y,z a_YAH=129 3522 3598 " H LYS A 227 "<>" O LEU A 223 " d_HA=2.035 d_AD=3.000 a_DHA=158.651 symop: x,y,z a_YAH=131 3246 4195 " H TYR A 263 "<>" O MET A 207 " d_HA=2.302 d_AD=3.276 a_DHA=160.248 symop: x,y,z a_YAH=157 3288 4157 " H VAL A 209 "<>" O ALA A 261 " d_HA=1.953 d_AD=2.826 a_DHA=142.604 symop: x,y,z a_YAH=144 3551 3644 " H GLU A 229 "<>" O LYS A 225 " d_HA=1.870 d_AD=2.869 a_DHA=168.198 symop: x,y,z a_YAH=167 3573 3662 " H TYR A 230 "<>" O ILE A 226 " d_HA=2.013 d_AD=2.974 a_DHA=158.375 symop: x,y,z a_YAH=157 3573 3675 " H GLY A 231 "<>" O ILE A 226 " d_HA=2.558 d_AD=3.318 a_DHA=131.556 symop: x,y,z a_YAH=140 3272 3674 " H TYR A 208 "<>" O GLY A 231 " d_HA=2.832 d_AD=3.678 a_DHA=141.251 symop: x,y,z a_YAH=170 3225 3736 " H PHE A 235 "<>" O TYR A 206 " d_HA=2.105 d_AD=3.040 a_DHA=152.265 symop: x,y,z a_YAH=156 3251 4186 " H MET A 207 "<>" O TYR A 263 " d_HA=1.983 d_AD=2.902 a_DHA=150.170 symop: x,y,z a_YAH=163 3643 3670 " HH TYR A 230 "<>" OE2 GLU A 229 " d_HA=2.342 d_AD=3.250 a_DHA=155.367 symop: x,y,z a_YAH=101 817 856 "HD21 ASN A 53 "<>" O PRO A 51 " d_HA=2.274 d_AD=2.972 a_DHA=125.371 symop: x,y,z a_YAH=168 850 1004 " H TYR A 63 "<>" OD1 ASN A 53 " d_HA=2.124 d_AD=2.940 a_DHA=136.366 symop: x,y,z a_YAH=138 617 3819 " HE1 TRP A 239 "<>" OE1 GLU A 38 " d_HA=2.411 d_AD=3.370 a_DHA=156.214 symop: x,y,z a_YAH=92 618 3798 "HH21 ARG A 238 "<>" OE2 GLU A 38 " d_HA=2.059 d_AD=3.055 a_DHA=165.315 symop: x,y,z a_YAH=91 618 644 " HZ1 LYS A 39 "<>" OE2 GLU A 38 " d_HA=1.841 d_AD=2.668 a_DHA=135.279 symop: x,y,z a_YAH=134 831 1023 " HG1 THR A 64 "<>" O VAL A 52 " d_HA=1.743 d_AD=2.718 a_DHA=170.435 symop: x,y,z a_YAH=134 847 1311 " H ASP A 82 "<>" O ASN A 53 " d_HA=1.943 d_AD=2.889 a_DHA=155.287 symop: x,y,z a_YAH=131 852 1306 " H ASN A 53 "<>" O ASP A 82 " d_HA=2.148 d_AD=3.035 a_DHA=144.696 symop: x,y,z a_YAH=125 568 634 " H LYS A 39 "<>" O GLU A 35 " d_HA=2.132 d_AD=3.116 a_DHA=161.973 symop: x,y,z a_YAH=166 583 655 " H MET A 40 "<>" O SER A 36 " d_HA=2.335 d_AD=3.144 a_DHA=136.079 symop: x,y,z a_YAH=139 539 599 " H ILE A 37 "<>" O LEU A 33 " d_HA=2.129 d_AD=3.107 a_DHA=160.452 symop: x,y,z a_YAH=152 558 619 " H GLU A 38 "<>" O ALA A 34 " d_HA=1.871 d_AD=2.887 a_DHA=177.303 symop: x,y,z a_YAH=167 325 397 " H ALA A 24 "<>" O ALA A 20 " d_HA=2.946 d_AD=3.682 a_DHA=130.027 symop: x,y,z a_YAH=146 335 381 " H LEU A 23 "<>" O ILE A 21 " d_HA=1.808 d_AD=2.749 a_DHA=153.197 symop: x,y,z a_YAH=95 335 397 " H ALA A 24 "<>" O ILE A 21 " d_HA=2.002 d_AD=2.986 a_DHA=162.722 symop: x,y,z a_YAH=136 3592 3675 " H GLY A 231 "<>" O LYS A 227 " d_HA=2.077 d_AD=2.946 a_DHA=142.555 symop: x,y,z a_YAH=119 3653 3700 " H LEU A 233 "<>" O TYR A 230 " d_HA=2.590 d_AD=3.479 a_DHA=147.019 symop: x,y,z a_YAH=146 773 1370 " HE2 HIS A 86 "<>" O PRO A 48 " d_HA=2.354 d_AD=3.041 a_DHA=123.921 symop: x,y,z a_YAH=136 789 1334 " H ALA A 49 "<>" O GLY A 84 " d_HA=2.051 d_AD=3.046 a_DHA=165.798 symop: x,y,z a_YAH=96 1464 1477 " H THR A 94 "<>" OD1 ASP A 93 " d_HA=2.709 d_AD=3.418 a_DHA=126.724 symop: x,y,z a_YAH=116 613 691 " H MET A 42 "<>" O GLU A 38 " d_HA=2.448 d_AD=3.358 a_DHA=149.181 symop: x,y,z a_YAH=133 1322 1473 " H VAL A 83 "<>" O THR A 94 " d_HA=2.080 d_AD=2.924 a_DHA=138.582 symop: x,y,z a_YAH=127 628 709 " H GLU A 43 "<>" O LYS A 39 " d_HA=1.998 d_AD=2.848 a_DHA=139.653 symop: x,y,z a_YAH=138 594 655 " H MET A 40 "<>" O ILE A 37 " d_HA=2.001 d_AD=2.689 a_DHA=122.959 symop: x,y,z a_YAH=108 594 672 " H ILE A 41 "<>" O ILE A 37 " d_HA=1.957 d_AD=2.859 a_DHA=146.516 symop: x,y,z a_YAH=154 248 327 " H ALA A 20 "<>" O VAL A 16 " d_HA=1.702 d_AD=2.696 a_DHA=165.313 symop: x,y,z a_YAH=170 248 309 " H LYS A 19 "<>" O VAL A 16 " d_HA=2.088 d_AD=2.793 a_DHA=124.373 symop: x,y,z a_YAH=101 264 340 " H ILE A 21 "<>" O ARG A 17 " d_HA=1.959 d_AD=2.976 a_DHA=175.686 symop: x,y,z a_YAH=175 2475 3688 " HG1 THR A 232 "<>" O TYR A 158 " d_HA=2.231 d_AD=3.062 a_DHA=142.562 symop: x,y,z a_YAH=150 1360 1406 " H GLY A 89 "<>" ND1 HIS A 86 " d_HA=2.006 d_AD=2.996 a_DHA=163.018 symop: x,y,z a_YAH=122 a_YAH=120 751 1364 " H HIS A 86 "<>" O LYS A 47 " d_HA=1.740 d_AD=2.726 a_DHA=163.403 symop: x,y,z a_YAH=166 757 1357 " H LYS A 47 "<>" O HIS A 86 " d_HA=2.060 d_AD=2.950 a_DHA=144.075 symop: x,y,z a_YAH=162 1341 1453 " H ALA A 92 "<>" O VAL A 85 " d_HA=1.865 d_AD=2.584 a_DHA=125.064 symop: x,y,z a_YAH=162 1345 1451 " H VAL A 85 "<>" O ALA A 92 " d_HA=2.187 d_AD=3.207 a_DHA=177.019 symop: x,y,z a_YAH=161 686 738 " H GLY A 45 "<>" O MET A 42 " d_HA=1.817 d_AD=2.707 a_DHA=144.340 symop: x,y,z a_YAH=103 667 745 " H GLY A 46 "<>" O ILE A 41 " d_HA=2.098 d_AD=3.028 a_DHA=151.012 symop: x,y,z a_YAH=148 667 723 " H LEU A 44 "<>" O ILE A 41 " d_HA=1.913 d_AD=2.896 a_DHA=162.634 symop: x,y,z a_YAH=113 1318 1477 " H THR A 94 "<>" O VAL A 83 " d_HA=2.501 d_AD=3.320 a_DHA=136.979 symop: x,y,z a_YAH=124 175 252 " H VAL A 16 "<>" O ILE A 12 " d_HA=1.857 d_AD=2.858 a_DHA=166.238 symop: x,y,z a_YAH=169 194 272 " H ARG A 17 "<>" O ALA A 13 " d_HA=2.061 d_AD=3.000 a_DHA=152.825 symop: x,y,z a_YAH=130 204 294 " H GLU A 18 "<>" O LYS A 14 " d_HA=1.845 d_AD=2.810 a_DHA=156.906 symop: x,y,z a_YAH=167 226 309 " H LYS A 19 "<>" O LYS A 15 " d_HA=2.374 d_AD=3.220 a_DHA=139.918 symop: x,y,z a_YAH=140 2436 2502 " H LYS A 159 "<>" O GLU A 156 " d_HA=2.084 d_AD=3.020 a_DHA=152.131 symop: x,y,z a_YAH=144 2442 2496 " H GLU A 156 "<>" O LYS A 159 " d_HA=2.082 d_AD=3.079 a_DHA=165.969 symop: x,y,z a_YAH=143 1374 1420 " H PHE A 90 "<>" O ILE A 87 " d_HA=1.773 d_AD=2.665 a_DHA=144.649 symop: x,y,z a_YAH=151 1393 2470 "HH21 ARG A 157 "<>" O ASP A 88 " d_HA=1.894 d_AD=2.597 a_DHA=123.113 symop: x,y,z a_YAH=138 1405 2484 " H TYR A 158 "<>" O GLY A 89 " d_HA=1.995 d_AD=2.997 a_DHA=169.093 symop: x,y,z a_YAH=114 1379 1412 " H ILE A 87 "<>" O PHE A 90 " d_HA=1.830 d_AD=2.817 a_DHA=162.196 symop: x,y,z a_YAH=137 121 180 " H ILE A 12 "<>" O LYS A 8 " d_HA=2.046 d_AD=3.056 a_DHA=173.554 symop: x,y,z a_YAH=162 143 196 " H ALA A 13 "<>" O ALA A 9 " d_HA=1.927 d_AD=2.855 a_DHA=150.939 symop: x,y,z a_YAH=136 153 210 " H LYS A 14 "<>" O GLY A 10 " d_HA=1.802 d_AD=2.632 a_DHA=136.573 symop: x,y,z a_YAH=133 4678 4713 " H GLU A 295 "<>" O THR A 293 " d_HA=2.320 d_AD=3.167 a_DHA=140.337 symop: x,y,z a_YAH=92 160 232 " H LYS A 15 "<>" O GLU A 11 " d_HA=1.816 d_AD=2.779 a_DHA=156.976 symop: x,y,z a_YAH=146 2440 2459 " H ARG A 157 "<>" OE1 GLU A 156 " d_HA=2.694 d_AD=3.556 a_DHA=142.910 symop: x,y,z a_YAH=131 2441 2411 " HZ1 LYS A 154 "<>" OE2 GLU A 156 " d_HA=1.862 d_AD=2.708 a_DHA=137.436 symop: x,y,z a_YAH=126 22 90 " H LEU A 6 "<>" O ASP A 2 " d_HA=2.210 d_AD=3.096 a_DHA=145.424 symop: x,y,z a_YAH=135 22 69 " H LYS A 5 "<>" O ASP A 2 " d_HA=2.098 d_AD=2.903 a_DHA=134.552 symop: x,y,z a_YAH=114 34 109 " H MET A 7 "<>" O THR A 3 " d_HA=1.830 d_AD=2.814 a_DHA=162.350 symop: x,y,z a_YAH=158 63 145 " H ALA A 9 "<>" O LYS A 5 " d_HA=1.992 d_AD=2.899 a_DHA=147.638 symop: x,y,z a_YAH=147 85 154 " H GLY A 10 "<>" O LEU A 6 " d_HA=2.151 d_AD=3.105 a_DHA=156.821 symop: x,y,z a_YAH=143 48 127 " H LYS A 8 "<>" O GLU A 4 " d_HA=2.456 d_AD=3.383 a_DHA=151.893 symop: x,y,z a_YAH=133 104 166 " H GLU A 11 "<>" O MET A 7 " d_HA=1.923 d_AD=2.833 a_DHA=147.985 symop: x,y,z a_YAH=152 138 164 " HZ2 LYS A 8 "<>" OE1 GLU A 11 " d_HA=1.751 d_AD=2.775 a_DHA=169.573 symop: x,y,z a_YAH=96 165 242 " HZ1 LYS A 15 "<>" OE2 GLU A 11 " d_HA=2.726 d_AD=3.377 a_DHA=121.863 symop: x,y,z a_YAH=164 4710 222 " HZ3 LYS A 14 "<>" OE1 GLU A 295 " d_HA=1.860 d_AD=2.837 a_DHA=157.001 symop: x,y,z a_YAH=126 26 80 " HZ2 LYS A 5 "<>" OD2 ASP A 2 " d_HA=1.908 d_AD=2.756 a_DHA=137.298 symop: x,y,z a_YAH=128 3 38 " H THR A 3 "<>" O MET A 1 " d_HA=2.047 d_AD=2.999 a_DHA=154.739 symop: x,y,z a_YAH=93 41 52 " HG1 THR A 3 "<>" OE1 GLU A 4 " d_HA=1.648 d_AD=2.592 a_DHA=160.343 symop: x,y,z a_YAH=173 ------------------------------------------------------------------------------- Total: 348 Symmetry: 0 Per residue: 1.1797 Mean SD Skew Kurtosis theta_1: 139.716 21.880 -0.292 2.048 theta_2: 130.686 22.728 -0.019 1.916 d_HA: 2.341 0.303 0.376 2.254 8 73 " H3 SER A 68 "<>" OE1 GLU A 72 " d_HA=1.804 d_AD=2.607 a_DHA=132.895 symop: x,y,z a_YAH=129 1252 1296 " HG SER A 144 "<>" OE1 GLU A 147 " d_HA=1.569 d_AD=2.564 a_DHA=171.812 symop: x,y,z a_YAH=128 1229 1326 "HH21 ARG A 148 "<>" O VAL A 143 " d_HA=2.169 d_AD=3.052 a_DHA=144.947 symop: x,y,z a_YAH=150 1229 1323 " HE ARG A 148 "<>" O VAL A 143 " d_HA=1.932 d_AD=2.898 a_DHA=157.988 symop: x,y,z a_YAH=142 1245 1276 " H LYS A 146 "<>" O SER A 144 " d_HA=1.907 d_AD=2.807 a_DHA=145.515 symop: x,y,z a_YAH=90 1245 1315 " H ARG A 148 "<>" O SER A 144 " d_HA=2.342 d_AD=3.319 a_DHA=161.558 symop: x,y,z a_YAH=155 1248 1297 " H SER A 144 "<>" OE2 GLU A 147 " d_HA=1.820 d_AD=2.781 a_DHA=154.888 symop: x,y,z a_YAH=121 1276 1296 " H LYS A 146 "<>" OE1 GLU A 147 " d_HA=2.580 d_AD=3.334 a_DHA=130.680 symop: x,y,z a_YAH=132 1256 1288 " HZ3 LYS A 146 "<>" O PRO A 145 " d_HA=1.903 d_AD=2.874 a_DHA=157.483 symop: x,y,z a_YAH=108 1270 1336 " H LEU A 149 "<>" O LYS A 146 " d_HA=1.856 d_AD=2.798 a_DHA=153.505 symop: x,y,z a_YAH=129 1270 1356 " H GLU A 150 "<>" O LYS A 146 " d_HA=2.144 d_AD=3.111 a_DHA=158.946 symop: x,y,z a_YAH=137 1292 1370 " H LEU A 151 "<>" O GLU A 147 " d_HA=1.914 d_AD=2.818 a_DHA=146.726 symop: x,y,z a_YAH=146 1445 1420 " HZ1 LYS B 70 "<>" OD1 ASP B 69 " d_HA=1.845 d_AD=2.673 a_DHA=135.475 symop: x,y,z a_YAH=151 1331 1390 " H LEU A 152 "<>" O LEU A 149 " d_HA=2.235 d_AD=2.918 a_DHA=123.323 symop: x,y,z a_YAH=117 1940 1986 " H SER B 102 "<>" O ILE B 99 " d_HA=2.235 d_AD=3.218 a_DHA=163.609 symop: x,y,z a_YAH=126 1162 1977 " H GLY B 101 "<>" O ILE A 139 " d_HA=1.849 d_AD=2.837 a_DHA=163.602 symop: x,y,z a_YAH=135 1325 1923 "HH12 ARG A 148 "<>" O MET B 98 " d_HA=1.926 d_AD=2.803 a_DHA=142.961 symop: x,y,z a_YAH=121 1327 1923 "HH22 ARG A 148 "<>" O MET B 98 " d_HA=1.948 d_AD=2.865 a_DHA=148.758 symop: x,y,z a_YAH=153 1945 1985 " H ILE B 99 "<>" OG SER B 102 " d_HA=2.003 d_AD=3.018 a_DHA=174.324 symop: x,y,z a_YAH=127 a_YAH=124 1324 1873 "HH11 ARG A 148 "<>" O VAL B 95 " d_HA=1.781 d_AD=2.755 a_DHA=159.931 symop: x,y,z a_YAH=145 1404 1456 " H LEU B 71 "<>" O SER B 68 " d_HA=1.977 d_AD=2.942 a_DHA=158.676 symop: x,y,z a_YAH=143 2377 2559 "HH22 ARG B 138 "<>" OE1 GLU B 127 " d_HA=1.703 d_AD=2.679 a_DHA=156.106 symop: x,y,z a_YAH=137 1167 1983 " H ILE A 139 "<>" O SER B 102 " d_HA=1.854 d_AD=2.844 a_DHA=164.172 symop: x,y,z a_YAH=168 1827 1914 " H GLU B 97 "<>" O LYS B 93 " d_HA=2.331 d_AD=3.200 a_DHA=143.001 symop: x,y,z a_YAH=145 1827 1894 " H LEU B 96 "<>" O LYS B 93 " d_HA=2.452 d_AD=3.181 a_DHA=128.121 symop: x,y,z a_YAH=100 1849 1928 " H MET B 98 "<>" O ARG B 94 " d_HA=2.288 d_AD=3.125 a_DHA=139.117 symop: x,y,z a_YAH=152 1849 1914 " H GLU B 97 "<>" O ARG B 94 " d_HA=2.396 d_AD=3.075 a_DHA=123.549 symop: x,y,z a_YAH=100 1794 1877 " H VAL B 95 "<>" O THR B 91 " d_HA=2.135 d_AD=3.136 a_DHA=168.067 symop: x,y,z a_YAH=164 1808 1894 " H LEU B 96 "<>" O LEU B 92 " d_HA=2.262 d_AD=3.117 a_DHA=140.955 symop: x,y,z a_YAH=144 127 50 " H LEU A 75 "<>" O LEU A 71 " d_HA=1.937 d_AD=2.904 a_DHA=157.579 symop: x,y,z a_YAH=168 103 158 " H ILE A 77 "<>" O LEU A 74 " d_HA=2.789 d_AD=3.529 a_DHA=130.598 symop: x,y,z a_YAH=93 2379 2539 " H GLU B 127 "<>" O ARG B 138 " d_HA=1.870 d_AD=2.841 a_DHA=158.985 symop: x,y,z a_YAH=157 2373 2547 " H ARG B 138 "<>" O GLU B 127 " d_HA=1.886 d_AD=2.872 a_DHA=161.941 symop: x,y,z a_YAH=165 2404 2517 " H GLY B 136 "<>" O VAL B 129 " d_HA=1.886 d_AD=2.859 a_DHA=160.681 symop: x,y,z a_YAH=143 2408 2516 " H VAL B 129 "<>" O GLY B 136 " d_HA=1.940 d_AD=2.906 a_DHA=157.418 symop: x,y,z a_YAH=140 1994 2460 " H ASP B 132 "<>" O ILE B 103 " d_HA=2.125 d_AD=3.004 a_DHA=144.340 symop: -y+1,x-y,z+1/3 a_YAH=155 2018 1122 " H ILE B 104 "<>" O VAL A 137 " d_HA=1.895 d_AD=2.867 a_DHA=160.060 symop: x,y,z a_YAH=142 2458 2473 " H GLU B 133 "<>" OD1 ASP B 132 " d_HA=2.223 d_AD=3.069 a_DHA=139.243 symop: x,y,z a_YAH=116 1782 186 " H MET B 90 "<>" O LEU A 79 " d_HA=2.281 d_AD=3.204 a_DHA=150.792 symop: x,y,z a_YAH=149 122 1833 " H LYS B 93 "<>" O LEU A 75 " d_HA=2.135 d_AD=3.096 a_DHA=156.892 symop: x,y,z a_YAH=145 1796 1857 " H ARG B 94 "<>" OG1 THR B 91 " d_HA=2.167 d_AD=3.138 a_DHA=159.077 symop: x,y,z a_YAH=132 a_YAH=122 191 1777 " H LEU A 79 "<>" O MET B 90 " d_HA=2.379 d_AD=3.153 a_DHA=132.422 symop: x,y,z a_YAH=130 69 146 " H ASP A 76 "<>" O GLU A 72 " d_HA=2.618 d_AD=3.372 a_DHA=131.832 symop: x,y,z a_YAH=150 84 158 " H ILE A 77 "<>" O LEU A 73 " d_HA=2.571 d_AD=3.351 a_DHA=133.999 symop: x,y,z a_YAH=122 2360 2188 "HH12 ARG B 125 "<>" OD1 ASP B 115 " d_HA=1.766 d_AD=2.748 a_DHA=160.918 symop: x,y,z a_YAH=109 2155 2359 "HH11 ARG B 125 "<>" O PRO B 113 " d_HA=1.868 d_AD=2.827 a_DHA=155.742 symop: x,y,z a_YAH=154 2350 2596 " H ARG B 125 "<>" O GLU B 141 " d_HA=1.913 d_AD=2.903 a_DHA=163.528 symop: x,y,z a_YAH=145 2169 2367 " H GLY B 126 "<>" O VAL B 114 " d_HA=2.080 d_AD=3.032 a_DHA=155.142 symop: x,y,z a_YAH=142 2173 2366 " H VAL B 114 "<>" O GLY B 126 " d_HA=1.913 d_AD=2.781 a_DHA=141.790 symop: x,y,z a_YAH=164 2342 2602 " H GLU B 141 "<>" O ARG B 125 " d_HA=2.089 d_AD=3.097 a_DHA=171.491 symop: x,y,z a_YAH=143 2342 2586 " H THR B 140 "<>" O ARG B 125 " d_HA=1.995 d_AD=2.869 a_DHA=143.160 symop: x,y,z a_YAH=124 576 2563 " H GLY A 101 "<>" O ILE B 139 " d_HA=1.840 d_AD=2.823 a_DHA=161.754 symop: x,y,z a_YAH=142 617 2523 " H ILE A 104 "<>" O VAL B 137 " d_HA=1.871 d_AD=2.833 a_DHA=157.526 symop: x,y,z a_YAH=136 582 2568 " H ILE B 139 "<>" O SER A 102 " d_HA=1.847 d_AD=2.856 a_DHA=171.529 symop: x,y,z a_YAH=167 612 2527 " H VAL B 137 "<>" O ILE A 104 " d_HA=1.861 d_AD=2.843 a_DHA=161.086 symop: x,y,z a_YAH=148 593 1059 " H ASP A 132 "<>" O ILE A 103 " d_HA=1.934 d_AD=2.926 a_DHA=165.779 symop: -x+y+1,-x+1,z-1/3 a_YAH=149 699 745 " H GLU A 112 "<>" O LEU A 109 " d_HA=2.102 d_AD=3.080 a_DHA=160.836 symop: x,y,z a_YAH=134 677 2504 " H PHE B 135 "<>" O LYS A 108 " d_HA=2.040 d_AD=3.036 a_DHA=168.585 symop: x,y,z a_YAH=170 722 2467 " H THR A 110 "<>" O GLU B 133 " d_HA=1.910 d_AD=2.923 a_DHA=173.466 symop: x,y,z a_YAH=152 725 2467 " HG1 THR A 110 "<>" O GLU B 133 " d_HA=1.862 d_AD=2.809 a_DHA=163.863 symop: x,y,z a_YAH=105 2436 2487 " H ASN B 134 "<>" O ILE B 131 " d_HA=1.906 d_AD=2.861 a_DHA=154.966 symop: x,y,z a_YAH=145 2441 2482 " H ILE B 131 "<>" O ASN B 134 " d_HA=1.894 d_AD=2.877 a_DHA=161.146 symop: x,y,z a_YAH=165 1866 2472 "HH11 ARG B 94 "<>" OE2 GLU B 133 " d_HA=1.697 d_AD=2.702 a_DHA=164.523 symop: -y+1,x-y,z+1/3 a_YAH=115 2756 2688 " HZ2 LYS B 146 "<>" OE2 GLU B 150 " d_HA=1.757 d_AD=2.663 a_DHA=144.050 symop: x,y,z a_YAH=126 2189 2362 "HH22 ARG B 125 "<>" OD2 ASP B 115 " d_HA=1.854 d_AD=2.774 a_DHA=147.097 symop: x,y,z a_YAH=101 2313 2634 " H VAL B 143 "<>" O ILE B 123 " d_HA=2.135 d_AD=3.134 a_DHA=168.066 symop: x,y,z a_YAH=155 1680 2185 " H GLU B 84 "<>" O ASP B 115 " d_HA=2.254 d_AD=3.169 a_DHA=149.584 symop: x,y,z a_YAH=141 2190 1674 " H ASP B 115 "<>" O GLU B 84 " d_HA=2.541 d_AD=3.406 a_DHA=143.156 symop: x,y,z a_YAH=160 2202 2332 " H ILE B 116 "<>" O ALA B 124 " d_HA=1.982 d_AD=2.882 a_DHA=146.697 symop: x,y,z a_YAH=163 1658 293 " H LEU A 85 "<>" O VAL B 83 " d_HA=2.049 d_AD=2.962 a_DHA=148.889 symop: x,y,z a_YAH=157 308 1658 " H GLY A 86 "<>" O VAL B 83 " d_HA=2.759 d_AD=3.729 a_DHA=161.750 symop: x,y,z a_YAH=135 307 1662 " H VAL B 83 "<>" O GLY A 86 " d_HA=2.009 d_AD=2.981 a_DHA=158.809 symop: x,y,z a_YAH=167 651 2496 " H LEU A 106 "<>" O PHE B 135 " d_HA=2.224 d_AD=3.070 a_DHA=139.763 symop: x,y,z a_YAH=152 637 1057 " H GLU A 105 "<>" OD1 ASP A 132 " d_HA=2.226 d_AD=3.194 a_DHA=157.521 symop: -x+y+1,-x+1,z-1/3 a_YAH=151 1058 466 "HH12 ARG A 94 "<>" OD2 ASP A 132 " d_HA=1.927 d_AD=2.835 a_DHA=146.163 symop: -y+1,x-y,z+1/3 a_YAH=119 1058 468 "HH22 ARG A 94 "<>" OD2 ASP A 132 " d_HA=1.878 d_AD=2.773 a_DHA=144.359 symop: -y+1,x-y,z+1/3 a_YAH=110 646 2492 "HD22 ASN B 134 "<>" O LEU A 106 " d_HA=1.859 d_AD=2.871 a_DHA=169.702 symop: x,y,z a_YAH=151 2698 2649 " H SER B 144 "<>" OE2 GLU B 147 " d_HA=1.850 d_AD=2.817 a_DHA=156.613 symop: x,y,z a_YAH=117 2698 2653 " HG SER B 144 "<>" OE2 GLU B 147 " d_HA=1.761 d_AD=2.717 a_DHA=162.264 symop: x,y,z a_YAH=104 2197 2334 " H ALA B 124 "<>" O ILE B 116 " d_HA=2.454 d_AD=3.330 a_DHA=144.481 symop: x,y,z a_YAH=144 2197 2318 " H ILE B 123 "<>" O ILE B 116 " d_HA=2.063 d_AD=3.061 a_DHA=167.365 symop: x,y,z a_YAH=160 2239 2272 " H VAL B 118 "<>" O LYS B 121 " d_HA=2.016 d_AD=2.977 a_DHA=156.373 symop: x,y,z a_YAH=154 1644 2221 " H LEU B 117 "<>" O THR B 82 " d_HA=1.967 d_AD=2.961 a_DHA=165.517 symop: x,y,z a_YAH=157 1648 2216 " H THR B 82 "<>" O LEU B 117 " d_HA=1.995 d_AD=2.879 a_DHA=143.735 symop: x,y,z a_YAH=155 330 277 " HE ARG A 87 "<>" OE1 GLU A 84 " d_HA=1.767 d_AD=2.659 a_DHA=142.433 symop: x,y,z a_YAH=100 314 670 " H ASP A 107 "<>" O ARG A 87 " d_HA=1.992 d_AD=2.996 a_DHA=169.297 symop: x,y,z a_YAH=160 322 668 " H ARG A 87 "<>" OD1 ASP A 107 " d_HA=2.061 d_AD=3.020 a_DHA=154.941 symop: x,y,z a_YAH=137 342 1628 " H THR A 88 "<>" O VAL B 81 " d_HA=2.334 d_AD=3.280 a_DHA=156.129 symop: x,y,z a_YAH=118 338 1632 " H VAL B 81 "<>" O THR A 88 " d_HA=2.046 d_AD=2.968 a_DHA=149.909 symop: x,y,z a_YAH=153 340 360 " H ARG A 89 "<>" OG1 THR A 88 " d_HA=2.139 d_AD=2.864 a_DHA=126.174 symop: x,y,z a_YAH=102 a_YAH=151 2693 2771 " H LEU B 151 "<>" O GLU B 147 " d_HA=1.946 d_AD=2.870 a_DHA=149.978 symop: x,y,z a_YAH=149 2757 2671 " H GLU B 150 "<>" O LYS B 146 " d_HA=2.230 d_AD=3.223 a_DHA=166.732 symop: x,y,z a_YAH=150 2265 2289 " HZ2 LYS B 121 "<>" O GLY B 120 " d_HA=1.840 d_AD=2.788 a_DHA=153.040 symop: x,y,z a_YAH=111 2235 2278 " H LYS B 121 "<>" O VAL B 118 " d_HA=1.901 d_AD=2.883 a_DHA=160.965 symop: x,y,z a_YAH=124 1606 2256 " H ASN B 119 "<>" O LYS B 80 " d_HA=2.041 d_AD=3.007 a_DHA=157.905 symop: x,y,z a_YAH=135 1622 1646 " HZ1 LYS B 80 "<>" OG1 THR B 82 " d_HA=1.819 d_AD=2.830 a_DHA=168.736 symop: x,y,z a_YAH=128 a_YAH=127 1612 2254 " H LYS B 80 "<>" OD1 ASN B 119 " d_HA=2.119 d_AD=3.106 a_DHA=163.263 symop: x,y,z a_YAH=156 376 1592 " H LEU B 79 "<>" O MET A 90 " d_HA=1.929 d_AD=2.812 a_DHA=143.230 symop: x,y,z a_YAH=148 368 1587 " HE ARG A 89 "<>" O LEU B 79 " d_HA=2.938 d_AD=3.925 a_DHA=166.719 symop: x,y,z a_YAH=100 381 1587 " H MET A 90 "<>" O LEU B 79 " d_HA=1.966 d_AD=2.950 a_DHA=162.883 symop: x,y,z a_YAH=146 1773 2823 "HH22 ARG B 89 "<>" OE2 GLU B 154 " d_HA=1.695 d_AD=2.720 a_DHA=175.620 symop: x-y,-y,-z+2/3 a_YAH=114 2814 2824 "HD22 ASN B 153 "<>" OXT GLU B 154 " d_HA=2.216 d_AD=3.038 a_DHA=136.389 symop: x,y,z a_YAH=121 2732 2790 " H LEU B 152 "<>" O LEU B 149 " d_HA=1.977 d_AD=2.912 a_DHA=151.991 symop: x,y,z a_YAH=112 2732 2809 " H ASN B 153 "<>" O LEU B 149 " d_HA=1.985 d_AD=2.975 a_DHA=163.911 symop: x,y,z a_YAH=156 371 1573 "HH21 ARG A 89 "<>" O PRO B 78 " d_HA=1.950 d_AD=2.862 a_DHA=147.413 symop: x,y,z a_YAH=134 222 2823 " HZ2 LYS A 80 "<>" OE2 GLU B 154 " d_HA=2.435 d_AD=3.269 a_DHA=138.327 symop: x-y,-y,-z+2/3 a_YAH=103 211 853 " H LYS A 80 "<>" OD1 ASN A 119 " d_HA=2.893 d_AD=3.697 a_DHA=136.429 symop: x,y,z a_YAH=149 211 2818 " H LYS A 80 "<>" O GLU B 154 " d_HA=2.640 d_AD=3.531 a_DHA=146.247 symop: x-y,-y,-z+2/3 a_YAH=133 223 2818 " HZ3 LYS A 80 "<>" O GLU B 154 " d_HA=1.801 d_AD=2.686 a_DHA=142.007 symop: x-y,-y,-z+2/3 a_YAH=117 1771 2823 "HH12 ARG B 89 "<>" OE2 GLU B 154 " d_HA=2.487 d_AD=3.294 a_DHA=136.514 symop: x-y,-y,-z+2/3 a_YAH=110 172 1770 "HH11 ARG B 89 "<>" O PRO A 78 " d_HA=1.881 d_AD=2.815 a_DHA=151.305 symop: x,y,z a_YAH=153 186 1782 " H MET B 90 "<>" O LEU A 79 " d_HA=2.281 d_AD=3.204 a_DHA=150.792 symop: x,y,z a_YAH=149 860 2807 "HD22 ASN A 119 "<>" OD1 ASN B 153 " d_HA=2.021 d_AD=2.947 a_DHA=150.800 symop: x-y,-y,-z+2/3 a_YAH=90 2094 2188 " HZ1 LYS B 108 "<>" OD1 ASP B 115 " d_HA=1.751 d_AD=2.646 a_DHA=143.980 symop: x,y,z a_YAH=151 2188 2360 "HH12 ARG B 125 "<>" OD1 ASP B 115 " d_HA=1.766 d_AD=2.748 a_DHA=160.918 symop: x,y,z a_YAH=109 1723 2069 " H ARG B 87 "<>" OD1 ASP B 107 " d_HA=1.811 d_AD=2.821 a_DHA=167.779 symop: x,y,z a_YAH=111 1715 2071 " H ASP B 107 "<>" O ARG B 87 " d_HA=2.006 d_AD=3.005 a_DHA=168.953 symop: x,y,z a_YAH=142 1741 1761 " H ARG B 89 "<>" OG1 THR B 88 " d_HA=2.123 d_AD=2.853 a_DHA=126.825 symop: x,y,z a_YAH=99 a_YAH=153 1746 2032 " HG1 THR B 88 "<>" O GLU B 105 " d_HA=2.460 d_AD=3.310 a_DHA=145.752 symop: x,y,z a_YAH=146 1679 1735 "HH22 ARG B 87 "<>" OE2 GLU B 84 " d_HA=1.781 d_AD=2.678 a_DHA=144.305 symop: x,y,z a_YAH=110 1679 1733 "HH12 ARG B 87 "<>" OE2 GLU B 84 " d_HA=1.902 d_AD=2.822 a_DHA=148.120 symop: x,y,z a_YAH=97 250 1678 " HG1 THR A 82 "<>" OE1 GLU B 84 " d_HA=1.777 d_AD=2.758 a_DHA=175.456 symop: x,y,z a_YAH=143 205 855 " H ASN A 119 "<>" O LYS A 80 " d_HA=2.236 d_AD=3.179 a_DHA=153.601 symop: x,y,z a_YAH=150 227 1743 " H THR B 88 "<>" O VAL A 81 " d_HA=1.937 d_AD=2.916 a_DHA=161.687 symop: x,y,z a_YAH=143 231 1739 " H VAL A 81 "<>" O THR B 88 " d_HA=1.931 d_AD=2.894 a_DHA=157.577 symop: x,y,z a_YAH=145 247 815 " H THR A 82 "<>" O LEU A 117 " d_HA=1.815 d_AD=2.826 a_DHA=173.473 symop: x,y,z a_YAH=166 834 877 " H LYS A 121 "<>" O VAL A 118 " d_HA=1.893 d_AD=2.887 a_DHA=164.707 symop: x,y,z a_YAH=128 838 871 " H VAL A 118 "<>" O LYS A 121 " d_HA=2.145 d_AD=3.081 a_DHA=152.712 symop: x,y,z a_YAH=147 887 1384 " HZ1 LYS A 121 "<>" O LEU A 152 " d_HA=1.804 d_AD=2.587 a_DHA=129.891 symop: x,y,z a_YAH=122 1370 1292 " H LEU A 151 "<>" O GLU A 147 " d_HA=1.914 d_AD=2.818 a_DHA=146.726 symop: x,y,z a_YAH=146 1390 1331 " H LEU A 152 "<>" O LEU A 149 " d_HA=2.235 d_AD=2.918 a_DHA=123.323 symop: x,y,z a_YAH=117 1451 1509 " H LEU B 74 "<>" O LEU B 71 " d_HA=1.903 d_AD=2.869 a_DHA=158.444 symop: x,y,z a_YAH=119 1470 1528 " H LEU B 75 "<>" O GLU B 72 " d_HA=2.043 d_AD=2.894 a_DHA=140.104 symop: x,y,z a_YAH=115 1470 1547 " H ASP B 76 "<>" O GLU B 72 " d_HA=2.691 d_AD=3.587 a_DHA=147.722 symop: x,y,z a_YAH=150 1504 1559 " H ILE B 77 "<>" O LEU B 74 " d_HA=1.992 d_AD=2.990 a_DHA=166.966 symop: x,y,z a_YAH=114 395 456 " H ARG A 94 "<>" OG1 THR A 91 " d_HA=2.551 d_AD=3.542 a_DHA=165.693 symop: x,y,z a_YAH=119 a_YAH=124 400 1523 " HG1 THR A 91 "<>" O LEU B 75 " d_HA=1.984 d_AD=2.871 a_DHA=150.601 symop: x,y,z a_YAH=139 432 1523 " H LYS A 93 "<>" O LEU B 75 " d_HA=1.897 d_AD=2.888 a_DHA=164.417 symop: x,y,z a_YAH=141 393 476 " H VAL A 95 "<>" O THR A 91 " d_HA=1.949 d_AD=2.933 a_DHA=161.906 symop: x,y,z a_YAH=156 412 1554 " H LEU A 92 "<>" O ILE B 77 " d_HA=2.214 d_AD=3.124 a_DHA=148.344 symop: x,y,z a_YAH=147 467 1071 "HH21 ARG A 94 "<>" OE2 GLU A 133 " d_HA=1.783 d_AD=2.728 a_DHA=151.221 symop: -x+y+1,-x+1,z-1/3 a_YAH=120 468 1058 "HH22 ARG A 94 "<>" OD2 ASP A 132 " d_HA=1.878 d_AD=2.773 a_DHA=144.359 symop: -x+y+1,-x+1,z-1/3 a_YAH=110 2100 2146 " H GLU B 112 "<>" O LEU B 109 " d_HA=2.015 d_AD=3.009 a_DHA=165.266 symop: x,y,z a_YAH=131 1066 2123 " H THR B 110 "<>" O GLU A 133 " d_HA=1.834 d_AD=2.843 a_DHA=171.053 symop: x,y,z a_YAH=161 1066 2126 " HG1 THR B 110 "<>" O GLU A 133 " d_HA=1.786 d_AD=2.754 a_DHA=172.355 symop: x,y,z a_YAH=113 1103 2078 " H PHE A 135 "<>" O LYS B 108 " d_HA=1.878 d_AD=2.890 a_DHA=174.245 symop: x,y,z a_YAH=166 1035 1086 " H ASN A 134 "<>" O ILE A 131 " d_HA=1.909 d_AD=2.899 a_DHA=163.202 symop: x,y,z a_YAH=145 1091 2037 "HD22 ASN A 134 "<>" OE2 GLU B 105 " d_HA=1.740 d_AD=2.762 a_DHA=169.985 symop: x,y,z a_YAH=120 1689 2095 " HZ2 LYS B 108 "<>" O LEU B 85 " d_HA=1.855 d_AD=2.785 a_DHA=150.370 symop: x,y,z a_YAH=136 1095 2052 " H LEU B 106 "<>" O PHE A 135 " d_HA=2.296 d_AD=3.156 a_DHA=141.725 symop: x,y,z a_YAH=158 1674 2190 " H ASP B 115 "<>" O GLU B 84 " d_HA=2.541 d_AD=3.406 a_DHA=143.156 symop: x,y,z a_YAH=160 257 1694 " H LEU B 85 "<>" O VAL A 83 " d_HA=2.003 d_AD=2.831 a_DHA=137.374 symop: x,y,z a_YAH=141 257 1709 " H GLY B 86 "<>" O VAL A 83 " d_HA=2.679 d_AD=3.640 a_DHA=159.095 symop: x,y,z a_YAH=137 261 1708 " H VAL A 83 "<>" O GLY B 86 " d_HA=1.988 d_AD=2.957 a_DHA=158.048 symop: x,y,z a_YAH=173 279 784 " H GLU A 84 "<>" O ASP A 115 " d_HA=1.912 d_AD=2.918 a_DHA=169.729 symop: x,y,z a_YAH=155 243 820 " H LEU A 117 "<>" O THR A 82 " d_HA=1.980 d_AD=2.987 a_DHA=169.614 symop: x,y,z a_YAH=160 277 330 " HE ARG A 87 "<>" OE1 GLU A 84 " d_HA=1.767 d_AD=2.659 a_DHA=142.433 symop: x,y,z a_YAH=100 278 333 "HH21 ARG A 87 "<>" OE2 GLU A 84 " d_HA=1.718 d_AD=2.737 a_DHA=167.931 symop: x,y,z a_YAH=104 796 917 " H ILE A 123 "<>" O ILE A 116 " d_HA=2.053 d_AD=3.046 a_DHA=165.014 symop: x,y,z a_YAH=155 796 933 " H ALA A 124 "<>" O ILE A 116 " d_HA=2.315 d_AD=3.274 a_DHA=157.261 symop: x,y,z a_YAH=149 50 127 " H LEU A 75 "<>" O LEU A 71 " d_HA=1.937 d_AD=2.904 a_DHA=157.579 symop: x,y,z a_YAH=168 50 108 " H LEU A 74 "<>" O LEU A 71 " d_HA=1.905 d_AD=2.770 a_DHA=141.787 symop: x,y,z a_YAH=104 3 55 " H LEU A 71 "<>" O SER A 68 " d_HA=1.841 d_AD=2.706 a_DHA=141.573 symop: x,y,z a_YAH=128 3 75 " H GLU A 72 "<>" O SER A 68 " d_HA=2.085 d_AD=3.034 a_DHA=155.387 symop: x,y,z a_YAH=151 12 1475 " HG SER A 68 "<>" OE2 GLU B 72 " d_HA=1.680 d_AD=2.662 a_DHA=168.214 symop: x-y,-y,-z+2/3 a_YAH=163 407 493 " H LEU A 96 "<>" O LEU A 92 " d_HA=2.089 d_AD=2.985 a_DHA=145.733 symop: x,y,z a_YAH=153 426 493 " H LEU A 96 "<>" O LYS A 93 " d_HA=2.500 d_AD=3.197 a_DHA=125.231 symop: x,y,z a_YAH=97 426 513 " H GLU A 97 "<>" O LYS A 93 " d_HA=2.017 d_AD=2.933 a_DHA=148.603 symop: x,y,z a_YAH=141 448 527 " H MET A 98 "<>" O ARG A 94 " d_HA=2.141 d_AD=3.025 a_DHA=144.818 symop: x,y,z a_YAH=151 466 1058 "HH12 ARG A 94 "<>" OD2 ASP A 132 " d_HA=1.927 d_AD=2.835 a_DHA=146.163 symop: -x+y+1,-x+1,z-1/3 a_YAH=119 1040 1081 " H ILE A 131 "<>" O ASN A 134 " d_HA=1.944 d_AD=2.922 a_DHA=160.001 symop: x,y,z a_YAH=159 1059 593 " H ASP A 132 "<>" O ILE A 103 " d_HA=1.934 d_AD=2.926 a_DHA=165.779 symop: -y+1,x-y,z+1/3 a_YAH=149 1003 1116 " H GLY A 136 "<>" O VAL A 129 " d_HA=2.070 d_AD=3.052 a_DHA=162.716 symop: x,y,z a_YAH=129 1007 1115 " H VAL A 129 "<>" O GLY A 136 " d_HA=2.030 d_AD=2.973 a_DHA=153.312 symop: x,y,z a_YAH=135 293 1658 " H LEU A 85 "<>" O VAL B 83 " d_HA=2.049 d_AD=2.962 a_DHA=148.889 symop: x,y,z a_YAH=157 1122 2018 " H ILE B 104 "<>" O VAL A 137 " d_HA=1.895 d_AD=2.867 a_DHA=160.060 symop: x,y,z a_YAH=142 1126 2013 " H VAL A 137 "<>" O ILE B 104 " d_HA=1.867 d_AD=2.833 a_DHA=157.548 symop: x,y,z a_YAH=147 273 789 " H ASP A 115 "<>" O GLU A 84 " d_HA=2.201 d_AD=3.135 a_DHA=152.663 symop: x,y,z a_YAH=158 768 966 " H GLY A 126 "<>" O VAL A 114 " d_HA=2.211 d_AD=3.172 a_DHA=156.731 symop: x,y,z a_YAH=144 693 787 " HZ1 LYS A 108 "<>" OD1 ASP A 115 " d_HA=1.839 d_AD=2.728 a_DHA=143.732 symop: x,y,z a_YAH=115 787 959 "HH12 ARG A 125 "<>" OD1 ASP A 115 " d_HA=1.845 d_AD=2.754 a_DHA=146.625 symop: x,y,z a_YAH=131 801 931 " H ILE A 116 "<>" O ALA A 124 " d_HA=2.022 d_AD=2.937 a_DHA=148.814 symop: x,y,z a_YAH=156 949 1195 " H ARG A 125 "<>" O GLU A 141 " d_HA=1.979 d_AD=2.974 a_DHA=165.027 symop: x,y,z a_YAH=136 912 1233 " H VAL A 143 "<>" O ILE A 123 " d_HA=1.982 d_AD=2.995 a_DHA=175.012 symop: x,y,z a_YAH=162 73 8 " H3 SER A 68 "<>" OE1 GLU A 72 " d_HA=1.804 d_AD=2.607 a_DHA=132.895 symop: x,y,z a_YAH=129 472 2725 "HH11 ARG B 148 "<>" O VAL A 95 " d_HA=1.767 d_AD=2.749 a_DHA=162.173 symop: x,y,z a_YAH=138 522 2726 "HH12 ARG B 148 "<>" O MET A 98 " d_HA=2.002 d_AD=2.823 a_DHA=136.363 symop: x,y,z a_YAH=120 522 2728 "HH22 ARG B 148 "<>" O MET A 98 " d_HA=1.906 d_AD=2.820 a_DHA=148.228 symop: x,y,z a_YAH=151 598 1019 " H ILE A 103 "<>" O VAL A 130 " d_HA=2.938 d_AD=3.740 a_DHA=136.814 symop: -x+y+1,-x+1,z-1/3 a_YAH=160 977 991 " H VAL A 128 "<>" OE2 GLU A 127 " d_HA=1.882 d_AD=2.857 a_DHA=158.429 symop: x,y,z a_YAH=112 972 1146 " H ARG A 138 "<>" O GLU A 127 " d_HA=1.887 d_AD=2.902 a_DHA=173.691 symop: x,y,z a_YAH=161 978 1138 " H GLU A 127 "<>" O ARG A 138 " d_HA=2.034 d_AD=2.982 a_DHA=155.216 symop: x,y,z a_YAH=151 695 754 " HZ3 LYS A 108 "<>" O PRO A 113 " d_HA=1.879 d_AD=2.725 a_DHA=137.542 symop: x,y,z a_YAH=151 695 743 " HZ3 LYS A 108 "<>" OE1 GLU A 112 " d_HA=2.374 d_AD=3.070 a_DHA=124.254 symop: x,y,z a_YAH=135 772 965 " H VAL A 114 "<>" O GLY A 126 " d_HA=2.066 d_AD=2.845 a_DHA=131.848 symop: x,y,z a_YAH=170 941 1185 " H THR A 140 "<>" O ARG A 125 " d_HA=1.929 d_AD=2.914 a_DHA=162.458 symop: x,y,z a_YAH=137 941 1201 " H GLU A 141 "<>" O ARG A 125 " d_HA=2.017 d_AD=3.026 a_DHA=171.594 symop: x,y,z a_YAH=141 743 958 "HH11 ARG A 125 "<>" OE1 GLU A 112 " d_HA=2.336 d_AD=3.309 a_DHA=159.953 symop: x,y,z a_YAH=146 957 1199 " HE ARG A 125 "<>" OE1 GLU A 141 " d_HA=1.845 d_AD=2.860 a_DHA=171.488 symop: x,y,z a_YAH=109 960 1199 "HH21 ARG A 125 "<>" OE1 GLU A 141 " d_HA=2.969 d_AD=3.709 a_DHA=131.192 symop: x,y,z a_YAH=157 2688 2756 " HZ2 LYS B 146 "<>" OE2 GLU B 150 " d_HA=1.757 d_AD=2.663 a_DHA=144.050 symop: x,y,z a_YAH=126 2671 2737 " H LEU B 149 "<>" O LYS B 146 " d_HA=2.023 d_AD=2.933 a_DHA=148.301 symop: x,y,z a_YAH=117 2671 2757 " H GLU B 150 "<>" O LYS B 146 " d_HA=2.230 d_AD=3.223 a_DHA=166.732 symop: x,y,z a_YAH=150 2630 2724 " HE ARG B 148 "<>" O VAL B 143 " d_HA=1.764 d_AD=2.747 a_DHA=161.840 symop: x,y,z a_YAH=144 2630 2727 "HH21 ARG B 148 "<>" O VAL B 143 " d_HA=2.211 d_AD=3.048 a_DHA=139.302 symop: x,y,z a_YAH=150 2646 2716 " H ARG B 148 "<>" O SER B 144 " d_HA=2.072 d_AD=3.026 a_DHA=155.772 symop: x,y,z a_YAH=163 539 585 " H SER A 102 "<>" O ILE A 99 " d_HA=2.168 d_AD=3.155 a_DHA=166.003 symop: x,y,z a_YAH=128 539 589 " HG SER A 102 "<>" O ILE A 99 " d_HA=1.749 d_AD=2.706 a_DHA=166.537 symop: x,y,z a_YAH=125 745 699 " H GLU A 112 "<>" O LEU A 109 " d_HA=2.102 d_AD=3.080 a_DHA=160.836 symop: x,y,z a_YAH=134 2649 2698 " H SER B 144 "<>" OE2 GLU B 147 " d_HA=1.850 d_AD=2.817 a_DHA=156.613 symop: x,y,z a_YAH=117 2653 2698 " HG SER B 144 "<>" OE2 GLU B 147 " d_HA=1.761 d_AD=2.717 a_DHA=162.264 symop: x,y,z a_YAH=104 1420 1445 " HZ1 LYS B 70 "<>" OD1 ASP B 69 " d_HA=1.845 d_AD=2.673 a_DHA=135.475 symop: x,y,z a_YAH=151 ------------------------------------------------------------------------------- Total: 183 Symmetry: 0 Per residue: 1.0640 Mean SD Skew Kurtosis theta_1: 147.049 17.756 -0.847 3.502 theta_2: 137.313 19.750 -0.366 2.145 d_HA: 2.243 0.242 0.861 3.260 4833 4776 " H LYS A 308 "<>" O SER A 304 " d_HA=1.960 d_AD=2.955 a_DHA=165.366 symop: x,y,z a_YAH=148 4754 4818 " H ASN A 307 "<>" O LYS A 303 " d_HA=2.066 d_AD=3.051 a_DHA=163.459 symop: x,y,z a_YAH=156 4703 4779 " H SER A 304 "<>" O ALA A 300 " d_HA=1.960 d_AD=2.968 a_DHA=174.767 symop: x,y,z a_YAH=167 1058 4783 " HG SER A 304 "<>" O PRO A 69 " d_HA=1.923 d_AD=2.896 a_DHA=170.896 symop: y-1,x,-z a_YAH=173 662 778 " HH TYR A 51 "<>" OD1 ASN A 45 " d_HA=1.690 d_AD=2.666 a_DHA=176.469 symop: x,y,z a_YAH=139 645 680 " HG1 THR A 46 "<>" O ASN A 44 " d_HA=1.755 d_AD=2.723 a_DHA=177.221 symop: x,y,z a_YAH=137 659 5870 "HH12 ARG A 379 "<>" O ASN A 45 " d_HA=2.192 d_AD=2.987 a_DHA=134.685 symop: x,y,z a_YAH=137 4859 4927 " H SER A 314 "<>" O LEU A 310 " d_HA=1.838 d_AD=2.823 a_DHA=162.268 symop: x,y,z a_YAH=155 4878 4944 " H TYR A 315 "<>" O GLY A 311 " d_HA=1.830 d_AD=2.833 a_DHA=169.977 symop: x,y,z a_YAH=156 2037 4943 " H GLN A 130 "<>" OH TYR A 315 " d_HA=2.053 d_AD=3.008 a_DHA=156.278 symop: y-1,x,-z a_YAH=100 a_YAH=122 2017 2063 " H GLY A 132 "<>" O ASN A 129 " d_HA=1.948 d_AD=2.936 a_DHA=163.286 symop: x,y,z a_YAH=120 4813 4879 " H GLY A 311 "<>" O ASN A 307 " d_HA=1.778 d_AD=2.751 a_DHA=159.377 symop: x,y,z a_YAH=152 1011 1110 " HZ3 LYS A 65 "<>" OD2 ASP A 73 " d_HA=1.777 d_AD=2.801 a_DHA=168.891 symop: x,y,z a_YAH=158 1075 5519 " HG1 THR A 356 "<>" OD1 ASP A 70 " d_HA=1.645 d_AD=2.622 a_DHA=167.237 symop: y-1,x,-z a_YAH=125 1047 1090 " H GLU A 71 "<>" OD1 ASN A 68 " d_HA=2.114 d_AD=3.016 a_DHA=146.581 symop: x,y,z a_YAH=119 1047 1077 " H ASP A 70 "<>" OD1 ASN A 68 " d_HA=2.668 d_AD=3.459 a_DHA=135.165 symop: x,y,z a_YAH=140 1044 1100 " H GLY A 72 "<>" O ASN A 68 " d_HA=2.458 d_AD=3.101 a_DHA=120.968 symop: x,y,z a_YAH=114 1049 1109 " H ASN A 68 "<>" OD1 ASP A 73 " d_HA=2.134 d_AD=3.127 a_DHA=164.373 symop: x,y,z a_YAH=151 716 740 "HE21 GLN A 48 "<>" O TYR A 50 " d_HA=1.785 d_AD=2.801 a_DHA=174.448 symop: x,y,z a_YAH=148 5812 5869 "HH11 ARG A 379 "<>" O GLY A 376 " d_HA=1.989 d_AD=2.974 a_DHA=162.963 symop: x,y,z a_YAH=129 648 677 " H THR A 46 "<>" OD1 ASN A 44 " d_HA=1.906 d_AD=2.818 a_DHA=148.609 symop: x,y,z a_YAH=133 648 710 " H GLN A 48 "<>" OD1 ASN A 44 " d_HA=2.156 d_AD=3.141 a_DHA=163.140 symop: x,y,z a_YAH=139 648 693 " H GLN A 47 "<>" OD1 ASN A 44 " d_HA=2.257 d_AD=3.080 a_DHA=137.192 symop: x,y,z a_YAH=132 664 708 " H ASN A 45 "<>" OE1 GLN A 48 " d_HA=1.845 d_AD=2.846 a_DHA=168.292 symop: x,y,z a_YAH=151 704 5868 " HE ARG A 379 "<>" O GLN A 48 " d_HA=2.186 d_AD=3.057 a_DHA=143.006 symop: x,y,z a_YAH=120 704 5871 "HH21 ARG A 379 "<>" O GLN A 48 " d_HA=1.814 d_AD=2.781 a_DHA=158.462 symop: x,y,z a_YAH=134 650 708 " H ASN A 44 "<>" OE1 GLN A 48 " d_HA=2.116 d_AD=2.904 a_DHA=132.746 symop: x,y,z a_YAH=111 673 5813 " H GLY A 376 "<>" O THR A 46 " d_HA=2.986 d_AD=3.762 a_DHA=134.370 symop: x,y,z a_YAH=147 566 654 "HD21 ASN A 44 "<>" O ASN A 39 " d_HA=1.896 d_AD=2.886 a_DHA=163.429 symop: x,y,z a_YAH=131 576 5771 "HD22 ASN A 39 "<>" OE1 GLN A 373 " d_HA=1.944 d_AD=2.946 a_DHA=168.359 symop: x,y,z a_YAH=152 5379 5671 " HZ3 LYS A 345 "<>" OE1 GLU A 367 " d_HA=1.767 d_AD=2.638 a_DHA=140.256 symop: x,y,z a_YAH=128 4924 4972 " H LYS A 317 "<>" O SER A 314 " d_HA=2.219 d_AD=2.987 a_DHA=131.177 symop: x,y,z a_YAH=104 4924 4992 " H THR A 318 "<>" O SER A 314 " d_HA=2.855 d_AD=3.712 a_DHA=142.806 symop: x,y,z a_YAH=152 4935 4992 " H THR A 318 "<>" O TYR A 315 " d_HA=2.778 d_AD=3.593 a_DHA=137.894 symop: x,y,z a_YAH=102 4935 5007 " H ASN A 319 "<>" O TYR A 315 " d_HA=2.539 d_AD=3.495 a_DHA=157.327 symop: x,y,z a_YAH=139 4931 5602 " HG SER A 314 "<>" OE1 GLU A 363 " d_HA=1.639 d_AD=2.630 a_DHA=175.164 symop: x,y,z a_YAH=136 2022 2069 " H ASN A 129 "<>" O PHE A 133 " d_HA=1.890 d_AD=2.891 a_DHA=168.656 symop: x,y,z a_YAH=163 2020 2077 " H PHE A 133 "<>" OD1 ASN A 129 " d_HA=2.006 d_AD=2.926 a_DHA=149.632 symop: x,y,z a_YAH=138 1976 2114 " H TYR A 135 "<>" O LYS A 127 " d_HA=1.977 d_AD=2.957 a_DHA=161.778 symop: x,y,z a_YAH=168 1053 1089 "HD21 ASN A 68 "<>" OE2 GLU A 71 " d_HA=1.911 d_AD=2.834 a_DHA=149.165 symop: x,y,z a_YAH=97 1088 5536 "HD22 ASN A 357 "<>" OE1 GLU A 71 " d_HA=1.913 d_AD=2.811 a_DHA=145.283 symop: y-1,x,-z a_YAH=124 1089 1169 "HH22 ARG A 76 "<>" OE2 GLU A 71 " d_HA=1.854 d_AD=2.787 a_DHA=149.928 symop: x,y,z a_YAH=150 1106 1993 " HZ2 LYS A 127 "<>" O ASP A 73 " d_HA=1.773 d_AD=2.716 a_DHA=151.745 symop: x,y,z a_YAH=113 1121 1165 " HE ARG A 76 "<>" OD1 ASP A 74 " d_HA=1.718 d_AD=2.722 a_DHA=166.129 symop: x,y,z a_YAH=124 1122 1953 " HZ3 LYS A 125 "<>" OD2 ASP A 74 " d_HA=1.793 d_AD=2.754 a_DHA=154.364 symop: x,y,z a_YAH=162 1122 1168 "HH21 ARG A 76 "<>" OD2 ASP A 74 " d_HA=1.898 d_AD=2.857 a_DHA=154.169 symop: x,y,z a_YAH=95 1015 1123 " H ASP A 74 "<>" O ALA A 66 " d_HA=2.090 d_AD=3.096 a_DHA=169.243 symop: x,y,z a_YAH=136 993 1030 " H ILE A 67 "<>" O LYS A 65 " d_HA=2.107 d_AD=2.914 a_DHA=135.350 symop: x,y,z a_YAH=105 1017 1118 " H ALA A 66 "<>" O ASP A 74 " d_HA=2.011 d_AD=2.883 a_DHA=142.541 symop: x,y,z a_YAH=145 721 999 " H LYS A 65 "<>" O LEU A 49 " d_HA=1.838 d_AD=2.838 a_DHA=167.209 symop: x,y,z a_YAH=160 770 953 " H TYR A 51 "<>" O TYR A 63 " d_HA=1.841 d_AD=2.850 a_DHA=172.922 symop: x,y,z a_YAH=161 761 962 " H TYR A 63 "<>" O TYR A 51 " d_HA=1.887 d_AD=2.868 a_DHA=161.168 symop: x,y,z a_YAH=155 5831 5906 " H TYR A 381 "<>" O TYR A 378 " d_HA=2.885 d_AD=3.519 a_DHA=121.529 symop: x,y,z a_YAH=126 5831 5923 " H ASN A 382 "<>" O TYR A 378 " d_HA=2.463 d_AD=3.414 a_DHA=156.794 symop: x,y,z a_YAH=160 5876 5942 " H SER A 384 "<>" O TYR A 380 " d_HA=2.195 d_AD=3.148 a_DHA=155.943 symop: x,y,z a_YAH=135 5876 5946 " HG SER A 384 "<>" O TYR A 380 " d_HA=1.737 d_AD=2.707 a_DHA=171.839 symop: x,y,z a_YAH=155 5852 5933 " H GLY A 383 "<>" O ARG A 379 " d_HA=1.910 d_AD=2.777 a_DHA=141.558 symop: x,y,z a_YAH=117 580 726 " H LEU A 49 "<>" O MET A 40 " d_HA=1.856 d_AD=2.869 a_DHA=173.628 symop: x,y,z a_YAH=139 580 749 " H TYR A 50 "<>" O MET A 40 " d_HA=2.197 d_AD=3.202 a_DHA=170.158 symop: x,y,z a_YAH=163 5127 5316 " H GLY A 341 "<>" OE1 GLN A 327 " d_HA=2.044 d_AD=2.958 a_DHA=149.110 symop: x,y,z a_YAH=139 5918 5978 " H TYR A 386 "<>" O ASN A 382 " d_HA=1.915 d_AD=2.885 a_DHA=158.554 symop: x,y,z a_YAH=144 5932 5995 " H MET A 387 "<>" O GLY A 383 " d_HA=1.885 d_AD=2.807 a_DHA=149.348 symop: x,y,z a_YAH=142 520 585 " H MET A 40 "<>" O THR A 36 " d_HA=2.067 d_AD=3.014 a_DHA=153.824 symop: x,y,z a_YAH=145 520 5780 "HE22 GLN A 373 "<>" O THR A 36 " d_HA=1.956 d_AD=2.901 a_DHA=153.039 symop: x,y,z a_YAH=125 534 605 " H PHE A 41 "<>" O PHE A 37 " d_HA=1.844 d_AD=2.800 a_DHA=155.674 symop: x,y,z a_YAH=162 618 554 " H GLY A 42 "<>" O ASP A 38 " d_HA=2.029 d_AD=2.759 a_DHA=127.083 symop: x,y,z a_YAH=134 5315 5367 " H LYS A 345 "<>" O GLY A 341 " d_HA=2.042 d_AD=3.036 a_DHA=164.974 symop: x,y,z a_YAH=161 5322 5385 " H ALA A 346 "<>" O GLU A 342 " d_HA=1.871 d_AD=2.810 a_DHA=152.816 symop: x,y,z a_YAH=143 495 559 " H ASP A 38 "<>" O ASN A 34 " d_HA=1.780 d_AD=2.790 a_DHA=173.221 symop: x,y,z a_YAH=170 509 571 " H ASN A 39 "<>" O SER A 35 " d_HA=1.861 d_AD=2.842 a_DHA=161.858 symop: x,y,z a_YAH=145 5682 5742 " H LEU A 371 "<>" O PHE A 368 " d_HA=2.043 d_AD=2.988 a_DHA=154.691 symop: x,y,z a_YAH=110 473 5737 " HZ1 LYS A 32 "<>" O LEU A 371 " d_HA=1.907 d_AD=2.928 a_DHA=175.094 symop: x,y,z a_YAH=154 474 5702 " HZ2 LYS A 32 "<>" O TRP A 369 " d_HA=1.790 d_AD=2.720 a_DHA=150.607 symop: x,y,z a_YAH=130 457 527 " HG1 THR A 36 "<>" O LYS A 32 " d_HA=1.639 d_AD=2.609 a_DHA=171.925 symop: x,y,z a_YAH=150 457 524 " H THR A 36 "<>" O LYS A 32 " d_HA=2.080 d_AD=2.934 a_DHA=140.444 symop: x,y,z a_YAH=134 440 512 " H SER A 35 "<>" O GLN A 31 " d_HA=1.783 d_AD=2.788 a_DHA=172.013 symop: x,y,z a_YAH=167 463 390 " H LYS A 32 "<>" O ASN A 28 " d_HA=2.053 d_AD=3.034 a_DHA=161.481 symop: x,y,z a_YAH=158 804 2093 " H VAL A 134 "<>" OH TYR A 53 " d_HA=1.891 d_AD=2.892 a_DHA=168.426 symop: x,y,z a_YAH=107 a_YAH=134 813 836 " HH TYR A 53 "<>" OE2 GLU A 55 " d_HA=1.797 d_AD=2.764 a_DHA=167.481 symop: x,y,z a_YAH=116 1935 2152 " H VAL A 137 "<>" O LYS A 125 " d_HA=1.848 d_AD=2.829 a_DHA=161.265 symop: x,y,z a_YAH=148 1935 2169 " H ASP A 138 "<>" O LYS A 125 " d_HA=2.136 d_AD=3.132 a_DHA=166.276 symop: x,y,z a_YAH=139 1982 2105 " H LYS A 127 "<>" O TYR A 135 " d_HA=1.997 d_AD=2.977 a_DHA=160.765 symop: x,y,z a_YAH=160 1130 1962 " H LEU A 126 "<>" O ILE A 75 " d_HA=1.830 d_AD=2.839 a_DHA=173.149 symop: x,y,z a_YAH=150 1135 1957 " H ILE A 75 "<>" O LEU A 126 " d_HA=1.955 d_AD=2.800 a_DHA=138.871 symop: x,y,z a_YAH=157 936 1222 "HE22 GLN A 80 "<>" O HIS A 62 " d_HA=2.142 d_AD=3.083 a_DHA=153.736 symop: x,y,z a_YAH=131 1149 1663 "HE22 GLN A 107 "<>" O ARG A 76 " d_HA=2.662 d_AD=3.417 a_DHA=131.695 symop: x,y,z a_YAH=94 1149 1215 " H GLN A 80 "<>" O ARG A 76 " d_HA=2.256 d_AD=3.210 a_DHA=156.351 symop: x,y,z a_YAH=141 979 1213 " H ILE A 64 "<>" OE1 GLN A 80 " d_HA=1.843 d_AD=2.821 a_DHA=160.930 symop: x,y,z a_YAH=161 4421 4385 " H ASP A 281 "<>" OE1 GLU A 279 " d_HA=1.900 d_AD=2.915 a_DHA=172.319 symop: x,y,z a_YAH=107 1202 1262 " H GLY A 83 "<>" O GLY A 79 " d_HA=1.900 d_AD=2.853 a_DHA=155.044 symop: x,y,z a_YAH=146 4396 5914 " HH TYR A 381 "<>" O PHE A 280 " d_HA=1.616 d_AD=2.591 a_DHA=174.098 symop: x,y,z a_YAH=123 5897 5955 " H LEU A 385 "<>" O TYR A 381 " d_HA=2.058 d_AD=3.074 a_DHA=174.599 symop: x,y,z a_YAH=162 5939 6012 " H LEU A 388 "<>" O SER A 384 " d_HA=1.964 d_AD=2.967 a_DHA=167.840 symop: x,y,z a_YAH=157 5337 5395 " H ALA A 347 "<>" O GLY A 343 " d_HA=1.879 d_AD=2.877 a_DHA=167.227 symop: x,y,z a_YAH=154 5344 5408 " H ASN A 348 "<>" O GLN A 344 " d_HA=2.055 d_AD=3.062 a_DHA=171.367 symop: x,y,z a_YAH=147 5950 6028 " H ALA A 389 "<>" O LEU A 385 " d_HA=1.804 d_AD=2.812 a_DHA=172.049 symop: x,y,z a_YAH=161 5969 6041 " H MET A 390 "<>" O TYR A 386 " d_HA=1.904 d_AD=2.859 a_DHA=155.135 symop: x,y,z a_YAH=142 5990 6058 " H LEU A 391 "<>" O MET A 387 " d_HA=2.349 d_AD=3.235 a_DHA=145.355 symop: x,y,z a_YAH=146 479 542 " H PHE A 37 "<>" O VAL A 33 " d_HA=2.171 d_AD=3.132 a_DHA=157.461 symop: x,y,z a_YAH=150 5361 5419 " H ALA A 349 "<>" O LYS A 345 " d_HA=2.117 d_AD=3.004 a_DHA=145.398 symop: x,y,z a_YAH=140 5383 5431 " H VAL A 350 "<>" O ALA A 346 " d_HA=2.269 d_AD=3.228 a_DHA=156.437 symop: x,y,z a_YAH=156 404 483 " H VAL A 33 "<>" O ILE A 29 " d_HA=1.888 d_AD=2.866 a_DHA=161.288 symop: x,y,z a_YAH=153 6036 6108 " H SER A 394 "<>" O MET A 390 " d_HA=2.689 d_AD=3.419 a_DHA=129.152 symop: x,y,z a_YAH=126 6036 6112 " HG SER A 394 "<>" O MET A 390 " d_HA=1.567 d_AD=2.543 a_DHA=172.112 symop: x,y,z a_YAH=138 423 500 " H ASN A 34 "<>" O GLN A 30 " d_HA=1.887 d_AD=2.890 a_DHA=170.720 symop: x,y,z a_YAH=145 2167 2192 " H GLY A 140 "<>" OD1 ASP A 138 " d_HA=1.862 d_AD=2.859 a_DHA=163.974 symop: x,y,z a_YAH=123 1941 2164 " H LYS A 125 "<>" O ASP A 138 " d_HA=2.510 d_AD=3.507 a_DHA=167.388 symop: x,y,z a_YAH=140 1629 2143 " HZ2 LYS A 136 "<>" O TYR A 106 " d_HA=1.844 d_AD=2.745 a_DHA=145.684 symop: x,y,z a_YAH=150 1927 2168 " HE1 TRP A 124 "<>" OD2 ASP A 138 " d_HA=1.826 d_AD=2.784 a_DHA=152.580 symop: x,y,z a_YAH=112 1177 1911 " H THR A 77 "<>" O TRP A 124 " d_HA=2.669 d_AD=3.549 a_DHA=145.095 symop: x,y,z a_YAH=117 1922 2191 " H TRP A 124 "<>" O GLY A 140 " d_HA=1.856 d_AD=2.854 a_DHA=166.907 symop: x,y,z a_YAH=162 1567 1638 " H TYR A 106 "<>" O PHE A 102 " d_HA=1.883 d_AD=2.869 a_DHA=162.780 symop: x,y,z a_YAH=159 1567 1656 " H GLN A 107 "<>" O PHE A 102 " d_HA=2.801 d_AD=3.708 a_DHA=149.585 symop: x,y,z a_YAH=132 1567 1621 " H ALA A 105 "<>" O PHE A 102 " d_HA=2.738 d_AD=3.393 a_DHA=122.759 symop: x,y,z a_YAH=95 1543 1621 " H ALA A 105 "<>" O ARG A 101 " d_HA=2.254 d_AD=3.149 a_DHA=146.980 symop: x,y,z a_YAH=142 1575 1486 " H PHE A 102 "<>" O ASN A 98 " d_HA=2.482 d_AD=3.430 a_DHA=155.501 symop: x,y,z a_YAH=135 1192 4482 "HH22 ARG A 284 "<>" OE2 GLU A 78 " d_HA=2.634 d_AD=3.364 a_DHA=128.808 symop: x,y,z a_YAH=111 1173 1229 " H SER A 81 "<>" O THR A 77 " d_HA=1.914 d_AD=2.924 a_DHA=171.142 symop: x,y,z a_YAH=160 1173 1233 " HG SER A 81 "<>" O THR A 77 " d_HA=2.712 d_AD=3.345 a_DHA=123.330 symop: x,y,z a_YAH=125 1203 5884 " H GLY A 79 "<>" OH TYR A 380 " d_HA=2.475 d_AD=3.189 a_DHA=127.117 symop: x,y,z a_YAH=148 a_YAH=92 1209 1273 " H MET A 84 "<>" O GLN A 80 " d_HA=1.973 d_AD=2.987 a_DHA=172.419 symop: x,y,z a_YAH=158 1221 1500 "HE21 GLN A 80 "<>" O LEU A 99 " d_HA=1.889 d_AD=2.831 a_DHA=153.317 symop: x,y,z a_YAH=119 1500 1589 " H ALA A 103 "<>" O LEU A 99 " d_HA=2.124 d_AD=3.123 a_DHA=167.167 symop: x,y,z a_YAH=156 1530 1454 " H TRP A 100 "<>" O PHE A 96 " d_HA=1.883 d_AD=2.890 a_DHA=170.301 symop: x,y,z a_YAH=157 4419 4480 "HH12 ARG A 284 "<>" OD1 ASP A 281 " d_HA=1.856 d_AD=2.757 a_DHA=143.975 symop: x,y,z a_YAH=125 4479 5905 "HH11 ARG A 284 "<>" OH TYR A 381 " d_HA=1.838 d_AD=2.787 a_DHA=158.603 symop: x,y,z a_YAH=109 a_YAH=119 1187 1233 " HG SER A 81 "<>" O GLU A 78 " d_HA=1.784 d_AD=2.699 a_DHA=155.936 symop: x,y,z a_YAH=119 1187 1248 " H TRP A 82 "<>" O GLU A 78 " d_HA=1.894 d_AD=2.893 a_DHA=167.006 symop: x,y,z a_YAH=165 1226 1289 " H THR A 85 "<>" O SER A 81 " d_HA=1.985 d_AD=2.917 a_DHA=151.763 symop: x,y,z a_YAH=136 1226 1292 " HG1 THR A 85 "<>" O SER A 81 " d_HA=1.774 d_AD=2.736 a_DHA=169.679 symop: x,y,z a_YAH=142 1237 1301 " H ALA A 86 "<>" O TRP A 82 " d_HA=1.854 d_AD=2.855 a_DHA=166.912 symop: x,y,z a_YAH=159 1261 1311 " H ALA A 87 "<>" O GLY A 83 " d_HA=1.904 d_AD=2.899 a_DHA=165.200 symop: x,y,z a_YAH=156 1268 1323 " H VAL A 88 "<>" O MET A 84 " d_HA=1.945 d_AD=2.957 a_DHA=173.285 symop: x,y,z a_YAH=160 4428 4490 " H VAL A 285 "<>" O ALA A 282 " d_HA=2.312 d_AD=3.259 a_DHA=155.572 symop: x,y,z a_YAH=108 4449 4381 " H TRP A 283 "<>" O GLU A 279 " d_HA=2.059 d_AD=2.909 a_DHA=139.328 symop: x,y,z a_YAH=153 4416 4470 " H ARG A 284 "<>" O ASP A 281 " d_HA=1.929 d_AD=2.866 a_DHA=151.230 symop: x,y,z a_YAH=129 1285 1340 " H MET A 89 "<>" O THR A 85 " d_HA=2.058 d_AD=3.044 a_DHA=162.589 symop: x,y,z a_YAH=152 1299 1357 " H LEU A 90 "<>" O ALA A 86 " d_HA=2.112 d_AD=3.054 a_DHA=153.196 symop: x,y,z a_YAH=151 6007 6058 " H LEU A 391 "<>" O LEU A 388 " d_HA=2.235 d_AD=2.946 a_DHA=125.748 symop: x,y,z a_YAH=107 6007 6079 " H HIS A 392 "<>" O LEU A 388 " d_HA=1.967 d_AD=2.965 a_DHA=165.954 symop: x,y,z a_YAH=157 1335 2465 "HH12 ARG A 159 "<>" O MET A 89 " d_HA=2.092 d_AD=2.852 a_DHA=130.414 symop: x,y,z a_YAH=119 5393 5445 " H ALA A 351 "<>" O ALA A 347 " d_HA=2.300 d_AD=3.262 a_DHA=158.119 symop: x,y,z a_YAH=149 5393 5431 " H VAL A 350 "<>" O ALA A 347 " d_HA=2.675 d_AD=3.304 a_DHA=120.087 symop: x,y,z a_YAH=101 5403 5458 " H LEU A 352 "<>" O ASN A 348 " d_HA=2.800 d_AD=3.610 a_DHA=137.230 symop: x,y,z a_YAH=140 5417 5458 " H LEU A 352 "<>" O ALA A 349 " d_HA=2.621 d_AD=3.466 a_DHA=140.866 symop: x,y,z a_YAH=101 5427 5477 " H LEU A 353 "<>" O VAL A 350 " d_HA=1.966 d_AD=2.972 a_DHA=169.288 symop: x,y,z a_YAH=130 6026 6093 " H VAL A 393 "<>" O ALA A 389 " d_HA=1.874 d_AD=2.891 a_DHA=177.813 symop: x,y,z a_YAH=166 6072 6117 " H GLY A 395 "<>" O HIS A 392 " d_HA=2.670 d_AD=3.666 a_DHA=166.884 symop: x,y,z a_YAH=103 6053 6108 " H SER A 394 "<>" O LEU A 391 " d_HA=2.704 d_AD=3.480 a_DHA=133.582 symop: x,y,z a_YAH=90 6053 6128 " H ASN A 396 "<>" O LEU A 391 " d_HA=2.078 d_AD=2.942 a_DHA=142.148 symop: x,y,z a_YAH=154 6053 6145 " H PHE A 397 "<>" O LEU A 391 " d_HA=2.219 d_AD=3.092 a_DHA=143.462 symop: x,y,z a_YAH=115 6107 6128 " H ASN A 396 "<>" OG SER A 394 " d_HA=2.972 d_AD=3.789 a_DHA=138.541 symop: x,y,z a_YAH=116 a_YAH=116 6107 6133 "HD22 ASN A 396 "<>" OG SER A 394 " d_HA=1.869 d_AD=2.850 a_DHA=163.672 symop: x,y,z a_YAH=110 a_YAH=132 427 6132 "HD21 ASN A 396 "<>" OE1 GLN A 30 " d_HA=1.891 d_AD=2.859 a_DHA=158.212 symop: x,y,z a_YAH=133 1836 2180 " HZ3 LYS A 118 "<>" OE1 GLU A 139 " d_HA=1.839 d_AD=2.847 a_DHA=164.597 symop: x,y,z a_YAH=139 1756 2181 " HE2 HIS A 113 "<>" OE2 GLU A 139 " d_HA=1.828 d_AD=2.816 a_DHA=160.130 symop: x,y,z a_YAH=91 1650 1903 " H ALA A 123 "<>" O GLN A 107 " d_HA=1.929 d_AD=2.821 a_DHA=145.731 symop: x,y,z a_YAH=147 1667 2142 " HZ1 LYS A 136 "<>" O LYS A 108 " d_HA=1.977 d_AD=2.961 a_DHA=159.709 symop: x,y,z a_YAH=131 1694 1864 " H ASN A 109 "<>" O VAL A 121 " d_HA=1.850 d_AD=2.863 a_DHA=171.955 symop: x,y,z a_YAH=168 3001 3033 " H TYR A 194 "<>" OG SER A 192 " d_HA=2.472 d_AD=3.457 a_DHA=164.463 symop: x,y,z a_YAH=110 a_YAH=139 1889 2258 " H TYR A 122 "<>" OE2 GLU A 146 " d_HA=1.876 d_AD=2.882 a_DHA=166.421 symop: x,y,z a_YAH=130 1587 1656 " H GLN A 107 "<>" O ALA A 103 " d_HA=2.291 d_AD=3.036 a_DHA=129.513 symop: x,y,z a_YAH=114 1587 1673 " H LYS A 108 "<>" O ALA A 103 " d_HA=1.982 d_AD=2.936 a_DHA=155.852 symop: x,y,z a_YAH=173 1519 1603 " H LYS A 104 "<>" O TRP A 100 " d_HA=1.916 d_AD=2.932 a_DHA=173.442 symop: x,y,z a_YAH=161 2212 2247 " H GLY A 145 "<>" O ALA A 142 " d_HA=1.825 d_AD=2.782 a_DHA=156.044 symop: x,y,z a_YAH=143 2246 2312 " H PHE A 149 "<>" O GLY A 145 " d_HA=1.797 d_AD=2.737 a_DHA=152.054 symop: x,y,z a_YAH=150 3123 3169 " H TYR A 203 "<>" O ASP A 200 " d_HA=2.077 d_AD=3.039 a_DHA=157.872 symop: x,y,z a_YAH=124 3126 3152 " H SER A 202 "<>" OD1 ASP A 200 " d_HA=1.864 d_AD=2.829 a_DHA=155.536 symop: x,y,z a_YAH=152 3126 3156 " HG SER A 202 "<>" OD1 ASP A 200 " d_HA=1.746 d_AD=2.695 a_DHA=157.768 symop: x,y,z a_YAH=100 3127 3177 " HH TYR A 203 "<>" OD2 ASP A 200 " d_HA=2.741 d_AD=3.436 a_DHA=129.444 symop: x,y,z a_YAH=129 3151 4481 "HH21 ARG A 284 "<>" OG SER A 202 " d_HA=2.060 d_AD=2.969 a_DHA=148.521 symop: x,y,z a_YAH=125 a_YAH=123 2236 2292 " H TYR A 148 "<>" O ALA A 144 " d_HA=1.898 d_AD=2.902 a_DHA=168.355 symop: x,y,z a_YAH=151 2283 2356 " H ALA A 152 "<>" O TYR A 148 " d_HA=1.795 d_AD=2.794 a_DHA=167.859 symop: x,y,z a_YAH=151 3135 3188 " H HIS A 204 "<>" O PRO A 201 " d_HA=2.351 d_AD=3.220 a_DHA=143.496 symop: x,y,z a_YAH=100 3149 4547 "HD21 ASN A 288 "<>" O SER A 202 " d_HA=2.015 d_AD=2.825 a_DHA=134.652 symop: x,y,z a_YAH=133 4462 4543 " H ASN A 288 "<>" O ARG A 284 " d_HA=1.852 d_AD=2.858 a_DHA=170.208 symop: x,y,z a_YAH=157 4486 4556 " H VAL A 289 "<>" O VAL A 285 " d_HA=1.966 d_AD=2.930 a_DHA=157.390 symop: x,y,z a_YAH=146 4521 4580 " H LEU A 291 "<>" O MET A 287 " d_HA=1.979 d_AD=2.979 a_DHA=166.935 symop: x,y,z a_YAH=154 4538 4599 " H ASP A 292 "<>" O ASN A 288 " d_HA=1.835 d_AD=2.815 a_DHA=161.641 symop: x,y,z a_YAH=149 1338 6163 " H LYS A 398 "<>" SD MET A 89 " d_HA=2.392 d_AD=3.406 a_DHA=175.304 symop: x,y,z a_YAH=118 a_YAH=98 4502 4569 " H GLY A 290 "<>" O ILE A 286 " d_HA=1.895 d_AD=2.892 a_DHA=165.839 symop: x,y,z a_YAH=148 5443 5493 " H ALA A 354 "<>" O ALA A 351 " d_HA=1.965 d_AD=2.941 a_DHA=160.855 symop: x,y,z a_YAH=130 5443 5504 " H SER A 355 "<>" O ALA A 351 " d_HA=2.839 d_AD=3.501 a_DHA=123.690 symop: x,y,z a_YAH=125 4568 4623 " H HIS A 294 "<>" O GLY A 290 " d_HA=1.938 d_AD=2.874 a_DHA=152.166 symop: x,y,z a_YAH=148 1743 1852 "HE21 GLN A 119 "<>" O HIS A 113 " d_HA=2.051 d_AD=3.031 a_DHA=160.816 symop: x,y,z a_YAH=156 1777 1802 " H LYS A 117 "<>" OD1 ASP A 115 " d_HA=2.024 d_AD=2.990 a_DHA=156.323 symop: x,y,z a_YAH=137 1746 1779 " H ASP A 115 "<>" ND1 HIS A 113 " d_HA=2.136 d_AD=3.104 a_DHA=159.678 symop: x,y,z a_YAH=129 a_YAH=122 1774 1824 " H LYS A 118 "<>" O ASP A 115 " d_HA=2.022 d_AD=2.893 a_DHA=142.248 symop: x,y,z a_YAH=121 1774 1846 " H GLN A 119 "<>" O ASP A 115 " d_HA=2.872 d_AD=3.526 a_DHA=123.312 symop: x,y,z a_YAH=147 1703 1750 " H HIS A 113 "<>" O PRO A 110 " d_HA=2.091 d_AD=2.961 a_DHA=142.715 symop: x,y,z a_YAH=127 1703 1858 " H GLY A 120 "<>" O PRO A 110 " d_HA=2.959 d_AD=3.793 a_DHA=140.392 symop: x,y,z a_YAH=94 1818 1868 " H VAL A 121 "<>" O LYS A 118 " d_HA=2.444 d_AD=3.437 a_DHA=167.518 symop: x,y,z a_YAH=114 1689 1858 " H GLY A 120 "<>" O ASN A 109 " d_HA=2.319 d_AD=3.072 a_DHA=130.396 symop: x,y,z a_YAH=114 1857 2751 " HG1 THR A 178 "<>" O GLY A 120 " d_HA=2.345 d_AD=3.283 a_DHA=163.333 symop: x,y,z a_YAH=122 1684 1720 " HZ2 LYS A 108 "<>" OD1 ASP A 111 " d_HA=1.901 d_AD=2.685 a_DHA=131.099 symop: x,y,z a_YAH=110 1685 1721 " HZ3 LYS A 108 "<>" OD2 ASP A 111 " d_HA=1.796 d_AD=2.697 a_DHA=144.246 symop: x,y,z a_YAH=104 2972 2999 "HH11 ARG A 190 "<>" O SER A 192 " d_HA=2.148 d_AD=3.101 a_DHA=156.951 symop: x,y,z a_YAH=155 2999 3050 " H ILE A 195 "<>" O SER A 192 " d_HA=2.645 d_AD=3.597 a_DHA=156.926 symop: x,y,z a_YAH=102 2987 3090 " H PHE A 191 "<>" O LEU A 198 " d_HA=2.219 d_AD=3.190 a_DHA=160.219 symop: x,y,z a_YAH=120 2222 2274 " H GLU A 147 "<>" O PRO A 143 " d_HA=1.953 d_AD=2.939 a_DHA=161.839 symop: x,y,z a_YAH=151 2253 2326 " H ALA A 150 "<>" O GLU A 146 " d_HA=1.947 d_AD=2.954 a_DHA=168.391 symop: x,y,z a_YAH=154 2639 2699 " H MET A 175 "<>" O ASP A 171 " d_HA=2.042 d_AD=3.038 a_DHA=166.508 symop: x,y,z a_YAH=150 2583 2653 " H ALA A 172 "<>" O TYR A 168 " d_HA=1.824 d_AD=2.778 a_DHA=155.539 symop: x,y,z a_YAH=149 3116 3187 " HG1 THR A 199 "<>" NE2 HIS A 204 " d_HA=2.115 d_AD=2.903 a_DHA=137.700 symop: x,y,z a_YAH=107 a_YAH=145 2273 3278 " HH TYR A 209 "<>" OE2 GLU A 147 " d_HA=1.576 d_AD=2.560 a_DHA=168.906 symop: x,y,z a_YAH=140 2268 2342 " H PHE A 151 "<>" O GLU A 147 " d_HA=2.128 d_AD=3.115 a_DHA=162.456 symop: x,y,z a_YAH=145 2304 2369 " H LEU A 153 "<>" O PHE A 149 " d_HA=1.912 d_AD=2.909 a_DHA=165.916 symop: x,y,z a_YAH=155 2324 2388 " H LEU A 154 "<>" O ALA A 150 " d_HA=2.009 d_AD=2.986 a_DHA=160.417 symop: x,y,z a_YAH=148 2334 2407 " H ASN A 155 "<>" O PHE A 151 " d_HA=2.010 d_AD=3.007 a_DHA=166.513 symop: x,y,z a_YAH=157 2334 2412 "HD22 ASN A 155 "<>" O PHE A 151 " d_HA=1.776 d_AD=2.767 a_DHA=165.930 symop: x,y,z a_YAH=123 2354 2418 " H ALA A 156 "<>" O ALA A 152 " d_HA=1.863 d_AD=2.825 a_DHA=157.614 symop: x,y,z a_YAH=147 2364 2429 " H SER A 157 "<>" O LEU A 153 " d_HA=1.953 d_AD=2.963 a_DHA=171.271 symop: x,y,z a_YAH=152 3181 4548 "HD22 ASN A 288 "<>" O HIS A 204 " d_HA=2.616 d_AD=3.334 a_DHA=128.446 symop: x,y,z a_YAH=122 3198 3249 " H PHE A 208 "<>" O ILE A 205 " d_HA=1.888 d_AD=2.821 a_DHA=151.346 symop: x,y,z a_YAH=133 3198 3270 " H TYR A 209 "<>" O ILE A 205 " d_HA=2.892 d_AD=3.822 a_DHA=153.626 symop: x,y,z a_YAH=151 3203 3269 " H ILE A 205 "<>" OH TYR A 209 " d_HA=2.322 d_AD=3.279 a_DHA=156.909 symop: x,y,z a_YAH=109 a_YAH=110 2405 6208 " H TYR A 400 "<>" OD1 ASN A 155 " d_HA=1.875 d_AD=2.879 a_DHA=166.899 symop: x,y,z a_YAH=163 2383 2439 " H ALA A 158 "<>" O LEU A 154 " d_HA=2.187 d_AD=3.177 a_DHA=164.668 symop: x,y,z a_YAH=145 2383 6243 "HD21 ASN A 402 "<>" O LEU A 154 " d_HA=1.859 d_AD=2.861 a_DHA=167.959 symop: x,y,z a_YAH=126 4737 4801 " H VAL A 306 "<>" O HIS A 302 " d_HA=2.053 d_AD=3.062 a_DHA=172.759 symop: x,y,z a_YAH=166 4744 4686 " H HIS A 302 "<>" O GLN A 299 " d_HA=2.281 d_AD=3.034 a_DHA=130.138 symop: x,y,z a_YAH=119 4552 4608 " H ALA A 293 "<>" O VAL A 289 " d_HA=1.838 d_AD=2.822 a_DHA=162.805 symop: x,y,z a_YAH=156 4575 4638 " H LEU A 295 "<>" O LEU A 291 " d_HA=1.883 d_AD=2.894 a_DHA=171.161 symop: x,y,z a_YAH=155 4594 4657 " H MET A 296 "<>" O ASP A 292 " d_HA=1.869 d_AD=2.806 a_DHA=152.081 symop: x,y,z a_YAH=142 4594 4670 " H GLY A 297 "<>" O ASP A 292 " d_HA=2.581 d_AD=3.280 a_DHA=125.994 symop: x,y,z a_YAH=141 218 6187 " H PHE A 399 "<>" OH TYR A 17 " d_HA=2.068 d_AD=3.054 a_DHA=165.153 symop: x,y,z a_YAH=119 a_YAH=92 4606 4670 " H GLY A 297 "<>" O ALA A 293 " d_HA=2.513 d_AD=3.182 a_DHA=123.131 symop: x,y,z a_YAH=99 138 4616 " H ALA A 11 "<>" O HIS A 294 " d_HA=1.756 d_AD=2.763 a_DHA=174.361 symop: x,y,z a_YAH=157 1786 1846 " H GLN A 119 "<>" O ALA A 116 " d_HA=2.697 d_AD=3.636 a_DHA=155.523 symop: x,y,z a_YAH=95 1786 2829 " HZ1 LYS A 182 "<>" O ALA A 116 " d_HA=1.720 d_AD=2.733 a_DHA=173.204 symop: x,y,z a_YAH=153 1844 2831 " HZ3 LYS A 182 "<>" OE1 GLN A 119 " d_HA=2.040 d_AD=2.882 a_DHA=138.254 symop: x,y,z a_YAH=141 2854 2971 " HE ARG A 190 "<>" O MET A 184 " d_HA=2.040 d_AD=2.986 a_DHA=154.371 symop: x,y,z a_YAH=114 2744 2819 " H LYS A 182 "<>" O THR A 178 " d_HA=1.944 d_AD=2.852 a_DHA=147.249 symop: x,y,z a_YAH=158 2744 2840 " H LEU A 183 "<>" O THR A 178 " d_HA=2.928 d_AD=3.724 a_DHA=136.550 symop: x,y,z a_YAH=137 2680 2748 " H THR A 178 "<>" O THR A 174 " d_HA=1.902 d_AD=2.888 a_DHA=162.983 symop: x,y,z a_YAH=155 2730 2804 " H ASN A 181 "<>" O ASN A 177 " d_HA=1.921 d_AD=2.906 a_DHA=162.325 symop: x,y,z a_YAH=154 2625 2684 " H THR A 174 "<>" O ASN A 170 " d_HA=2.109 d_AD=3.010 a_DHA=146.737 symop: x,y,z a_YAH=143 2625 2687 " HG1 THR A 174 "<>" O ASN A 170 " d_HA=2.160 d_AD=3.124 a_DHA=172.302 symop: x,y,z a_YAH=140 2871 2922 " H ILE A 188 "<>" O GLU A 185 " d_HA=1.886 d_AD=2.868 a_DHA=161.979 symop: x,y,z a_YAH=127 2835 2963 " H ARG A 190 "<>" O LEU A 183 " d_HA=1.873 d_AD=2.857 a_DHA=162.174 symop: x,y,z a_YAH=156 2877 2917 " H GLU A 185 "<>" O ILE A 188 " d_HA=1.918 d_AD=2.923 a_DHA=168.214 symop: x,y,z a_YAH=157 2758 2819 " H LYS A 182 "<>" O ILE A 179 " d_HA=2.997 d_AD=3.728 a_DHA=129.595 symop: x,y,z a_YAH=93 2758 2840 " H LEU A 183 "<>" O ILE A 179 " d_HA=2.104 d_AD=2.960 a_DHA=141.461 symop: x,y,z a_YAH=123 2694 2763 " H ILE A 179 "<>" O MET A 175 " d_HA=1.863 d_AD=2.870 a_DHA=170.648 symop: x,y,z a_YAH=158 2711 2783 " H LYS A 180 "<>" O LEU A 176 " d_HA=2.074 d_AD=3.071 a_DHA=167.297 symop: x,y,z a_YAH=146 2651 2716 " H LEU A 176 "<>" O ALA A 172 " d_HA=1.877 d_AD=2.868 a_DHA=164.749 symop: x,y,z a_YAH=154 2661 2735 " H ASN A 177 "<>" O ILE A 173 " d_HA=2.134 d_AD=3.069 a_DHA=152.302 symop: x,y,z a_YAH=140 2661 2740 "HD22 ASN A 177 "<>" O ILE A 173 " d_HA=1.840 d_AD=2.837 a_DHA=167.199 symop: x,y,z a_YAH=136 2604 2666 " H ILE A 173 "<>" O TYR A 169 " d_HA=1.973 d_AD=2.955 a_DHA=161.754 symop: x,y,z a_YAH=156 3618 3679 " H THR A 234 "<>" O LYS A 231 " d_HA=2.253 d_AD=3.055 a_DHA=135.068 symop: x,y,z a_YAH=96 3618 3694 " H LEU A 235 "<>" O LYS A 231 " d_HA=1.783 d_AD=2.760 a_DHA=161.013 symop: x,y,z a_YAH=156 3640 3713 " H LEU A 236 "<>" O SER A 232 " d_HA=2.031 d_AD=3.042 a_DHA=175.551 symop: x,y,z a_YAH=161 3192 3642 " HD1 HIS A 204 "<>" OG SER A 232 " d_HA=1.921 d_AD=2.828 a_DHA=147.770 symop: x,y,z a_YAH=101 a_YAH=97 3578 3643 " H SER A 232 "<>" O VAL A 228 " d_HA=1.816 d_AD=2.809 a_DHA=164.591 symop: x,y,z a_YAH=152 3594 3659 " H ARG A 233 "<>" O ALA A 229 " d_HA=1.922 d_AD=2.927 a_DHA=168.487 symop: x,y,z a_YAH=153 3217 3287 " H ASP A 210 "<>" O PRO A 206 " d_HA=2.429 d_AD=3.422 a_DHA=166.442 symop: x,y,z a_YAH=148 3231 3303 " H TYR A 211 "<>" O ALA A 207 " d_HA=1.993 d_AD=2.946 a_DHA=155.403 symop: x,y,z a_YAH=146 3241 3323 " H PHE A 212 "<>" O PHE A 208 " d_HA=1.774 d_AD=2.772 a_DHA=167.851 symop: x,y,z a_YAH=158 3294 3369 "HD22 ASN A 215 "<>" O TYR A 211 " d_HA=1.800 d_AD=2.811 a_DHA=174.910 symop: x,y,z a_YAH=136 3294 3364 " H ASN A 215 "<>" O TYR A 211 " d_HA=2.308 d_AD=3.166 a_DHA=141.415 symop: x,y,z a_YAH=147 3368 6223 "HD21 ASN A 215 "<>" OD1 ASN A 401 " d_HA=2.076 d_AD=2.991 a_DHA=150.281 symop: x,y,z a_YAH=137 3311 6199 " HH TYR A 211 "<>" O TYR A 400 " d_HA=1.701 d_AD=2.676 a_DHA=179.196 symop: x,y,z a_YAH=145 3362 6239 " H ASN A 402 "<>" OD1 ASN A 215 " d_HA=1.822 d_AD=2.815 a_DHA=166.782 symop: x,y,z a_YAH=150 3362 6244 "HD22 ASN A 402 "<>" OD1 ASN A 215 " d_HA=1.908 d_AD=2.903 a_DHA=166.160 symop: x,y,z a_YAH=131 3651 3733 " H LYS A 237 "<>" O ARG A 233 " d_HA=2.809 d_AD=3.668 a_DHA=143.425 symop: x,y,z a_YAH=104 3651 3745 " HZ3 LYS A 237 "<>" O ARG A 233 " d_HA=2.371 d_AD=3.226 a_DHA=140.467 symop: x,y,z a_YAH=142 3667 4598 " HE ARG A 233 "<>" OD2 ASP A 292 " d_HA=1.801 d_AD=2.825 a_DHA=171.536 symop: x,y,z a_YAH=113 4598 4750 " HE2 HIS A 302 "<>" OD2 ASP A 292 " d_HA=1.751 d_AD=2.761 a_DHA=167.347 symop: x,y,z a_YAH=118 3286 3671 "HH22 ARG A 233 "<>" OD2 ASP A 210 " d_HA=1.788 d_AD=2.730 a_DHA=151.498 symop: x,y,z a_YAH=156 3286 3669 "HH12 ARG A 233 "<>" OD2 ASP A 210 " d_HA=1.804 d_AD=2.765 a_DHA=153.863 symop: x,y,z a_YAH=134 3670 4597 "HH21 ARG A 233 "<>" OD1 ASP A 292 " d_HA=1.690 d_AD=2.709 a_DHA=172.829 symop: x,y,z a_YAH=125 154 3355 "HD22 ASN A 214 "<>" OH TYR A 12 " d_HA=1.917 d_AD=2.910 a_DHA=165.914 symop: x,y,z a_YAH=93 a_YAH=134 163 6223 " HH TYR A 12 "<>" OD1 ASN A 401 " d_HA=1.643 d_AD=2.615 a_DHA=172.422 symop: x,y,z a_YAH=129 4669 4698 "HE21 GLN A 299 "<>" O GLY A 297 " d_HA=2.188 d_AD=3.117 a_DHA=151.633 symop: x,y,z a_YAH=103 155 4633 " H TYR A 12 "<>" O LEU A 295 " d_HA=1.968 d_AD=2.947 a_DHA=161.698 symop: x,y,z a_YAH=135 170 129 " H SER A 13 "<>" O GLY A 10 " d_HA=2.878 d_AD=3.554 a_DHA=124.821 symop: x,y,z a_YAH=110 4692 4740 " H GLN A 299 "<>" ND1 HIS A 302 " d_HA=1.984 d_AD=2.962 a_DHA=160.669 symop: x,y,z a_YAH=134 a_YAH=106 2886 3636 " HZ3 LYS A 231 "<>" O ASN A 186 " d_HA=1.795 d_AD=2.805 a_DHA=170.140 symop: x,y,z a_YAH=133 3492 3582 " H VAL A 228 "<>" O TYR A 224 " d_HA=1.951 d_AD=2.945 a_DHA=164.886 symop: x,y,z a_YAH=154 3315 3377 " H VAL A 216 "<>" O PHE A 212 " d_HA=2.151 d_AD=2.904 a_DHA=129.872 symop: x,y,z a_YAH=157 3315 3364 " H ASN A 215 "<>" O PHE A 212 " d_HA=2.231 d_AD=2.959 a_DHA=127.330 symop: x,y,z a_YAH=105 2621 3359 " HH TYR A 169 "<>" O ASN A 215 " d_HA=1.615 d_AD=2.583 a_DHA=173.155 symop: x,y,z a_YAH=153 3561 3624 " H LYS A 231 "<>" O GLN A 227 " d_HA=1.916 d_AD=2.925 a_DHA=169.539 symop: x,y,z a_YAH=158 3604 3682 " HG1 THR A 234 "<>" O THR A 230 " d_HA=1.790 d_AD=2.763 a_DHA=174.255 symop: x,y,z a_YAH=147 3513 3596 " H ALA A 229 "<>" O TRP A 225 " d_HA=1.869 d_AD=2.867 a_DHA=167.033 symop: x,y,z a_YAH=152 3537 3608 " H THR A 230 "<>" O ARG A 226 " d_HA=2.005 d_AD=2.972 a_DHA=158.708 symop: x,y,z a_YAH=138 3537 3611 " HG1 THR A 230 "<>" O ARG A 226 " d_HA=1.890 d_AD=2.855 a_DHA=170.149 symop: x,y,z a_YAH=148 3261 3337 " H ALA A 213 "<>" O TYR A 209 " d_HA=1.894 d_AD=2.897 a_DHA=169.413 symop: x,y,z a_YAH=158 3282 3350 " H ASN A 214 "<>" O ASP A 210 " d_HA=2.313 d_AD=3.228 a_DHA=149.654 symop: x,y,z a_YAH=142 3335 3377 " H VAL A 216 "<>" O ALA A 213 " d_HA=2.853 d_AD=3.718 a_DHA=144.012 symop: x,y,z a_YAH=91 3285 3554 "HH11 ARG A 226 "<>" OD1 ASP A 210 " d_HA=1.708 d_AD=2.688 a_DHA=157.678 symop: x,y,z a_YAH=157 4983 5672 " HZ2 LYS A 317 "<>" OE2 GLU A 367 " d_HA=1.681 d_AD=2.628 a_DHA=151.385 symop: x,y,z a_YAH=118 5702 474 " HZ2 LYS A 32 "<>" O TRP A 369 " d_HA=1.790 d_AD=2.720 a_DHA=150.607 symop: x,y,z a_YAH=130 5653 5729 " H SER A 370 "<>" O ASN A 366 " d_HA=2.101 d_AD=3.060 a_DHA=157.588 symop: x,y,z a_YAH=146 5653 5733 " HG SER A 370 "<>" O ASN A 366 " d_HA=1.866 d_AD=2.803 a_DHA=160.187 symop: x,y,z a_YAH=139 2975 3067 "HH22 ARG A 190 "<>" OD1 ASP A 196 " d_HA=1.792 d_AD=2.757 a_DHA=155.008 symop: x,y,z a_YAH=108 2465 1335 "HH12 ARG A 159 "<>" O MET A 89 " d_HA=2.092 d_AD=2.852 a_DHA=130.414 symop: x,y,z a_YAH=119 2794 3447 " HZ2 LYS A 180 "<>" OD1 ASP A 221 " d_HA=1.730 d_AD=2.647 a_DHA=146.448 symop: x,y,z a_YAH=148 3412 3448 "HD21 ASN A 218 "<>" OD2 ASP A 221 " d_HA=1.792 d_AD=2.794 a_DHA=161.970 symop: x,y,z a_YAH=127 444 3396 " HG1 THR A 217 "<>" OE1 GLN A 31 " d_HA=1.996 d_AD=2.811 a_DHA=140.117 symop: -x+1,-x+y+1,-z+1/3 a_YAH=128 2904 3635 " HZ2 LYS A 231 "<>" OE1 GLN A 187 " d_HA=1.790 d_AD=2.812 a_DHA=177.650 symop: x,y,z a_YAH=137 2913 3565 "HE22 GLN A 187 "<>" OE1 GLN A 227 " d_HA=1.850 d_AD=2.865 a_DHA=177.180 symop: x,y,z a_YAH=145 3478 3567 " H GLN A 227 "<>" O ASN A 223 " d_HA=1.995 d_AD=2.914 a_DHA=149.021 symop: x,y,z a_YAH=153 3434 3501 " H TYR A 224 "<>" O ALA A 220 " d_HA=1.902 d_AD=2.892 a_DHA=163.106 symop: x,y,z a_YAH=147 3444 3524 " H TRP A 225 "<>" O ASP A 221 " d_HA=2.016 d_AD=3.035 a_DHA=177.143 symop: x,y,z a_YAH=154 3373 3474 " HZ3 LYS A 222 "<>" O VAL A 216 " d_HA=1.815 d_AD=2.686 a_DHA=140.311 symop: x,y,z a_YAH=167 3403 3449 " H ASP A 221 "<>" O ASN A 218 " d_HA=2.528 d_AD=3.160 a_DHA=120.379 symop: x,y,z a_YAH=119 3403 3462 " H LYS A 222 "<>" O ASN A 218 " d_HA=2.200 d_AD=3.184 a_DHA=162.454 symop: x,y,z a_YAH=155 3456 3545 " H ARG A 226 "<>" O LYS A 222 " d_HA=2.089 d_AD=3.069 a_DHA=161.725 symop: x,y,z a_YAH=151 5613 5690 " H PHE A 368 "<>" O PHE A 364 " d_HA=2.200 d_AD=3.081 a_DHA=144.400 symop: x,y,z a_YAH=146 5633 5690 " H PHE A 368 "<>" O PHE A 365 " d_HA=2.638 d_AD=3.325 a_DHA=125.013 symop: x,y,z a_YAH=92 5633 5713 " H TRP A 369 "<>" O PHE A 365 " d_HA=1.834 d_AD=2.843 a_DHA=170.054 symop: x,y,z a_YAH=156 390 446 " H GLN A 31 "<>" O ASN A 28 " d_HA=2.088 d_AD=2.849 a_DHA=130.749 symop: x,y,z a_YAH=111 390 463 " H LYS A 32 "<>" O ASN A 28 " d_HA=2.053 d_AD=3.034 a_DHA=161.481 symop: x,y,z a_YAH=158 5584 5658 " H ASN A 366 "<>" O ASN A 362 " d_HA=2.313 d_AD=3.260 a_DHA=154.973 symop: x,y,z a_YAH=129 5584 5663 "HD22 ASN A 366 "<>" O ASN A 362 " d_HA=1.892 d_AD=2.747 a_DHA=139.490 symop: x,y,z a_YAH=121 5598 5673 " H GLU A 367 "<>" O GLU A 363 " d_HA=2.087 d_AD=3.081 a_DHA=165.147 symop: x,y,z a_YAH=155 370 5656 " HZ1 LYS A 26 "<>" OD1 ASN A 366 " d_HA=1.770 d_AD=2.698 a_DHA=149.417 symop: x,y,z a_YAH=143 5587 5662 "HD21 ASN A 366 "<>" OD1 ASN A 362 " d_HA=2.537 d_AD=3.382 a_DHA=141.482 symop: x,y,z a_YAH=122 2426 2496 " H GLY A 161 "<>" O SER A 157 " d_HA=2.152 d_AD=2.956 a_DHA=135.222 symop: x,y,z a_YAH=124 2505 2613 " H TYR A 169 "<>" OD1 ASN A 162 " d_HA=1.836 d_AD=2.826 a_DHA=165.647 symop: x,y,z a_YAH=126 2428 2511 "HD21 ASN A 162 "<>" OG SER A 157 " d_HA=1.846 d_AD=2.855 a_DHA=169.244 symop: x,y,z a_YAH=122 a_YAH=127 2429 2364 " H SER A 157 "<>" O LEU A 153 " d_HA=1.953 d_AD=2.963 a_DHA=171.271 symop: x,y,z a_YAH=152 2433 6237 " HG SER A 157 "<>" OD1 ASN A 402 " d_HA=1.580 d_AD=2.558 a_DHA=170.152 symop: x,y,z a_YAH=139 2439 2383 " H ALA A 158 "<>" O LEU A 154 " d_HA=2.187 d_AD=3.177 a_DHA=164.668 symop: x,y,z a_YAH=145 2416 2482 " H TRP A 160 "<>" O ALA A 156 " d_HA=1.935 d_AD=2.944 a_DHA=173.065 symop: x,y,z a_YAH=164 2416 2496 " H GLY A 161 "<>" O ALA A 156 " d_HA=2.883 d_AD=3.661 a_DHA=134.432 symop: x,y,z a_YAH=139 2402 2455 " H ARG A 159 "<>" O ASN A 155 " d_HA=1.985 d_AD=2.884 a_DHA=146.203 symop: x,y,z a_YAH=151 3050 2999 " H ILE A 195 "<>" O SER A 192 " d_HA=2.645 d_AD=3.597 a_DHA=156.926 symop: x,y,z a_YAH=102 1374 2487 " HE1 TRP A 160 "<>" OD1 ASN A 91 " d_HA=2.367 d_AD=3.305 a_DHA=153.579 symop: x,y,z a_YAH=91 1319 2464 "HH11 ARG A 159 "<>" O VAL A 88 " d_HA=1.774 d_AD=2.736 a_DHA=156.098 symop: x,y,z a_YAH=153 1319 1376 " H ASN A 91 "<>" O VAL A 88 " d_HA=2.420 d_AD=3.376 a_DHA=157.890 symop: x,y,z a_YAH=99 2973 3067 "HH12 ARG A 190 "<>" OD1 ASP A 196 " d_HA=1.816 d_AD=2.763 a_DHA=151.847 symop: x,y,z a_YAH=150 1371 1413 " H GLN A 93 "<>" O ASN A 91 " d_HA=2.385 d_AD=3.167 a_DHA=133.730 symop: x,y,z a_YAH=101 1309 1391 " H LYS A 92 "<>" O ALA A 87 " d_HA=1.937 d_AD=2.882 a_DHA=153.358 symop: x,y,z a_YAH=147 2875 3095 " H LEU A 198 "<>" OE1 GLU A 185 " d_HA=2.819 d_AD=3.747 a_DHA=151.993 symop: x,y,z a_YAH=148 3417 3483 " H ASN A 223 "<>" O GLN A 219 " d_HA=1.963 d_AD=2.940 a_DHA=160.563 symop: x,y,z a_YAH=153 3421 3487 "HD21 ASN A 223 "<>" OE1 GLN A 219 " d_HA=2.140 d_AD=3.003 a_DHA=141.969 symop: x,y,z a_YAH=134 5557 5621 " H PHE A 364 "<>" O GLN A 360 " d_HA=2.050 d_AD=3.032 a_DHA=162.504 symop: x,y,z a_YAH=168 5574 5641 " H PHE A 365 "<>" O ALA A 361 " d_HA=1.967 d_AD=2.915 a_DHA=153.740 symop: x,y,z a_YAH=147 269 335 " H MET A 24 "<>" O LEU A 20 " d_HA=1.880 d_AD=2.874 a_DHA=165.752 symop: x,y,z a_YAH=162 288 360 " H LYS A 26 "<>" O ALA A 21 " d_HA=1.954 d_AD=2.931 a_DHA=160.066 symop: x,y,z a_YAH=153 290 6089 " H ALA A 21 "<>" O VAL A 393 " d_HA=1.849 d_AD=2.863 a_DHA=177.454 symop: x,y,z a_YAH=147 5540 5589 " H ASN A 362 "<>" O ALA A 358 " d_HA=2.289 d_AD=3.169 a_DHA=144.428 symop: x,y,z a_YAH=127 5540 5594 "HD22 ASN A 362 "<>" O ALA A 358 " d_HA=1.980 d_AD=2.966 a_DHA=162.990 symop: x,y,z a_YAH=150 5550 5604 " H GLU A 363 "<>" O GLY A 359 " d_HA=1.986 d_AD=2.915 a_DHA=150.682 symop: x,y,z a_YAH=145 298 348 " H GLY A 25 "<>" O GLN A 22 " d_HA=2.068 d_AD=2.923 a_DHA=140.584 symop: x,y,z a_YAH=111 298 2579 "HD22 ASN A 167 "<>" O GLN A 22 " d_HA=2.100 d_AD=3.077 a_DHA=160.337 symop: -x+1,-x+y+1,-z+1/3 a_YAH=125 330 372 " HZ3 LYS A 26 "<>" O MET A 24 " d_HA=2.790 d_AD=3.587 a_DHA=135.596 symop: x,y,z a_YAH=164 354 2634 "HD21 ASN A 170 "<>" O LYS A 26 " d_HA=1.997 d_AD=2.959 a_DHA=157.034 symop: -x+1,-x+y+1,-z+1/3 a_YAH=155 354 2578 "HD21 ASN A 167 "<>" O LYS A 26 " d_HA=1.919 d_AD=2.877 a_DHA=157.179 symop: -x+1,-x+y+1,-z+1/3 a_YAH=123 2572 2630 " H ASN A 170 "<>" OD1 ASN A 167 " d_HA=2.009 d_AD=2.995 a_DHA=162.493 symop: x,y,z a_YAH=149 2569 2644 " H ASP A 171 "<>" O ASN A 167 " d_HA=2.018 d_AD=3.018 a_DHA=169.574 symop: x,y,z a_YAH=160 2549 2592 " H TYR A 168 "<>" O PHE A 166 " d_HA=2.374 d_AD=3.168 a_DHA=134.410 symop: x,y,z a_YAH=94 4202 4261 " H ILE A 267 "<>" OE1 GLN A 271 " d_HA=1.838 d_AD=2.857 a_DHA=177.858 symop: x,y,z a_YAH=141 4216 4263 " H GLN A 271 "<>" O PHE A 268 " d_HA=2.344 d_AD=3.299 a_DHA=157.424 symop: x,y,z a_YAH=123 4224 4261 " H PHE A 268 "<>" OE1 GLN A 271 " d_HA=2.671 d_AD=3.486 a_DHA=137.703 symop: x,y,z a_YAH=145 1419 2591 "HE21 GLN A 93 "<>" OH TYR A 168 " d_HA=1.914 d_AD=2.901 a_DHA=162.436 symop: x,y,z a_YAH=136 a_YAH=110 1477 2600 " HH TYR A 168 "<>" OD1 ASP A 97 " d_HA=1.593 d_AD=2.579 a_DHA=172.682 symop: x,y,z a_YAH=110 1407 1479 " H ASP A 97 "<>" O GLN A 93 " d_HA=1.997 d_AD=3.011 a_DHA=172.744 symop: x,y,z a_YAH=154 3090 2987 " H PHE A 191 "<>" O LEU A 198 " d_HA=2.219 d_AD=3.190 a_DHA=160.219 symop: x,y,z a_YAH=120 3076 4064 "HH11 ARG A 257 "<>" O ASN A 197 " d_HA=1.745 d_AD=2.756 a_DHA=172.597 symop: x,y,z a_YAH=133 3113 4036 " H THR A 199 "<>" O SER A 256 " d_HA=1.983 d_AD=2.969 a_DHA=163.429 symop: x,y,z a_YAH=165 1385 1462 " H PHE A 96 "<>" O LYS A 92 " d_HA=2.250 d_AD=3.133 a_DHA=144.828 symop: x,y,z a_YAH=139 3079 4076 " H LEU A 258 "<>" OD1 ASN A 197 " d_HA=1.915 d_AD=2.915 a_DHA=166.226 symop: x,y,z a_YAH=161 1402 1444 " HZ2 LYS A 92 "<>" OE2 GLU A 95 " d_HA=2.948 d_AD=3.618 a_DHA=124.337 symop: x,y,z a_YAH=138 557 1401 " HZ1 LYS A 92 "<>" OD1 ASP A 38 " d_HA=1.738 d_AD=2.744 a_DHA=164.632 symop: x,y,z a_YAH=155 436 6105 "HE22 GLN A 30 "<>" O SER A 394 " d_HA=2.439 d_AD=3.425 a_DHA=162.713 symop: x,y,z a_YAH=146 4816 5531 " H ASN A 357 "<>" OD1 ASN A 307 " d_HA=2.818 d_AD=3.825 a_DHA=175.745 symop: x,y,z a_YAH=112 4816 5570 "HE22 GLN A 360 "<>" OD1 ASN A 307 " d_HA=1.973 d_AD=2.887 a_DHA=148.889 symop: x,y,z a_YAH=128 4816 5516 " H THR A 356 "<>" OD1 ASN A 307 " d_HA=2.361 d_AD=3.359 a_DHA=168.323 symop: x,y,z a_YAH=102 250 319 "HH21 ARG A 18 "<>" OE1 GLU A 23 " d_HA=1.685 d_AD=2.709 a_DHA=175.956 symop: x,y,z a_YAH=123 255 321 " H GLU A 23 "<>" O ASN A 19 " d_HA=1.909 d_AD=2.895 a_DHA=162.559 symop: x,y,z a_YAH=156 258 304 " H GLN A 22 "<>" OD1 ASN A 19 " d_HA=2.069 d_AD=3.008 a_DHA=152.712 symop: x,y,z a_YAH=122 5529 5551 " H GLY A 359 "<>" OD1 ASN A 357 " d_HA=2.144 d_AD=2.933 a_DHA=133.298 symop: x,y,z a_YAH=146 5529 5563 " H GLN A 360 "<>" OD1 ASN A 357 " d_HA=1.872 d_AD=2.876 a_DHA=170.394 symop: x,y,z a_YAH=137 5526 5576 " H ALA A 361 "<>" O ASN A 357 " d_HA=1.969 d_AD=2.912 a_DHA=153.817 symop: x,y,z a_YAH=142 15 54 " H ASN A 4 "<>" O PHE A 2 " d_HA=2.331 d_AD=2.997 a_DHA=122.341 symop: x,y,z a_YAH=111 40 319 " H ASN A 3 "<>" OE1 GLU A 23 " d_HA=1.835 d_AD=2.853 a_DHA=175.439 symop: x,y,z a_YAH=132 6 315 " H2 ALA A 1 "<>" O GLU A 23 " d_HA=1.930 d_AD=2.873 a_DHA=153.327 symop: x,y,z a_YAH=139 1613 2642 " HZ1 LYS A 104 "<>" OD1 ASP A 171 " d_HA=1.937 d_AD=2.701 a_DHA=129.255 symop: x,y,z a_YAH=109 4274 4294 "HD22 ASN A 273 "<>" O ALA A 272 " d_HA=2.020 d_AD=2.855 a_DHA=138.695 symop: x,y,z a_YAH=97 4193 4274 " HH TYR A 266 "<>" O ALA A 272 " d_HA=2.350 d_AD=3.271 a_DHA=158.875 symop: x,y,z a_YAH=135 5 2516 " H1 ALA A 1 "<>" O SER A 163 " d_HA=2.262 d_AD=2.930 a_DHA=121.940 symop: -x+1,-x+y+1,-z+1/3 a_YAH=102 5 2527 " H1 ALA A 1 "<>" O GLY A 164 " d_HA=1.863 d_AD=2.713 a_DHA=138.907 symop: -x+1,-x+y+1,-z+1/3 a_YAH=142 1535 2643 " HE1 TRP A 100 "<>" OD2 ASP A 171 " d_HA=1.878 d_AD=2.888 a_DHA=167.479 symop: x,y,z a_YAH=128 1614 2643 " HZ2 LYS A 104 "<>" OD2 ASP A 171 " d_HA=1.783 d_AD=2.711 a_DHA=148.428 symop: x,y,z a_YAH=103 4269 4284 "HE21 GLN A 271 "<>" O ASN A 273 " d_HA=1.827 d_AD=2.816 a_DHA=163.664 symop: x,y,z a_YAH=140 1474 1551 " H ARG A 101 "<>" O ASP A 97 " d_HA=1.893 d_AD=2.895 a_DHA=166.302 symop: x,y,z a_YAH=155 4169 4270 "HE22 GLN A 271 "<>" O GLY A 265 " d_HA=2.169 d_AD=3.028 a_DHA=141.903 symop: x,y,z a_YAH=140 4169 4313 " H GLY A 275 "<>" O GLY A 265 " d_HA=2.027 d_AD=3.016 a_DHA=163.583 symop: x,y,z a_YAH=148 4170 4323 " H GLY A 265 "<>" OE1 GLN A 276 " d_HA=1.802 d_AD=2.799 a_DHA=168.091 symop: x,y,z a_YAH=152 1424 1491 " H ASN A 98 "<>" O GLU A 94 " d_HA=2.069 d_AD=3.067 a_DHA=166.080 symop: x,y,z a_YAH=157 1439 1505 " H LEU A 99 "<>" O GLU A 95 " d_HA=2.217 d_AD=3.172 a_DHA=155.466 symop: x,y,z a_YAH=142 1454 1530 " H TRP A 100 "<>" O PHE A 96 " d_HA=1.883 d_AD=2.890 a_DHA=170.301 symop: x,y,z a_YAH=157 3109 4039 " H SER A 256 "<>" O THR A 199 " d_HA=1.866 d_AD=2.878 a_DHA=173.220 symop: x,y,z a_YAH=147 4017 4138 " H VAL A 263 "<>" O LEU A 255 " d_HA=1.984 d_AD=2.975 a_DHA=162.553 symop: x,y,z a_YAH=128 1429 1495 "HD21 ASN A 98 "<>" OE2 GLU A 94 " d_HA=2.823 d_AD=3.615 a_DHA=135.198 symop: x,y,z a_YAH=114 4043 4047 " HG SER A 256 "<>" O ARG A 257 " d_HA=1.739 d_AD=2.687 a_DHA=164.343 symop: x,y,z a_YAH=132 4047 4103 " H GLY A 260 "<>" O ARG A 257 " d_HA=1.941 d_AD=2.886 a_DHA=154.427 symop: x,y,z a_YAH=127 4055 4109 " H ARG A 257 "<>" O SER A 261 " d_HA=1.827 d_AD=2.832 a_DHA=168.893 symop: x,y,z a_YAH=152 4093 4112 " H SER A 261 "<>" OD1 ASP A 259 " d_HA=1.903 d_AD=2.857 a_DHA=155.101 symop: x,y,z a_YAH=125 4093 4116 " HG SER A 261 "<>" OD1 ASP A 259 " d_HA=1.706 d_AD=2.692 a_DHA=171.117 symop: x,y,z a_YAH=105 3832 4111 " HZ3 LYS A 242 "<>" OG SER A 261 " d_HA=1.863 d_AD=2.788 a_DHA=148.914 symop: x,y,z a_YAH=134 a_YAH=105 3694 3618 " H LEU A 235 "<>" O LYS A 231 " d_HA=1.783 d_AD=2.760 a_DHA=161.013 symop: x,y,z a_YAH=156 3759 4090 "HD22 ASN A 238 "<>" O ASP A 259 " d_HA=2.122 d_AD=3.051 a_DHA=150.911 symop: x,y,z a_YAH=144 3831 4094 " HZ2 LYS A 242 "<>" OD2 ASP A 259 " d_HA=1.794 d_AD=2.716 a_DHA=147.035 symop: x,y,z a_YAH=150 554 618 " H GLY A 42 "<>" O ASP A 38 " d_HA=2.029 d_AD=2.759 a_DHA=127.083 symop: x,y,z a_YAH=134 5493 5443 " H ALA A 354 "<>" O ALA A 351 " d_HA=1.965 d_AD=2.941 a_DHA=160.855 symop: x,y,z a_YAH=130 239 4622 " H ARG A 18 "<>" NE2 HIS A 294 " d_HA=1.941 d_AD=2.887 a_DHA=154.358 symop: x,y,z a_YAH=126 a_YAH=119 5519 1075 " HG1 THR A 356 "<>" OD1 ASP A 70 " d_HA=1.645 d_AD=2.622 a_DHA=167.237 symop: y,x+1,-z a_YAH=125 5504 5443 " H SER A 355 "<>" O ALA A 351 " d_HA=2.839 d_AD=3.501 a_DHA=123.690 symop: x,y,z a_YAH=125 248 5472 "HH11 ARG A 18 "<>" O LEU A 353 " d_HA=2.292 d_AD=2.980 a_DHA=124.511 symop: x,y,z a_YAH=121 247 320 " HE ARG A 18 "<>" OE2 GLU A 23 " d_HA=1.848 d_AD=2.867 a_DHA=171.804 symop: x,y,z a_YAH=113 59 5512 "HD22 ASN A 4 "<>" O THR A 356 " d_HA=2.262 d_AD=3.242 a_DHA=161.985 symop: x,y,z a_YAH=143 35 251 "HH22 ARG A 18 "<>" O ASN A 3 " d_HA=2.169 d_AD=2.920 a_DHA=129.838 symop: x,y,z a_YAH=121 38 68 " H ASN A 5 "<>" OD1 ASN A 3 " d_HA=2.025 d_AD=2.996 a_DHA=158.601 symop: x,y,z a_YAH=132 52 4293 "HD21 ASN A 273 "<>" OD1 ASN A 4 " d_HA=2.473 d_AD=3.326 a_DHA=142.176 symop: y,x+1,-z a_YAH=121 52 5282 "HH12 ARG A 337 "<>" OD1 ASN A 4 " d_HA=2.937 d_AD=3.670 a_DHA=130.709 symop: y,x+1,-z a_YAH=124 52 5284 "HH22 ARG A 337 "<>" OD1 ASN A 4 " d_HA=2.025 d_AD=3.021 a_DHA=165.082 symop: y,x+1,-z a_YAH=160 4385 4421 " H ASP A 281 "<>" OE1 GLU A 279 " d_HA=1.900 d_AD=2.915 a_DHA=172.319 symop: x,y,z a_YAH=107 1559 2539 " HE ARG A 101 "<>" OE2 GLU A 165 " d_HA=1.745 d_AD=2.744 a_DHA=164.088 symop: x,y,z a_YAH=106 1562 2538 "HH21 ARG A 101 "<>" OE1 GLU A 165 " d_HA=1.722 d_AD=2.737 a_DHA=167.153 symop: x,y,z a_YAH=131 4005 4336 " H PHE A 254 "<>" O TRP A 277 " d_HA=1.856 d_AD=2.853 a_DHA=166.501 symop: x,y,z a_YAH=169 4022 4312 " H LEU A 255 "<>" O GLY A 275 " d_HA=1.984 d_AD=2.985 a_DHA=168.478 symop: x,y,z a_YAH=133 4386 4430 " H ALA A 282 "<>" OE2 GLU A 279 " d_HA=1.845 d_AD=2.855 a_DHA=169.192 symop: x,y,z a_YAH=134 4298 4347 " H TRP A 277 "<>" O PRO A 274 " d_HA=2.138 d_AD=3.091 a_DHA=155.777 symop: x,y,z a_YAH=127 4331 5179 "HE21 GLN A 276 "<>" OG SER A 330 " d_HA=1.981 d_AD=2.975 a_DHA=165.219 symop: x,y,z a_YAH=146 a_YAH=104 891 1561 "HH12 ARG A 101 "<>" OH TYR A 59 " d_HA=2.722 d_AD=3.383 a_DHA=122.754 symop: x,y,z a_YAH=116 a_YAH=131 1489 1561 "HH12 ARG A 101 "<>" OD1 ASN A 98 " d_HA=1.852 d_AD=2.807 a_DHA=154.811 symop: x,y,z a_YAH=130 1489 1563 "HH22 ARG A 101 "<>" OD1 ASN A 98 " d_HA=2.130 d_AD=2.994 a_DHA=141.994 symop: x,y,z a_YAH=141 943 1486 " H HIS A 62 "<>" O ASN A 98 " d_HA=2.012 d_AD=3.022 a_DHA=173.328 symop: x,y,z a_YAH=110 1486 1575 " H PHE A 102 "<>" O ASN A 98 " d_HA=2.482 d_AD=3.430 a_DHA=155.501 symop: x,y,z a_YAH=135 3769 3987 " H THR A 253 "<>" NE2 HIS A 239 " d_HA=2.017 d_AD=2.992 a_DHA=160.567 symop: x,y,z a_YAH=148 a_YAH=102 3990 4017 " HG1 THR A 253 "<>" O LEU A 255 " d_HA=2.572 d_AD=3.301 a_DHA=132.372 symop: x,y,z a_YAH=128 3990 4312 " HG1 THR A 253 "<>" O GLY A 275 " d_HA=2.267 d_AD=2.999 a_DHA=131.890 symop: x,y,z a_YAH=153 900 939 " HH TYR A 59 "<>" ND1 HIS A 62 " d_HA=1.774 d_AD=2.749 a_DHA=175.537 symop: x,y,z a_YAH=143 a_YAH=110 3774 4038 " HD1 HIS A 239 "<>" OG SER A 256 " d_HA=2.987 d_AD=3.803 a_DHA=137.659 symop: x,y,z a_YAH=93 a_YAH=155 3774 4102 " HD1 HIS A 239 "<>" O GLY A 260 " d_HA=2.509 d_AD=3.329 a_DHA=137.201 symop: x,y,z a_YAH=119 632 949 " HE2 HIS A 62 "<>" OH TYR A 43 " d_HA=1.894 d_AD=2.838 a_DHA=153.359 symop: x,y,z a_YAH=116 a_YAH=124 3733 3651 " H LYS A 237 "<>" O ARG A 233 " d_HA=2.809 d_AD=3.668 a_DHA=143.425 symop: x,y,z a_YAH=104 3675 3754 " H ASN A 238 "<>" O THR A 234 " d_HA=1.882 d_AD=2.880 a_DHA=168.039 symop: x,y,z a_YAH=158 3689 3770 " H HIS A 239 "<>" O LEU A 235 " d_HA=1.835 d_AD=2.836 a_DHA=168.860 symop: x,y,z a_YAH=160 3708 3788 " H PHE A 240 "<>" O LEU A 236 " d_HA=1.882 d_AD=2.892 a_DHA=173.296 symop: x,y,z a_YAH=154 3749 3820 " H LYS A 242 "<>" O ASN A 238 " d_HA=1.865 d_AD=2.847 a_DHA=160.857 symop: x,y,z a_YAH=153 3745 3651 " HZ3 LYS A 237 "<>" O ARG A 233 " d_HA=2.371 d_AD=3.226 a_DHA=140.467 symop: x,y,z a_YAH=142 4686 4744 " H HIS A 302 "<>" O GLN A 299 " d_HA=2.281 d_AD=3.034 a_DHA=130.138 symop: x,y,z a_YAH=119 4686 4760 " H LYS A 303 "<>" O GLN A 299 " d_HA=2.498 d_AD=3.485 a_DHA=165.389 symop: x,y,z a_YAH=154 91 4678 " H ALA A 298 "<>" O SER A 7 " d_HA=1.953 d_AD=2.887 a_DHA=151.598 symop: x,y,z a_YAH=144 44 63 "HD21 ASN A 3 "<>" O ASN A 5 " d_HA=2.541 d_AD=3.243 a_DHA=126.407 symop: x,y,z a_YAH=129 4381 4449 " H TRP A 283 "<>" O GLU A 279 " d_HA=2.059 d_AD=2.909 a_DHA=139.328 symop: x,y,z a_YAH=153 4360 5165 " H TYR A 329 "<>" O TYR A 278 " d_HA=2.012 d_AD=3.016 a_DHA=166.543 symop: x,y,z a_YAH=150 4369 5156 " H TYR A 278 "<>" O TYR A 329 " d_HA=1.859 d_AD=2.846 a_DHA=163.548 symop: x,y,z a_YAH=163 5177 5217 " H GLY A 333 "<>" O SER A 330 " d_HA=1.887 d_AD=2.812 a_DHA=150.273 symop: x,y,z a_YAH=122 904 1560 "HH11 ARG A 101 "<>" O LYS A 60 " d_HA=1.968 d_AD=2.973 a_DHA=173.042 symop: x,y,z a_YAH=135 796 910 " H LYS A 60 "<>" O TYR A 53 " d_HA=1.988 d_AD=2.932 a_DHA=154.216 symop: x,y,z a_YAH=150 796 928 " H ALA A 61 "<>" O TYR A 53 " d_HA=2.388 d_AD=3.368 a_DHA=162.786 symop: x,y,z a_YAH=140 805 926 " H TYR A 53 "<>" O ALA A 61 " d_HA=1.803 d_AD=2.810 a_DHA=170.981 symop: x,y,z a_YAH=153 3763 3840 " H VAL A 243 "<>" O HIS A 239 " d_HA=1.967 d_AD=2.913 a_DHA=155.015 symop: x,y,z a_YAH=156 3836 3941 " H ASN A 250 "<>" O VAL A 243 " d_HA=1.935 d_AD=2.815 a_DHA=142.917 symop: x,y,z a_YAH=164 3727 3804 " H THR A 241 "<>" O LYS A 237 " d_HA=1.909 d_AD=2.852 a_DHA=154.480 symop: x,y,z a_YAH=148 3800 3855 " H SER A 244 "<>" O THR A 241 " d_HA=2.119 d_AD=3.056 a_DHA=152.963 symop: x,y,z a_YAH=107 102 4699 "HE22 GLN A 299 "<>" O SER A 8 " d_HA=2.404 d_AD=3.223 a_DHA=138.019 symop: x,y,z a_YAH=126 129 170 " H SER A 13 "<>" O GLY A 10 " d_HA=2.878 d_AD=3.554 a_DHA=124.821 symop: x,y,z a_YAH=110 129 185 " HG SER A 14 "<>" O GLY A 10 " d_HA=1.810 d_AD=2.766 a_DHA=166.673 symop: x,y,z a_YAH=118 129 181 " H SER A 14 "<>" O GLY A 10 " d_HA=2.355 d_AD=3.335 a_DHA=163.281 symop: x,y,z a_YAH=150 98 113 " HG SER A 7 "<>" O VAL A 9 " d_HA=1.715 d_AD=2.672 a_DHA=164.454 symop: x,y,z a_YAH=121 178 203 " HG1 THR A 16 "<>" O SER A 14 " d_HA=2.028 d_AD=2.998 a_DHA=174.865 symop: x,y,z a_YAH=129 180 200 " H THR A 16 "<>" OG SER A 14 " d_HA=2.429 d_AD=3.395 a_DHA=159.130 symop: x,y,z a_YAH=104 a_YAH=133 4454 5123 " HE1 TRP A 283 "<>" O GLN A 327 " d_HA=1.904 d_AD=2.902 a_DHA=165.588 symop: x,y,z a_YAH=145 5108 5357 "HE22 GLN A 344 "<>" O GLU A 326 " d_HA=2.042 d_AD=3.045 a_DHA=169.617 symop: x,y,z a_YAH=140 5129 5288 " H GLN A 327 "<>" O GLY A 338 " d_HA=1.883 d_AD=2.865 a_DHA=161.190 symop: x,y,z a_YAH=154 5140 5239 " H GLN A 335 "<>" O VAL A 328 " d_HA=1.968 d_AD=2.987 a_DHA=174.134 symop: x,y,z a_YAH=144 5216 5245 "HE21 GLN A 335 "<>" O GLY A 333 " d_HA=1.847 d_AD=2.843 a_DHA=168.421 symop: x,y,z a_YAH=128 835 921 " HZ2 LYS A 60 "<>" OE1 GLU A 55 " d_HA=1.700 d_AD=2.642 a_DHA=150.299 symop: x,y,z a_YAH=136 4368 5356 "HE21 GLN A 344 "<>" OH TYR A 278 " d_HA=2.090 d_AD=3.078 a_DHA=165.413 symop: x,y,z a_YAH=105 a_YAH=141 5180 5216 " H SER A 330 "<>" O GLY A 333 " d_HA=1.928 d_AD=2.918 a_DHA=164.193 symop: x,y,z a_YAH=141 837 867 " H GLU A 55 "<>" O VAL A 58 " d_HA=2.113 d_AD=3.085 a_DHA=158.432 symop: x,y,z a_YAH=159 3895 5210 " H GLY A 332 "<>" O HIS A 248 " d_HA=2.960 d_AD=3.577 a_DHA=120.184 symop: x,y,z a_YAH=115 3895 3955 " H LEU A 251 "<>" O HIS A 248 " d_HA=2.878 d_AD=3.879 a_DHA=170.991 symop: x,y,z a_YAH=114 3912 3946 "HD22 ASN A 250 "<>" O TRP A 249 " d_HA=2.222 d_AD=2.972 a_DHA=129.514 symop: x,y,z a_YAH=97 860 3928 " HE1 TRP A 249 "<>" O GLY A 57 " d_HA=2.024 d_AD=2.949 a_DHA=149.827 symop: -y+1,x-y+1,z+1/3 a_YAH=120 860 3877 " HG SER A 246 "<>" O GLY A 57 " d_HA=2.554 d_AD=3.471 a_DHA=158.599 symop: -y+1,x-y+1,z+1/3 a_YAH=151 4787 4851 " H ALA A 309 "<>" O ALA A 305 " d_HA=2.264 d_AD=3.220 a_DHA=156.787 symop: x,y,z a_YAH=140 3864 3939 " H GLY A 245 "<>" OD1 ASN A 250 " d_HA=1.971 d_AD=2.954 a_DHA=163.114 symop: x,y,z a_YAH=110 3939 4844 " HZ2 LYS A 308 "<>" OD1 ASN A 250 " d_HA=1.892 d_AD=2.859 a_DHA=157.123 symop: x,y,z a_YAH=131 3863 3923 " H TRP A 249 "<>" O GLY A 245 " d_HA=1.817 d_AD=2.779 a_DHA=157.149 symop: x,y,z a_YAH=125 4713 4789 " H ALA A 305 "<>" O TRP A 301 " d_HA=1.939 d_AD=2.894 a_DHA=155.681 symop: x,y,z a_YAH=144 4776 4833 " H LYS A 308 "<>" O SER A 304 " d_HA=1.960 d_AD=2.955 a_DHA=165.366 symop: x,y,z a_YAH=148 3854 4843 " HZ1 LYS A 308 "<>" OG SER A 244 " d_HA=1.986 d_AD=2.840 a_DHA=139.837 symop: x,y,z a_YAH=107 a_YAH=146 5057 5113 " HZ1 LYS A 322 "<>" OE2 GLU A 326 " d_HA=1.724 d_AD=2.744 a_DHA=170.329 symop: x,y,z a_YAH=144 5112 5272 " H ARG A 337 "<>" OE1 GLU A 326 " d_HA=2.982 d_AD=3.697 a_DHA=128.275 symop: x,y,z a_YAH=148 5087 5307 " H ALA A 340 "<>" O TYR A 325 " d_HA=1.899 d_AD=2.888 a_DHA=163.704 symop: x,y,z a_YAH=155 5114 5164 " H GLU A 326 "<>" OH TYR A 329 " d_HA=1.940 d_AD=2.940 a_DHA=167.975 symop: x,y,z a_YAH=102 a_YAH=141 5025 5113 "HD21 ASN A 320 "<>" OE2 GLU A 326 " d_HA=1.930 d_AD=2.931 a_DHA=167.635 symop: x,y,z a_YAH=123 2044 5209 "HE22 GLN A 130 "<>" O GLY A 332 " d_HA=2.301 d_AD=3.302 a_DHA=169.383 symop: y-1,x,-z a_YAH=127 831 871 " H VAL A 58 "<>" O GLU A 55 " d_HA=2.562 d_AD=3.342 a_DHA=133.639 symop: x,y,z a_YAH=122 4849 4910 " H LEU A 313 "<>" O ALA A 309 " d_HA=2.069 d_AD=3.052 a_DHA=161.928 symop: x,y,z a_YAH=149 4885 4958 " H ALA A 316 "<>" O PHE A 312 " d_HA=1.805 d_AD=2.755 a_DHA=154.077 symop: x,y,z a_YAH=151 4797 4864 " H LEU A 310 "<>" O VAL A 306 " d_HA=1.842 d_AD=2.849 a_DHA=172.685 symop: x,y,z a_YAH=162 4827 4893 " H PHE A 312 "<>" O LYS A 308 " d_HA=2.065 d_AD=3.006 a_DHA=153.140 symop: x,y,z a_YAH=137 5019 5047 " H LYS A 322 "<>" OD1 ASN A 320 " d_HA=2.129 d_AD=3.082 a_DHA=155.883 symop: x,y,z a_YAH=128 5019 5059 " HZ3 LYS A 322 "<>" OD1 ASN A 320 " d_HA=1.796 d_AD=2.789 a_DHA=164.388 symop: x,y,z a_YAH=122 4905 4972 " H LYS A 317 "<>" O LEU A 313 " d_HA=2.325 d_AD=3.090 a_DHA=131.135 symop: x,y,z a_YAH=135 4972 4924 " H LYS A 317 "<>" O SER A 314 " d_HA=2.219 d_AD=2.987 a_DHA=131.177 symop: x,y,z a_YAH=104 5016 5068 " H ASN A 323 "<>" O ASN A 320 " d_HA=2.124 d_AD=3.078 a_DHA=156.574 symop: x,y,z a_YAH=117 ------------------------------------------------------------------------------- Total: 579 Symmetry: 0 Per residue: 1.4332 Mean SD Skew Kurtosis theta_1: 144.551 23.082 -0.554 2.019 theta_2: 130.765 22.990 -0.217 1.740 d_HA: 2.328 0.330 0.512 2.003 3314 3823 " HZ3 LYS C 66 "<>" O ALA C 34 " d_HA=2.930 d_AD=3.734 a_DHA=136.718 symop: x,y,z a_YAH=137 3940 3864 " H ILE C 74 "<>" O MET C 70 " d_HA=2.182 d_AD=3.102 a_DHA=150.207 symop: x,y,z a_YAH=142 3864 3940 " H ILE C 74 "<>" O MET C 70 " d_HA=2.182 d_AD=3.102 a_DHA=150.207 symop: x,y,z a_YAH=142 3823 3314 " HZ3 LYS C 66 "<>" O ALA C 34 " d_HA=2.930 d_AD=3.734 a_DHA=136.718 symop: x,y,z a_YAH=137 307 343 " H ALA A 20 "<>" OE1 GLU A 23 " d_HA=1.825 d_AD=2.841 a_DHA=174.647 symop: x,y,z a_YAH=147 343 1360 " HH TYR A 84 "<>" OE1 GLU A 23 " d_HA=1.568 d_AD=2.548 a_DHA=169.198 symop: x,y,z a_YAH=116 2859 2792 " H ASP C 6 "<>" O GLN C 2 " d_HA=1.978 d_AD=2.980 a_DHA=168.277 symop: x,y,z a_YAH=152 3935 4010 " H GLU C 78 "<>" O ILE C 74 " d_HA=1.951 d_AD=2.922 a_DHA=157.771 symop: x,y,z a_YAH=162 4004 4081 " H LYS C 82 "<>" O GLU C 78 " d_HA=2.022 d_AD=3.030 a_DHA=170.024 symop: x,y,z a_YAH=164 3338 4093 " HZ3 LYS C 82 "<>" O VAL C 36 " d_HA=1.933 d_AD=2.916 a_DHA=161.114 symop: y-1,-x+1,z-1/4 a_YAH=147 3297 3355 " H GLY C 37 "<>" O GLN C 33 " d_HA=2.174 d_AD=2.910 a_DHA=127.993 symop: x,y,z a_YAH=119 3854 3923 " H TYR C 73 "<>" O ALA C 69 " d_HA=2.479 d_AD=3.396 a_DHA=150.568 symop: x,y,z a_YAH=127 3881 3959 " H ASP C 75 "<>" O LYS C 71 " d_HA=1.964 d_AD=2.959 a_DHA=165.260 symop: x,y,z a_YAH=169 344 1339 " HZ3 LYS A 83 "<>" OE2 GLU A 23 " d_HA=1.693 d_AD=2.701 a_DHA=166.626 symop: x,y,z a_YAH=110 287 2796 " HZ3 LYS A 18 "<>" OE1 GLN C 2 " d_HA=1.766 d_AD=2.746 a_DHA=159.309 symop: x,y,z a_YAH=104 2809 2872 " H LYS C 7 "<>" O ALA C 3 " d_HA=2.076 d_AD=3.011 a_DHA=151.665 symop: x,y,z a_YAH=154 3988 4059 " H LYS C 81 "<>" O VAL C 77 " d_HA=2.125 d_AD=3.023 a_DHA=145.787 symop: x,y,z a_YAH=141 4053 4141 " H GLY C 85 "<>" O LYS C 81 " d_HA=2.118 d_AD=2.840 a_DHA=126.517 symop: x,y,z a_YAH=119 3301 3693 " HE1 TRP C 58 "<>" OE1 GLN C 33 " d_HA=2.294 d_AD=3.020 a_DHA=126.858 symop: x,y,z a_YAH=135 1228 1305 " H LYS A 82 "<>" O GLU A 78 " d_HA=2.507 d_AD=3.456 a_DHA=155.864 symop: x,y,z a_YAH=137 721 760 " H PHE A 49 "<>" O LEU A 47 " d_HA=2.042 d_AD=2.849 a_DHA=134.465 symop: x,y,z a_YAH=111 3767 3373 " HZ1 LYS C 62 "<>" O ILE C 39 " d_HA=2.943 d_AD=3.718 a_DHA=133.432 symop: x,y,z a_YAH=164 3757 3701 " H LYS C 62 "<>" O ASN C 59 " d_HA=2.382 d_AD=3.380 a_DHA=169.020 symop: x,y,z a_YAH=112 951 879 "HE21 GLN A 60 "<>" O ASP A 56 " d_HA=1.956 d_AD=2.937 a_DHA=161.642 symop: x,y,z a_YAH=117 675 882 " HE ARG A 43 "<>" OD1 ASP A 56 " d_HA=1.798 d_AD=2.758 a_DHA=153.950 symop: x,y,z a_YAH=150 697 745 " H ASP A 48 "<>" O GLY A 45 " d_HA=2.279 d_AD=3.225 a_DHA=155.450 symop: x,y,z a_YAH=144 991 928 " HZ1 LYS A 62 "<>" OD1 ASN A 59 " d_HA=2.553 d_AD=3.322 a_DHA=132.157 symop: x,y,z a_YAH=154 3354 3693 " HE1 TRP C 58 "<>" O GLY C 37 " d_HA=2.296 d_AD=3.176 a_DHA=143.258 symop: x,y,z a_YAH=143 3355 3297 " H GLY C 37 "<>" O GLN C 33 " d_HA=2.174 d_AD=2.910 a_DHA=127.993 symop: x,y,z a_YAH=119 3923 3854 " H TYR C 73 "<>" O ALA C 69 " d_HA=2.479 d_AD=3.396 a_DHA=150.568 symop: x,y,z a_YAH=127 3903 3972 " H LYS C 76 "<>" O SER C 72 " d_HA=1.957 d_AD=2.965 a_DHA=170.721 symop: x,y,z a_YAH=153 3959 3881 " H ASP C 75 "<>" O LYS C 71 " d_HA=1.964 d_AD=2.959 a_DHA=165.260 symop: x,y,z a_YAH=169 3805 3869 " H MET C 70 "<>" O LYS C 66 " d_HA=2.159 d_AD=3.005 a_DHA=139.604 symop: x,y,z a_YAH=129 3827 3869 " H MET C 70 "<>" O GLU C 67 " d_HA=2.450 d_AD=3.108 a_DHA=121.917 symop: x,y,z a_YAH=97 3827 3887 " H LYS C 71 "<>" O GLU C 67 " d_HA=1.994 d_AD=2.959 a_DHA=157.397 symop: x,y,z a_YAH=153 1339 344 " HZ3 LYS A 83 "<>" OE2 GLU A 23 " d_HA=1.693 d_AD=2.701 a_DHA=166.626 symop: x,y,z a_YAH=110 2779 2842 " H PHE C 5 "<>" O SER C 1 " d_HA=2.620 d_AD=3.598 a_DHA=163.291 symop: x,y,z a_YAH=140 2779 2825 " H GLU C 4 "<>" O SER C 1 " d_HA=2.374 d_AD=3.076 a_DHA=125.774 symop: x,y,z a_YAH=141 2782 3831 " H1 SER C 1 "<>" OE1 GLU C 67 " d_HA=2.103 d_AD=2.786 a_DHA=122.642 symop: x,y,z a_YAH=128 2783 3832 " H2 SER C 1 "<>" OE2 GLU C 67 " d_HA=2.674 d_AD=3.424 a_DHA=130.891 symop: x,y,z a_YAH=96 2788 2823 " HG SER C 1 "<>" OE1 GLU C 4 " d_HA=2.001 d_AD=2.864 a_DHA=145.215 symop: x,y,z a_YAH=156 1206 2824 " HZ1 LYS A 76 "<>" OE2 GLU C 4 " d_HA=2.630 d_AD=3.579 a_DHA=155.019 symop: y-1,-x+1,z-1/4 a_YAH=111 305 359 " H MET A 24 "<>" O ALA A 20 " d_HA=2.077 d_AD=3.055 a_DHA=159.948 symop: x,y,z a_YAH=147 315 376 " H LEU A 25 "<>" O ASP A 21 " d_HA=1.950 d_AD=2.912 a_DHA=156.276 symop: x,y,z a_YAH=157 327 398 " H PHE A 26 "<>" O ASP A 22 " d_HA=2.037 d_AD=2.998 a_DHA=156.357 symop: x,y,z a_YAH=146 330 345 " H GLU A 23 "<>" OD1 ASP A 22 " d_HA=1.908 d_AD=2.827 a_DHA=147.958 symop: x,y,z a_YAH=113 2834 2900 " H ALA C 9 "<>" O PHE C 5 " d_HA=1.878 d_AD=2.874 a_DHA=166.078 symop: x,y,z a_YAH=167 2819 2890 " H ALA C 8 "<>" O GLU C 4 " d_HA=2.017 d_AD=2.997 a_DHA=161.610 symop: x,y,z a_YAH=145 2927 4070 " HZ2 LYS C 81 "<>" OE1 GLU C 11 " d_HA=1.682 d_AD=2.671 a_DHA=162.476 symop: x,y,z a_YAH=101 4009 4071 " HZ3 LYS C 81 "<>" OE2 GLU C 78 " d_HA=1.733 d_AD=2.699 a_DHA=155.425 symop: x,y,z a_YAH=96 3402 4008 "HD22 ASN C 40 "<>" OE1 GLU C 78 " d_HA=2.866 d_AD=3.800 a_DHA=153.271 symop: y-1,-x+1,z-1/4 a_YAH=156 3275 3328 " H THR C 35 "<>" O LYS C 32 " d_HA=2.436 d_AD=3.119 a_DHA=124.013 symop: x,y,z a_YAH=104 3275 3355 " H GLY C 37 "<>" O LYS C 32 " d_HA=2.962 d_AD=3.900 a_DHA=154.053 symop: x,y,z a_YAH=136 3275 3342 " H VAL C 36 "<>" O LYS C 32 " d_HA=1.883 d_AD=2.888 a_DHA=168.558 symop: x,y,z a_YAH=171 3205 3281 " H LYS C 32 "<>" O TYR C 28 " d_HA=1.968 d_AD=2.945 a_DHA=159.905 symop: x,y,z a_YAH=151 3237 3316 " H ALA C 34 "<>" O HIS C 30 " d_HA=1.960 d_AD=2.963 a_DHA=168.524 symop: x,y,z a_YAH=149 3254 3328 " H THR C 35 "<>" O TYR C 31 " d_HA=2.129 d_AD=3.022 a_DHA=145.746 symop: x,y,z a_YAH=144 3254 3331 " HG1 THR C 35 "<>" O TYR C 31 " d_HA=1.762 d_AD=2.735 a_DHA=176.236 symop: x,y,z a_YAH=134 3914 3992 " H VAL C 77 "<>" O TYR C 73 " d_HA=2.089 d_AD=2.969 a_DHA=143.753 symop: x,y,z a_YAH=138 3966 4039 " H LEU C 80 "<>" O LYS C 76 " d_HA=2.012 d_AD=2.941 a_DHA=150.690 symop: x,y,z a_YAH=146 3954 4025 " H GLU C 79 "<>" O ASP C 75 " d_HA=1.933 d_AD=2.929 a_DHA=164.833 symop: x,y,z a_YAH=156 3794 3856 " H ALA C 69 "<>" O SER C 65 " d_HA=1.876 d_AD=2.859 a_DHA=162.462 symop: x,y,z a_YAH=155 3842 3906 " H SER C 72 "<>" O ASP C 68 " d_HA=2.091 d_AD=3.104 a_DHA=177.825 symop: x,y,z a_YAH=153 1208 1247 " HZ3 LYS A 76 "<>" OE1 GLU A 79 " d_HA=1.754 d_AD=2.739 a_DHA=159.110 symop: x,y,z a_YAH=123 339 415 " H ILE A 27 "<>" O GLU A 23 " d_HA=1.947 d_AD=2.960 a_DHA=173.065 symop: x,y,z a_YAH=167 789 2857 " HZ2 LYS A 50 "<>" OD1 ASP C 6 " d_HA=2.307 d_AD=3.141 a_DHA=138.351 symop: x,y,z a_YAH=149 3186 3263 " H TYR C 31 "<>" O ILE C 27 " d_HA=1.977 d_AD=2.956 a_DHA=160.255 symop: x,y,z a_YAH=150 4019 4103 " H LYS C 83 "<>" O GLU C 79 " d_HA=2.075 d_AD=3.061 a_DHA=162.744 symop: x,y,z a_YAH=142 4034 4141 " H GLY C 85 "<>" O LEU C 80 " d_HA=2.698 d_AD=3.571 a_DHA=144.529 symop: x,y,z a_YAH=138 4034 4128 " H TYR C 84 "<>" O LEU C 80 " d_HA=1.894 d_AD=2.885 a_DHA=164.696 symop: x,y,z a_YAH=145 3310 3364 "HE22 GLN C 33 "<>" OD1 ASP C 38 " d_HA=2.023 d_AD=3.009 a_DHA=162.366 symop: x,y,z a_YAH=118 3364 3774 " H GLY C 63 "<>" OD1 ASP C 38 " d_HA=1.719 d_AD=2.724 a_DHA=169.638 symop: x,y,z a_YAH=139 3309 3780 "HE21 GLN C 33 "<>" O THR C 64 " d_HA=1.969 d_AD=2.979 a_DHA=172.464 symop: x,y,z a_YAH=135 3732 3784 " H THR C 64 "<>" O LEU C 61 " d_HA=1.904 d_AD=2.879 a_DHA=160.072 symop: x,y,z a_YAH=150 3732 3787 " HG1 THR C 64 "<>" O LEU C 61 " d_HA=1.854 d_AD=2.749 a_DHA=152.180 symop: x,y,z a_YAH=121 1159 1234 " H GLU A 78 "<>" O ILE A 74 " d_HA=1.766 d_AD=2.773 a_DHA=169.749 symop: x,y,z a_YAH=161 1178 1249 " H GLU A 79 "<>" O ASP A 75 " d_HA=1.952 d_AD=2.869 a_DHA=148.024 symop: x,y,z a_YAH=142 1190 1263 " H LEU A 80 "<>" O LYS A 76 " d_HA=1.960 d_AD=2.963 a_DHA=167.631 symop: x,y,z a_YAH=154 1212 1283 " H LYS A 81 "<>" O VAL A 77 " d_HA=1.915 d_AD=2.879 a_DHA=156.936 symop: x,y,z a_YAH=154 2092 2205 " HZ1 LYS B 52 "<>" O MET B 46 " d_HA=1.779 d_AD=2.697 a_DHA=147.593 symop: x,y,z a_YAH=108 2085 2133 " H ASP B 48 "<>" O GLY B 45 " d_HA=2.434 d_AD=3.350 a_DHA=150.429 symop: x,y,z a_YAH=148 704 818 " HZ2 LYS A 52 "<>" O MET A 46 " d_HA=1.948 d_AD=2.682 a_DHA=126.044 symop: x,y,z a_YAH=130 3769 4097 " HZ3 LYS C 62 "<>" O LYS C 83 " d_HA=2.962 d_AD=3.945 a_DHA=163.772 symop: y-1,-x+1,z-1/4 a_YAH=99 1233 1295 " HZ3 LYS A 81 "<>" OE2 GLU A 78 " d_HA=1.726 d_AD=2.741 a_DHA=169.121 symop: x,y,z a_YAH=104 112 166 " H VAL A 12 "<>" O ALA A 8 " d_HA=1.994 d_AD=2.999 a_DHA=168.581 symop: x,y,z a_YAH=152 151 1294 " HZ2 LYS A 81 "<>" OE1 GLU A 11 " d_HA=1.699 d_AD=2.679 a_DHA=159.317 symop: x,y,z a_YAH=106 147 205 " H ASN A 14 "<>" O GLU A 11 " d_HA=2.086 d_AD=3.062 a_DHA=161.380 symop: x,y,z a_YAH=127 147 210 "HD22 ASN A 14 "<>" O GLU A 11 " d_HA=1.967 d_AD=2.886 a_DHA=149.720 symop: x,y,z a_YAH=113 162 219 " H LEU A 15 "<>" O VAL A 12 " d_HA=2.200 d_AD=3.168 a_DHA=159.756 symop: x,y,z a_YAH=122 90 153 " H GLU A 11 "<>" O LYS A 7 " d_HA=1.809 d_AD=2.803 a_DHA=165.662 symop: x,y,z a_YAH=157 90 138 " H GLU A 10 "<>" O LYS A 7 " d_HA=2.122 d_AD=2.898 a_DHA=131.695 symop: x,y,z a_YAH=105 132 184 " H LYS A 13 "<>" O GLU A 10 " d_HA=2.611 d_AD=3.476 a_DHA=143.313 symop: x,y,z a_YAH=104 196 136 " HZ3 LYS A 13 "<>" OE1 GLU A 10 " d_HA=1.935 d_AD=2.925 a_DHA=160.792 symop: x,y,z a_YAH=150 630 871 " HE1 TRP A 55 "<>" O THR A 41 " d_HA=1.916 d_AD=2.886 a_DHA=157.404 symop: x,y,z a_YAH=118 2792 2859 " H ASP C 6 "<>" O GLN C 2 " d_HA=1.978 d_AD=2.980 a_DHA=168.277 symop: x,y,z a_YAH=152 752 825 " H ALA A 53 "<>" O PHE A 49 " d_HA=1.894 d_AD=2.892 a_DHA=167.754 symop: x,y,z a_YAH=160 3373 3767 " HZ1 LYS C 62 "<>" O ILE C 39 " d_HA=2.943 d_AD=3.718 a_DHA=133.432 symop: x,y,z a_YAH=164 3693 3301 " HE1 TRP C 58 "<>" OE1 GLN C 33 " d_HA=2.294 d_AD=3.020 a_DHA=126.858 symop: x,y,z a_YAH=135 1360 343 " HH TYR A 84 "<>" OE1 GLU A 23 " d_HA=1.568 d_AD=2.548 a_DHA=169.198 symop: x,y,z a_YAH=116 371 457 " HG SER A 29 "<>" O LEU A 25 " d_HA=1.748 d_AD=2.716 a_DHA=171.643 symop: x,y,z a_YAH=130 371 453 " H SER A 29 "<>" O LEU A 25 " d_HA=1.878 d_AD=2.870 a_DHA=165.738 symop: x,y,z a_YAH=151 357 850 " HZ2 LYS A 54 "<>" SD MET A 24 " d_HA=2.645 d_AD=3.359 a_DHA=127.112 symop: x,y,z a_YAH=147 a_YAH=97 772 851 " HZ3 LYS A 54 "<>" O LYS A 50 " d_HA=2.847 d_AD=3.717 a_DHA=144.046 symop: x,y,z a_YAH=122 772 839 " H LYS A 54 "<>" O LYS A 50 " d_HA=2.643 d_AD=3.594 a_DHA=156.652 symop: x,y,z a_YAH=129 2866 2914 " H GLU C 10 "<>" O LYS C 7 " d_HA=2.040 d_AD=2.934 a_DHA=146.036 symop: x,y,z a_YAH=104 2866 2929 " H GLU C 11 "<>" O LYS C 7 " d_HA=1.872 d_AD=2.877 a_DHA=169.111 symop: x,y,z a_YAH=162 2888 2942 " H VAL C 12 "<>" O ALA C 8 " d_HA=2.124 d_AD=3.121 a_DHA=166.993 symop: x,y,z a_YAH=150 2908 2960 " H LYS C 13 "<>" O GLU C 10 " d_HA=2.058 d_AD=3.036 a_DHA=160.495 symop: x,y,z a_YAH=127 3677 3737 " H LEU C 61 "<>" O TRP C 58 " d_HA=2.117 d_AD=2.972 a_DHA=141.095 symop: x,y,z a_YAH=104 3226 3303 " H GLN C 33 "<>" O SER C 29 " d_HA=1.911 d_AD=2.925 a_DHA=176.366 symop: x,y,z a_YAH=150 3166 3244 " H HIS C 30 "<>" O PHE C 26 " d_HA=2.032 d_AD=3.026 a_DHA=165.171 symop: x,y,z a_YAH=149 3166 3248 " HD1 HIS C 30 "<>" O PHE C 26 " d_HA=1.835 d_AD=2.781 a_DHA=153.415 symop: x,y,z a_YAH=121 3796 3833 " H GLU C 67 "<>" OG SER C 65 " d_HA=2.492 d_AD=3.258 a_DHA=132.299 symop: x,y,z a_YAH=108 a_YAH=141 3801 3846 " HG SER C 65 "<>" OD2 ASP C 68 " d_HA=1.621 d_AD=2.610 a_DHA=170.508 symop: x,y,z a_YAH=122 1127 1196 " H LYS A 76 "<>" O SER A 72 " d_HA=2.066 d_AD=3.044 a_DHA=160.136 symop: x,y,z a_YAH=138 390 468 " H HIS A 30 "<>" O PHE A 26 " d_HA=1.962 d_AD=2.968 a_DHA=171.613 symop: x,y,z a_YAH=166 390 472 " HD1 HIS A 30 "<>" O PHE A 26 " d_HA=1.954 d_AD=2.787 a_DHA=137.689 symop: x,y,z a_YAH=121 354 438 " H TYR A 28 "<>" O MET A 24 " d_HA=1.982 d_AD=2.973 a_DHA=164.284 symop: x,y,z a_YAH=146 410 487 " H TYR A 31 "<>" O ILE A 27 " d_HA=2.027 d_AD=2.999 a_DHA=159.580 symop: x,y,z a_YAH=149 2912 2972 " HZ3 LYS C 13 "<>" OE1 GLU C 10 " d_HA=1.736 d_AD=2.618 a_DHA=141.411 symop: x,y,z a_YAH=113 2913 2971 " HZ2 LYS C 13 "<>" OE2 GLU C 10 " d_HA=2.129 d_AD=2.926 a_DHA=133.767 symop: x,y,z a_YAH=98 3413 3420 " HG1 THR C 41 "<>" O GLU C 42 " d_HA=2.469 d_AD=3.412 a_DHA=164.810 symop: x,y,z a_YAH=119 3609 3688 " H TRP C 58 "<>" O LYS C 54 " d_HA=2.218 d_AD=3.163 a_DHA=154.236 symop: x,y,z a_YAH=147 3147 3229 " H SER C 29 "<>" O LEU C 25 " d_HA=1.862 d_AD=2.870 a_DHA=170.252 symop: x,y,z a_YAH=161 3103 3174 " H PHE C 26 "<>" O ASP C 22 " d_HA=1.892 d_AD=2.883 a_DHA=163.620 symop: x,y,z a_YAH=152 3115 3191 " H ILE C 27 "<>" O GLU C 23 " d_HA=1.984 d_AD=2.987 a_DHA=168.132 symop: x,y,z a_YAH=159 3130 3214 " H TYR C 28 "<>" O MET C 24 " d_HA=1.958 d_AD=2.942 a_DHA=161.962 symop: x,y,z a_YAH=148 3120 4113 " HZ1 LYS C 83 "<>" OE2 GLU C 23 " d_HA=1.672 d_AD=2.682 a_DHA=166.995 symop: x,y,z a_YAH=131 1105 1183 " H ASP A 75 "<>" O LYS A 71 " d_HA=1.803 d_AD=2.806 a_DHA=169.162 symop: x,y,z a_YAH=166 1138 1216 " H VAL A 77 "<>" O TYR A 73 " d_HA=1.884 d_AD=2.841 a_DHA=155.497 symop: x,y,z a_YAH=148 2109 2148 " H PHE B 49 "<>" O LEU B 47 " d_HA=1.855 d_AD=2.724 a_DHA=141.322 symop: x,y,z a_YAH=108 2128 2195 " H LYS B 52 "<>" O ASP B 48 " d_HA=1.864 d_AD=2.867 a_DHA=167.797 symop: x,y,z a_YAH=150 3081 3135 " H MET C 24 "<>" O ALA C 20 " d_HA=1.933 d_AD=2.921 a_DHA=162.790 symop: x,y,z a_YAH=153 3083 3119 " H ALA C 20 "<>" OE1 GLU C 23 " d_HA=1.798 d_AD=2.799 a_DHA=167.014 symop: x,y,z a_YAH=150 3119 4136 " HH TYR C 84 "<>" OE1 GLU C 23 " d_HA=1.676 d_AD=2.660 a_DHA=176.507 symop: x,y,z a_YAH=112 43 114 " H ALA A 8 "<>" O GLU A 4 " d_HA=1.783 d_AD=2.776 a_DHA=165.130 symop: x,y,z a_YAH=152 58 124 " H ALA A 9 "<>" O PHE A 5 " d_HA=1.948 d_AD=2.943 a_DHA=164.737 symop: x,y,z a_YAH=162 2131 2183 " H GLY B 51 "<>" OD1 ASP B 48 " d_HA=1.868 d_AD=2.738 a_DHA=141.280 symop: x,y,z a_YAH=125 2025 2032 " HG1 THR B 41 "<>" O GLU B 42 " d_HA=2.441 d_AD=3.400 a_DHA=172.057 symop: x,y,z a_YAH=116 2018 2259 " HE1 TRP B 55 "<>" O THR B 41 " d_HA=1.801 d_AD=2.783 a_DHA=160.265 symop: x,y,z a_YAH=127 1524 1584 " HZ3 LYS B 13 "<>" OE1 GLU B 10 " d_HA=1.686 d_AD=2.710 a_DHA=175.092 symop: x,y,z a_YAH=133 1525 3564 " HZ1 LYS C 50 "<>" OE2 GLU B 10 " d_HA=1.782 d_AD=2.780 a_DHA=161.564 symop: x+1,y,z a_YAH=140 78 138 " H GLU A 10 "<>" O ASP A 6 " d_HA=2.545 d_AD=3.285 a_DHA=129.457 symop: x,y,z a_YAH=128 78 2178 " HZ3 LYS B 50 "<>" O ASP A 6 " d_HA=2.756 d_AD=3.574 a_DHA=137.979 symop: x,y,z a_YAH=136 96 33 " H LYS A 7 "<>" O ALA A 3 " d_HA=2.112 d_AD=3.003 a_DHA=144.888 symop: x,y,z a_YAH=136 2176 137 " HZ1 LYS B 50 "<>" OE2 GLU A 10 " d_HA=1.739 d_AD=2.699 a_DHA=153.932 symop: x,y,z a_YAH=116 1469 3061 " HZ1 LYS C 18 "<>" OD1 ASP B 6 " d_HA=2.888 d_AD=3.603 a_DHA=128.077 symop: x+1,y,z a_YAH=95 1408 3063 " HZ3 LYS C 18 "<>" OE1 GLN B 2 " d_HA=1.777 d_AD=2.700 a_DHA=148.417 symop: x+1,y,z a_YAH=110 801 884 " H ASP A 56 "<>" O LYS A 52 " d_HA=1.905 d_AD=2.911 a_DHA=170.638 symop: x,y,z a_YAH=154 823 893 " H ALA A 57 "<>" O ALA A 53 " d_HA=2.009 d_AD=3.016 a_DHA=171.529 symop: x,y,z a_YAH=151 740 807 " H LYS A 52 "<>" O ASP A 48 " d_HA=1.881 d_AD=2.888 a_DHA=168.705 symop: x,y,z a_YAH=143 2938 2995 " H LEU C 15 "<>" O VAL C 12 " d_HA=2.726 d_AD=3.727 a_DHA=171.025 symop: x,y,z a_YAH=101 3015 4140 " H LYS C 16 "<>" O GLY C 85 " d_HA=1.862 d_AD=2.882 a_DHA=178.042 symop: x,y,z a_YAH=162 3701 3757 " H LYS C 62 "<>" O ASN C 59 " d_HA=2.382 d_AD=3.380 a_DHA=169.020 symop: x,y,z a_YAH=112 1243 1305 " H LYS A 82 "<>" O GLU A 79 " d_HA=2.532 d_AD=3.177 a_DHA=121.181 symop: x,y,z a_YAH=103 1243 1327 " H LYS A 83 "<>" O GLU A 79 " d_HA=2.084 d_AD=3.091 a_DHA=171.484 symop: x,y,z a_YAH=148 1305 1228 " H LYS A 82 "<>" O GLU A 78 " d_HA=2.507 d_AD=3.456 a_DHA=155.864 symop: x,y,z a_YAH=137 452 472 " HD1 HIS A 30 "<>" OG SER A 29 " d_HA=2.494 d_AD=3.266 a_DHA=132.712 symop: x,y,z a_YAH=133 a_YAH=98 833 912 " H TRP A 58 "<>" O LYS A 54 " d_HA=2.111 d_AD=3.031 a_DHA=149.891 symop: x,y,z a_YAH=144 794 866 " H TRP A 55 "<>" O GLY A 51 " d_HA=2.111 d_AD=3.098 a_DHA=164.552 symop: x,y,z a_YAH=158 743 795 " H GLY A 51 "<>" OD1 ASP A 48 " d_HA=1.839 d_AD=2.776 a_DHA=151.238 symop: x,y,z a_YAH=116 2923 2981 " H ASN C 14 "<>" O GLU C 11 " d_HA=1.992 d_AD=2.929 a_DHA=152.236 symop: x,y,z a_YAH=125 3026 4152 " HZ2 LYS C 16 "<>" OXT ILE C 86 " d_HA=1.687 d_AD=2.694 a_DHA=165.922 symop: x,y,z a_YAH=96 3406 3647 " HE1 TRP C 55 "<>" O THR C 41 " d_HA=1.982 d_AD=2.935 a_DHA=154.326 symop: x,y,z a_YAH=118 3631 3688 " H TRP C 58 "<>" O TRP C 55 " d_HA=2.457 d_AD=3.096 a_DHA=120.364 symop: x,y,z a_YAH=108 3631 3706 " H ASN C 59 "<>" O TRP C 55 " d_HA=1.875 d_AD=2.843 a_DHA=158.480 symop: x,y,z a_YAH=154 3655 3721 " H GLN C 60 "<>" O ASP C 56 " d_HA=2.069 d_AD=2.984 a_DHA=148.726 symop: x,y,z a_YAH=148 1277 1365 " H GLY A 85 "<>" O LYS A 81 " d_HA=2.464 d_AD=3.152 a_DHA=124.659 symop: x,y,z a_YAH=128 1299 1365 " H GLY A 85 "<>" O LYS A 82 " d_HA=2.864 d_AD=3.659 a_DHA=136.001 symop: x,y,z a_YAH=93 1258 1352 " H TYR A 84 "<>" O LEU A 80 " d_HA=2.045 d_AD=3.030 a_DHA=163.631 symop: x,y,z a_YAH=159 239 1364 " H LYS A 16 "<>" O GLY A 85 " d_HA=2.560 d_AD=3.576 a_DHA=176.161 symop: x,y,z a_YAH=166 1066 1134 " HG SER A 72 "<>" O ASP A 68 " d_HA=1.759 d_AD=2.729 a_DHA=173.490 symop: x,y,z a_YAH=133 1066 1130 " H SER A 72 "<>" O ASP A 68 " d_HA=1.915 d_AD=2.917 a_DHA=171.011 symop: x,y,z a_YAH=158 429 505 " H LYS A 32 "<>" O TYR A 28 " d_HA=1.971 d_AD=2.963 a_DHA=164.324 symop: x,y,z a_YAH=159 450 527 " H GLN A 33 "<>" O SER A 29 " d_HA=1.972 d_AD=2.976 a_DHA=170.432 symop: x,y,z a_YAH=154 3577 3660 " H ASP C 56 "<>" O LYS C 52 " d_HA=1.851 d_AD=2.862 a_DHA=175.186 symop: x,y,z a_YAH=162 3599 3669 " H ALA C 57 "<>" O ALA C 53 " d_HA=2.052 d_AD=3.009 a_DHA=156.772 symop: x,y,z a_YAH=148 1400 1435 " HG SER B 1 "<>" OE1 GLU B 4 " d_HA=1.536 d_AD=2.534 a_DHA=170.620 symop: x,y,z a_YAH=141 1051 1111 " H LYS A 71 "<>" O GLU A 67 " d_HA=1.887 d_AD=2.868 a_DHA=160.858 symop: x,y,z a_YAH=158 1078 1147 " H TYR A 73 "<>" O ALA A 69 " d_HA=1.894 d_AD=2.849 a_DHA=155.945 symop: x,y,z a_YAH=155 1088 1164 " H ILE A 74 "<>" O MET A 70 " d_HA=2.155 d_AD=3.095 a_DHA=153.313 symop: x,y,z a_YAH=135 461 540 " H ALA A 34 "<>" O HIS A 30 " d_HA=1.921 d_AD=2.881 a_DHA=156.551 symop: x,y,z a_YAH=153 478 552 " H THR A 35 "<>" O TYR A 31 " d_HA=2.112 d_AD=3.059 a_DHA=155.179 symop: x,y,z a_YAH=150 478 555 " HG1 THR A 35 "<>" O TYR A 31 " d_HA=1.890 d_AD=2.852 a_DHA=170.413 symop: x,y,z a_YAH=133 2140 2213 " H ALA B 53 "<>" O PHE B 49 " d_HA=1.979 d_AD=2.963 a_DHA=163.335 symop: x,y,z a_YAH=144 2066 2271 "HH21 ARG B 43 "<>" OD2 ASP B 56 " d_HA=1.804 d_AD=2.771 a_DHA=153.199 symop: x,y,z a_YAH=92 2063 2270 " HE ARG B 43 "<>" OD1 ASP B 56 " d_HA=1.787 d_AD=2.774 a_DHA=159.606 symop: x,y,z a_YAH=139 3516 3583 " H LYS C 52 "<>" O ASP C 48 " d_HA=1.928 d_AD=2.910 a_DHA=161.824 symop: x,y,z a_YAH=143 3528 3601 " H ALA C 53 "<>" O PHE C 49 " d_HA=1.981 d_AD=2.978 a_DHA=167.200 symop: x,y,z a_YAH=147 3548 3615 " H LYS C 54 "<>" O LYS C 50 " d_HA=2.158 d_AD=3.156 a_DHA=167.436 symop: x,y,z a_YAH=151 3570 3642 " H TRP C 55 "<>" O GLY C 51 " d_HA=1.863 d_AD=2.844 a_DHA=161.865 symop: x,y,z a_YAH=155 1943 3095 " HG1 THR B 35 "<>" OD2 ASP C 21 " d_HA=2.374 d_AD=3.343 a_DHA=176.043 symop: x+1,y,z a_YAH=107 3091 3152 " H LEU C 25 "<>" O ASP C 21 " d_HA=2.036 d_AD=3.005 a_DHA=158.007 symop: x,y,z a_YAH=150 1638 2764 " HZ2 LYS B 16 "<>" OXT ILE B 86 " d_HA=1.834 d_AD=2.860 a_DHA=172.827 symop: x,y,z a_YAH=92 2665 2753 " H GLY B 85 "<>" O LYS B 81 " d_HA=2.340 d_AD=3.045 a_DHA=126.013 symop: x,y,z a_YAH=115 2621 2681 " HZ1 LYS B 81 "<>" OE2 GLU B 78 " d_HA=1.646 d_AD=2.654 a_DHA=168.934 symop: x,y,z a_YAH=130 12 1055 " HG SER A 1 "<>" OE1 GLU A 67 " d_HA=1.896 d_AD=2.880 a_DHA=172.476 symop: x,y,z a_YAH=103 2160 2227 " H LYS B 54 "<>" O LYS B 50 " d_HA=2.562 d_AD=3.497 a_DHA=153.704 symop: x,y,z a_YAH=128 2160 2239 " HZ3 LYS B 54 "<>" O LYS B 50 " d_HA=2.717 d_AD=3.603 a_DHA=145.802 symop: x,y,z a_YAH=122 2182 2254 " H TRP B 55 "<>" O GLY B 51 " d_HA=1.965 d_AD=2.969 a_DHA=171.289 symop: x,y,z a_YAH=155 2189 2272 " H ASP B 56 "<>" O LYS B 52 " d_HA=1.782 d_AD=2.794 a_DHA=178.085 symop: x,y,z a_YAH=170 2243 2318 " H ASN B 59 "<>" O TRP B 55 " d_HA=1.994 d_AD=2.957 a_DHA=157.485 symop: x,y,z a_YAH=154 3519 3571 " H GLY C 51 "<>" OD1 ASP C 48 " d_HA=1.853 d_AD=2.811 a_DHA=154.971 symop: x,y,z a_YAH=125 1936 2435 " HZ3 LYS B 66 "<>" O THR B 35 " d_HA=1.995 d_AD=2.823 a_DHA=136.617 symop: x,y,z a_YAH=120 2646 2740 " H TYR B 84 "<>" O LEU B 80 " d_HA=1.936 d_AD=2.927 a_DHA=165.535 symop: x,y,z a_YAH=158 2687 2753 " H GLY B 85 "<>" O LYS B 82 " d_HA=2.969 d_AD=3.701 a_DHA=130.116 symop: x,y,z a_YAH=90 2616 2705 " HZ3 LYS B 82 "<>" O GLU B 78 " d_HA=2.364 d_AD=3.091 a_DHA=127.650 symop: x,y,z a_YAH=114 2616 2693 " H LYS B 82 "<>" O GLU B 78 " d_HA=2.222 d_AD=3.141 a_DHA=149.690 symop: x,y,z a_YAH=141 2631 2715 " H LYS B 83 "<>" O GLU B 79 " d_HA=1.839 d_AD=2.847 a_DHA=171.065 symop: x,y,z a_YAH=152 2547 2622 " H GLU B 78 "<>" O ILE B 74 " d_HA=1.885 d_AD=2.879 a_DHA=164.142 symop: x,y,z a_YAH=160 2566 2637 " H GLU B 79 "<>" O ASP B 75 " d_HA=2.187 d_AD=3.138 a_DHA=154.551 symop: x,y,z a_YAH=141 7 47 " H2 SER A 1 "<>" OE1 GLU A 4 " d_HA=1.904 d_AD=2.802 a_DHA=145.281 symop: x,y,z a_YAH=91 3 66 " H PHE A 5 "<>" O SER A 1 " d_HA=1.966 d_AD=2.961 a_DHA=165.838 symop: x,y,z a_YAH=160 16 83 " H ASP A 6 "<>" O GLN A 2 " d_HA=1.848 d_AD=2.865 a_DHA=177.435 symop: x,y,z a_YAH=152 1572 1520 " H LYS B 13 "<>" O GLU B 10 " d_HA=2.328 d_AD=3.281 a_DHA=156.069 symop: x,y,z a_YAH=116 2635 2596 " HZ3 LYS B 76 "<>" OE1 GLU B 79 " d_HA=1.685 d_AD=2.705 a_DHA=170.720 symop: x,y,z a_YAH=103 925 981 " H LYS A 62 "<>" O ASN A 59 " d_HA=2.390 d_AD=3.364 a_DHA=161.838 symop: x,y,z a_YAH=108 879 945 " H GLN A 60 "<>" O ASP A 56 " d_HA=2.175 d_AD=3.026 a_DHA=140.455 symop: x,y,z a_YAH=153 879 951 "HE21 GLN A 60 "<>" O ASP A 56 " d_HA=1.956 d_AD=2.937 a_DHA=161.642 symop: x,y,z a_YAH=117 956 1008 " H THR A 64 "<>" O LEU A 61 " d_HA=1.945 d_AD=2.871 a_DHA=150.428 symop: x,y,z a_YAH=152 956 1011 " HG1 THR A 64 "<>" O LEU A 61 " d_HA=1.889 d_AD=2.790 a_DHA=153.459 symop: x,y,z a_YAH=125 855 930 " H ASN A 59 "<>" O TRP A 55 " d_HA=1.888 d_AD=2.866 a_DHA=160.944 symop: x,y,z a_YAH=155 901 961 " H LEU A 61 "<>" O TRP A 58 " d_HA=2.056 d_AD=3.024 a_DHA=159.104 symop: x,y,z a_YAH=113 1025 1070 " HG SER A 65 "<>" OD2 ASP A 68 " d_HA=1.695 d_AD=2.666 a_DHA=165.544 symop: x,y,z a_YAH=111 1018 1080 " H ALA A 69 "<>" O SER A 65 " d_HA=1.923 d_AD=2.935 a_DHA=174.800 symop: x,y,z a_YAH=165 525 917 " HE1 TRP A 58 "<>" OE1 GLN A 33 " d_HA=2.209 d_AD=3.015 a_DHA=134.027 symop: x,y,z a_YAH=153 533 1004 "HE21 GLN A 33 "<>" O THR A 64 " d_HA=2.136 d_AD=3.122 a_DHA=165.408 symop: x,y,z a_YAH=117 3451 3658 " HE ARG C 43 "<>" OD1 ASP C 56 " d_HA=1.695 d_AD=2.705 a_DHA=167.604 symop: x,y,z a_YAH=129 3454 3659 "HH21 ARG C 43 "<>" OD2 ASP C 56 " d_HA=1.693 d_AD=2.693 a_DHA=161.219 symop: x,y,z a_YAH=102 1539 2683 " HZ3 LYS B 81 "<>" OE1 GLU B 11 " d_HA=1.741 d_AD=2.711 a_DHA=157.466 symop: x,y,z a_YAH=94 1478 1541 " H GLU B 11 "<>" O LYS B 7 " d_HA=1.850 d_AD=2.855 a_DHA=169.277 symop: x,y,z a_YAH=157 1478 1526 " H GLU B 10 "<>" O LYS B 7 " d_HA=2.013 d_AD=2.874 a_DHA=141.206 symop: x,y,z a_YAH=104 1421 1484 " H LYS B 7 "<>" O ALA B 3 " d_HA=2.068 d_AD=2.964 a_DHA=145.830 symop: x,y,z a_YAH=133 1431 1502 " H ALA B 8 "<>" O GLU B 4 " d_HA=2.029 d_AD=3.027 a_DHA=167.175 symop: x,y,z a_YAH=139 1391 1437 " H GLU B 4 "<>" O SER B 1 " d_HA=1.845 d_AD=2.784 a_DHA=152.625 symop: x,y,z a_YAH=164 1391 1454 " H PHE B 5 "<>" O SER B 1 " d_HA=2.989 d_AD=3.858 a_DHA=145.007 symop: x,y,z a_YAH=113 250 1376 " HZ2 LYS A 16 "<>" OXT ILE A 86 " d_HA=1.716 d_AD=2.693 a_DHA=157.826 symop: x,y,z a_YAH=96 1020 1057 " H GLU A 67 "<>" OG SER A 65 " d_HA=2.877 d_AD=3.492 a_DHA=120.091 symop: x,y,z a_YAH=90 a_YAH=159 1020 1071 " H ASP A 68 "<>" OG SER A 65 " d_HA=1.814 d_AD=2.809 a_DHA=165.949 symop: x,y,z a_YAH=142 a_YAH=97 1029 1093 " H MET A 70 "<>" O LYS A 66 " d_HA=2.004 d_AD=2.988 a_DHA=161.953 symop: x,y,z a_YAH=135 499 579 " H GLY A 37 "<>" O LYS A 32 " d_HA=2.467 d_AD=3.442 a_DHA=161.911 symop: x,y,z a_YAH=139 499 566 " H VAL A 36 "<>" O LYS A 32 " d_HA=1.845 d_AD=2.826 a_DHA=162.109 symop: x,y,z a_YAH=155 516 1707 " HZ2 LYS A 32 "<>" OD2 ASP B 21 " d_HA=2.991 d_AD=3.835 a_DHA=140.541 symop: x,y,z a_YAH=158 1950 2433 " HZ1 LYS B 66 "<>" O VAL B 36 " d_HA=1.971 d_AD=2.916 a_DHA=152.910 symop: x,y,z a_YAH=112 1627 2752 " H LYS B 16 "<>" O GLY B 85 " d_HA=2.058 d_AD=3.073 a_DHA=174.232 symop: x,y,z a_YAH=143 28 1091 "HE21 GLN A 2 "<>" SD MET A 70 " d_HA=2.684 d_AD=3.394 a_DHA=127.691 symop: x,y,z a_YAH=143 a_YAH=108 2211 2281 " H ALA B 57 "<>" O ALA B 53 " d_HA=2.195 d_AD=3.132 a_DHA=153.293 symop: x,y,z a_YAH=135 2221 2300 " H TRP B 58 "<>" O LYS B 54 " d_HA=2.085 d_AD=3.062 a_DHA=160.738 symop: x,y,z a_YAH=160 2267 2339 "HE21 GLN B 60 "<>" O ASP B 56 " d_HA=1.937 d_AD=2.936 a_DHA=167.930 symop: x,y,z a_YAH=137 2267 2333 " H GLN B 60 "<>" O ASP B 56 " d_HA=2.241 d_AD=3.128 a_DHA=145.470 symop: x,y,z a_YAH=147 2289 2349 " H LEU B 61 "<>" O TRP B 58 " d_HA=2.181 d_AD=3.065 a_DHA=144.922 symop: x,y,z a_YAH=110 2313 2369 " H LYS B 62 "<>" O ASN B 59 " d_HA=2.223 d_AD=3.215 a_DHA=165.754 symop: x,y,z a_YAH=119 3473 3521 " H ASP C 48 "<>" O GLY C 45 " d_HA=2.112 d_AD=3.104 a_DHA=165.587 symop: x,y,z a_YAH=160 3480 3594 " HZ2 LYS C 52 "<>" O MET C 46 " d_HA=1.916 d_AD=2.801 a_DHA=143.213 symop: x,y,z a_YAH=109 3497 3536 " H PHE C 49 "<>" O LEU C 47 " d_HA=1.959 d_AD=2.800 a_DHA=137.960 symop: x,y,z a_YAH=109 1866 1940 " H THR B 35 "<>" O TYR B 31 " d_HA=2.102 d_AD=2.989 a_DHA=144.633 symop: x,y,z a_YAH=144 1887 1940 " H THR B 35 "<>" O LYS B 32 " d_HA=2.605 d_AD=3.238 a_DHA=120.285 symop: x,y,z a_YAH=93 1887 1954 " H VAL B 36 "<>" O LYS B 32 " d_HA=2.002 d_AD=2.889 a_DHA=144.441 symop: x,y,z a_YAH=148 1887 1967 " H GLY B 37 "<>" O LYS B 32 " d_HA=2.457 d_AD=3.420 a_DHA=158.147 symop: x,y,z a_YAH=139 2578 2651 " H LEU B 80 "<>" O LYS B 76 " d_HA=1.855 d_AD=2.849 a_DHA=164.111 symop: x,y,z a_YAH=160 2600 2671 " H LYS B 81 "<>" O VAL B 77 " d_HA=1.824 d_AD=2.800 a_DHA=159.421 symop: x,y,z a_YAH=152 2526 2604 " H VAL B 77 "<>" O TYR B 73 " d_HA=1.866 d_AD=2.861 a_DHA=164.906 symop: x,y,z a_YAH=150 2466 2535 " H TYR B 73 "<>" O ALA B 69 " d_HA=2.155 d_AD=3.142 a_DHA=163.378 symop: x,y,z a_YAH=157 2476 2552 " H ILE B 74 "<>" O MET B 70 " d_HA=2.439 d_AD=3.346 a_DHA=148.320 symop: x,y,z a_YAH=139 2493 2571 " H ASP B 75 "<>" O LYS B 71 " d_HA=2.021 d_AD=3.023 a_DHA=168.145 symop: x,y,z a_YAH=163 2493 2552 " H ILE B 74 "<>" O LYS B 71 " d_HA=2.295 d_AD=2.990 a_DHA=124.521 symop: x,y,z a_YAH=108 2515 2584 " H LYS B 76 "<>" O SER B 72 " d_HA=1.916 d_AD=2.874 a_DHA=156.109 symop: x,y,z a_YAH=143 2439 2499 " H LYS B 71 "<>" O GLU B 67 " d_HA=2.098 d_AD=3.030 a_DHA=151.564 symop: x,y,z a_YAH=148 2454 2518 " H SER B 72 "<>" O ASP B 68 " d_HA=2.133 d_AD=3.141 a_DHA=171.148 symop: x,y,z a_YAH=154 2408 2459 " H ASP B 68 "<>" OG SER B 65 " d_HA=1.918 d_AD=2.922 a_DHA=169.990 symop: x,y,z a_YAH=146 a_YAH=99 2413 2458 " HG SER B 65 "<>" OD2 ASP B 68 " d_HA=1.732 d_AD=2.676 a_DHA=159.501 symop: x,y,z a_YAH=108 1719 1733 " H GLU B 23 "<>" OD2 ASP B 22 " d_HA=2.000 d_AD=2.879 a_DHA=142.966 symop: x,y,z a_YAH=96 20 1675 " HZ3 LYS B 18 "<>" OE1 GLN A 2 " d_HA=1.735 d_AD=2.737 a_DHA=164.174 symop: x,y,z a_YAH=150 1913 2305 " HE1 TRP B 58 "<>" OE1 GLN B 33 " d_HA=2.204 d_AD=3.013 a_DHA=134.712 symop: x,y,z a_YAH=135 1922 1976 "HE22 GLN B 33 "<>" OD1 ASP B 38 " d_HA=1.801 d_AD=2.773 a_DHA=157.160 symop: x,y,z a_YAH=147 1976 2386 " H GLY B 63 "<>" OD1 ASP B 38 " d_HA=1.882 d_AD=2.874 a_DHA=163.677 symop: x,y,z a_YAH=100 1798 1875 " H TYR B 31 "<>" O ILE B 27 " d_HA=1.982 d_AD=2.888 a_DHA=147.257 symop: x,y,z a_YAH=135 1849 1928 " H ALA B 34 "<>" O HIS B 30 " d_HA=1.966 d_AD=2.962 a_DHA=166.255 symop: x,y,z a_YAH=149 1046 2458 " HZ2 LYS A 66 "<>" OD2 ASP B 68 " d_HA=1.940 d_AD=2.809 a_DHA=140.354 symop: y,-x+1,z-1/4 a_YAH=97 1693 1747 " H MET B 24 "<>" O ALA B 20 " d_HA=1.952 d_AD=2.943 a_DHA=162.974 symop: x,y,z a_YAH=162 1715 1764 " H LEU B 25 "<>" O ASP B 22 " d_HA=2.254 d_AD=2.925 a_DHA=122.020 symop: x,y,z a_YAH=106 1715 1786 " H PHE B 26 "<>" O ASP B 22 " d_HA=1.830 d_AD=2.836 a_DHA=169.491 symop: x,y,z a_YAH=164 928 991 " HZ1 LYS A 62 "<>" OD1 ASN A 59 " d_HA=2.553 d_AD=3.322 a_DHA=132.157 symop: x,y,z a_YAH=154 871 630 " HE1 TRP A 55 "<>" O THR A 41 " d_HA=1.916 d_AD=2.886 a_DHA=157.404 symop: x,y,z a_YAH=118 534 588 "HE22 GLN A 33 "<>" OD1 ASP A 38 " d_HA=1.742 d_AD=2.752 a_DHA=168.447 symop: x,y,z a_YAH=140 588 998 " H GLY A 63 "<>" OD1 ASP A 38 " d_HA=1.769 d_AD=2.768 a_DHA=166.119 symop: x,y,z a_YAH=105 578 917 " HE1 TRP A 58 "<>" O GLY A 37 " d_HA=2.155 d_AD=3.021 a_DHA=140.691 symop: x,y,z a_YAH=144 33 96 " H LYS A 7 "<>" O ALA A 3 " d_HA=2.112 d_AD=3.003 a_DHA=144.888 symop: x,y,z a_YAH=136 136 196 " HZ3 LYS A 13 "<>" OE1 GLU A 10 " d_HA=1.935 d_AD=2.925 a_DHA=160.792 symop: x,y,z a_YAH=150 137 2176 " HZ1 LYS B 50 "<>" OE2 GLU A 10 " d_HA=1.739 d_AD=2.699 a_DHA=153.932 symop: x,y,z a_YAH=116 1520 1572 " H LYS B 13 "<>" O GLU B 10 " d_HA=2.328 d_AD=3.281 a_DHA=156.069 symop: x,y,z a_YAH=116 1404 1454 " H PHE B 5 "<>" O GLN B 2 " d_HA=2.462 d_AD=3.152 a_DHA=125.227 symop: x,y,z a_YAH=91 1404 1471 " H ASP B 6 "<>" O GLN B 2 " d_HA=1.858 d_AD=2.868 a_DHA=174.436 symop: x,y,z a_YAH=159 1535 1593 " H ASN B 14 "<>" O GLU B 11 " d_HA=1.888 d_AD=2.889 a_DHA=167.915 symop: x,y,z a_YAH=135 1550 1607 " H LEU B 15 "<>" O VAL B 12 " d_HA=2.877 d_AD=3.797 a_DHA=152.001 symop: x,y,z a_YAH=107 1500 1554 " H VAL B 12 "<>" O ALA B 8 " d_HA=1.942 d_AD=2.951 a_DHA=170.753 symop: x,y,z a_YAH=158 1446 1512 " H ALA B 9 "<>" O PHE B 5 " d_HA=1.924 d_AD=2.916 a_DHA=164.540 symop: x,y,z a_YAH=155 2596 2635 " HZ3 LYS B 76 "<>" OE1 GLU B 79 " d_HA=1.685 d_AD=2.705 a_DHA=170.720 symop: x,y,z a_YAH=103 1703 1764 " H LEU B 25 "<>" O ASP B 21 " d_HA=2.195 d_AD=3.042 a_DHA=139.351 symop: x,y,z a_YAH=136 1764 1715 " H LEU B 25 "<>" O ASP B 22 " d_HA=2.254 d_AD=2.925 a_DHA=122.020 symop: x,y,z a_YAH=106 2344 2399 " HG1 THR B 64 "<>" O LEU B 61 " d_HA=1.676 d_AD=2.617 a_DHA=161.228 symop: x,y,z a_YAH=123 2344 2396 " H THR B 64 "<>" O LEU B 61 " d_HA=1.932 d_AD=2.814 a_DHA=143.699 symop: x,y,z a_YAH=149 1742 1826 " H TYR B 28 "<>" O MET B 24 " d_HA=2.192 d_AD=3.108 a_DHA=149.302 symop: x,y,z a_YAH=130 1817 1893 " H LYS B 32 "<>" O TYR B 28 " d_HA=2.005 d_AD=2.998 a_DHA=164.095 symop: x,y,z a_YAH=152 1838 1915 " H GLN B 33 "<>" O SER B 29 " d_HA=1.931 d_AD=2.942 a_DHA=174.670 symop: x,y,z a_YAH=162 2305 1913 " HE1 TRP B 58 "<>" OE1 GLN B 33 " d_HA=2.204 d_AD=3.013 a_DHA=134.712 symop: x,y,z a_YAH=135 1966 2305 " HE1 TRP B 58 "<>" O GLY B 37 " d_HA=2.378 d_AD=3.194 a_DHA=135.951 symop: x,y,z a_YAH=149 1621 1978 " H ASP B 38 "<>" O LYS B 16 " d_HA=1.930 d_AD=2.917 a_DHA=163.308 symop: y,-x+1,z-1/4 a_YAH=153 2417 2481 " H MET B 70 "<>" O LYS B 66 " d_HA=1.855 d_AD=2.851 a_DHA=165.510 symop: x,y,z a_YAH=153 2406 2468 " H ALA B 69 "<>" O SER B 65 " d_HA=2.096 d_AD=3.057 a_DHA=157.346 symop: x,y,z a_YAH=148 1695 1731 " H ALA B 20 "<>" OE1 GLU B 23 " d_HA=1.895 d_AD=2.881 a_DHA=162.503 symop: x,y,z a_YAH=147 1731 2748 " HH TYR B 84 "<>" OE1 GLU B 23 " d_HA=1.620 d_AD=2.606 a_DHA=177.078 symop: x,y,z a_YAH=119 1732 2726 " HZ2 LYS B 83 "<>" OE2 GLU B 23 " d_HA=1.669 d_AD=2.671 a_DHA=163.986 symop: x,y,z a_YAH=127 1860 1778 " HD1 HIS B 30 "<>" O PHE B 26 " d_HA=1.854 d_AD=2.777 a_DHA=149.410 symop: x,y,z a_YAH=117 2399 2344 " HG1 THR B 64 "<>" O LEU B 61 " d_HA=1.676 d_AD=2.617 a_DHA=161.228 symop: x,y,z a_YAH=123 1747 1693 " H MET B 24 "<>" O ALA B 20 " d_HA=1.952 d_AD=2.943 a_DHA=162.974 symop: x,y,z a_YAH=162 1759 1841 " H SER B 29 "<>" O LEU B 25 " d_HA=1.778 d_AD=2.785 a_DHA=169.480 symop: x,y,z a_YAH=168 1786 1715 " H PHE B 26 "<>" O ASP B 22 " d_HA=1.830 d_AD=2.836 a_DHA=169.491 symop: x,y,z a_YAH=164 1778 1856 " H HIS B 30 "<>" O PHE B 26 " d_HA=1.992 d_AD=2.981 a_DHA=163.860 symop: x,y,z a_YAH=153 1778 1860 " HD1 HIS B 30 "<>" O PHE B 26 " d_HA=1.854 d_AD=2.777 a_DHA=149.410 symop: x,y,z a_YAH=117 1921 2392 "HE21 GLN B 33 "<>" O THR B 64 " d_HA=2.196 d_AD=3.127 a_DHA=153.083 symop: x,y,z a_YAH=123 1803 1727 " H ILE B 27 "<>" O GLU B 23 " d_HA=1.981 d_AD=2.991 a_DHA=170.667 symop: x,y,z a_YAH=148 1727 1803 " H ILE B 27 "<>" O GLU B 23 " d_HA=1.981 d_AD=2.991 a_DHA=170.667 symop: x,y,z a_YAH=148 ------------------------------------------------------------------------------- Total: 378 Symmetry: 0 Per residue: 1.4651 Mean SD Skew Kurtosis theta_1: 143.260 23.022 -0.436 1.865 theta_2: 128.858 24.515 -0.071 1.573 d_HA: 2.337 0.320 0.428 1.968 38 1517 " HH TYR A 135 "<>" O PRO A 43 " d_HA=1.691 d_AD=2.651 a_DHA=167.041 symop: x,y,z a_YAH=135 451 1611 " H THR A 142 "<>" O PHE A 69 " d_HA=2.342 d_AD=3.275 a_DHA=152.476 symop: x,y,z a_YAH=130 540 595 " H LYS A 78 "<>" O ALA A 74 " d_HA=2.677 d_AD=3.538 a_DHA=142.851 symop: x,y,z a_YAH=148 3134 3468 " H ASN B 102 "<>" O VAL B 124 " d_HA=1.844 d_AD=2.859 a_DHA=176.485 symop: x,y,z a_YAH=166 3233 3298 " H PHE B 113 "<>" O ALA B 109 " d_HA=2.122 d_AD=3.136 a_DHA=176.174 symop: x,y,z a_YAH=154 55 285 " H SER A 58 "<>" OD1 ASN A 44 " d_HA=2.019 d_AD=2.883 a_DHA=141.384 symop: x,y,z a_YAH=148 55 74 " H PHE A 45 "<>" OD1 ASN A 44 " d_HA=2.637 d_AD=3.358 a_DHA=128.204 symop: x,y,z a_YAH=92 284 61 "HD21 ASN A 44 "<>" OG SER A 58 " d_HA=2.715 d_AD=3.374 a_DHA=122.204 symop: x,y,z a_YAH=116 a_YAH=130 437 978 " H VAL A 101 "<>" O ASN A 68 " d_HA=2.041 d_AD=2.809 a_DHA=130.498 symop: x,y,z a_YAH=140 248 298 " H ASP A 59 "<>" O GLU A 56 " d_HA=2.185 d_AD=3.097 a_DHA=148.762 symop: x,y,z a_YAH=110 966 1299 " H ALA A 100 "<>" O PRO A 122 " d_HA=1.903 d_AD=2.916 a_DHA=172.641 symop: x,y,z a_YAH=162 2590 3750 " H THR B 142 "<>" O PHE B 69 " d_HA=2.309 d_AD=3.285 a_DHA=160.863 symop: x,y,z a_YAH=137 2598 3746 " H PHE B 69 "<>" O THR B 142 " d_HA=1.918 d_AD=2.911 a_DHA=164.585 symop: x,y,z a_YAH=168 2679 2720 " H ALA B 77 "<>" O ALA B 74 " d_HA=2.008 d_AD=2.858 a_DHA=140.028 symop: x,y,z a_YAH=129 2679 2734 " H LYS B 78 "<>" O ALA B 74 " d_HA=2.981 d_AD=3.828 a_DHA=141.488 symop: x,y,z a_YAH=139 1243 1188 " H GLY A 118 "<>" O LYS A 115 " d_HA=2.582 d_AD=3.556 a_DHA=161.962 symop: x,y,z a_YAH=100 1253 1171 " H VAL A 119 "<>" O MET A 114 " d_HA=2.073 d_AD=3.070 a_DHA=167.392 symop: x,y,z a_YAH=147 3974 3764 " H THR B 143 "<>" O VAL B 156 " d_HA=1.875 d_AD=2.872 a_DHA=166.598 symop: x,y,z a_YAH=148 4280 199 " HZ1 LYS A 53 "<>" O GLU B 176 " d_HA=2.625 d_AD=3.337 a_DHA=127.038 symop: x,y,z a_YAH=162 3026 4284 "HE22 GLN B 94 "<>" OE1 GLU B 176 " d_HA=2.117 d_AD=2.999 a_DHA=143.246 symop: x,y,z a_YAH=93 2275 2316 " H GLY B 52 "<>" O ASP B 49 " d_HA=1.872 d_AD=2.852 a_DHA=160.926 symop: x,y,z a_YAH=121 2241 2373 " H ILE B 55 "<>" O LEU B 47 " d_HA=1.825 d_AD=2.813 a_DHA=163.427 symop: x,y,z a_YAH=166 2260 3489 " H LEU B 125 "<>" O GLU B 48 " d_HA=2.170 d_AD=3.142 a_DHA=159.471 symop: x,y,z a_YAH=158 2368 2246 " H LEU B 47 "<>" O ILE B 55 " d_HA=2.203 d_AD=3.191 a_DHA=163.660 symop: x,y,z a_YAH=146 2407 2205 " H LEU B 57 "<>" O PHE B 45 " d_HA=2.095 d_AD=3.052 a_DHA=156.040 symop: x,y,z a_YAH=159 2200 2423 "HD21 ASN B 44 "<>" OG SER B 58 " d_HA=1.832 d_AD=2.751 a_DHA=149.239 symop: x,y,z a_YAH=127 a_YAH=113 2392 2428 " HG SER B 58 "<>" OE2 GLU B 56 " d_HA=1.869 d_AD=2.698 a_DHA=140.466 symop: x,y,z a_YAH=118 3266 3192 " H HIS B 111 "<>" O LYS B 107 " d_HA=1.946 d_AD=2.938 a_DHA=165.066 symop: x,y,z a_YAH=149 3132 3172 " H GLU B 105 "<>" OD1 ASN B 102 " d_HA=2.078 d_AD=3.031 a_DHA=155.304 symop: x,y,z a_YAH=165 418 1643 " H PHE A 144 "<>" O LEU A 67 " d_HA=1.808 d_AD=2.810 a_DHA=168.428 symop: x,y,z a_YAH=154 459 1607 " H PHE A 69 "<>" O THR A 142 " d_HA=1.876 d_AD=2.887 a_DHA=172.374 symop: x,y,z a_YAH=160 2177 3656 " HH TYR B 135 "<>" O PRO B 43 " d_HA=1.691 d_AD=2.661 a_DHA=172.403 symop: x,y,z a_YAH=126 3507 3603 " H LEU B 132 "<>" OD2 ASP B 126 " d_HA=1.883 d_AD=2.855 a_DHA=158.350 symop: x,y,z a_YAH=141 3129 3508 " H ASP B 126 "<>" O ASN B 102 " d_HA=2.006 d_AD=2.953 a_DHA=154.168 symop: x,y,z a_YAH=159 3129 3160 " H GLY B 104 "<>" O ASN B 102 " d_HA=2.445 d_AD=3.240 a_DHA=134.853 symop: x,y,z a_YAH=103 2645 3171 " H THR B 72 "<>" OE2 GLU B 105 " d_HA=1.717 d_AD=2.714 a_DHA=165.713 symop: x,y,z a_YAH=124 2648 3170 " HG1 THR B 72 "<>" OE1 GLU B 105 " d_HA=1.602 d_AD=2.564 a_DHA=162.108 symop: x,y,z a_YAH=109 3138 3171 "HD21 ASN B 102 "<>" OE2 GLU B 105 " d_HA=1.858 d_AD=2.863 a_DHA=166.055 symop: x,y,z a_YAH=118 398 952 " H VAL A 99 "<>" O PHE A 66 " d_HA=2.074 d_AD=3.082 a_DHA=172.431 symop: x,y,z a_YAH=142 442 948 " H ASN A 68 "<>" O VAL A 99 " d_HA=2.004 d_AD=2.962 a_DHA=156.415 symop: x,y,z a_YAH=139 565 639 " H GLU A 80 "<>" O PRO A 76 " d_HA=1.832 d_AD=2.846 a_DHA=175.444 symop: x,y,z a_YAH=167 565 617 " H LYS A 79 "<>" O PRO A 76 " d_HA=2.392 d_AD=3.058 a_DHA=122.549 symop: x,y,z a_YAH=108 579 656 " H PHE A 81 "<>" O ALA A 77 " d_HA=2.106 d_AD=3.066 a_DHA=157.387 symop: x,y,z a_YAH=128 550 595 " H LYS A 78 "<>" O GLU A 75 " d_HA=2.525 d_AD=3.295 a_DHA=132.458 symop: x,y,z a_YAH=99 550 617 " H LYS A 79 "<>" O GLU A 75 " d_HA=2.469 d_AD=3.386 a_DHA=150.348 symop: x,y,z a_YAH=148 3582 3648 " H TYR B 135 "<>" O VAL B 131 " d_HA=2.361 d_AD=3.114 a_DHA=130.315 symop: x,y,z a_YAH=141 2621 3113 " H TRP B 70 "<>" O VAL B 101 " d_HA=2.081 d_AD=3.023 a_DHA=153.245 symop: x,y,z a_YAH=166 2610 3147 " H VAL B 103 "<>" O TRP B 70 " d_HA=2.011 d_AD=2.992 a_DHA=161.368 symop: x,y,z a_YAH=165 2634 2681 " H ALA B 74 "<>" O GLY B 71 " d_HA=2.153 d_AD=3.138 a_DHA=164.529 symop: x,y,z a_YAH=117 282 330 " H LYS A 61 "<>" O SER A 58 " d_HA=2.467 d_AD=3.402 a_DHA=153.552 symop: x,y,z a_YAH=111 263 310 " H LEU A 60 "<>" O LEU A 57 " d_HA=2.249 d_AD=3.136 a_DHA=145.434 symop: x,y,z a_YAH=107 648 722 " H ALA A 85 "<>" O PHE A 81 " d_HA=1.905 d_AD=2.901 a_DHA=165.483 symop: x,y,z a_YAH=155 2655 2695 " H GLU B 75 "<>" O TRP B 73 " d_HA=2.651 d_AD=3.283 a_DHA=120.575 symop: x,y,z a_YAH=109 2655 2896 "HE22 GLN B 87 "<>" O TRP B 73 " d_HA=2.484 d_AD=3.457 a_DHA=160.190 symop: x+1/2,-y+1/2,-z a_YAH=165 2694 2745 " HZ2 LYS B 78 "<>" OE2 GLU B 75 " d_HA=1.773 d_AD=2.719 a_DHA=151.329 symop: x,y,z a_YAH=123 778 919 " HH TYR A 88 "<>" OE2 GLU A 97 " d_HA=1.551 d_AD=2.543 a_DHA=176.987 symop: x,y,z a_YAH=145 919 934 " H ILE A 98 "<>" OE2 GLU A 97 " d_HA=2.426 d_AD=3.335 a_DHA=148.414 symop: x,y,z a_YAH=115 3699 3753 " HG1 THR B 142 "<>" O PRO B 139 " d_HA=2.458 d_AD=3.202 a_DHA=136.680 symop: x,y,z a_YAH=156 2878 3713 "HD21 ASN B 86 "<>" O LEU B 140 " d_HA=1.879 d_AD=2.820 a_DHA=153.081 symop: x-1/2,-y+1/2,-z a_YAH=141 3718 4060 " H LEU B 140 "<>" OE1 GLU B 162 " d_HA=2.418 d_AD=3.356 a_DHA=152.701 symop: x+1/2,-y+1/2,-z a_YAH=101 2869 2927 " H LYS B 89 "<>" O ASN B 86 " d_HA=2.310 d_AD=3.203 a_DHA=146.157 symop: x,y,z a_YAH=109 2883 2950 " H HIS B 90 "<>" O GLN B 87 " d_HA=2.045 d_AD=2.948 a_DHA=147.330 symop: x,y,z a_YAH=120 2883 2968 " H PHE B 91 "<>" O GLN B 87 " d_HA=2.052 d_AD=2.992 a_DHA=153.428 symop: x,y,z a_YAH=159 3017 4254 " HZ2 LYS B 173 "<>" OE1 GLN B 94 " d_HA=1.816 d_AD=2.752 a_DHA=151.126 symop: x,y,z a_YAH=152 4253 4286 " HZ1 LYS B 173 "<>" OXT GLU B 176 " d_HA=1.728 d_AD=2.706 a_DHA=157.528 symop: x,y,z a_YAH=157 2872 2939 " HZ3 LYS B 89 "<>" OD1 ASN B 86 " d_HA=2.086 d_AD=2.879 a_DHA=132.721 symop: x,y,z a_YAH=155 2900 2986 " H LYS B 92 "<>" O TYR B 88 " d_HA=2.128 d_AD=3.071 a_DHA=153.693 symop: x,y,z a_YAH=133 2943 3005 " H SER B 93 "<>" O HIS B 90 " d_HA=2.652 d_AD=3.462 a_DHA=137.000 symop: x,y,z a_YAH=128 2960 3019 " H GLN B 94 "<>" O PHE B 91 " d_HA=1.983 d_AD=2.917 a_DHA=152.564 symop: x,y,z a_YAH=100 2960 3041 " H VAL B 96 "<>" O PHE B 91 " d_HA=2.063 d_AD=3.036 a_DHA=159.744 symop: x,y,z a_YAH=156 3002 3025 "HE21 GLN B 94 "<>" O SER B 93 " d_HA=2.562 d_AD=3.526 a_DHA=161.058 symop: x,y,z a_YAH=109 532 4285 " HE1 TRP A 73 "<>" OE2 GLU B 176 " d_HA=2.952 d_AD=3.830 a_DHA=144.639 symop: -x,y-1/2,-z+1/2 a_YAH=156 1459 1509 " H TYR A 135 "<>" O LEU A 132 " d_HA=2.134 d_AD=3.014 a_DHA=144.143 symop: x,y,z a_YAH=107 1459 1537 " H VAL A 137 "<>" O LEU A 132 " d_HA=2.551 d_AD=3.561 a_DHA=177.165 symop: x,y,z a_YAH=141 1478 1526 " H ASP A 136 "<>" O ASP A 133 " d_HA=2.768 d_AD=3.722 a_DHA=157.972 symop: x,y,z a_YAH=92 1426 1492 " H ALA A 134 "<>" O GLN A 130 " d_HA=2.068 d_AD=2.951 a_DHA=144.337 symop: x,y,z a_YAH=133 2278 2328 " H LYS B 53 "<>" OD1 ASP B 49 " d_HA=2.156 d_AD=3.134 a_DHA=160.286 symop: x,y,z a_YAH=127 2278 2306 " H ASN B 51 "<>" OD1 ASP B 49 " d_HA=1.979 d_AD=2.895 a_DHA=148.243 symop: x,y,z a_YAH=122 2278 2311 "HD22 ASN B 51 "<>" OD1 ASP B 49 " d_HA=2.053 d_AD=2.979 a_DHA=149.453 symop: x,y,z a_YAH=90 2291 3452 " H THR B 50 "<>" O VAL B 123 " d_HA=2.310 d_AD=3.144 a_DHA=138.697 symop: x,y,z a_YAH=160 2280 2322 " H ASP B 49 "<>" O LYS B 53 " d_HA=1.943 d_AD=2.944 a_DHA=168.956 symop: x,y,z a_YAH=132 2393 2436 " H GLU B 56 "<>" OD2 ASP B 59 " d_HA=2.534 d_AD=3.476 a_DHA=154.162 symop: x,y,z a_YAH=126 2387 2437 " H ASP B 59 "<>" O GLU B 56 " d_HA=2.217 d_AD=3.113 a_DHA=146.399 symop: x,y,z a_YAH=107 2424 2194 " H SER B 58 "<>" OD1 ASN B 44 " d_HA=2.432 d_AD=3.309 a_DHA=143.991 symop: x,y,z a_YAH=123 2421 2469 " H LYS B 61 "<>" O SER B 58 " d_HA=2.449 d_AD=3.411 a_DHA=158.854 symop: x,y,z a_YAH=111 2980 3031 " H GLY B 95 "<>" O LYS B 92 " d_HA=2.456 d_AD=3.352 a_DHA=147.773 symop: x,y,z a_YAH=101 1368 1464 " H LEU A 132 "<>" OD2 ASP A 126 " d_HA=1.837 d_AD=2.779 a_DHA=151.985 symop: x,y,z a_YAH=146 1443 1509 " H TYR A 135 "<>" O VAL A 131 " d_HA=2.556 d_AD=3.222 a_DHA=122.979 symop: x,y,z a_YAH=133 1447 1367 " H VAL A 131 "<>" OD1 ASP A 126 " d_HA=1.996 d_AD=3.007 a_DHA=168.943 symop: x,y,z a_YAH=97 2402 2449 " H LEU B 60 "<>" O LEU B 57 " d_HA=2.246 d_AD=3.171 a_DHA=150.895 symop: x,y,z a_YAH=114 1736 30 " H ALA A 42 "<>" O GLY A 150 " d_HA=2.135 d_AD=3.100 a_DHA=158.285 symop: x,y,z a_YAH=163 1655 1785 " H VAL A 153 "<>" O LEU A 145 " d_HA=1.909 d_AD=2.920 a_DHA=171.462 symop: x,y,z a_YAH=170 1655 1803 " H LYS A 154 "<>" O LEU A 145 " d_HA=2.747 d_AD=3.659 a_DHA=149.745 symop: x,y,z a_YAH=135 638 1891 " H MET A 160 "<>" OE2 GLU A 80 " d_HA=1.817 d_AD=2.833 a_DHA=172.101 symop: x,y,z a_YAH=107 1785 1655 " H VAL A 153 "<>" O LEU A 145 " d_HA=1.909 d_AD=2.920 a_DHA=171.462 symop: x,y,z a_YAH=170 1946 1907 " H THR A 161 "<>" SD MET A 164 " d_HA=2.429 d_AD=3.436 a_DHA=175.639 symop: x,y,z a_YAH=100 a_YAH=119 3565 3631 " H ALA B 134 "<>" O GLN B 130 " d_HA=1.920 d_AD=2.862 a_DHA=153.256 symop: x,y,z a_YAH=144 3586 3506 " H VAL B 131 "<>" OD1 ASP B 126 " d_HA=2.031 d_AD=3.039 a_DHA=169.071 symop: x,y,z a_YAH=102 1693 1737 " H GLY A 150 "<>" O ASN A 147 " d_HA=1.899 d_AD=2.882 a_DHA=160.512 symop: x,y,z a_YAH=131 1698 1743 " H ASN A 147 "<>" O LYS A 151 " d_HA=2.042 d_AD=3.029 a_DHA=164.658 symop: x,y,z a_YAH=150 382 1679 " H ILE A 146 "<>" O VAL A 65 " d_HA=1.883 d_AD=2.877 a_DHA=164.093 symop: x,y,z a_YAH=159 386 1674 " H VAL A 65 "<>" O ILE A 146 " d_HA=1.796 d_AD=2.798 a_DHA=168.952 symop: x,y,z a_YAH=142 423 1635 " H LEU A 67 "<>" O PHE A 144 " d_HA=2.028 d_AD=2.994 a_DHA=157.517 symop: x,y,z a_YAH=162 699 3569 " HH TYR A 83 "<>" OE1 GLN B 130 " d_HA=1.700 d_AD=2.670 a_DHA=172.126 symop: -x+1,y-1/2,-z+1/2 a_YAH=106 3533 3577 "HE21 GLN B 130 "<>" OD2 ASP B 128 " d_HA=1.770 d_AD=2.733 a_DHA=154.560 symop: x,y,z a_YAH=95 1803 1655 " H LYS A 154 "<>" O LEU A 145 " d_HA=2.747 d_AD=3.659 a_DHA=149.745 symop: x,y,z a_YAH=135 3617 3665 " H ASP B 136 "<>" O ASP B 133 " d_HA=2.215 d_AD=3.191 a_DHA=161.168 symop: x,y,z a_YAH=106 3598 3648 " H TYR B 135 "<>" O LEU B 132 " d_HA=2.422 d_AD=3.239 a_DHA=137.189 symop: x,y,z a_YAH=100 3598 3676 " H VAL B 137 "<>" O LEU B 132 " d_HA=2.158 d_AD=3.153 a_DHA=166.026 symop: x,y,z a_YAH=153 3541 3622 " H ASP B 133 "<>" O ARG B 129 " d_HA=2.201 d_AD=3.211 a_DHA=173.473 symop: x,y,z a_YAH=150 2671 4060 " HE1 TRP B 73 "<>" OE1 GLU B 162 " d_HA=1.806 d_AD=2.831 a_DHA=173.187 symop: x+1/2,-y+1/2,-z a_YAH=110 4071 4140 " H ASP B 167 "<>" O SER B 163 " d_HA=2.054 d_AD=3.070 a_DHA=178.100 symop: x,y,z a_YAH=155 324 4195 "HD22 ASN B 170 "<>" O LYS A 61 " d_HA=2.935 d_AD=3.767 a_DHA=140.287 symop: x,y,z a_YAH=137 347 1707 " H GLY A 62 "<>" O PRO A 148 " d_HA=1.996 d_AD=3.001 a_DHA=170.197 symop: x,y,z a_YAH=131 305 359 " H LYS A 63 "<>" O LEU A 60 " d_HA=2.137 d_AD=3.077 a_DHA=152.823 symop: x,y,z a_YAH=138 375 920 " H GLU A 97 "<>" O GLY A 64 " d_HA=1.767 d_AD=2.761 a_DHA=165.546 symop: x,y,z a_YAH=158 406 914 " H PHE A 66 "<>" O GLU A 97 " d_HA=1.794 d_AD=2.811 a_DHA=178.173 symop: x,y,z a_YAH=167 682 750 " H GLN A 87 "<>" O TYR A 83 " d_HA=1.876 d_AD=2.893 a_DHA=177.213 symop: x,y,z a_YAH=165 703 770 " H TYR A 88 "<>" O MET A 84 " d_HA=1.859 d_AD=2.810 a_DHA=154.555 symop: x,y,z a_YAH=145 633 708 " H MET A 84 "<>" O GLU A 80 " d_HA=1.867 d_AD=2.880 a_DHA=172.820 symop: x,y,z a_YAH=164 4056 4125 " H HIS B 166 "<>" O GLU B 162 " d_HA=1.928 d_AD=2.908 a_DHA=161.174 symop: x,y,z a_YAH=155 4099 4173 " H MET B 169 "<>" O ILE B 165 " d_HA=2.080 d_AD=2.970 a_DHA=145.055 symop: x,y,z a_YAH=142 4118 4173 " H MET B 169 "<>" O HIS B 166 " d_HA=2.465 d_AD=3.119 a_DHA=121.569 symop: x,y,z a_YAH=100 4118 4190 " H ASN B 170 "<>" O HIS B 166 " d_HA=1.954 d_AD=2.934 a_DHA=160.743 symop: x,y,z a_YAH=157 4135 4204 " H LEU B 171 "<>" O ASP B 167 " d_HA=2.069 d_AD=3.023 a_DHA=155.349 symop: x,y,z a_YAH=148 4185 4243 " H LYS B 173 "<>" O ASN B 170 " d_HA=2.729 d_AD=3.613 a_DHA=145.821 symop: x,y,z a_YAH=93 841 892 " H GLY A 95 "<>" O LYS A 92 " d_HA=2.159 d_AD=3.120 a_DHA=158.036 symop: x,y,z a_YAH=114 761 847 " H LYS A 92 "<>" O TYR A 88 " d_HA=1.948 d_AD=2.937 a_DHA=163.043 symop: x,y,z a_YAH=145 720 788 " H LYS A 89 "<>" O ALA A 85 " d_HA=2.490 d_AD=3.385 a_DHA=146.916 symop: x,y,z a_YAH=137 720 1274 "HD21 ASN A 120 "<>" O ALA A 85 " d_HA=2.174 d_AD=3.070 a_DHA=146.956 symop: x,y,z a_YAH=132 668 735 " H ASN A 86 "<>" O PRO A 82 " d_HA=2.044 d_AD=2.990 a_DHA=153.893 symop: x,y,z a_YAH=144 2879 4061 "HD22 ASN B 86 "<>" OE2 GLU B 162 " d_HA=1.784 d_AD=2.781 a_DHA=162.559 symop: x,y,z a_YAH=130 4060 2671 " HE1 TRP B 73 "<>" OE1 GLU B 162 " d_HA=1.806 d_AD=2.831 a_DHA=173.187 symop: x-1/2,-y+1/2,-z a_YAH=110 2821 2889 " H GLN B 87 "<>" O TYR B 83 " d_HA=1.874 d_AD=2.888 a_DHA=174.225 symop: x,y,z a_YAH=168 2842 2909 " H TYR B 88 "<>" O MET B 84 " d_HA=1.817 d_AD=2.794 a_DHA=160.283 symop: x,y,z a_YAH=156 4168 4223 " H ILE B 172 "<>" O MET B 169 " d_HA=2.682 d_AD=3.382 a_DHA=126.411 symop: x,y,z a_YAH=101 4168 4243 " H LYS B 173 "<>" O MET B 169 " d_HA=2.355 d_AD=3.074 a_DHA=127.042 symop: x,y,z a_YAH=150 2807 2874 " H ASN B 86 "<>" O PRO B 82 " d_HA=1.968 d_AD=2.842 a_DHA=142.579 symop: x,y,z a_YAH=143 2859 2927 " H LYS B 89 "<>" O ALA B 85 " d_HA=2.879 d_AD=3.600 a_DHA=128.608 symop: x,y,z a_YAH=125 2859 3413 "HD21 ASN B 120 "<>" O ALA B 85 " d_HA=1.891 d_AD=2.856 a_DHA=156.965 symop: x,y,z a_YAH=130 2515 3030 " H GLY B 64 "<>" O GLY B 95 " d_HA=2.184 d_AD=3.095 a_DHA=149.240 symop: x,y,z a_YAH=146 1418 3865 " HE ARG A 129 "<>" OE2 GLU B 149 " d_HA=2.417 d_AD=3.126 a_DHA=126.269 symop: -x,y-1/2,-z+1/2 a_YAH=157 1422 4259 "HH22 ARG A 129 "<>" O PRO B 174 " d_HA=1.940 d_AD=2.934 a_DHA=165.470 symop: -x,y-1/2,-z+1/2 a_YAH=137 1402 1483 " H ASP A 133 "<>" O ARG A 129 " d_HA=2.207 d_AD=3.214 a_DHA=171.024 symop: x,y,z a_YAH=148 1049 2432 " HG SER A 106 "<>" O ASP B 59 " d_HA=2.504 d_AD=3.397 a_DHA=153.141 symop: -x,y-1/2,-z+1/2 a_YAH=129 1044 1096 " H ALA A 109 "<>" OG SER A 106 " d_HA=2.511 d_AD=3.472 a_DHA=158.020 symop: x,y,z a_YAH=128 a_YAH=123 2908 2996 " HZ1 LYS B 92 "<>" OH TYR B 88 " d_HA=2.843 d_AD=3.521 a_DHA=124.792 symop: x,y,z a_YAH=129 a_YAH=117 2917 3057 " HH TYR B 88 "<>" OE1 GLU B 97 " d_HA=1.547 d_AD=2.542 a_DHA=177.444 symop: x,y,z a_YAH=127 1419 1004 "HH11 ARG A 129 "<>" O VAL A 103 " d_HA=2.907 d_AD=3.642 a_DHA=130.441 symop: x,y,z a_YAH=136 2444 2498 " H LYS B 63 "<>" O LEU B 60 " d_HA=2.141 d_AD=3.071 a_DHA=151.391 symop: x,y,z a_YAH=133 1907 1946 " H THR A 161 "<>" SD MET A 164 " d_HA=2.429 d_AD=3.436 a_DHA=175.639 symop: x,y,z a_YAH=100 a_YAH=119 3503 3549 " H ARG B 129 "<>" O ASP B 126 " d_HA=1.992 d_AD=2.944 a_DHA=155.156 symop: x,y,z a_YAH=111 3506 3586 " H VAL B 131 "<>" OD1 ASP B 126 " d_HA=2.031 d_AD=3.039 a_DHA=169.071 symop: x,y,z a_YAH=102 1660 1797 " H LEU A 145 "<>" O LYS A 154 " d_HA=1.874 d_AD=2.884 a_DHA=172.944 symop: x,y,z a_YAH=167 1621 1839 " H VAL A 156 "<>" O THR A 143 " d_HA=1.897 d_AD=2.855 a_DHA=155.855 symop: x,y,z a_YAH=154 1625 1835 " H THR A 143 "<>" O VAL A 156 " d_HA=1.821 d_AD=2.816 a_DHA=166.109 symop: x,y,z a_YAH=153 1696 1749 " H LYS A 151 "<>" OD1 ASN A 147 " d_HA=1.984 d_AD=2.922 a_DHA=151.421 symop: x,y,z a_YAH=166 1960 2034 " H MET A 169 "<>" O ILE A 165 " d_HA=1.973 d_AD=2.919 a_DHA=153.602 symop: x,y,z a_YAH=150 2008 2084 " H ILE A 172 "<>" O TYR A 168 " d_HA=2.711 d_AD=3.492 a_DHA=134.145 symop: x,y,z a_YAH=137 1943 2017 " H TYR A 168 "<>" O MET A 164 " d_HA=1.895 d_AD=2.879 a_DHA=162.002 symop: x,y,z a_YAH=156 1903 1965 " H ILE A 165 "<>" O THR A 161 " d_HA=1.974 d_AD=2.973 a_DHA=167.328 symop: x,y,z a_YAH=157 1905 1948 " H MET A 164 "<>" OG1 THR A 161 " d_HA=2.020 d_AD=2.979 a_DHA=156.434 symop: x,y,z a_YAH=138 a_YAH=112 20 3188 " HG SER B 106 "<>" OD2 ASP A 41 " d_HA=2.945 d_AD=3.872 a_DHA=160.385 symop: x-1/2,-y+1/2,-z a_YAH=144 3 1769 " H VAL A 152 "<>" O SER A 40 " d_HA=1.849 d_AD=2.772 a_DHA=150.130 symop: x,y,z a_YAH=169 19 1760 " HZ2 LYS A 151 "<>" OD1 ASP A 41 " d_HA=1.726 d_AD=2.637 a_DHA=145.750 symop: x,y,z a_YAH=132 8 1765 " H3 SER A 40 "<>" O VAL A 152 " d_HA=2.166 d_AD=3.080 a_DHA=148.640 symop: x,y,z a_YAH=138 4042 4104 " H ILE B 165 "<>" O THR B 161 " d_HA=2.020 d_AD=2.993 a_DHA=159.655 symop: x,y,z a_YAH=153 4044 4087 " H MET B 164 "<>" OG1 THR B 161 " d_HA=2.003 d_AD=2.954 a_DHA=155.721 symop: x,y,z a_YAH=125 a_YAH=119 376 891 " H GLY A 64 "<>" O GLY A 95 " d_HA=2.042 d_AD=3.006 a_DHA=158.411 symop: x,y,z a_YAH=157 2029 2084 " H ILE A 172 "<>" O MET A 169 " d_HA=2.636 d_AD=3.473 a_DHA=140.008 symop: x,y,z a_YAH=99 2029 2104 " H LYS A 173 "<>" O MET A 169 " d_HA=2.484 d_AD=3.126 a_DHA=120.800 symop: x,y,z a_YAH=142 1917 1986 " H HIS A 166 "<>" O GLU A 162 " d_HA=1.895 d_AD=2.897 a_DHA=169.157 symop: x,y,z a_YAH=156 756 1922 "HE21 GLN A 87 "<>" OE2 GLU A 162 " d_HA=1.778 d_AD=2.787 a_DHA=168.312 symop: x,y,z a_YAH=114 4082 4156 " H TYR B 168 "<>" O MET B 164 " d_HA=1.896 d_AD=2.878 a_DHA=161.800 symop: x,y,z a_YAH=148 4147 4223 " H ILE B 172 "<>" O TYR B 168 " d_HA=2.822 d_AD=3.720 a_DHA=148.065 symop: x,y,z a_YAH=131 821 880 " H GLN A 94 "<>" O PHE A 91 " d_HA=2.328 d_AD=3.142 a_DHA=136.774 symop: x,y,z a_YAH=96 821 902 " H VAL A 96 "<>" O PHE A 91 " d_HA=2.185 d_AD=3.144 a_DHA=157.082 symop: x,y,z a_YAH=149 744 829 " H PHE A 91 "<>" O GLN A 87 " d_HA=1.868 d_AD=2.879 a_DHA=173.016 symop: x,y,z a_YAH=163 744 811 " H HIS A 90 "<>" O GLN A 87 " d_HA=2.251 d_AD=3.022 a_DHA=131.963 symop: x,y,z a_YAH=107 730 788 " H LYS A 89 "<>" O ASN A 86 " d_HA=2.601 d_AD=3.329 a_DHA=128.654 symop: x,y,z a_YAH=101 733 800 " HZ3 LYS A 89 "<>" OD1 ASN A 86 " d_HA=2.092 d_AD=3.007 a_DHA=147.933 symop: x,y,z a_YAH=149 740 1922 "HD22 ASN A 86 "<>" OE2 GLU A 162 " d_HA=1.811 d_AD=2.838 a_DHA=172.935 symop: x,y,z a_YAH=136 136 177 " H GLY A 52 "<>" O ASP A 49 " d_HA=2.069 d_AD=3.034 a_DHA=157.484 symop: x,y,z a_YAH=110 2772 2847 " H MET B 84 "<>" O GLU B 80 " d_HA=1.893 d_AD=2.909 a_DHA=178.000 symop: x,y,z a_YAH=164 863 3842 "HD22 ASN B 147 "<>" O SER A 93 " d_HA=1.919 d_AD=2.860 a_DHA=152.870 symop: x,y,z a_YAH=137 1075 1142 " H ASN A 112 "<>" O ILE A 108 " d_HA=1.990 d_AD=2.973 a_DHA=162.289 symop: x,y,z a_YAH=147 1094 1159 " H PHE A 113 "<>" O ALA A 109 " d_HA=2.076 d_AD=3.008 a_DHA=151.453 symop: x,y,z a_YAH=147 1042 1108 " H VAL A 110 "<>" O SER A 106 " d_HA=2.196 d_AD=3.206 a_DHA=171.720 symop: x,y,z a_YAH=172 1053 1127 " H HIS A 111 "<>" O LYS A 107 " d_HA=2.127 d_AD=3.115 a_DHA=163.763 symop: x,y,z a_YAH=139 121 1350 " H LEU A 125 "<>" O GLU A 48 " d_HA=2.143 d_AD=3.135 a_DHA=164.329 symop: x,y,z a_YAH=179 2787 2861 " H ALA B 85 "<>" O PHE B 81 " d_HA=1.862 d_AD=2.868 a_DHA=170.875 symop: x,y,z a_YAH=157 2545 3053 " H PHE B 66 "<>" O GLU B 97 " d_HA=1.891 d_AD=2.908 a_DHA=176.747 symop: x,y,z a_YAH=166 2514 3059 " H GLU B 97 "<>" O GLY B 64 " d_HA=1.842 d_AD=2.829 a_DHA=162.848 symop: x,y,z a_YAH=165 2525 3813 " H VAL B 65 "<>" O ILE B 146 " d_HA=1.822 d_AD=2.822 a_DHA=167.755 symop: x,y,z a_YAH=145 3832 3876 " H GLY B 150 "<>" O ASN B 147 " d_HA=1.878 d_AD=2.858 a_DHA=160.234 symop: x,y,z a_YAH=125 3835 3888 " H LYS B 151 "<>" OD1 ASN B 147 " d_HA=1.891 d_AD=2.857 a_DHA=156.883 symop: x,y,z a_YAH=154 509 1032 " HG1 THR A 72 "<>" OE2 GLU A 105 " d_HA=1.736 d_AD=2.695 a_DHA=162.552 symop: x,y,z a_YAH=114 993 1033 " H GLU A 105 "<>" OD1 ASN A 102 " d_HA=1.906 d_AD=2.870 a_DHA=157.504 symop: x,y,z a_YAH=165 1345 1380 " H THR A 127 "<>" O LEU A 125 " d_HA=2.385 d_AD=3.156 a_DHA=132.209 symop: x,y,z a_YAH=100 3327 3382 " H GLY B 118 "<>" O LYS B 115 " d_HA=2.379 d_AD=3.358 a_DHA=162.615 symop: x,y,z a_YAH=107 3310 3392 " H VAL B 119 "<>" O MET B 114 " d_HA=2.073 d_AD=3.046 a_DHA=159.941 symop: x,y,z a_YAH=151 3057 3073 " H ILE B 98 "<>" OE1 GLU B 97 " d_HA=2.180 d_AD=3.121 a_DHA=153.146 symop: x,y,z a_YAH=116 2486 3846 " H GLY B 62 "<>" O PRO B 148 " d_HA=1.959 d_AD=2.965 a_DHA=170.686 symop: x,y,z a_YAH=136 2498 2444 " H LYS B 63 "<>" O LEU B 60 " d_HA=2.141 d_AD=3.071 a_DHA=151.391 symop: x,y,z a_YAH=133 1394 1438 "HE21 GLN A 130 "<>" OD2 ASP A 128 " d_HA=1.755 d_AD=2.748 a_DHA=160.844 symop: x,y,z a_YAH=103 2996 2908 " HZ1 LYS B 92 "<>" OH TYR B 88 " d_HA=2.843 d_AD=3.521 a_DHA=124.792 symop: x,y,z a_YAH=129 a_YAH=117 1004 1419 "HH11 ARG A 129 "<>" O VAL A 103 " d_HA=2.907 d_AD=3.642 a_DHA=130.441 symop: x,y,z a_YAH=136 1364 1410 " H ARG A 129 "<>" O ASP A 126 " d_HA=1.965 d_AD=2.929 a_DHA=157.284 symop: x,y,z a_YAH=115 1367 1447 " H VAL A 131 "<>" OD1 ASP A 126 " d_HA=1.996 d_AD=3.007 a_DHA=168.943 symop: x,y,z a_YAH=97 3508 3129 " H ASP B 126 "<>" O ASN B 102 " d_HA=2.006 d_AD=2.953 a_DHA=154.168 symop: x,y,z a_YAH=159 3181 3247 " H VAL B 110 "<>" O SER B 106 " d_HA=2.008 d_AD=3.013 a_DHA=170.733 symop: x,y,z a_YAH=167 3183 3235 " H ALA B 109 "<>" OG SER B 106 " d_HA=2.160 d_AD=3.121 a_DHA=157.942 symop: x,y,z a_YAH=127 a_YAH=113 30 1736 " H ALA A 42 "<>" O GLY A 150 " d_HA=2.135 d_AD=3.100 a_DHA=158.285 symop: x,y,z a_YAH=163 1607 459 " H PHE A 69 "<>" O THR A 142 " d_HA=1.876 d_AD=2.887 a_DHA=172.374 symop: x,y,z a_YAH=160 1611 451 " H THR A 142 "<>" O PHE A 69 " d_HA=2.342 d_AD=3.275 a_DHA=152.476 symop: x,y,z a_YAH=130 2046 2104 " H LYS A 173 "<>" O ASN A 170 " d_HA=2.662 d_AD=3.566 a_DHA=148.700 symop: x,y,z a_YAH=94 1996 2065 " H LEU A 171 "<>" O ASP A 167 " d_HA=2.017 d_AD=2.929 a_DHA=148.221 symop: x,y,z a_YAH=142 1932 2001 " H ASP A 167 "<>" O SER A 163 " d_HA=2.131 d_AD=3.128 a_DHA=166.379 symop: x,y,z a_YAH=146 2000 2201 "HD22 ASN B 44 "<>" OD2 ASP A 167 " d_HA=1.907 d_AD=2.893 a_DHA=160.559 symop: -x+1,y-1/2,-z+1/2 a_YAH=126 1910 2191 " HG1 THR A 161 "<>" O ASN B 44 " d_HA=1.794 d_AD=2.683 a_DHA=149.747 symop: -x+1,y-1/2,-z+1/2 a_YAH=154 3484 3519 " H THR B 127 "<>" O LEU B 125 " d_HA=2.145 d_AD=3.003 a_DHA=140.904 symop: x,y,z a_YAH=101 1560 1614 " HG1 THR A 142 "<>" O PRO A 139 " d_HA=1.985 d_AD=2.874 a_DHA=152.183 symop: x,y,z a_YAH=115 1979 2051 " H ASN A 170 "<>" O HIS A 166 " d_HA=1.965 d_AD=2.945 a_DHA=161.273 symop: x,y,z a_YAH=156 2049 2116 " HZ3 LYS A 173 "<>" OD1 ASN A 170 " d_HA=2.630 d_AD=3.397 a_DHA=132.537 symop: x,y,z a_YAH=175 1990 1999 " HD1 HIS A 166 "<>" OD1 ASP A 167 " d_HA=2.302 d_AD=3.302 a_DHA=165.469 symop: x,y,z a_YAH=132 2777 4030 " H MET B 160 "<>" OE2 GLU B 80 " d_HA=1.775 d_AD=2.798 a_DHA=176.932 symop: x,y,z a_YAH=112 878 2115 " HZ2 LYS A 173 "<>" OE1 GLN A 94 " d_HA=1.932 d_AD=2.913 a_DHA=160.571 symop: x,y,z a_YAH=148 1120 1194 " H LYS A 115 "<>" O HIS A 111 " d_HA=1.949 d_AD=2.947 a_DHA=166.255 symop: x,y,z a_YAH=150 152 1313 " H THR A 50 "<>" O VAL A 123 " d_HA=2.400 d_AD=3.144 a_DHA=129.422 symop: x,y,z a_YAH=167 139 189 " H LYS A 53 "<>" OD1 ASP A 49 " d_HA=1.830 d_AD=2.813 a_DHA=160.624 symop: x,y,z a_YAH=130 139 167 " H ASN A 51 "<>" OD1 ASP A 49 " d_HA=2.081 d_AD=2.895 a_DHA=135.724 symop: x,y,z a_YAH=107 140 172 "HD22 ASN A 51 "<>" OD2 ASP A 49 " d_HA=2.302 d_AD=3.271 a_DHA=158.672 symop: x,y,z a_YAH=103 2734 2679 " H LYS B 78 "<>" O ALA B 74 " d_HA=2.981 d_AD=3.828 a_DHA=141.488 symop: x,y,z a_YAH=139 2704 2756 " H LYS B 79 "<>" O PRO B 76 " d_HA=2.168 d_AD=2.958 a_DHA=133.391 symop: x,y,z a_YAH=109 2704 2778 " H GLU B 80 "<>" O PRO B 76 " d_HA=1.839 d_AD=2.836 a_DHA=166.246 symop: x,y,z a_YAH=157 2557 3782 " H PHE B 144 "<>" O LEU B 67 " d_HA=1.814 d_AD=2.821 a_DHA=170.234 symop: x,y,z a_YAH=159 3794 3924 " H VAL B 153 "<>" O LEU B 145 " d_HA=1.863 d_AD=2.873 a_DHA=170.017 symop: x,y,z a_YAH=166 3794 3942 " H LYS B 154 "<>" O LEU B 145 " d_HA=2.807 d_AD=3.684 a_DHA=145.258 symop: x,y,z a_YAH=136 3799 3936 " H LEU B 145 "<>" O LYS B 154 " d_HA=1.893 d_AD=2.909 a_DHA=176.439 symop: x,y,z a_YAH=157 1137 1217 " HG SER A 116 "<>" O ASN A 112 " d_HA=1.834 d_AD=2.772 a_DHA=163.954 symop: x,y,z a_YAH=150 1137 1213 " H SER A 116 "<>" O ASN A 112 " d_HA=2.024 d_AD=2.976 a_DHA=155.570 symop: x,y,z a_YAH=140 1151 1230 " H TYR A 117 "<>" O PHE A 113 " d_HA=2.063 d_AD=3.036 a_DHA=160.175 symop: x,y,z a_YAH=161 1104 1176 " H MET A 114 "<>" O VAL A 110 " d_HA=1.834 d_AD=2.850 a_DHA=176.879 symop: x,y,z a_YAH=165 141 183 " H ASP A 49 "<>" O LYS A 53 " d_HA=1.946 d_AD=2.913 a_DHA=158.397 symop: x,y,z a_YAH=133 102 234 " H ILE A 55 "<>" O LEU A 47 " d_HA=1.805 d_AD=2.804 a_DHA=167.167 symop: x,y,z a_YAH=175 107 229 " H LEU A 47 "<>" O ILE A 55 " d_HA=2.188 d_AD=3.175 a_DHA=163.718 symop: x,y,z a_YAH=143 223 252 "HH12 ARG A 54 "<>" OE1 GLU A 56 " d_HA=2.563 d_AD=3.291 a_DHA=128.030 symop: x,y,z a_YAH=130 223 297 "HH12 ARG A 54 "<>" OD2 ASP A 59 " d_HA=2.656 d_AD=3.394 a_DHA=129.209 symop: x,y,z a_YAH=141 225 252 "HH22 ARG A 54 "<>" OE1 GLU A 56 " d_HA=1.692 d_AD=2.695 a_DHA=164.274 symop: x,y,z a_YAH=137 252 3377 " HH TYR B 117 "<>" OE1 GLU A 56 " d_HA=2.802 d_AD=3.634 a_DHA=144.891 symop: x-1/2,-y+1/2,-z a_YAH=136 2718 2795 " H PHE B 81 "<>" O ALA B 77 " d_HA=1.876 d_AD=2.862 a_DHA=162.839 symop: x,y,z a_YAH=143 3105 3438 " H ALA B 100 "<>" O PRO B 122 " d_HA=2.024 d_AD=3.032 a_DHA=170.630 symop: x,y,z a_YAH=157 2537 3091 " H VAL B 99 "<>" O PHE B 66 " d_HA=2.043 d_AD=3.056 a_DHA=173.841 symop: x,y,z a_YAH=133 2562 3774 " H LEU B 67 "<>" O PHE B 144 " d_HA=2.187 d_AD=3.100 a_DHA=148.913 symop: x,y,z a_YAH=172 2581 3087 " H ASN B 68 "<>" O VAL B 99 " d_HA=1.927 d_AD=2.919 a_DHA=164.782 symop: x,y,z a_YAH=146 2521 3818 " H ILE B 146 "<>" O VAL B 65 " d_HA=1.891 d_AD=2.884 a_DHA=164.193 symop: x,y,z a_YAH=156 2521 2562 " H LEU B 67 "<>" O VAL B 65 " d_HA=2.785 d_AD=3.411 a_DHA=120.313 symop: x,y,z a_YAH=98 3837 3882 " H ASN B 147 "<>" O LYS B 151 " d_HA=2.015 d_AD=3.013 a_DHA=167.135 symop: x,y,z a_YAH=153 506 1031 " H THR A 72 "<>" OE1 GLU A 105 " d_HA=1.718 d_AD=2.725 a_DHA=168.483 symop: x,y,z a_YAH=121 999 1031 "HD21 ASN A 102 "<>" OE1 GLU A 105 " d_HA=1.971 d_AD=2.959 a_DHA=162.180 symop: x,y,z a_YAH=126 990 1369 " H ASP A 126 "<>" O ASN A 102 " d_HA=2.075 d_AD=3.047 a_DHA=159.642 symop: x,y,z a_YAH=157 990 1021 " H GLY A 104 "<>" O ASN A 102 " d_HA=1.995 d_AD=2.931 a_DHA=152.542 symop: x,y,z a_YAH=101 995 1329 " H ASN A 102 "<>" O VAL A 124 " d_HA=1.843 d_AD=2.855 a_DHA=173.490 symop: x,y,z a_YAH=167 66 268 " H LEU A 57 "<>" O PHE A 45 " d_HA=2.209 d_AD=3.171 a_DHA=158.309 symop: x,y,z a_YAH=151 253 3356 " HG SER B 116 "<>" OE2 GLU A 56 " d_HA=1.597 d_AD=2.588 a_DHA=174.375 symop: x-1/2,-y+1/2,-z a_YAH=126 3276 3352 " H SER B 116 "<>" O ASN B 112 " d_HA=1.912 d_AD=2.925 a_DHA=174.488 symop: x,y,z a_YAH=163 3290 3369 " H TYR B 117 "<>" O PHE B 113 " d_HA=2.040 d_AD=3.030 a_DHA=164.911 symop: x,y,z a_YAH=157 3103 3472 " H VAL B 124 "<>" O ALA B 100 " d_HA=1.955 d_AD=2.955 a_DHA=167.179 symop: x,y,z a_YAH=148 495 542 " H ALA A 74 "<>" O GLY A 71 " d_HA=2.246 d_AD=3.197 a_DHA=156.293 symop: x,y,z a_YAH=114 471 1008 " H VAL A 103 "<>" O TRP A 70 " d_HA=1.982 d_AD=2.970 a_DHA=163.242 symop: x,y,z a_YAH=162 3259 3333 " H LYS B 115 "<>" O HIS B 111 " d_HA=2.082 d_AD=3.033 a_DHA=154.921 symop: x,y,z a_YAH=143 3243 3315 " H MET B 114 "<>" O VAL B 110 " d_HA=1.908 d_AD=2.909 a_DHA=167.585 symop: x,y,z a_YAH=158 3468 3134 " H ASN B 102 "<>" O VAL B 124 " d_HA=1.844 d_AD=2.859 a_DHA=176.485 symop: x,y,z a_YAH=166 3214 3281 " H ASN B 112 "<>" O ILE B 108 " d_HA=1.943 d_AD=2.922 a_DHA=161.187 symop: x,y,z a_YAH=157 2194 2213 " H PHE B 45 "<>" OD1 ASN B 44 " d_HA=2.174 d_AD=2.937 a_DHA=130.581 symop: x,y,z a_YAH=115 2194 2424 " H SER B 58 "<>" OD1 ASN B 44 " d_HA=2.432 d_AD=3.309 a_DHA=143.991 symop: x,y,z a_YAH=123 2205 2407 " H LEU B 57 "<>" O PHE B 45 " d_HA=2.095 d_AD=3.052 a_DHA=156.040 symop: x,y,z a_YAH=159 2246 2368 " H LEU B 47 "<>" O ILE B 55 " d_HA=2.203 d_AD=3.191 a_DHA=163.660 symop: x,y,z a_YAH=146 3489 2260 " H LEU B 125 "<>" O GLU B 48 " d_HA=2.170 d_AD=3.142 a_DHA=159.471 symop: x,y,z a_YAH=158 3192 3266 " H HIS B 111 "<>" O LYS B 107 " d_HA=1.946 d_AD=2.938 a_DHA=165.066 symop: x,y,z a_YAH=149 4284 3026 "HE22 GLN B 94 "<>" OE1 GLU B 176 " d_HA=2.117 d_AD=2.999 a_DHA=143.246 symop: x,y,z a_YAH=93 1521 1552 " H SER A 138 "<>" O ASP A 136 " d_HA=2.985 d_AD=3.601 a_DHA=120.060 symop: x,y,z a_YAH=109 200 1549 " HZ2 LYS A 53 "<>" O SER A 138 " d_HA=2.871 d_AD=3.753 a_DHA=145.680 symop: -x,y+1/2,-z+1/2 a_YAH=112 3764 3974 " H THR B 143 "<>" O VAL B 156 " d_HA=1.875 d_AD=2.872 a_DHA=166.598 symop: x,y,z a_YAH=148 1171 1253 " H VAL A 119 "<>" O MET A 114 " d_HA=2.073 d_AD=3.070 a_DHA=167.392 symop: x,y,z a_YAH=147 1188 1243 " H GLY A 118 "<>" O LYS A 115 " d_HA=2.582 d_AD=3.556 a_DHA=161.962 symop: x,y,z a_YAH=100 199 4280 " HZ1 LYS A 53 "<>" O GLU B 176 " d_HA=2.625 d_AD=3.337 a_DHA=127.038 symop: x,y,z a_YAH=162 2689 2734 " H LYS B 78 "<>" O GLU B 75 " d_HA=2.231 d_AD=3.025 a_DHA=133.953 symop: x,y,z a_YAH=112 2689 2756 " H LYS B 79 "<>" O GLU B 75 " d_HA=2.745 d_AD=3.594 a_DHA=141.503 symop: x,y,z a_YAH=145 2720 2679 " H ALA B 77 "<>" O ALA B 74 " d_HA=2.008 d_AD=2.858 a_DHA=140.028 symop: x,y,z a_YAH=129 3760 3978 " H VAL B 156 "<>" O THR B 143 " d_HA=1.779 d_AD=2.779 a_DHA=166.960 symop: x,y,z a_YAH=161 2142 3908 " H VAL B 152 "<>" O SER B 40 " d_HA=1.900 d_AD=2.788 a_DHA=144.865 symop: x,y,z a_YAH=170 2147 3904 " H3 SER B 40 "<>" O VAL B 152 " d_HA=2.465 d_AD=3.234 a_DHA=132.058 symop: x,y,z a_YAH=136 2576 3117 " H VAL B 101 "<>" O ASN B 68 " d_HA=1.835 d_AD=2.758 a_DHA=149.226 symop: x,y,z a_YAH=139 2169 3875 " H ALA B 42 "<>" O GLY B 150 " d_HA=2.103 d_AD=3.061 a_DHA=156.896 symop: x,y,z a_YAH=160 2159 3900 " HZ3 LYS B 151 "<>" OD2 ASP B 41 " d_HA=1.725 d_AD=2.689 a_DHA=154.894 symop: x,y,z a_YAH=103 487 964 " HE1 TRP A 70 "<>" O ALA A 100 " d_HA=2.067 d_AD=3.040 a_DHA=158.948 symop: x,y,z a_YAH=101 964 1333 " H VAL A 124 "<>" O ALA A 100 " d_HA=2.196 d_AD=3.176 a_DHA=162.270 symop: x,y,z a_YAH=122 74 55 " H PHE A 45 "<>" OD1 ASN A 44 " d_HA=2.637 d_AD=3.358 a_DHA=128.204 symop: x,y,z a_YAH=92 61 253 "HD21 ASN A 44 "<>" OE2 GLU A 56 " d_HA=2.013 d_AD=2.906 a_DHA=144.116 symop: x,y,z a_YAH=116 61 284 "HD21 ASN A 44 "<>" OG SER A 58 " d_HA=2.715 d_AD=3.374 a_DHA=122.204 symop: x,y,z a_YAH=116 a_YAH=130 3298 3233 " H PHE B 113 "<>" O ALA B 109 " d_HA=2.122 d_AD=3.136 a_DHA=176.174 symop: x,y,z a_YAH=154 555 606 " HZ2 LYS A 78 "<>" OE2 GLU A 75 " d_HA=1.782 d_AD=2.658 a_DHA=140.820 symop: x,y,z a_YAH=97 482 974 " H TRP A 70 "<>" O VAL A 101 " d_HA=2.124 d_AD=3.058 a_DHA=151.946 symop: x,y,z a_YAH=161 3281 3214 " H ASN B 112 "<>" O ILE B 108 " d_HA=1.943 d_AD=2.922 a_DHA=161.187 symop: x,y,z a_YAH=157 ------------------------------------------------------------------------------- Total: 305 Symmetry: 0 Per residue: 1.1172 Mean SD Skew Kurtosis theta_1: 146.494 20.849 -0.707 2.291 theta_2: 132.792 24.836 -0.185 1.667 d_HA: 2.345 0.316 0.490 2.061 5868 6264 "HH21 ARG B2182 "<>" O HIS B2159 " d_HA=1.943 d_AD=2.881 a_DHA=151.733 symop: x,y,z a_YAH=171 6264 6226 "HH21 ARG B2182 "<>" O LEU B2181 " d_HA=2.842 d_AD=3.545 a_DHA=126.614 symop: x,y,z a_YAH=130 5651 5724 " H THR B2149 "<>" O GLU B2145 " d_HA=1.988 d_AD=2.950 a_DHA=156.213 symop: x,y,z a_YAH=149 5701 5760 " H ASN B2152 "<>" O LEU B2148 " d_HA=1.858 d_AD=2.864 a_DHA=168.944 symop: x,y,z a_YAH=151 5720 5775 " H LYS B2153 "<>" O THR B2149 " d_HA=2.523 d_AD=3.454 a_DHA=152.335 symop: x,y,z a_YAH=129 6263 5808 "HH12 ARG B2182 "<>" O PHE B2155 " d_HA=1.755 d_AD=2.739 a_DHA=162.699 symop: x,y,z a_YAH=150 5875 5828 " H HIS B2159 "<>" O MET B2156 " d_HA=2.121 d_AD=3.033 a_DHA=148.789 symop: x,y,z a_YAH=150 6265 5808 "HH22 ARG B2182 "<>" O PHE B2155 " d_HA=2.362 d_AD=3.143 a_DHA=133.822 symop: x,y,z a_YAH=142 6265 5828 "HH22 ARG B2182 "<>" O MET B2156 " d_HA=2.231 d_AD=2.928 a_DHA=125.224 symop: x,y,z a_YAH=92 5233 5314 " HZ3 LYS B2124 "<>" OD1 ASN B2120 " d_HA=1.858 d_AD=2.655 a_DHA=132.267 symop: x,y,z a_YAH=119 5314 5230 " HZ3 LYS B2124 "<>" O ASN B2120 " d_HA=2.494 d_AD=3.284 a_DHA=133.720 symop: x,y,z a_YAH=131 7132 5794 " HZ2 LYS B2233 "<>" ND1 HIS B2154 " d_HA=1.850 d_AD=2.815 a_DHA=156.756 symop: x,y,z a_YAH=137 a_YAH=116 7133 7106 " HZ3 LYS B2233 "<>" OD1 ASP B2232 " d_HA=1.916 d_AD=2.866 a_DHA=152.540 symop: x,y,z a_YAH=171 737 657 " HZ2 LYS A1124 "<>" OD1 ASN A1120 " d_HA=1.719 d_AD=2.739 a_DHA=175.728 symop: x,y,z a_YAH=169 1636 1685 " HE ARG A1182 "<>" O PRO A1180 " d_HA=2.162 d_AD=2.886 a_DHA=126.995 symop: x,y,z a_YAH=130 1610 6317 " HZ2 LYS B2185 "<>" O LEU A1178 " d_HA=2.119 d_AD=2.935 a_DHA=136.023 symop: x,y,z a_YAH=145 1629 1677 " H ARG A1182 "<>" O GLY A1179 " d_HA=2.306 d_AD=3.223 a_DHA=149.510 symop: x,y,z a_YAH=136 1629 6318 " HZ3 LYS B2185 "<>" O GLY A1179 " d_HA=1.935 d_AD=2.871 a_DHA=151.759 symop: x,y,z a_YAH=119 6042 6070 " H SER B2171 "<>" OD1 ASP B2169 " d_HA=2.030 d_AD=2.947 a_DHA=148.689 symop: x,y,z a_YAH=140 6042 6074 " HG SER B2171 "<>" OD1 ASP B2169 " d_HA=1.614 d_AD=2.599 a_DHA=172.133 symop: x,y,z a_YAH=107 5942 6269 " H PHE B2163 "<>" O SER B2183 " d_HA=1.861 d_AD=2.867 a_DHA=171.133 symop: x,y,z a_YAH=166 5324 5244 " H GLN B2125 "<>" O TYR B2121 " d_HA=2.537 d_AD=3.197 a_DHA=122.569 symop: x,y,z a_YAH=134 5341 5286 " H LYS B2126 "<>" O ALA B2123 " d_HA=2.089 d_AD=3.069 a_DHA=161.841 symop: x,y,z a_YAH=110 5755 6262 "HH11 ARG B2182 "<>" O ASN B2152 " d_HA=1.997 d_AD=2.945 a_DHA=154.802 symop: x,y,z a_YAH=128 5758 6206 " H GLY B2179 "<>" OD1 ASN B2152 " d_HA=1.868 d_AD=2.813 a_DHA=153.768 symop: x,y,z a_YAH=108 3067 3667 " HZ1 LYS A1304 "<>" O GLU A1265 " d_HA=2.702 d_AD=3.533 a_DHA=139.286 symop: x,y,z a_YAH=135 3067 3739 "HD22 ASN A1308 "<>" O GLU A1265 " d_HA=2.866 d_AD=3.671 a_DHA=136.916 symop: x,y,z a_YAH=151 3669 3733 " HZ3 LYS A1304 "<>" ND2 ASN A1308 " d_HA=2.275 d_AD=3.199 a_DHA=150.728 symop: x,y,z a_YAH=91 a_YAH=103 a_YAH=95 3039 3774 "HH12 ARG A1263 "<>" O GLU A1311 " d_HA=2.610 d_AD=3.329 a_DHA=128.350 symop: x,y,z a_YAH=148 3021 3085 " H SER A1266 "<>" O ARG A1263 " d_HA=1.878 d_AD=2.876 a_DHA=166.424 symop: x,y,z a_YAH=132 3082 3122 " H TYR A1269 "<>" O SER A1266 " d_HA=2.332 d_AD=3.295 a_DHA=159.015 symop: x,y,z a_YAH=103 2987 3029 " H ARG A1263 "<>" OE2 GLU A1261 " d_HA=1.815 d_AD=2.808 a_DHA=163.421 symop: x,y,z a_YAH=131 2987 3037 " HE ARG A1263 "<>" OE2 GLU A1261 " d_HA=1.886 d_AD=2.885 a_DHA=164.423 symop: x,y,z a_YAH=112 3014 3134 "HH11 ARG A1262 "<>" O ILE A1270 " d_HA=2.421 d_AD=3.380 a_DHA=158.935 symop: x,y,z a_YAH=127 3153 3200 " H GLU A1274 "<>" O PRO A1271 " d_HA=2.468 d_AD=3.363 a_DHA=147.123 symop: x,y,z a_YAH=115 2904 3188 " H GLY A1273 "<>" OD1 ASN A1256 " d_HA=1.902 d_AD=2.797 a_DHA=145.371 symop: x,y,z a_YAH=131 1600 6364 " H LYS B2188 "<>" OE2 GLU A1177 " d_HA=1.967 d_AD=2.950 a_DHA=159.961 symop: x,y,z a_YAH=161 1655 6868 " H LEU A1181 "<>" OE2 GLU B2217 " d_HA=1.757 d_AD=2.694 a_DHA=150.774 symop: x,y,z a_YAH=116 6011 6385 " H ILE B2189 "<>" O VAL B2167 " d_HA=1.925 d_AD=2.856 a_DHA=151.941 symop: x,y,z a_YAH=140 6015 6338 " H VAL B2167 "<>" O PHE B2187 " d_HA=1.957 d_AD=2.973 a_DHA=173.976 symop: x,y,z a_YAH=171 5971 6867 " HH TYR B2164 "<>" OE1 GLU B2217 " d_HA=1.565 d_AD=2.553 a_DHA=177.030 symop: x,y,z a_YAH=140 6793 6869 " H GLU B2217 "<>" O HIS B2213 " d_HA=2.506 d_AD=3.253 a_DHA=130.091 symop: x,y,z a_YAH=143 6793 6853 " H HIS B2216 "<>" O HIS B2213 " d_HA=2.093 d_AD=2.972 a_DHA=143.818 symop: x,y,z a_YAH=121 5975 6346 " H PHE B2187 "<>" O ILE B2165 " d_HA=1.949 d_AD=2.921 a_DHA=159.184 symop: x,y,z a_YAH=164 6039 6086 " H ARG B2172 "<>" O ASP B2169 " d_HA=2.075 d_AD=3.013 a_DHA=152.339 symop: x,y,z a_YAH=122 6043 6095 "HH11 ARG B2172 "<>" OD2 ASP B2169 " d_HA=1.827 d_AD=2.752 a_DHA=148.096 symop: x,y,z a_YAH=118 776 5335 " HZ2 LYS A1126 "<>" O LYS B2126 " d_HA=1.857 d_AD=2.854 a_DHA=166.038 symop: x,y,z a_YAH=147 5380 6897 " H THR B2128 "<>" OD1 ASP B2219 " d_HA=1.880 d_AD=2.895 a_DHA=172.556 symop: x,y,z a_YAH=135 5934 6306 " H LYS B2185 "<>" O PHE B2163 " d_HA=1.898 d_AD=2.815 a_DHA=147.857 symop: x,y,z a_YAH=170 5980 6300 " H ILE B2165 "<>" O LYS B2185 " d_HA=1.872 d_AD=2.865 a_DHA=165.568 symop: x,y,z a_YAH=165 5508 6097 "HH21 ARG B2172 "<>" O GLY B2137 " d_HA=1.912 d_AD=2.824 a_DHA=147.625 symop: x,y,z a_YAH=111 5508 5565 " H ILE B2140 "<>" O GLY B2137 " d_HA=2.429 d_AD=3.378 a_DHA=156.113 symop: x,y,z a_YAH=122 5560 5637 " H LEU B2144 "<>" O ILE B2140 " d_HA=2.591 d_AD=3.335 a_DHA=130.248 symop: x,y,z a_YAH=110 5585 5515 " H GLU B2141 "<>" O ARG B2138 " d_HA=2.426 d_AD=3.075 a_DHA=121.344 symop: x,y,z a_YAH=114 5532 5583 "HH11 ARG B2138 "<>" OE1 GLU B2141 " d_HA=1.714 d_AD=2.641 a_DHA=146.869 symop: x,y,z a_YAH=145 5584 6097 "HH21 ARG B2172 "<>" OE2 GLU B2141 " d_HA=2.890 d_AD=3.548 a_DHA=122.990 symop: x,y,z a_YAH=154 5584 6094 " HE ARG B2172 "<>" OE2 GLU B2141 " d_HA=1.732 d_AD=2.704 a_DHA=157.515 symop: x,y,z a_YAH=156 5330 5244 "HE21 GLN B2125 "<>" O TYR B2121 " d_HA=2.143 d_AD=2.974 a_DHA=138.207 symop: x,y,z a_YAH=127 5265 5324 " H GLN B2125 "<>" O TYR B2122 " d_HA=2.095 d_AD=2.923 a_DHA=137.636 symop: x,y,z a_YAH=102 5265 5362 " H ILE B2127 "<>" O TYR B2122 " d_HA=2.364 d_AD=3.361 a_DHA=170.666 symop: x,y,z a_YAH=144 5376 6899 " H ASP B2219 "<>" O THR B2128 " d_HA=1.959 d_AD=2.834 a_DHA=142.894 symop: x,y,z a_YAH=141 5376 6914 " H PHE B2220 "<>" O THR B2128 " d_HA=2.750 d_AD=3.624 a_DHA=144.880 symop: x,y,z a_YAH=150 5394 5885 " H VAL B2129 "<>" O PRO B2160 " d_HA=1.904 d_AD=2.887 a_DHA=161.994 symop: x,y,z a_YAH=148 5390 5920 " H ILE B2162 "<>" O VAL B2129 " d_HA=2.042 d_AD=3.018 a_DHA=160.130 symop: x,y,z a_YAH=147 5407 6906 " H GLY B2130 "<>" O PHE B2220 " d_HA=1.799 d_AD=2.800 a_DHA=168.394 symop: x,y,z a_YAH=156 5413 5963 " H TYR B2164 "<>" O LEU B2131 " d_HA=1.800 d_AD=2.801 a_DHA=167.857 symop: x,y,z a_YAH=149 5418 5915 " H LEU B2131 "<>" O ILE B2162 " d_HA=1.990 d_AD=2.909 a_DHA=148.887 symop: x,y,z a_YAH=168 3651 3734 " H ASN A1308 "<>" O LYS A1304 " d_HA=2.348 d_AD=3.064 a_DHA=127.123 symop: x,y,z a_YAH=135 3651 3713 " H LYS A1307 "<>" O LYS A1304 " d_HA=2.270 d_AD=3.107 a_DHA=139.015 symop: x,y,z a_YAH=94 3613 3691 " H LYS A1306 "<>" O ILE A1302 " d_HA=1.880 d_AD=2.884 a_DHA=168.393 symop: x,y,z a_YAH=156 3673 3734 " H ASN A1308 "<>" O ASP A1305 " d_HA=2.278 d_AD=3.040 a_DHA=131.326 symop: x,y,z a_YAH=99 3673 3760 " H ILE A1310 "<>" O ASP A1305 " d_HA=1.941 d_AD=2.950 a_DHA=172.695 symop: x,y,z a_YAH=141 3095 3676 " H ALA A1267 "<>" OD1 ASP A1305 " d_HA=1.849 d_AD=2.786 a_DHA=151.131 symop: x,y,z a_YAH=96 3606 3678 " H ASP A1305 "<>" O GLY A1301 " d_HA=2.086 d_AD=3.049 a_DHA=157.605 symop: x,y,z a_YAH=151 3668 3676 " HZ2 LYS A1304 "<>" OD1 ASP A1305 " d_HA=1.806 d_AD=2.707 a_DHA=144.244 symop: x,y,z a_YAH=160 1914 3779 "HH12 ARG A1194 "<>" OE2 GLU A1311 " d_HA=2.158 d_AD=2.988 a_DHA=136.762 symop: x,y,z a_YAH=179 3041 3774 "HH22 ARG A1263 "<>" O GLU A1311 " d_HA=1.808 d_AD=2.751 a_DHA=153.201 symop: x,y,z a_YAH=147 3789 3847 " H HIS A1315 "<>" O ALA A1312 " d_HA=2.384 d_AD=3.079 a_DHA=124.645 symop: x,y,z a_YAH=127 3089 3677 " HG SER A1266 "<>" OD2 ASP A1305 " d_HA=1.509 d_AD=2.493 a_DHA=168.153 symop: x,y,z a_YAH=139 3093 3963 " HZ3 LYS A1322 "<>" O ALA A1267 " d_HA=1.827 d_AD=2.818 a_DHA=162.845 symop: x,y,z a_YAH=147 3113 3962 " HZ2 LYS A1322 "<>" O TYR A1269 " d_HA=1.718 d_AD=2.715 a_DHA=164.861 symop: x,y,z a_YAH=132 1936 3779 " HE1 TRP A1195 "<>" OE2 GLU A1311 " d_HA=1.735 d_AD=2.694 a_DHA=153.171 symop: x,y,z a_YAH=103 2986 3040 "HH21 ARG A1263 "<>" OE1 GLU A1261 " d_HA=1.729 d_AD=2.697 a_DHA=155.982 symop: x,y,z a_YAH=112 2986 3805 " H GLN A1313 "<>" OE1 GLU A1261 " d_HA=1.760 d_AD=2.745 a_DHA=161.987 symop: x,y,z a_YAH=159 2982 3139 " H ILE A1270 "<>" O GLU A1261 " d_HA=1.849 d_AD=2.848 a_DHA=166.628 symop: x,y,z a_YAH=177 2947 3811 "HE21 GLN A1313 "<>" O THR A1259 " d_HA=2.195 d_AD=3.029 a_DHA=138.432 symop: x,y,z a_YAH=117 2927 3013 " HE ARG A1262 "<>" O PHE A1258 " d_HA=2.861 d_AD=3.562 a_DHA=126.985 symop: x,y,z a_YAH=174 2927 3016 "HH21 ARG A1262 "<>" O PHE A1258 " d_HA=1.929 d_AD=2.827 a_DHA=145.723 symop: x,y,z a_YAH=136 2887 3017 "HH22 ARG A1262 "<>" O PRO A1255 " d_HA=1.743 d_AD=2.735 a_DHA=165.335 symop: x,y,z a_YAH=149 2875 2920 " H ASP A1257 "<>" O ASP A1254 " d_HA=1.923 d_AD=2.868 a_DHA=153.724 symop: x,y,z a_YAH=132 2875 2935 " H PHE A1258 "<>" O ASP A1254 " d_HA=2.781 d_AD=3.523 a_DHA=130.857 symop: x,y,z a_YAH=141 2878 2906 " H ASN A1256 "<>" OD1 ASP A1254 " d_HA=2.137 d_AD=3.140 a_DHA=168.736 symop: x,y,z a_YAH=134 2878 2911 "HD22 ASN A1256 "<>" OD1 ASP A1254 " d_HA=1.741 d_AD=2.753 a_DHA=167.519 symop: x,y,z a_YAH=154 6399 6456 " H LYS B2193 "<>" O LYS B2190 " d_HA=2.262 d_AD=2.965 a_DHA=125.160 symop: x,y,z a_YAH=110 6405 9172 " H LYS B2190 "<>" O1 SO4 B3364 " d_HA=2.008 d_AD=3.016 a_DHA=166.767 symop: x,y,z a_YAH=126 6859 9168 " HE2 HIS B2216 "<>" O2 SO4 B3363 " d_HA=1.736 d_AD=2.755 a_DHA=166.717 symop: x,y,z a_YAH=120 6767 6841 "HE21 GLN B2215 "<>" O VAL B2211 " d_HA=2.066 d_AD=2.885 a_DHA=135.742 symop: x,y,z a_YAH=139 9175 6467 " HZ2 LYS B2193 "<>" O4 SO4 B3364 " d_HA=1.833 d_AD=2.682 a_DHA=137.008 symop: x,y,z a_YAH=95 7480 7764 " H GLY B2273 "<>" OD1 ASN B2256 " d_HA=1.866 d_AD=2.778 a_DHA=147.753 symop: x,y,z a_YAH=159 6748 6835 " H GLN B2215 "<>" O ILE B2210 " d_HA=1.932 d_AD=2.908 a_DHA=159.891 symop: x,y,z a_YAH=138 6810 6882 " H VAL B2218 "<>" O ILE B2214 " d_HA=2.249 d_AD=3.202 a_DHA=155.503 symop: x,y,z a_YAH=165 6810 6869 " H GLU B2217 "<>" O ILE B2214 " d_HA=2.218 d_AD=3.046 a_DHA=137.644 symop: x,y,z a_YAH=100 6731 6800 " H HIS B2213 "<>" O HIS B2209 " d_HA=1.918 d_AD=2.890 a_DHA=159.458 symop: x,y,z a_YAH=147 6731 6815 " H ILE B2214 "<>" O HIS B2209 " d_HA=1.865 d_AD=2.844 a_DHA=161.014 symop: x,y,z a_YAH=140 5999 5446 " H MET B2166 "<>" O VAL B2133 " d_HA=1.926 d_AD=2.926 a_DHA=167.158 symop: x,y,z a_YAH=164 5482 6032 " H ASP B2168 "<>" O ALA B2135 " d_HA=2.476 d_AD=3.330 a_DHA=141.738 symop: x,y,z a_YAH=150 5484 5994 " H ALA B2135 "<>" O MET B2166 " d_HA=1.853 d_AD=2.842 a_DHA=162.244 symop: x,y,z a_YAH=167 6030 6098 "HH22 ARG B2172 "<>" OD1 ASP B2168 " d_HA=2.197 d_AD=3.178 a_DHA=161.074 symop: x,y,z a_YAH=121 7590 7710 "HH11 ARG B2262 "<>" O ILE B2270 " d_HA=2.081 d_AD=3.060 a_DHA=161.601 symop: x,y,z a_YAH=134 7729 7776 " H GLU B2274 "<>" O PRO B2271 " d_HA=2.290 d_AD=3.157 a_DHA=142.972 symop: x,y,z a_YAH=130 5434 6972 " HG CYS B2223 "<>" OG1 THR B2132 " d_HA=1.933 d_AD=3.227 a_DHA=159.498 symop: x,y,z a_YAH=135 a_YAH=111 5446 5999 " H MET B2166 "<>" O VAL B2133 " d_HA=1.926 d_AD=2.926 a_DHA=167.158 symop: x,y,z a_YAH=164 5450 5954 " H VAL B2133 "<>" O TYR B2164 " d_HA=2.008 d_AD=2.915 a_DHA=147.434 symop: x,y,z a_YAH=162 5492 5548 " H TYR B2139 "<>" O VAL B2136 " d_HA=2.297 d_AD=3.187 a_DHA=146.420 symop: x,y,z a_YAH=141 5406 6953 " H PHE B2222 "<>" O GLY B2130 " d_HA=1.947 d_AD=2.904 a_DHA=156.223 symop: x,y,z a_YAH=133 6931 7949 " H LEU B2221 "<>" O GLY B2286 " d_HA=1.762 d_AD=2.754 a_DHA=165.190 symop: x,y,z a_YAH=172 5436 6945 " H THR B2132 "<>" O PHE B2222 " d_HA=1.890 d_AD=2.872 a_DHA=160.896 symop: x,y,z a_YAH=155 5432 6981 " H MET B2224 "<>" O THR B2132 " d_HA=2.427 d_AD=3.142 a_DHA=126.850 symop: x,y,z a_YAH=143 5439 9159 " HG1 THR B2132 "<>" O3 SO4 B3361 " d_HA=2.656 d_AD=3.548 a_DHA=152.009 symop: x,y,z a_YAH=160 6981 9159 " H MET B2224 "<>" O3 SO4 B3361 " d_HA=2.842 d_AD=3.570 a_DHA=129.070 symop: x,y,z a_YAH=105 2191 2265 "HE21 GLN A1215 "<>" O VAL A1211 " d_HA=1.874 d_AD=2.809 a_DHA=150.899 symop: x,y,z a_YAH=128 2209 2140 " H ALA A1212 "<>" O GLU A1208 " d_HA=2.022 d_AD=2.995 a_DHA=159.344 symop: x,y,z a_YAH=141 1964 3702 " HZ2 LYS A1306 "<>" OD1 ASP A1197 " d_HA=1.686 d_AD=2.627 a_DHA=150.373 symop: x,y,z a_YAH=108 3564 3637 " H LEU A1303 "<>" O PHE A1299 " d_HA=1.921 d_AD=2.922 a_DHA=167.566 symop: x,y,z a_YAH=156 3584 3657 " H LYS A1304 "<>" O LYS A1300 " d_HA=1.974 d_AD=2.928 a_DHA=154.889 symop: x,y,z a_YAH=145 1965 3701 " HZ1 LYS A1306 "<>" OD2 ASP A1197 " d_HA=1.909 d_AD=2.697 a_DHA=131.618 symop: x,y,z a_YAH=109 3702 1964 " HZ2 LYS A1306 "<>" OD1 ASP A1197 " d_HA=1.686 d_AD=2.627 a_DHA=150.373 symop: x,y,z a_YAH=108 1944 2008 " H MET A1200 "<>" O GLN A1196 " d_HA=2.694 d_AD=3.521 a_DHA=139.273 symop: x,y,z a_YAH=117 3553 3618 " H ILE A1302 "<>" O CYS A1298 " d_HA=1.810 d_AD=2.824 a_DHA=176.329 symop: x,y,z a_YAH=165 3538 3607 " H GLY A1301 "<>" O GLU A1297 " d_HA=1.846 d_AD=2.840 a_DHA=165.004 symop: x,y,z a_YAH=150 1957 3789 "HE22 GLN A1196 "<>" O ALA A1312 " d_HA=2.577 d_AD=3.462 a_DHA=145.823 symop: x,y,z a_YAH=122 3840 3902 " H HIS A1319 "<>" O HIS A1315 " d_HA=2.878 d_AD=3.785 a_DHA=149.512 symop: x,y,z a_YAH=136 3840 3887 " H SER A1318 "<>" O HIS A1315 " d_HA=2.731 d_AD=3.436 a_DHA=126.661 symop: x,y,z a_YAH=100 3884 3951 " H LYS A1322 "<>" O SER A1318 " d_HA=2.136 d_AD=3.084 a_DHA=153.939 symop: x,y,z a_YAH=135 3895 3976 " H TYR A1323 "<>" O HIS A1319 " d_HA=1.789 d_AD=2.776 a_DHA=163.105 symop: x,y,z a_YAH=151 3945 4013 " H LEU A1325 "<>" O LYS A1322 " d_HA=2.377 d_AD=3.107 a_DHA=128.187 symop: x,y,z a_YAH=96 3945 4032 " H LEU A1326 "<>" O LYS A1322 " d_HA=2.134 d_AD=3.133 a_DHA=167.488 symop: x,y,z a_YAH=159 4008 4078 " HZ3 LYS A1328 "<>" O LEU A1325 " d_HA=1.761 d_AD=2.764 a_DHA=166.931 symop: x,y,z a_YAH=144 3816 3887 " H SER A1318 "<>" O TRP A1314 " d_HA=1.822 d_AD=2.781 a_DHA=155.605 symop: x,y,z a_YAH=139 3869 3936 " H ASN A1321 "<>" O GLU A1317 " d_HA=1.766 d_AD=2.762 a_DHA=165.713 symop: x,y,z a_YAH=155 3931 4013 " H LEU A1325 "<>" O ASN A1321 " d_HA=2.279 d_AD=3.043 a_DHA=131.161 symop: x,y,z a_YAH=133 3220 4077 " HZ2 LYS A1328 "<>" OD2 ASP A1276 " d_HA=1.744 d_AD=2.696 a_DHA=152.753 symop: x,y,z a_YAH=121 3265 3874 " HH TYR A1278 "<>" OE2 GLU A1317 " d_HA=1.671 d_AD=2.624 a_DHA=161.626 symop: x,y,z a_YAH=122 2978 3228 " HH TYR A1260 "<>" O PHE A1277 " d_HA=1.850 d_AD=2.801 a_DHA=166.078 symop: x,y,z a_YAH=117 3228 3940 "HD21 ASN A1321 "<>" O PHE A1277 " d_HA=2.168 d_AD=3.170 a_DHA=171.528 symop: x,y,z a_YAH=160 2814 9153 " HE1 TRP A1250 "<>" O2 SO4 B3360 " d_HA=1.935 d_AD=2.893 a_DHA=152.153 symop: x-1/2,-y+1/2,-z a_YAH=127 2798 2867 " H ALA A1253 "<>" O TRP A1250 " d_HA=1.920 d_AD=2.889 a_DHA=159.276 symop: x,y,z a_YAH=115 370 3216 " HZ1 LYS A1102 "<>" O ASP A1276 " d_HA=1.778 d_AD=2.788 a_DHA=166.635 symop: x,y,z a_YAH=138 6467 9175 " HZ2 LYS B2193 "<>" O4 SO4 B3364 " d_HA=1.833 d_AD=2.682 a_DHA=137.008 symop: x,y,z a_YAH=95 6415 6439 " HZ1 LYS B2190 "<>" OE1 GLU B2192 " d_HA=1.736 d_AD=2.646 a_DHA=145.515 symop: x,y,z a_YAH=127 6421 6480 " H ARG B2194 "<>" O PRO B2191 " d_HA=2.110 d_AD=3.037 a_DHA=150.531 symop: x,y,z a_YAH=113 6435 6507 " H TRP B2195 "<>" O GLU B2192 " d_HA=2.455 d_AD=3.464 a_DHA=172.840 symop: x,y,z a_YAH=128 6842 9169 "HE22 GLN B2215 "<>" O3 SO4 B3363 " d_HA=2.262 d_AD=2.906 a_DHA=120.131 symop: x,y,z a_YAH=132 6716 6785 " H ALA B2212 "<>" O GLU B2208 " d_HA=1.922 d_AD=2.923 a_DHA=168.401 symop: x,y,z a_YAH=152 6466 6720 " HZ1 LYS B2193 "<>" OE1 GLU B2208 " d_HA=1.785 d_AD=2.776 a_DHA=162.220 symop: x,y,z a_YAH=169 6468 6678 " HZ3 LYS B2193 "<>" OG1 THR B2205 " d_HA=1.864 d_AD=2.854 a_DHA=165.225 symop: x,y,z a_YAH=110 a_YAH=140 6596 6680 " H THR B2205 "<>" O MET B2201 " d_HA=1.909 d_AD=2.895 a_DHA=163.838 symop: x,y,z a_YAH=150 6596 6683 " HG1 THR B2205 "<>" O MET B2201 " d_HA=1.693 d_AD=2.648 a_DHA=166.035 symop: x,y,z a_YAH=138 6450 6526 " H GLN B2196 "<>" O LYS B2193 " d_HA=2.100 d_AD=3.074 a_DHA=160.939 symop: x,y,z a_YAH=102 7451 7496 " H ASP B2257 "<>" O ASP B2254 " d_HA=1.866 d_AD=2.816 a_DHA=154.934 symop: x,y,z a_YAH=140 7451 7511 " H PHE B2258 "<>" O ASP B2254 " d_HA=2.820 d_AD=3.630 a_DHA=137.701 symop: x,y,z a_YAH=139 7463 7593 "HH22 ARG B2262 "<>" O PRO B2255 " d_HA=1.806 d_AD=2.786 a_DHA=161.032 symop: x,y,z a_YAH=149 6690 6753 " H ILE B2210 "<>" O ILE B2206 " d_HA=1.936 d_AD=2.874 a_DHA=152.084 symop: x,y,z a_YAH=145 6709 6771 " H VAL B2211 "<>" O GLY B2207 " d_HA=2.025 d_AD=3.026 a_DHA=167.339 symop: x,y,z a_YAH=160 6654 6722 " H GLU B2208 "<>" O LYS B2204 " d_HA=1.823 d_AD=2.802 a_DHA=160.474 symop: x,y,z a_YAH=151 6676 6738 " H HIS B2209 "<>" O THR B2205 " d_HA=1.847 d_AD=2.857 a_DHA=171.213 symop: x,y,z a_YAH=159 6680 6596 " H THR B2205 "<>" O MET B2201 " d_HA=1.909 d_AD=2.895 a_DHA=163.838 symop: x,y,z a_YAH=150 4948 7795 " HZ3 LYS B2102 "<>" OD1 ASP B2276 " d_HA=1.719 d_AD=2.702 a_DHA=157.614 symop: x,y,z a_YAH=128 7503 7546 " H TYR B2260 "<>" O PHE B2258 " d_HA=1.966 d_AD=2.876 a_DHA=148.765 symop: x,y,z a_YAH=91 7503 7589 " HE ARG B2262 "<>" O PHE B2258 " d_HA=2.711 d_AD=3.472 a_DHA=132.364 symop: x,y,z a_YAH=171 7503 7592 "HH21 ARG B2262 "<>" O PHE B2258 " d_HA=1.882 d_AD=2.837 a_DHA=155.067 symop: x,y,z a_YAH=137 8379 8408 " HE1 TRP B2314 "<>" OE1 GLN B2313 " d_HA=2.554 d_AD=3.267 a_DHA=127.421 symop: x,y,z a_YAH=99 7956 8004 " H GLN B2290 "<>" O THR B2287 " d_HA=2.232 d_AD=3.001 a_DHA=131.495 symop: x,y,z a_YAH=108 7956 8019 " H VAL B2291 "<>" O THR B2287 " d_HA=1.950 d_AD=2.955 a_DHA=170.680 symop: x,y,z a_YAH=166 7958 8004 " H GLN B2290 "<>" OG1 THR B2287 " d_HA=2.563 d_AD=3.441 a_DHA=144.747 symop: x,y,z a_YAH=126 a_YAH=122 7970 8036 " H LEU B2292 "<>" O PRO B2288 " d_HA=1.830 d_AD=2.796 a_DHA=158.340 symop: x,y,z a_YAH=154 6613 6695 " H ILE B2206 "<>" O ARG B2202 " d_HA=1.793 d_AD=2.807 a_DHA=176.034 symop: x,y,z a_YAH=175 6631 6996 "HH12 ARG B2202 "<>" OD1 ASP B2225 " d_HA=1.750 d_AD=2.697 a_DHA=152.234 symop: x,y,z a_YAH=122 6633 6996 "HH22 ARG B2202 "<>" OD1 ASP B2225 " d_HA=1.746 d_AD=2.723 a_DHA=157.362 symop: x,y,z a_YAH=158 7558 7715 " H ILE B2270 "<>" O GLU B2261 " d_HA=1.917 d_AD=2.929 a_DHA=173.836 symop: x,y,z a_YAH=162 7562 7616 "HH21 ARG B2263 "<>" OE1 GLU B2261 " d_HA=1.654 d_AD=2.675 a_DHA=174.702 symop: x,y,z a_YAH=114 7562 8381 " H GLN B2313 "<>" OE1 GLU B2261 " d_HA=1.938 d_AD=2.817 a_DHA=143.066 symop: x,y,z a_YAH=143 7563 7605 " H ARG B2263 "<>" OE2 GLU B2261 " d_HA=1.779 d_AD=2.757 a_DHA=159.210 symop: x,y,z a_YAH=127 7563 7581 " H ARG B2262 "<>" OE2 GLU B2261 " d_HA=2.083 d_AD=2.825 a_DHA=128.022 symop: x,y,z a_YAH=105 7563 7613 " HE ARG B2263 "<>" OE2 GLU B2261 " d_HA=1.810 d_AD=2.830 a_DHA=172.694 symop: x,y,z a_YAH=102 7235 7960 " H THR B2287 "<>" O GLU B2241 " d_HA=1.918 d_AD=2.862 a_DHA=153.506 symop: x,y,z a_YAH=126 6926 7950 " H GLY B2286 "<>" O LEU B2221 " d_HA=1.910 d_AD=2.878 a_DHA=157.548 symop: x,y,z a_YAH=156 7942 7265 " H VAL B2243 "<>" O GLY B2285 " d_HA=1.788 d_AD=2.727 a_DHA=151.357 symop: x,y,z a_YAH=148 6968 7922 " H CYS B2223 "<>" O PHE B2284 " d_HA=1.828 d_AD=2.838 a_DHA=173.714 symop: x,y,z a_YAH=167 2003 2084 " H LYS A1204 "<>" O MET A1200 " d_HA=2.256 d_AD=3.159 a_DHA=147.525 symop: x,y,z a_YAH=128 3521 3590 " H LYS A1300 "<>" O GLN A1296 " d_HA=1.835 d_AD=2.827 a_DHA=164.054 symop: x,y,z a_YAH=154 1961 2025 " H MET A1201 "<>" O ASP A1197 " d_HA=1.941 d_AD=2.791 a_DHA=138.927 symop: x,y,z a_YAH=138 1973 2025 " H MET A1201 "<>" O ILE A1198 " d_HA=2.239 d_AD=2.943 a_DHA=124.925 symop: x,y,z a_YAH=106 1973 2045 " H ARG A1202 "<>" O ILE A1198 " d_HA=1.928 d_AD=2.919 a_DHA=163.824 symop: x,y,z a_YAH=150 1992 2066 " H MET A1203 "<>" O SER A1199 " d_HA=1.905 d_AD=2.904 a_DHA=167.213 symop: x,y,z a_YAH=153 3507 3572 " H PHE A1299 "<>" O THR A1295 " d_HA=1.910 d_AD=2.884 a_DHA=159.480 symop: x,y,z a_YAH=143 3488 3556 " H CYS A1298 "<>" O ILE A1294 " d_HA=1.926 d_AD=2.936 a_DHA=171.671 symop: x,y,z a_YAH=164 3474 3544 " H GLU A1297 "<>" O ASN A1293 " d_HA=1.938 d_AD=2.949 a_DHA=170.971 symop: x,y,z a_YAH=154 3484 3975 "HD22 ASN A1293 "<>" OH TYR A1323 " d_HA=1.985 d_AD=2.996 a_DHA=176.995 symop: x,y,z a_YAH=110 a_YAH=135 1896 1966 " H ASP A1197 "<>" O ARG A1194 " d_HA=1.965 d_AD=2.915 a_DHA=155.838 symop: x,y,z a_YAH=114 1896 1978 " H ILE A1198 "<>" O ARG A1194 " d_HA=2.316 d_AD=3.226 a_DHA=149.157 symop: x,y,z a_YAH=170 1999 3860 " HG SER A1199 "<>" OD1 ASP A1316 " d_HA=1.791 d_AD=2.722 a_DHA=155.767 symop: x,y,z a_YAH=104 3857 3902 " H HIS A1319 "<>" O ASP A1316 " d_HA=2.592 d_AD=3.240 a_DHA=121.629 symop: x,y,z a_YAH=92 3857 3917 " H LEU A1320 "<>" O ASP A1316 " d_HA=1.799 d_AD=2.775 a_DHA=159.666 symop: x,y,z a_YAH=151 3912 3996 " H PHE A1324 "<>" O LEU A1320 " d_HA=1.863 d_AD=2.874 a_DHA=171.468 symop: x,y,z a_YAH=159 3967 4051 " H ASN A1327 "<>" O TYR A1323 " d_HA=1.733 d_AD=2.721 a_DHA=163.821 symop: x,y,z a_YAH=163 3967 4056 "HD22 ASN A1327 "<>" O TYR A1323 " d_HA=2.652 d_AD=3.330 a_DHA=124.749 symop: x,y,z a_YAH=115 3309 3873 " H ALA A1281 "<>" OE1 GLU A1317 " d_HA=1.757 d_AD=2.765 a_DHA=167.121 symop: x,y,z a_YAH=136 2753 3248 " H GLN A1247 "<>" O TYR A1278 " d_HA=2.022 d_AD=3.035 a_DHA=178.746 symop: x,y,z a_YAH=137 3278 3934 " H TYR A1279 "<>" OD1 ASN A1321 " d_HA=1.762 d_AD=2.755 a_DHA=165.252 symop: x,y,z a_YAH=140 340 406 " H LYS A1104 "<>" O THR A1101 " d_HA=1.970 d_AD=2.926 a_DHA=155.508 symop: x,y,z a_YAH=126 342 387 " H TRP A1103 "<>" OG1 THR A1101 " d_HA=2.284 d_AD=3.166 a_DHA=145.264 symop: x,y,z a_YAH=98 a_YAH=101 342 424 " H ALA A1105 "<>" OG1 THR A1101 " d_HA=2.108 d_AD=3.041 a_DHA=152.555 symop: x,y,z a_YAH=146 a_YAH=93 2790 4270 " HE1 TRP A1249 "<>" OD2 ASP A1340 " d_HA=2.833 d_AD=3.468 a_DHA=121.089 symop: x,y,z a_YAH=117 2751 2785 " H TRP A1249 "<>" OE1 GLN A1247 " d_HA=2.027 d_AD=2.983 a_DHA=155.524 symop: x,y,z a_YAH=160 2751 2809 " H TRP A1250 "<>" OE1 GLN A1247 " d_HA=2.836 d_AD=3.808 a_DHA=160.683 symop: x,y,z a_YAH=138 2760 9153 "HE22 GLN A1247 "<>" O2 SO4 B3360 " d_HA=1.752 d_AD=2.750 a_DHA=159.238 symop: x-1/2,-y+1/2,-z a_YAH=128 2747 2831 " H TYR A1251 "<>" O GLN A1247 " d_HA=2.456 d_AD=3.188 a_DHA=128.576 symop: x,y,z a_YAH=151 6579 6660 " H LYS B2204 "<>" O MET B2200 " d_HA=2.012 d_AD=2.982 a_DHA=158.614 symop: x,y,z a_YAH=147 2861 4389 " HZ3 LYS A1252 "<>" OD2 ASP A1348 " d_HA=1.706 d_AD=2.662 a_DHA=152.960 symop: x,y,z a_YAH=140 7374 7443 " H ALA B2253 "<>" O TRP B2250 " d_HA=1.887 d_AD=2.877 a_DHA=165.914 symop: x,y,z a_YAH=126 8031 8103 " H GLN B2296 "<>" O LEU B2292 " d_HA=1.805 d_AD=2.800 a_DHA=165.439 symop: x,y,z a_YAH=167 6637 6710 " H GLY B2207 "<>" O MET B2203 " d_HA=2.284 d_AD=3.254 a_DHA=159.716 symop: x,y,z a_YAH=137 6660 6579 " H LYS B2204 "<>" O MET B2200 " d_HA=2.012 d_AD=2.982 a_DHA=158.614 symop: x,y,z a_YAH=147 6568 6642 " H MET B2203 "<>" O SER B2199 " d_HA=2.502 d_AD=3.490 a_DHA=165.107 symop: x,y,z a_YAH=149 6537 6571 " H SER B2199 "<>" O ASP B2197 " d_HA=1.811 d_AD=2.712 a_DHA=145.921 symop: x,y,z a_YAH=107 6549 6621 " H ARG B2202 "<>" O ILE B2198 " d_HA=1.869 d_AD=2.880 a_DHA=172.273 symop: x,y,z a_YAH=152 7796 8653 " HZ2 LYS B2328 "<>" OD2 ASP B2276 " d_HA=1.679 d_AD=2.653 a_DHA=157.384 symop: x,y,z a_YAH=171 7545 7797 " H ASP B2276 "<>" OH TYR B2260 " d_HA=2.387 d_AD=3.245 a_DHA=142.000 symop: x,y,z a_YAH=153 a_YAH=95 7554 7804 " HH TYR B2260 "<>" O PHE B2277 " d_HA=1.694 d_AD=2.647 a_DHA=164.239 symop: x,y,z a_YAH=126 7984 8055 " H ASN B2293 "<>" O THR B2289 " d_HA=2.014 d_AD=3.005 a_DHA=165.251 symop: x,y,z a_YAH=135 7998 8069 " H ILE B2294 "<>" O GLN B2290 " d_HA=1.790 d_AD=2.739 a_DHA=154.580 symop: x,y,z a_YAH=152 8015 8087 " H THR B2295 "<>" O VAL B2291 " d_HA=1.935 d_AD=2.944 a_DHA=173.328 symop: x,y,z a_YAH=151 8015 8090 " HG1 THR B2295 "<>" O VAL B2291 " d_HA=1.976 d_AD=2.930 a_DHA=168.721 symop: x,y,z a_YAH=133 8083 8148 " H PHE B2299 "<>" O THR B2295 " d_HA=1.858 d_AD=2.849 a_DHA=164.268 symop: x,y,z a_YAH=151 6642 6568 " H MET B2203 "<>" O SER B2199 " d_HA=2.502 d_AD=3.490 a_DHA=165.107 symop: x,y,z a_YAH=149 8436 8451 " H GLU B2317 "<>" OD1 ASP B2316 " d_HA=2.293 d_AD=2.993 a_DHA=124.786 symop: x,y,z a_YAH=104 8584 8654 " HZ3 LYS B2328 "<>" O LEU B2325 " d_HA=1.755 d_AD=2.717 a_DHA=155.783 symop: x,y,z a_YAH=133 7862 8564 " HH TYR B2279 "<>" O PHE B2324 " d_HA=2.778 d_AD=3.668 a_DHA=153.975 symop: x,y,z a_YAH=121 8507 8589 " H LEU B2325 "<>" O ASN B2321 " d_HA=2.188 d_AD=2.861 a_DHA=122.176 symop: x,y,z a_YAH=128 8589 8521 " H LEU B2325 "<>" O LYS B2322 " d_HA=2.416 d_AD=3.171 a_DHA=130.482 symop: x,y,z a_YAH=94 8463 8416 " H SER B2318 "<>" O HIS B2315 " d_HA=2.519 d_AD=3.249 a_DHA=128.208 symop: x,y,z a_YAH=108 8403 8462 " H TRP B2314 "<>" OG SER B2318 " d_HA=2.037 d_AD=2.966 a_DHA=151.229 symop: x,y,z a_YAH=108 a_YAH=119 7252 8676 " H THR B2330 "<>" OG SER B2242 " d_HA=2.172 d_AD=3.156 a_DHA=162.185 symop: x,y,z a_YAH=130 a_YAH=123 2020 2104 " H THR A1205 "<>" O MET A1201 " d_HA=1.801 d_AD=2.808 a_DHA=172.748 symop: x,y,z a_YAH=177 2061 2134 " H GLY A1207 "<>" O MET A1203 " d_HA=2.484 d_AD=3.491 a_DHA=171.800 symop: x,y,z a_YAH=140 2078 2146 " H GLU A1208 "<>" O LYS A1204 " d_HA=2.011 d_AD=2.953 a_DHA=152.911 symop: x,y,z a_YAH=148 3455 3514 " HG1 THR A1295 "<>" O LEU A1292 " d_HA=2.083 d_AD=2.880 a_DHA=138.749 symop: x,y,z a_YAH=106 3455 3527 " H GLN A1296 "<>" O LEU A1292 " d_HA=1.851 d_AD=2.827 a_DHA=160.734 symop: x,y,z a_YAH=154 3408 3479 " H ASN A1293 "<>" O THR A1289 " d_HA=2.281 d_AD=3.231 a_DHA=155.646 symop: x,y,z a_YAH=133 2037 2119 " H ILE A1206 "<>" O ARG A1202 " d_HA=1.844 d_AD=2.852 a_DHA=170.942 symop: x,y,z a_YAH=170 3439 3514 " HG1 THR A1295 "<>" O VAL A1291 " d_HA=2.554 d_AD=3.288 a_DHA=132.971 symop: x,y,z a_YAH=124 3439 3511 " H THR A1295 "<>" O VAL A1291 " d_HA=1.842 d_AD=2.855 a_DHA=176.291 symop: x,y,z a_YAH=159 3422 3493 " H ILE A1294 "<>" O GLN A1290 " d_HA=1.850 d_AD=2.826 a_DHA=160.532 symop: x,y,z a_YAH=155 2054 3861 "HH11 ARG A1202 "<>" OD2 ASP A1316 " d_HA=1.958 d_AD=2.735 a_DHA=131.080 symop: x,y,z a_YAH=148 2056 2420 "HH21 ARG A1202 "<>" OD1 ASP A1225 " d_HA=1.816 d_AD=2.662 a_DHA=137.302 symop: x,y,z a_YAH=117 2057 3307 "HH22 ARG A1202 "<>" O ALA A1281 " d_HA=2.692 d_AD=3.677 a_DHA=166.626 symop: x,y,z a_YAH=150 2676 4100 " H THR A1330 "<>" OG SER A1242 " d_HA=2.505 d_AD=3.444 a_DHA=153.428 symop: x,y,z a_YAH=127 a_YAH=124 2717 3327 " H GLN A1245 "<>" O ILE A1283 " d_HA=2.868 d_AD=3.506 a_DHA=121.537 symop: x,y,z a_YAH=168 3290 3332 " H ILE A1283 "<>" O HIS A1280 " d_HA=2.818 d_AD=3.779 a_DHA=159.377 symop: x,y,z a_YAH=101 2685 3367 " H GLY A1285 "<>" O VAL A1243 " d_HA=1.946 d_AD=2.898 a_DHA=155.045 symop: x,y,z a_YAH=147 2703 4110 " H ALA A1244 "<>" O LYS A1331 " d_HA=2.202 d_AD=3.166 a_DHA=159.183 symop: x,y,z a_YAH=151 392 4082 " HE1 TRP A1103 "<>" O PRO A1329 " d_HA=1.835 d_AD=2.828 a_DHA=162.386 symop: x,y,z a_YAH=143 2674 4100 " H THR A1330 "<>" O SER A1242 " d_HA=2.263 d_AD=2.928 a_DHA=121.725 symop: x,y,z a_YAH=121 2674 4116 " H LYS A1331 "<>" O SER A1242 " d_HA=2.358 d_AD=3.175 a_DHA=136.628 symop: x,y,z a_YAH=155 2674 4103 " HG1 THR A1330 "<>" O SER A1242 " d_HA=1.871 d_AD=2.841 a_DHA=173.234 symop: x,y,z a_YAH=130 3293 4238 " HG CYS A1338 "<>" ND1 HIS A1280 " d_HA=1.988 d_AD=3.307 a_DHA=166.101 symop: x,y,z a_YAH=146 a_YAH=90 2711 3297 " H HIS A1280 "<>" O GLN A1245 " d_HA=1.945 d_AD=2.919 a_DHA=160.684 symop: x,y,z a_YAH=139 2723 2728 "HE21 GLN A1245 "<>" O LEU A1246 " d_HA=1.866 d_AD=2.856 a_DHA=162.396 symop: x,y,z a_YAH=134 2733 4151 " H LEU A1246 "<>" O LEU A1333 " d_HA=2.032 d_AD=2.993 a_DHA=156.831 symop: x,y,z a_YAH=159 2701 4156 " H LEU A1333 "<>" O ALA A1244 " d_HA=1.888 d_AD=2.866 a_DHA=159.947 symop: x,y,z a_YAH=157 432 4137 " H ILE A1332 "<>" O PRO A1106 " d_HA=2.041 d_AD=3.000 a_DHA=157.075 symop: x,y,z a_YAH=150 344 422 " H THR A1101 "<>" O ALA A1105 " d_HA=1.828 d_AD=2.829 a_DHA=167.793 symop: x,y,z a_YAH=156 4269 4306 " H HIS A1342 "<>" OD1 ASP A1340 " d_HA=1.847 d_AD=2.856 a_DHA=168.208 symop: x,y,z a_YAH=120 4231 4539 " HE1 TRP A1356 "<>" O CYS A1338 " d_HA=2.056 d_AD=2.984 a_DHA=150.834 symop: x,y,z a_YAH=111 293 494 " HE1 TRP A1109 "<>" O VAL A1098 " d_HA=1.907 d_AD=2.837 a_DHA=150.351 symop: x,y,z a_YAH=141 309 450 " H VAL A1107 "<>" O THR A1099 " d_HA=1.900 d_AD=2.893 a_DHA=164.926 symop: x,y,z a_YAH=123 7435 8965 " HZ1 LYS B2252 "<>" OD2 ASP B2348 " d_HA=1.902 d_AD=2.636 a_DHA=125.546 symop: x,y,z a_YAH=99 4266 4321 " H ILE A1343 "<>" O ASP A1340 " d_HA=2.211 d_AD=3.145 a_DHA=152.294 symop: x,y,z a_YAH=113 4278 4336 " H GLY A1344 "<>" O TYR A1341 " d_HA=2.043 d_AD=2.891 a_DHA=139.836 symop: x,y,z a_YAH=101 4299 6532 "HE21 GLN B2196 "<>" O HIS A1342 " d_HA=1.837 d_AD=2.852 a_DHA=175.250 symop: x-1/2,-y+1/2,-z a_YAH=139 2839 4389 " HH TYR A1251 "<>" OD2 ASP A1348 " d_HA=1.747 d_AD=2.710 a_DHA=170.265 symop: x,y,z a_YAH=106 277 316 " HG1 THR A1099 "<>" O VAL A1097 " d_HA=2.658 d_AD=3.505 a_DHA=146.268 symop: x,y,z a_YAH=155 4853 4892 " HG1 THR B2099 "<>" O VAL B2097 " d_HA=2.971 d_AD=3.823 a_DHA=147.631 symop: x,y,z a_YAH=150 4869 5070 " HE1 TRP B2109 "<>" O VAL B2098 " d_HA=1.864 d_AD=2.780 a_DHA=147.910 symop: x,y,z a_YAH=148 4316 6542 " H ASP B2197 "<>" O ILE A1343 " d_HA=2.103 d_AD=2.985 a_DHA=144.070 symop: x-1/2,-y+1/2,-z a_YAH=144 4347 6540 " H LEU A1345 "<>" OD1 ASP B2197 " d_HA=2.985 d_AD=3.948 a_DHA=159.460 symop: x-1/2,-y+1/2,-z a_YAH=145 4916 4982 " H LYS B2104 "<>" O THR B2101 " d_HA=1.943 d_AD=2.890 a_DHA=154.053 symop: x,y,z a_YAH=119 4920 4998 " H THR B2101 "<>" O ALA B2105 " d_HA=1.928 d_AD=2.926 a_DHA=166.262 symop: x,y,z a_YAH=155 7323 7407 " H TYR B2251 "<>" O GLN B2247 " d_HA=2.361 d_AD=3.197 a_DHA=139.173 symop: x,y,z a_YAH=167 7323 7385 " H TRP B2250 "<>" O GLN B2247 " d_HA=2.442 d_AD=3.119 a_DHA=123.734 symop: x,y,z a_YAH=107 7327 7361 " H TRP B2249 "<>" OE1 GLN B2247 " d_HA=2.003 d_AD=2.988 a_DHA=162.164 symop: x,y,z a_YAH=166 8119 8177 " HZ2 LYS B2300 "<>" OE2 GLU B2297 " d_HA=1.962 d_AD=2.834 a_DHA=141.201 symop: x,y,z a_YAH=101 8097 8166 " H LYS B2300 "<>" O GLN B2296 " d_HA=2.142 d_AD=3.083 a_DHA=153.014 symop: x,y,z a_YAH=130 8140 8213 " H LEU B2303 "<>" O PHE B2299 " d_HA=1.853 d_AD=2.831 a_DHA=160.390 symop: x,y,z a_YAH=156 6541 8277 " HZ1 LYS B2306 "<>" OD2 ASP B2197 " d_HA=1.786 d_AD=2.730 a_DHA=151.202 symop: x,y,z a_YAH=92 4918 4963 " H TRP B2103 "<>" OG1 THR B2101 " d_HA=2.489 d_AD=3.255 a_DHA=132.279 symop: x,y,z a_YAH=98 a_YAH=100 4918 5000 " H ALA B2105 "<>" OG1 THR B2101 " d_HA=2.113 d_AD=3.063 a_DHA=155.813 symop: x,y,z a_YAH=147 a_YAH=92 7329 7824 " H GLN B2247 "<>" O TYR B2278 " d_HA=1.978 d_AD=2.986 a_DHA=171.431 symop: x,y,z a_YAH=144 7845 8516 "HD21 ASN B2321 "<>" O TYR B2279 " d_HA=1.894 d_AD=2.842 a_DHA=153.982 symop: x,y,z a_YAH=141 7854 8510 " H TYR B2279 "<>" OD1 ASN B2321 " d_HA=1.781 d_AD=2.794 a_DHA=175.418 symop: x,y,z a_YAH=129 7841 8449 " HH TYR B2278 "<>" OE1 GLU B2317 " d_HA=1.617 d_AD=2.598 a_DHA=170.541 symop: x,y,z a_YAH=121 8050 8120 " H GLU B2297 "<>" O ASN B2293 " d_HA=2.232 d_AD=3.135 a_DHA=147.618 symop: x,y,z a_YAH=131 8064 8120 " H GLU B2297 "<>" O ILE B2294 " d_HA=2.866 d_AD=3.509 a_DHA=121.935 symop: x,y,z a_YAH=93 8064 8132 " H CYS B2298 "<>" O ILE B2294 " d_HA=1.940 d_AD=2.948 a_DHA=172.132 symop: x,y,z a_YAH=154 8064 8136 " HG CYS B2298 "<>" O ILE B2294 " d_HA=1.842 d_AD=3.140 a_DHA=160.843 symop: x,y,z a_YAH=133 8114 8183 " H GLY B2301 "<>" O GLU B2297 " d_HA=1.849 d_AD=2.838 a_DHA=163.220 symop: x,y,z a_YAH=159 8129 8194 " H ILE B2302 "<>" O CYS B2298 " d_HA=1.873 d_AD=2.888 a_DHA=175.414 symop: x,y,z a_YAH=161 6575 8437 " HG SER B2199 "<>" OD2 ASP B2316 " d_HA=1.590 d_AD=2.576 a_DHA=172.010 symop: x,y,z a_YAH=118 8416 8478 " H HIS B2319 "<>" O HIS B2315 " d_HA=2.571 d_AD=3.466 a_DHA=146.733 symop: x,y,z a_YAH=142 8416 8463 " H SER B2318 "<>" O HIS B2315 " d_HA=2.519 d_AD=3.249 a_DHA=128.208 symop: x,y,z a_YAH=108 4968 8658 " HE1 TRP B2103 "<>" O PRO B2329 " d_HA=1.873 d_AD=2.893 a_DHA=172.616 symop: x,y,z a_YAH=140 8445 8512 " H ASN B2321 "<>" O GLU B2317 " d_HA=2.057 d_AD=3.026 a_DHA=158.352 symop: x,y,z a_YAH=143 8445 8517 "HD22 ASN B2321 "<>" O GLU B2317 " d_HA=1.807 d_AD=2.792 a_DHA=161.843 symop: x,y,z a_YAH=128 8392 8463 " H SER B2318 "<>" O TRP B2314 " d_HA=2.158 d_AD=3.096 a_DHA=152.254 symop: x,y,z a_YAH=114 8488 8572 " H PHE B2324 "<>" O LEU B2320 " d_HA=1.820 d_AD=2.824 a_DHA=167.931 symop: x,y,z a_YAH=149 8433 8478 " H HIS B2319 "<>" O ASP B2316 " d_HA=2.179 d_AD=2.857 a_DHA=122.553 symop: x,y,z a_YAH=107 8433 8493 " H LEU B2320 "<>" O ASP B2316 " d_HA=1.732 d_AD=2.745 a_DHA=175.957 symop: x,y,z a_YAH=169 8451 8436 " H GLU B2317 "<>" OD1 ASP B2316 " d_HA=2.293 d_AD=2.993 a_DHA=124.786 symop: x,y,z a_YAH=104 8478 8416 " H HIS B2319 "<>" O HIS B2315 " d_HA=2.571 d_AD=3.466 a_DHA=146.733 symop: x,y,z a_YAH=142 2140 2209 " H ALA A1212 "<>" O GLU A1208 " d_HA=2.022 d_AD=2.995 a_DHA=159.344 symop: x,y,z a_YAH=141 2100 2162 " H HIS A1209 "<>" O THR A1205 " d_HA=1.861 d_AD=2.863 a_DHA=167.439 symop: x,y,z a_YAH=161 2114 2177 " H ILE A1210 "<>" O ILE A1206 " d_HA=1.805 d_AD=2.773 a_DHA=158.449 symop: x,y,z a_YAH=154 2133 2195 " H VAL A1211 "<>" O GLY A1207 " d_HA=1.983 d_AD=2.981 a_DHA=166.267 symop: x,y,z a_YAH=152 3394 3460 " H LEU A1292 "<>" O PRO A1288 " d_HA=1.800 d_AD=2.784 a_DHA=162.257 symop: x,y,z a_YAH=153 1418 908 " H ALA A1135 "<>" O MET A1166 " d_HA=1.972 d_AD=2.950 a_DHA=161.035 symop: x,y,z a_YAH=169 3380 3428 " H GLN A1290 "<>" O THR A1287 " d_HA=2.195 d_AD=2.884 a_DHA=123.732 symop: x,y,z a_YAH=109 3380 3443 " H VAL A1291 "<>" O THR A1287 " d_HA=1.900 d_AD=2.904 a_DHA=169.331 symop: x,y,z a_YAH=161 2663 3434 "HE21 GLN A1290 "<>" OE1 GLU A1241 " d_HA=1.845 d_AD=2.846 a_DHA=163.237 symop: x,y,z a_YAH=138 2664 3387 " HG1 THR A1287 "<>" OE2 GLU A1241 " d_HA=1.906 d_AD=2.887 a_DHA=175.768 symop: x,y,z a_YAH=139 3382 3428 " H GLN A1290 "<>" OG1 THR A1287 " d_HA=2.534 d_AD=3.442 a_DHA=148.958 symop: x,y,z a_YAH=118 a_YAH=132 933 1454 " H GLY A1137 "<>" OD1 ASP A1168 " d_HA=1.818 d_AD=2.836 a_DHA=172.746 symop: x,y,z a_YAH=106 906 1456 " H ASP A1168 "<>" O ALA A1135 " d_HA=2.942 d_AD=3.764 a_DHA=138.653 symop: x,y,z a_YAH=139 856 2405 " H MET A1224 "<>" O THR A1132 " d_HA=1.926 d_AD=2.938 a_DHA=174.471 symop: x,y,z a_YAH=162 2389 3354 " H PHE A1284 "<>" O CYS A1223 " d_HA=2.155 d_AD=3.154 a_DHA=166.374 symop: x,y,z a_YAH=155 2350 3374 " H GLY A1286 "<>" O LEU A1221 " d_HA=1.975 d_AD=2.928 a_DHA=154.688 symop: x,y,z a_YAH=153 2392 3346 " H CYS A1223 "<>" O PHE A1284 " d_HA=1.751 d_AD=2.762 a_DHA=178.478 symop: x,y,z a_YAH=174 2689 3366 " H VAL A1243 "<>" O GLY A1285 " d_HA=1.767 d_AD=2.737 a_DHA=158.175 symop: x,y,z a_YAH=140 2659 3384 " H THR A1287 "<>" O GLU A1241 " d_HA=1.860 d_AD=2.818 a_DHA=155.840 symop: x,y,z a_YAH=140 2665 4098 " H GLU A1241 "<>" OG1 THR A1330 " d_HA=2.270 d_AD=3.004 a_DHA=128.382 symop: x,y,z a_YAH=136 a_YAH=112 916 972 " H TYR A1139 "<>" O VAL A1136 " d_HA=2.275 d_AD=3.255 a_DHA=163.395 symop: x,y,z a_YAH=128 932 989 " H ILE A1140 "<>" O GLY A1137 " d_HA=1.893 d_AD=2.851 a_DHA=156.545 symop: x,y,z a_YAH=140 932 1009 " H GLU A1141 "<>" O GLY A1137 " d_HA=2.735 d_AD=3.688 a_DHA=157.905 symop: x,y,z a_YAH=137 908 1418 " H ALA A1135 "<>" O MET A1166 " d_HA=1.972 d_AD=2.950 a_DHA=161.035 symop: x,y,z a_YAH=169 2429 2463 " H GLN A1228 "<>" O VAL A1226 " d_HA=1.950 d_AD=2.890 a_DHA=152.594 symop: x,y,z a_YAH=93 2417 2469 "HE21 GLN A1228 "<>" O ASP A1225 " d_HA=1.780 d_AD=2.783 a_DHA=169.298 symop: x,y,z a_YAH=117 2422 3317 " H ASP A1225 "<>" O ALA A1282 " d_HA=2.167 d_AD=3.126 a_DHA=156.962 symop: x,y,z a_YAH=126 2470 3317 "HE22 GLN A1228 "<>" O ALA A1282 " d_HA=1.999 d_AD=2.913 a_DHA=149.794 symop: x,y,z a_YAH=114 939 1025 " H HIS A1142 "<>" O ARG A1138 " d_HA=2.080 d_AD=2.924 a_DHA=139.586 symop: x,y,z a_YAH=146 963 1044 " H TYR A1143 "<>" O TYR A1139 " d_HA=2.091 d_AD=3.047 a_DHA=157.259 symop: x,y,z a_YAH=131 963 1061 " H LEU A1144 "<>" O TYR A1139 " d_HA=2.574 d_AD=3.387 a_DHA=137.224 symop: x,y,z a_YAH=140 2445 4553 " H GLN A1357 "<>" O ASP A1227 " d_HA=1.946 d_AD=2.866 a_DHA=149.128 symop: x,y,z a_YAH=137 2724 4170 "HE22 GLN A1245 "<>" O SER A1334 " d_HA=1.857 d_AD=2.831 a_DHA=160.489 symop: x,y,z a_YAH=116 466 4132 " H VAL A1108 "<>" O ILE A1332 " d_HA=1.762 d_AD=2.761 a_DHA=166.793 symop: x,y,z a_YAH=159 4843 9008 " HZ1 LYS B2350 "<>" OE2 GLU B2096 " d_HA=1.850 d_AD=2.631 a_DHA=130.009 symop: x,y,z a_YAH=114 1052 4564 " HH TYR A1143 "<>" O THR A1358 " d_HA=2.737 d_AD=3.705 a_DHA=177.945 symop: x,y,z a_YAH=121 4242 4534 " H TRP A1356 "<>" O TRP A1339 " d_HA=2.039 d_AD=2.982 a_DHA=153.448 symop: x,y,z a_YAH=133 4253 4495 " H TRP A1339 "<>" O MET A1354 " d_HA=1.893 d_AD=2.889 a_DHA=166.759 symop: x,y,z a_YAH=151 4170 4219 " H TYR A1337 "<>" O SER A1334 " d_HA=1.974 d_AD=2.963 a_DHA=164.531 symop: x,y,z a_YAH=128 4181 4234 " H CYS A1338 "<>" O PRO A1335 " d_HA=1.923 d_AD=2.908 a_DHA=163.410 symop: x,y,z a_YAH=112 4195 4500 " H MET A1354 "<>" O GLU A1336 " d_HA=2.644 d_AD=3.598 a_DHA=157.539 symop: x,y,z a_YAH=143 4195 4479 " H LYS A1353 "<>" O GLU A1336 " d_HA=1.710 d_AD=2.723 a_DHA=177.702 symop: x,y,z a_YAH=155 462 4173 " H SER A1334 "<>" O VAL A1108 " d_HA=1.981 d_AD=2.916 a_DHA=152.440 symop: x,y,z a_YAH=151 4172 4201 " H GLU A1336 "<>" OG SER A1334 " d_HA=2.393 d_AD=3.259 a_DHA=143.427 symop: x,y,z a_YAH=101 a_YAH=100 4177 4199 " HG SER A1334 "<>" OE1 GLU A1336 " d_HA=1.759 d_AD=2.716 a_DHA=163.611 symop: x,y,z a_YAH=123 4800 4857 " H VAL B2097 "<>" O ARG B2094 " d_HA=2.638 d_AD=3.603 a_DHA=159.850 symop: x,y,z a_YAH=118 4819 4842 "HH21 ARG B2094 "<>" OE1 GLU B2096 " d_HA=1.904 d_AD=2.774 a_DHA=141.785 symop: x,y,z a_YAH=136 7415 8965 " HH TYR B2251 "<>" OD2 ASP B2348 " d_HA=1.780 d_AD=2.742 a_DHA=170.027 symop: x,y,z a_YAH=95 4258 4335 " HE1 TRP A1339 "<>" O GLY A1344 " d_HA=1.906 d_AD=2.837 a_DHA=150.668 symop: x,y,z a_YAH=159 242 4200 "HH12 ARG A1094 "<>" OE2 GLU A1336 " d_HA=1.735 d_AD=2.756 a_DHA=170.507 symop: x,y,z a_YAH=123 244 4385 "HH22 ARG A1094 "<>" O ASP A1348 " d_HA=1.739 d_AD=2.656 a_DHA=147.252 symop: x,y,z a_YAH=135 4200 4422 " H LYS A1350 "<>" OE2 GLU A1336 " d_HA=1.985 d_AD=2.909 a_DHA=149.611 symop: x,y,z a_YAH=125 224 281 " H VAL A1097 "<>" O ARG A1094 " d_HA=2.360 d_AD=3.364 a_DHA=172.496 symop: x,y,z a_YAH=120 168 232 " H ARG A1094 "<>" O PRO A1091 " d_HA=1.957 d_AD=2.906 a_DHA=154.498 symop: x,y,z a_YAH=123 4744 4808 " H ARG B2094 "<>" O PRO B2091 " d_HA=1.918 d_AD=2.903 a_DHA=162.815 symop: x,y,z a_YAH=126 8189 8267 " H LYS B2306 "<>" O ILE B2302 " d_HA=1.842 d_AD=2.843 a_DHA=166.457 symop: x,y,z a_YAH=154 8208 8289 " H LYS B2307 "<>" O LEU B2303 " d_HA=2.005 d_AD=2.979 a_DHA=159.686 symop: x,y,z a_YAH=146 4361 4402 " H ILE A1349 "<>" O PRO A1346 " d_HA=1.826 d_AD=2.832 a_DHA=169.693 symop: x,y,z a_YAH=139 240 267 " HE ARG A1094 "<>" OE2 GLU A1096 " d_HA=1.819 d_AD=2.739 a_DHA=149.018 symop: x,y,z a_YAH=105 243 267 "HH21 ARG A1094 "<>" OE2 GLU A1096 " d_HA=1.846 d_AD=2.723 a_DHA=142.362 symop: x,y,z a_YAH=161 267 4434 " HZ3 LYS A1350 "<>" OE2 GLU A1096 " d_HA=1.957 d_AD=2.719 a_DHA=129.504 symop: x,y,z a_YAH=112 4375 4433 " HZ2 LYS A1350 "<>" O ALA A1347 " d_HA=1.727 d_AD=2.669 a_DHA=151.974 symop: x,y,z a_YAH=152 266 4432 " HZ1 LYS A1350 "<>" OE1 GLU A1096 " d_HA=1.983 d_AD=2.838 a_DHA=139.893 symop: x,y,z a_YAH=103 4885 5026 " H VAL B2107 "<>" O THR B2099 " d_HA=1.929 d_AD=2.940 a_DHA=174.830 symop: x,y,z a_YAH=118 5042 8708 " H VAL B2108 "<>" O ILE B2332 " d_HA=1.794 d_AD=2.805 a_DHA=172.040 symop: x,y,z a_YAH=160 7299 7304 "HE21 GLN B2245 "<>" O LEU B2246 " d_HA=1.846 d_AD=2.845 a_DHA=166.059 symop: x,y,z a_YAH=132 7300 8746 "HE22 GLN B2245 "<>" O SER B2334 " d_HA=1.886 d_AD=2.874 a_DHA=165.051 symop: x,y,z a_YAH=111 7366 8846 " HE1 TRP B2249 "<>" OD2 ASP B2340 " d_HA=1.857 d_AD=2.751 a_DHA=143.157 symop: x,y,z a_YAH=118 8118 8178 " HZ3 LYS B2300 "<>" OE1 GLU B2297 " d_HA=1.734 d_AD=2.592 a_DHA=137.981 symop: x,y,z a_YAH=114 8160 8233 " H LYS B2304 "<>" O LYS B2300 " d_HA=1.982 d_AD=2.941 a_DHA=155.622 symop: x,y,z a_YAH=144 8279 8354 " HZ3 LYS B2306 "<>" OE1 GLU B2311 " d_HA=1.736 d_AD=2.605 a_DHA=140.643 symop: x,y,z a_YAH=151 5008 8713 " H ILE B2332 "<>" O PRO B2106 " d_HA=1.937 d_AD=2.916 a_DHA=161.847 symop: x,y,z a_YAH=163 7277 8732 " H LEU B2333 "<>" O ALA B2244 " d_HA=1.849 d_AD=2.833 a_DHA=161.339 symop: x,y,z a_YAH=159 7293 7903 " H GLN B2245 "<>" O ILE B2283 " d_HA=2.611 d_AD=3.389 a_DHA=133.133 symop: x,y,z a_YAH=165 7309 8727 " H LEU B2246 "<>" O LEU B2333 " d_HA=2.019 d_AD=3.006 a_DHA=163.412 symop: x,y,z a_YAH=158 7287 7873 " H HIS B2280 "<>" O GLN B2245 " d_HA=1.871 d_AD=2.827 a_DHA=156.678 symop: x,y,z a_YAH=149 7869 7895 " H ALA B2282 "<>" ND1 HIS B2280 " d_HA=2.240 d_AD=3.148 a_DHA=148.650 symop: x,y,z a_YAH=122 a_YAH=112 8182 8254 " H ASP B2305 "<>" O GLY B2301 " d_HA=1.942 d_AD=2.945 a_DHA=168.669 symop: x,y,z a_YAH=157 8365 8423 " H HIS B2315 "<>" O ALA B2312 " d_HA=2.113 d_AD=3.043 a_DHA=151.811 symop: x,y,z a_YAH=117 7250 8679 " HG1 THR B2330 "<>" O SER B2242 " d_HA=1.891 d_AD=2.836 a_DHA=162.957 symop: x,y,z a_YAH=125 7250 8692 " H LYS B2331 "<>" O SER B2242 " d_HA=2.182 d_AD=3.025 a_DHA=138.885 symop: x,y,z a_YAH=155 7265 7942 " H VAL B2243 "<>" O GLY B2285 " d_HA=1.788 d_AD=2.727 a_DHA=151.357 symop: x,y,z a_YAH=148 8676 7252 " H THR B2330 "<>" OG SER B2242 " d_HA=2.172 d_AD=3.156 a_DHA=162.185 symop: x,y,z a_YAH=130 a_YAH=123 7261 7943 " H GLY B2285 "<>" O VAL B2243 " d_HA=1.983 d_AD=2.901 a_DHA=149.259 symop: x,y,z a_YAH=145 7279 8686 " H ALA B2244 "<>" O LYS B2331 " d_HA=2.247 d_AD=3.206 a_DHA=158.376 symop: x,y,z a_YAH=148 7866 7908 " H ILE B2283 "<>" O HIS B2280 " d_HA=2.799 d_AD=3.780 a_DHA=163.351 symop: x,y,z a_YAH=103 7885 8450 " H ALA B2281 "<>" OE2 GLU B2317 " d_HA=2.356 d_AD=3.298 a_DHA=153.648 symop: x,y,z a_YAH=111 8521 8608 " H LEU B2326 "<>" O LYS B2322 " d_HA=1.983 d_AD=2.996 a_DHA=172.499 symop: x,y,z a_YAH=160 8521 8589 " H LEU B2325 "<>" O LYS B2322 " d_HA=2.416 d_AD=3.171 a_DHA=130.482 symop: x,y,z a_YAH=94 8543 8632 "HD22 ASN B2327 "<>" O TYR B2323 " d_HA=2.935 d_AD=3.657 a_DHA=129.112 symop: x,y,z a_YAH=117 8543 8627 " H ASN B2327 "<>" O TYR B2323 " d_HA=1.722 d_AD=2.697 a_DHA=160.157 symop: x,y,z a_YAH=160 8471 8552 " H TYR B2323 "<>" O HIS B2319 " d_HA=1.737 d_AD=2.744 a_DHA=171.427 symop: x,y,z a_YAH=163 8460 8527 " H LYS B2322 "<>" O SER B2318 " d_HA=2.614 d_AD=3.455 a_DHA=140.064 symop: x,y,z a_YAH=125 2155 2224 " H HIS A1213 "<>" O HIS A1209 " d_HA=1.883 d_AD=2.886 a_DHA=168.812 symop: x,y,z a_YAH=154 2155 2239 " H ILE A1214 "<>" O HIS A1209 " d_HA=2.274 d_AD=3.067 a_DHA=134.059 symop: x,y,z a_YAH=137 2220 2239 " H ILE A1214 "<>" ND1 HIS A1213 " d_HA=2.273 d_AD=2.969 a_DHA=124.596 symop: x,y,z a_YAH=99 a_YAH=130 2172 2259 " H GLN A1215 "<>" O ILE A1210 " d_HA=2.135 d_AD=3.109 a_DHA=160.442 symop: x,y,z a_YAH=138 2217 2277 " H HIS A1216 "<>" O HIS A1213 " d_HA=1.859 d_AD=2.848 a_DHA=163.167 symop: x,y,z a_YAH=146 2217 2293 " H GLU A1217 "<>" O HIS A1213 " d_HA=2.548 d_AD=3.414 a_DHA=143.408 symop: x,y,z a_YAH=135 2234 2293 " H GLU A1217 "<>" O ILE A1214 " d_HA=2.317 d_AD=3.034 a_DHA=126.795 symop: x,y,z a_YAH=97 2234 2306 " H VAL A1218 "<>" O ILE A1214 " d_HA=2.201 d_AD=3.116 a_DHA=149.024 symop: x,y,z a_YAH=164 1466 1494 " H SER A1171 "<>" OD1 ASP A1169 " d_HA=2.100 d_AD=3.083 a_DHA=162.038 symop: x,y,z a_YAH=139 1467 1520 "HH12 ARG A1172 "<>" OD2 ASP A1169 " d_HA=1.701 d_AD=2.668 a_DHA=156.198 symop: x,y,z a_YAH=107 1467 1522 "HH22 ARG A1172 "<>" OD2 ASP A1169 " d_HA=2.669 d_AD=3.361 a_DHA=126.130 symop: x,y,z a_YAH=98 1435 1809 " H ILE A1189 "<>" O VAL A1167 " d_HA=1.842 d_AD=2.846 a_DHA=168.865 symop: x,y,z a_YAH=135 1399 1770 " H PHE A1187 "<>" O ILE A1165 " d_HA=1.872 d_AD=2.825 a_DHA=154.918 symop: x,y,z a_YAH=169 870 1423 " H MET A1166 "<>" O VAL A1133 " d_HA=1.881 d_AD=2.897 a_DHA=177.701 symop: x,y,z a_YAH=166 1463 1510 " H ARG A1172 "<>" O ASP A1169 " d_HA=2.155 d_AD=3.149 a_DHA=165.627 symop: x,y,z a_YAH=134 1439 1762 " H VAL A1167 "<>" O PHE A1187 " d_HA=1.927 d_AD=2.938 a_DHA=172.507 symop: x,y,z a_YAH=177 874 1378 " H VAL A1133 "<>" O TYR A1164 " d_HA=1.951 d_AD=2.951 a_DHA=167.083 symop: x,y,z a_YAH=174 837 1387 " H TYR A1164 "<>" O LEU A1131 " d_HA=1.778 d_AD=2.784 a_DHA=172.001 symop: x,y,z a_YAH=160 860 2369 " H THR A1132 "<>" O PHE A1222 " d_HA=1.803 d_AD=2.782 a_DHA=160.364 symop: x,y,z a_YAH=158 830 2377 " H PHE A1222 "<>" O GLY A1130 " d_HA=1.907 d_AD=2.884 a_DHA=160.695 symop: x,y,z a_YAH=135 2355 3373 " H LEU A1221 "<>" O GLY A1286 " d_HA=1.783 d_AD=2.788 a_DHA=170.287 symop: x,y,z a_YAH=174 1008 1518 " HE ARG A1172 "<>" OE2 GLU A1141 " d_HA=1.974 d_AD=2.956 a_DHA=159.507 symop: x,y,z a_YAH=153 1113 1035 " H PHE A1147 "<>" O TYR A1143 " d_HA=1.864 d_AD=2.872 a_DHA=170.638 symop: x,y,z a_YAH=168 2633 4128 " HZ3 LYS A1331 "<>" O LEU A1239 " d_HA=1.767 d_AD=2.708 a_DHA=151.229 symop: x,y,z a_YAH=146 984 1061 " H LEU A1144 "<>" O ILE A1140 " d_HA=2.431 d_AD=3.268 a_DHA=139.703 symop: x,y,z a_YAH=116 1035 1113 " H PHE A1147 "<>" O TYR A1143 " d_HA=1.864 d_AD=2.872 a_DHA=170.638 symop: x,y,z a_YAH=168 2478 4512 " H VAL A1229 "<>" O SER A1355 " d_HA=1.851 d_AD=2.843 a_DHA=164.065 symop: x,y,z a_YAH=162 2609 4227 " HH TYR A1337 "<>" OE2 GLU A1237 " d_HA=1.804 d_AD=2.774 a_DHA=173.079 symop: x,y,z a_YAH=108 68 121 " H TRP A1088 "<>" O LEU A1085 " d_HA=2.229 d_AD=3.164 a_DHA=153.094 symop: x,y,z a_YAH=128 68 142 " H PHE A1089 "<>" O LEU A1085 " d_HA=1.862 d_AD=2.816 a_DHA=156.087 symop: x,y,z a_YAH=163 46 103 " H ASP A1087 "<>" O LYS A1084 " d_HA=2.144 d_AD=3.102 a_DHA=157.566 symop: x,y,z a_YAH=107 1094 4560 "HE22 GLN A1357 "<>" OE1 GLU A1146 " d_HA=1.777 d_AD=2.756 a_DHA=157.513 symop: x,y,z a_YAH=120 2474 4515 " H SER A1355 "<>" O VAL A1229 " d_HA=1.977 d_AD=2.967 a_DHA=163.956 symop: x,y,z a_YAH=148 4519 4523 " HG SER A1355 "<>" O TRP A1356 " d_HA=2.712 d_AD=3.548 a_DHA=144.637 symop: x,y,z a_YAH=121 2516 4473 " H GLN A1231 "<>" O LYS A1353 " d_HA=2.005 d_AD=2.816 a_DHA=135.623 symop: x,y,z a_YAH=109 478 531 " HG1 THR A1112 "<>" O TRP A1109 " d_HA=1.630 d_AD=2.604 a_DHA=172.131 symop: x,y,z a_YAH=137 478 528 " H THR A1112 "<>" O TRP A1109 " d_HA=2.163 d_AD=3.119 a_DHA=156.374 symop: x,y,z a_YAH=133 110 564 " H ASN A1114 "<>" O TRP A1088 " d_HA=1.800 d_AD=2.768 a_DHA=158.508 symop: x,y,z a_YAH=150 159 524 " H ASN A1090 "<>" O THR A1112 " d_HA=1.814 d_AD=2.803 a_DHA=162.776 symop: x,y,z a_YAH=146 87 4794 " HZ1 LYS B2093 "<>" O SER A1086 " d_HA=1.750 d_AD=2.746 a_DHA=164.491 symop: -x+1,y+1/2,-z+1/2 a_YAH=130 4816 4842 " HE ARG B2094 "<>" OE1 GLU B2096 " d_HA=1.884 d_AD=2.795 a_DHA=147.366 symop: x,y,z a_YAH=157 4820 8961 "HH22 ARG B2094 "<>" O ASP B2348 " d_HA=1.789 d_AD=2.658 a_DHA=140.493 symop: x,y,z a_YAH=142 8937 8978 " H ILE B2349 "<>" O PRO B2346 " d_HA=2.087 d_AD=3.093 a_DHA=169.463 symop: x,y,z a_YAH=128 4551 4569 " H THR A1358 "<>" OE1 GLN A1357 " d_HA=2.733 d_AD=3.553 a_DHA=138.001 symop: x,y,z a_YAH=114 2514 4295 " HH TYR A1341 "<>" OE1 GLN A1231 " d_HA=2.913 d_AD=3.840 a_DHA=162.163 symop: x,y,z a_YAH=120 4438 4491 " HZ3 LYS A1353 "<>" O LEU A1351 " d_HA=1.870 d_AD=2.847 a_DHA=159.714 symop: x,y,z a_YAH=131 241 502 "HH11 ARG A1094 "<>" O GLU A1110 " d_HA=2.112 d_AD=3.119 a_DHA=175.822 symop: x,y,z a_YAH=115 506 4489 " HZ1 LYS A1353 "<>" OE1 GLU A1110 " d_HA=1.673 d_AD=2.687 a_DHA=170.240 symop: x,y,z a_YAH=161 508 4199 " H GLU A1110 "<>" OE1 GLU A1336 " d_HA=1.780 d_AD=2.760 a_DHA=158.742 symop: x,y,z a_YAH=106 154 208 " H LYS A1093 "<>" O ASN A1090 " d_HA=2.176 d_AD=3.160 a_DHA=162.728 symop: x,y,z a_YAH=118 157 190 " H PHE A1092 "<>" OD1 ASN A1090 " d_HA=2.394 d_AD=3.113 a_DHA=127.455 symop: x,y,z a_YAH=144 4733 4766 " H PHE B2092 "<>" OD1 ASN B2090 " d_HA=2.396 d_AD=3.108 a_DHA=126.678 symop: x,y,z a_YAH=145 4730 4784 " H LYS B2093 "<>" O ASN B2090 " d_HA=2.105 d_AD=3.104 a_DHA=166.822 symop: x,y,z a_YAH=125 4735 5100 " H ASN B2090 "<>" O THR B2112 " d_HA=1.883 d_AD=2.884 a_DHA=167.358 symop: x,y,z a_YAH=144 4817 5078 "HH11 ARG B2094 "<>" O GLU B2110 " d_HA=1.962 d_AD=2.970 a_DHA=173.674 symop: x,y,z a_YAH=123 5054 5104 " H THR B2112 "<>" O TRP B2109 " d_HA=2.154 d_AD=3.104 a_DHA=155.269 symop: x,y,z a_YAH=133 5054 5107 " HG1 THR B2112 "<>" O TRP B2109 " d_HA=1.642 d_AD=2.618 a_DHA=174.552 symop: x,y,z a_YAH=136 4818 8776 "HH12 ARG B2094 "<>" OE2 GLU B2336 " d_HA=1.770 d_AD=2.783 a_DHA=167.001 symop: x,y,z a_YAH=120 5084 8775 " H GLU B2110 "<>" OE1 GLU B2336 " d_HA=1.776 d_AD=2.783 a_DHA=167.251 symop: x,y,z a_YAH=113 8753 8775 " HG SER B2334 "<>" OE1 GLU B2336 " d_HA=1.717 d_AD=2.674 a_DHA=163.488 symop: x,y,z a_YAH=126 8776 8998 " H LYS B2350 "<>" OE2 GLU B2336 " d_HA=1.964 d_AD=2.923 a_DHA=155.371 symop: x,y,z a_YAH=126 8842 8897 " H ILE B2343 "<>" O ASP B2340 " d_HA=2.305 d_AD=3.163 a_DHA=141.616 symop: x,y,z a_YAH=113 8854 8912 " H GLY B2344 "<>" O TYR B2341 " d_HA=2.041 d_AD=2.810 a_DHA=130.911 symop: x,y,z a_YAH=96 8227 8315 "HD22 ASN B2308 "<>" O LYS B2304 " d_HA=1.871 d_AD=2.876 a_DHA=169.112 symop: x,y,z a_YAH=143 8249 8310 " H ASN B2308 "<>" O ASP B2305 " d_HA=2.018 d_AD=2.935 a_DHA=149.568 symop: x,y,z a_YAH=106 8249 8336 " H ILE B2310 "<>" O ASP B2305 " d_HA=2.021 d_AD=3.027 a_DHA=170.044 symop: x,y,z a_YAH=138 8261 8324 " H ASP B2309 "<>" O LYS B2306 " d_HA=2.209 d_AD=3.209 a_DHA=169.671 symop: x,y,z a_YAH=113 4640 4665 " HZ3 LYS B2084 "<>" OG SER B2086 " d_HA=2.120 d_AD=2.973 a_DHA=139.984 symop: x,y,z a_YAH=114 a_YAH=127 4670 4677 " HG SER B2086 "<>" OD1 ASP B2087 " d_HA=2.718 d_AD=3.665 a_DHA=164.098 symop: x,y,z a_YAH=123 4644 4697 " H TRP B2088 "<>" O LEU B2085 " d_HA=2.314 d_AD=3.247 a_DHA=152.829 symop: x,y,z a_YAH=125 4644 4718 " H PHE B2089 "<>" O LEU B2085 " d_HA=1.900 d_AD=2.869 a_DHA=159.140 symop: x,y,z a_YAH=167 5038 8749 " H SER B2334 "<>" O VAL B2108 " d_HA=2.057 d_AD=2.998 a_DHA=153.413 symop: x,y,z a_YAH=144 8746 8795 " H TYR B2337 "<>" O SER B2334 " d_HA=1.922 d_AD=2.920 a_DHA=167.095 symop: x,y,z a_YAH=132 8748 8777 " H GLU B2336 "<>" OG SER B2334 " d_HA=2.299 d_AD=3.205 a_DHA=148.686 symop: x,y,z a_YAH=104 a_YAH=100 8757 8810 " H CYS B2338 "<>" O PRO B2335 " d_HA=2.090 d_AD=3.063 a_DHA=161.021 symop: x,y,z a_YAH=109 8771 9055 " H LYS B2353 "<>" O GLU B2336 " d_HA=1.719 d_AD=2.732 a_DHA=174.911 symop: x,y,z a_YAH=157 8771 9076 " H MET B2354 "<>" O GLU B2336 " d_HA=2.681 d_AD=3.645 a_DHA=159.969 symop: x,y,z a_YAH=137 8829 9071 " H TRP B2339 "<>" O MET B2354 " d_HA=1.833 d_AD=2.832 a_DHA=167.767 symop: x,y,z a_YAH=147 8807 9115 " HE1 TRP B2356 "<>" O CYS B2338 " d_HA=2.309 d_AD=3.110 a_DHA=134.900 symop: x,y,z a_YAH=108 8818 9110 " H TRP B2356 "<>" O TRP B2339 " d_HA=2.350 d_AD=3.252 a_DHA=148.149 symop: x,y,z a_YAH=126 8845 8882 " H HIS B2342 "<>" OD1 ASP B2340 " d_HA=1.835 d_AD=2.822 a_DHA=161.161 symop: x,y,z a_YAH=129 8888 9123 " HE2 HIS B2342 "<>" O GLN B2357 " d_HA=2.803 d_AD=3.643 a_DHA=139.093 symop: x,y,z a_YAH=137 8888 9144 " HE2 HIS B2342 "<>" OXT THR B2358 " d_HA=2.077 d_AD=2.905 a_DHA=135.847 symop: x,y,z a_YAH=129 4622 4679 " H ASP B2087 "<>" O LYS B2084 " d_HA=1.986 d_AD=2.954 a_DHA=158.843 symop: x,y,z a_YAH=121 4628 4678 " H LYS B2084 "<>" OD2 ASP B2087 " d_HA=1.904 d_AD=2.872 a_DHA=156.374 symop: x,y,z a_YAH=136 7037 8814 " HG CYS B2338 "<>" OE1 GLN B2228 " d_HA=2.125 d_AD=3.349 a_DHA=148.068 symop: x,y,z a_YAH=171 8809 9115 " HE1 TRP B2356 "<>" SG CYS B2338 " d_HA=2.592 d_AD=3.312 a_DHA=127.786 symop: x,y,z a_YAH=105 a_YAH=124 7658 7698 " H TYR B2269 "<>" O SER B2266 " d_HA=2.615 d_AD=3.562 a_DHA=155.559 symop: x,y,z a_YAH=102 7671 8252 " H ALA B2267 "<>" OD1 ASP B2305 " d_HA=1.782 d_AD=2.792 a_DHA=169.074 symop: x,y,z a_YAH=131 7665 8253 " HG SER B2266 "<>" OD2 ASP B2305 " d_HA=1.631 d_AD=2.616 a_DHA=169.701 symop: x,y,z a_YAH=110 7616 7562 "HH21 ARG B2263 "<>" OE1 GLU B2261 " d_HA=1.654 d_AD=2.675 a_DHA=174.702 symop: x,y,z a_YAH=114 7617 8350 "HH22 ARG B2263 "<>" O GLU B2311 " d_HA=1.709 d_AD=2.702 a_DHA=164.458 symop: x,y,z a_YAH=146 7209 8704 " HZ3 LYS B2331 "<>" O LEU B2239 " d_HA=1.736 d_AD=2.693 a_DHA=154.016 symop: x,y,z a_YAH=133 6965 7930 " H PHE B2284 "<>" O CYS B2223 " d_HA=2.452 d_AD=3.420 a_DHA=158.429 symop: x,y,z a_YAH=133 6998 7893 " H ASP B2225 "<>" O ALA B2282 " d_HA=2.874 d_AD=3.611 a_DHA=130.289 symop: x,y,z a_YAH=100 7046 7893 "HE22 GLN B2228 "<>" O ALA B2282 " d_HA=1.819 d_AD=2.811 a_DHA=164.954 symop: x,y,z a_YAH=129 6996 6631 "HH12 ARG B2202 "<>" OD1 ASP B2225 " d_HA=1.750 d_AD=2.697 a_DHA=152.234 symop: x,y,z a_YAH=122 6996 6633 "HH22 ARG B2202 "<>" OD1 ASP B2225 " d_HA=1.746 d_AD=2.723 a_DHA=157.362 symop: x,y,z a_YAH=158 7669 8538 " HZ2 LYS B2322 "<>" O ALA B2267 " d_HA=1.820 d_AD=2.658 a_DHA=136.869 symop: x,y,z a_YAH=145 8539 9162 " HZ3 LYS B2322 "<>" O1 SO4 B3362 " d_HA=1.772 d_AD=2.796 a_DHA=170.277 symop: x,y,z a_YAH=113 1742 6186 " HZ3 LYS A1185 "<>" O LEU B2178 " d_HA=2.868 d_AD=3.770 a_DHA=149.094 symop: x,y,z a_YAH=120 6205 6253 " H ARG B2182 "<>" O GLY B2179 " d_HA=2.644 d_AD=3.399 a_DHA=131.247 symop: x,y,z a_YAH=139 1740 2292 " HZ1 LYS A1185 "<>" OE2 GLU A1217 " d_HA=1.798 d_AD=2.644 a_DHA=137.765 symop: x,y,z a_YAH=116 1741 2291 " HZ2 LYS A1185 "<>" OE1 GLU A1217 " d_HA=2.016 d_AD=2.843 a_DHA=136.188 symop: x,y,z a_YAH=105 2292 6231 " H LEU B2181 "<>" OE2 GLU A1217 " d_HA=1.742 d_AD=2.640 a_DHA=144.993 symop: x,y,z a_YAH=115 2292 6253 " H ARG B2182 "<>" OE2 GLU A1217 " d_HA=2.720 d_AD=3.567 a_DHA=141.142 symop: x,y,z a_YAH=166 1358 1730 " H LYS A1185 "<>" O PHE A1163 " d_HA=1.917 d_AD=2.884 a_DHA=157.259 symop: x,y,z a_YAH=166 1404 1724 " H ILE A1165 "<>" O LYS A1185 " d_HA=1.937 d_AD=2.949 a_DHA=173.541 symop: x,y,z a_YAH=160 1366 1693 " H PHE A1163 "<>" O SER A1183 " d_HA=1.847 d_AD=2.852 a_DHA=170.221 symop: x,y,z a_YAH=152 831 2330 " H GLY A1130 "<>" O PHE A1220 " d_HA=1.769 d_AD=2.780 a_DHA=172.865 symop: x,y,z a_YAH=160 800 2323 " H ASP A1219 "<>" O THR A1128 " d_HA=1.949 d_AD=2.862 a_DHA=148.165 symop: x,y,z a_YAH=143 800 2338 " H PHE A1220 "<>" O THR A1128 " d_HA=2.730 d_AD=3.643 a_DHA=150.062 symop: x,y,z a_YAH=153 804 2321 " H THR A1128 "<>" OD1 ASP A1219 " d_HA=1.897 d_AD=2.897 a_DHA=166.120 symop: x,y,z a_YAH=145 2322 5351 " HZ1 LYS B2126 "<>" OD2 ASP A1219 " d_HA=1.773 d_AD=2.764 a_DHA=160.985 symop: x,y,z a_YAH=103 1475 1531 " H MET A1173 "<>" O VAL A1170 " d_HA=2.571 d_AD=3.463 a_DHA=147.634 symop: x,y,z a_YAH=90 842 1339 " H LEU A1131 "<>" O ILE A1162 " d_HA=2.000 d_AD=2.948 a_DHA=154.054 symop: x,y,z a_YAH=163 814 1344 " H ILE A1162 "<>" O VAL A1129 " d_HA=2.049 d_AD=3.024 a_DHA=160.066 symop: x,y,z a_YAH=143 818 1309 " H VAL A1129 "<>" O PRO A1160 " d_HA=1.862 d_AD=2.853 a_DHA=163.466 symop: x,y,z a_YAH=145 685 746 " HH TYR A1121 "<>" OE1 GLN A1125 " d_HA=1.838 d_AD=2.733 a_DHA=151.245 symop: x,y,z a_YAH=145 1130 1056 " H LEU A1148 "<>" O LEU A1144 " d_HA=1.959 d_AD=2.950 a_DHA=164.113 symop: x,y,z a_YAH=142 1148 1075 " H THR A1149 "<>" O GLU A1145 " d_HA=1.875 d_AD=2.872 a_DHA=165.728 symop: x,y,z a_YAH=152 1105 1171 " H ALA A1151 "<>" O PHE A1147 " d_HA=1.801 d_AD=2.791 a_DHA=163.389 symop: x,y,z a_YAH=155 1125 1184 " H ASN A1152 "<>" O LEU A1148 " d_HA=1.789 d_AD=2.795 a_DHA=168.610 symop: x,y,z a_YAH=162 1169 1240 " H PHE A1155 "<>" O ALA A1151 " d_HA=1.905 d_AD=2.873 a_DHA=158.123 symop: x,y,z a_YAH=133 1169 1222 " H HIS A1154 "<>" O ALA A1151 " d_HA=2.514 d_AD=3.269 a_DHA=130.781 symop: x,y,z a_YAH=98 1232 1687 "HH12 ARG A1182 "<>" O PHE A1155 " d_HA=1.740 d_AD=2.745 a_DHA=171.684 symop: x,y,z a_YAH=157 1232 1689 "HH22 ARG A1182 "<>" O PHE A1155 " d_HA=2.611 d_AD=3.365 a_DHA=131.511 symop: x,y,z a_YAH=142 1257 2561 " H MET A1156 "<>" O PHE A1234 " d_HA=1.845 d_AD=2.844 a_DHA=166.807 symop: x,y,z a_YAH=153 2588 2638 " H LEU A1239 "<>" O VAL A1236 " d_HA=2.207 d_AD=3.127 a_DHA=150.708 symop: x,y,z a_YAH=102 52 102 " H LYS A1084 "<>" OD2 ASP A1087 " d_HA=1.932 d_AD=2.907 a_DHA=158.859 symop: x,y,z a_YAH=122 1056 1130 " H LEU A1148 "<>" O LEU A1144 " d_HA=1.959 d_AD=2.950 a_DHA=164.113 symop: x,y,z a_YAH=142 1075 1151 " HG1 THR A1149 "<>" O GLU A1145 " d_HA=1.797 d_AD=2.737 a_DHA=161.223 symop: x,y,z a_YAH=136 1075 1148 " H THR A1149 "<>" O GLU A1145 " d_HA=1.875 d_AD=2.872 a_DHA=165.728 symop: x,y,z a_YAH=152 1090 1161 " H SER A1150 "<>" O GLU A1146 " d_HA=2.004 d_AD=2.962 a_DHA=155.773 symop: x,y,z a_YAH=144 1090 1165 " HG SER A1150 "<>" O GLU A1146 " d_HA=1.756 d_AD=2.709 a_DHA=163.095 symop: x,y,z a_YAH=130 1160 2498 " H PHE A1230 "<>" OG SER A1150 " d_HA=1.970 d_AD=2.931 a_DHA=157.049 symop: x,y,z a_YAH=99 a_YAH=142 1158 1222 " H HIS A1154 "<>" O SER A1150 " d_HA=2.245 d_AD=3.075 a_DHA=137.991 symop: x,y,z a_YAH=147 1215 2569 " H PHE A1234 "<>" O HIS A1154 " d_HA=2.138 d_AD=3.048 a_DHA=148.602 symop: x,y,z a_YAH=119 589 2608 " HE ARG A1115 "<>" OE1 GLU A1237 " d_HA=1.706 d_AD=2.727 a_DHA=176.855 symop: x,y,z a_YAH=117 592 2609 "HH21 ARG A1115 "<>" OE2 GLU A1237 " d_HA=1.761 d_AD=2.782 a_DHA=172.398 symop: x,y,z a_YAH=104 2581 2626 " HG1 THR A1238 "<>" O GLY A1235 " d_HA=1.840 d_AD=2.784 a_DHA=163.018 symop: x,y,z a_YAH=153 2581 2623 " H THR A1238 "<>" O GLY A1235 " d_HA=1.889 d_AD=2.895 a_DHA=169.800 symop: x,y,z a_YAH=136 2582 2609 " H GLY A1235 "<>" OE2 GLU A1237 " d_HA=1.947 d_AD=2.924 a_DHA=160.129 symop: x,y,z a_YAH=107 559 628 " H LEU A1118 "<>" O ASN A1114 " d_HA=2.413 d_AD=3.332 a_DHA=150.496 symop: x,y,z a_YAH=141 559 611 " H VAL A1117 "<>" O ASN A1114 " d_HA=2.771 d_AD=3.408 a_DHA=120.986 symop: x,y,z a_YAH=98 63 102 " HZ2 LYS A1084 "<>" OD2 ASP A1087 " d_HA=1.858 d_AD=2.727 a_DHA=140.535 symop: x,y,z a_YAH=108 64 101 " HZ3 LYS A1084 "<>" OD1 ASP A1087 " d_HA=1.839 d_AD=2.706 a_DHA=140.086 symop: x,y,z a_YAH=109 2532 4473 " H ASP A1232 "<>" O LYS A1353 " d_HA=2.238 d_AD=3.233 a_DHA=167.466 symop: x,y,z a_YAH=103 593 2539 "HH22 ARG A1115 "<>" O LYS A1233 " d_HA=1.904 d_AD=2.758 a_DHA=139.432 symop: x,y,z a_YAH=128 538 581 " H ARG A1115 "<>" O TYR A1113 " d_HA=2.811 d_AD=3.463 a_DHA=122.612 symop: x,y,z a_YAH=97 507 518 " H GLY A1111 "<>" OE2 GLU A1110 " d_HA=1.896 d_AD=2.790 a_DHA=143.954 symop: x,y,z a_YAH=100 5114 5157 " H ARG B2115 "<>" O TYR B2113 " d_HA=2.992 d_AD=3.646 a_DHA=123.232 symop: x,y,z a_YAH=92 5082 5131 " HH TYR B2113 "<>" OE1 GLU B2110 " d_HA=1.657 d_AD=2.619 a_DHA=165.405 symop: x,y,z a_YAH=120 5082 9065 " HZ1 LYS B2353 "<>" OE1 GLU B2110 " d_HA=1.694 d_AD=2.706 a_DHA=171.786 symop: x,y,z a_YAH=152 5083 5094 " H GLY B2111 "<>" OE2 GLU B2110 " d_HA=2.042 d_AD=2.902 a_DHA=140.540 symop: x,y,z a_YAH=98 9014 9067 " HZ3 LYS B2353 "<>" O LEU B2351 " d_HA=1.787 d_AD=2.786 a_DHA=166.072 symop: x,y,z a_YAH=136 220 4663 " HZ3 LYS A1093 "<>" O SER B2086 " d_HA=2.117 d_AD=2.927 a_DHA=134.923 symop: -x+1,y+1/2,-z+1/2 a_YAH=113 220 4677 " HZ3 LYS A1093 "<>" OD1 ASP B2087 " d_HA=2.526 d_AD=3.193 a_DHA=122.613 symop: -x+1,y+1/2,-z+1/2 a_YAH=132 4686 5140 " H ASN B2114 "<>" O TRP B2088 " d_HA=1.853 d_AD=2.761 a_DHA=147.240 symop: x,y,z a_YAH=140 5135 5187 " H VAL B2117 "<>" O ASN B2114 " d_HA=2.768 d_AD=3.418 a_DHA=122.234 symop: x,y,z a_YAH=100 5135 5204 " H LEU B2118 "<>" O ASN B2114 " d_HA=2.500 d_AD=3.463 a_DHA=158.943 symop: x,y,z a_YAH=146 5168 7185 "HH21 ARG B2115 "<>" OE2 GLU B2237 " d_HA=1.756 d_AD=2.766 a_DHA=167.977 symop: x,y,z a_YAH=97 7185 8803 " HH TYR B2337 "<>" OE2 GLU B2237 " d_HA=1.835 d_AD=2.806 a_DHA=174.834 symop: x,y,z a_YAH=105 7050 9091 " H SER B2355 "<>" O VAL B2229 " d_HA=2.097 d_AD=3.080 a_DHA=161.835 symop: x,y,z a_YAH=145 7098 9090 "HE21 GLN B2231 "<>" OG SER B2355 " d_HA=1.839 d_AD=2.838 a_DHA=166.328 symop: x,y,z a_YAH=143 a_YAH=109 9095 9099 " HG SER B2355 "<>" O TRP B2356 " d_HA=2.477 d_AD=3.416 a_DHA=161.275 symop: x,y,z a_YAH=138 7164 7214 " H LEU B2239 "<>" O VAL B2236 " d_HA=2.227 d_AD=3.168 a_DHA=154.356 symop: x,y,z a_YAH=102 7157 7199 " H THR B2238 "<>" O GLY B2235 " d_HA=1.880 d_AD=2.873 a_DHA=165.087 symop: x,y,z a_YAH=133 7157 7202 " HG1 THR B2238 "<>" O GLY B2235 " d_HA=1.744 d_AD=2.696 a_DHA=165.885 symop: x,y,z a_YAH=154 7158 7185 " H GLY B2235 "<>" OE2 GLU B2237 " d_HA=1.925 d_AD=2.885 a_DHA=156.019 symop: x,y,z a_YAH=117 7054 9088 " H VAL B2229 "<>" O SER B2355 " d_HA=1.855 d_AD=2.834 a_DHA=161.080 symop: x,y,z a_YAH=166 4608 5252 " H LEU B2083 "<>" OH TYR B2121 " d_HA=2.949 d_AD=3.718 a_DHA=133.321 symop: x,y,z a_YAH=111 a_YAH=131 6993 7045 "HE21 GLN B2228 "<>" O ASP B2225 " d_HA=1.893 d_AD=2.873 a_DHA=160.375 symop: x,y,z a_YAH=116 5539 5620 " H TYR B2143 "<>" O TYR B2139 " d_HA=2.091 d_AD=3.064 a_DHA=160.576 symop: x,y,z a_YAH=137 5539 5637 " H LEU B2144 "<>" O TYR B2139 " d_HA=2.472 d_AD=3.365 a_DHA=146.944 symop: x,y,z a_YAH=149 5515 5601 " H HIS B2142 "<>" O ARG B2138 " d_HA=1.966 d_AD=2.973 a_DHA=170.743 symop: x,y,z a_YAH=162 5515 5585 " H GLU B2141 "<>" O ARG B2138 " d_HA=2.426 d_AD=3.075 a_DHA=121.344 symop: x,y,z a_YAH=114 7597 7661 " H SER B2266 "<>" O ARG B2263 " d_HA=1.936 d_AD=2.933 a_DHA=167.384 symop: x,y,z a_YAH=132 6226 6264 "HH21 ARG B2182 "<>" O LEU B2181 " d_HA=2.842 d_AD=3.545 a_DHA=126.614 symop: x,y,z a_YAH=130 5286 5341 " H LYS B2126 "<>" O ALA B2123 " d_HA=2.089 d_AD=3.069 a_DHA=161.841 symop: x,y,z a_YAH=110 5903 6226 " H VAL B2161 "<>" O LEU B2181 " d_HA=1.985 d_AD=2.808 a_DHA=136.430 symop: x,y,z a_YAH=130 6119 6157 " H ILE B2176 "<>" O PRO B2174 " d_HA=1.962 d_AD=2.818 a_DHA=140.349 symop: x,y,z a_YAH=109 1704 6288 " H PHE B2184 "<>" O PHE A1184 " d_HA=1.768 d_AD=2.743 a_DHA=160.341 symop: x,y,z a_YAH=168 1712 6280 " H PHE A1184 "<>" O PHE B2184 " d_HA=1.867 d_AD=2.868 a_DHA=166.875 symop: x,y,z a_YAH=151 1695 6276 " HG SER B2183 "<>" OG SER A1183 " d_HA=1.903 d_AD=2.848 a_DHA=163.055 symop: x,y,z a_YAH=94 a_YAH=148 742 5352 " HZ2 LYS B2126 "<>" O GLN A1125 " d_HA=2.674 d_AD=3.632 a_DHA=157.952 symop: x,y,z a_YAH=146 6051 6107 " H MET B2173 "<>" O VAL B2170 " d_HA=2.381 d_AD=3.318 a_DHA=153.945 symop: x,y,z a_YAH=97 1323 1700 " HG SER A1183 "<>" O VAL A1161 " d_HA=2.332 d_AD=3.237 a_DHA=154.986 symop: x,y,z a_YAH=139 1323 1696 " H SER A1183 "<>" O VAL A1161 " d_HA=2.109 d_AD=2.915 a_DHA=135.091 symop: x,y,z a_YAH=143 1292 1688 "HH21 ARG A1182 "<>" O HIS A1159 " d_HA=2.012 d_AD=2.898 a_DHA=144.184 symop: x,y,z a_YAH=165 1327 1650 " H VAL A1161 "<>" O LEU A1181 " d_HA=1.806 d_AD=2.715 a_DHA=146.941 symop: x,y,z a_YAH=162 689 748 " H GLN A1125 "<>" O TYR A1122 " d_HA=2.093 d_AD=2.885 a_DHA=133.657 symop: x,y,z a_YAH=99 689 786 " H ILE A1127 "<>" O TYR A1122 " d_HA=2.437 d_AD=3.375 a_DHA=154.467 symop: x,y,z a_YAH=137 668 748 " H GLN A1125 "<>" O TYR A1121 " d_HA=2.715 d_AD=3.376 a_DHA=123.241 symop: x,y,z a_YAH=125 1543 1581 " H ILE A1176 "<>" O PRO A1174 " d_HA=2.115 d_AD=2.993 a_DHA=144.151 symop: x,y,z a_YAH=95 1182 1630 " H GLY A1179 "<>" OD1 ASN A1152 " d_HA=1.836 d_AD=2.811 a_DHA=160.710 symop: x,y,z a_YAH=106 1179 1686 "HH11 ARG A1182 "<>" O ASN A1152 " d_HA=2.054 d_AD=2.991 a_DHA=152.704 symop: x,y,z a_YAH=129 1685 1636 " HE ARG A1182 "<>" O PRO A1180 " d_HA=2.162 d_AD=2.886 a_DHA=126.995 symop: x,y,z a_YAH=130 1252 1299 " H HIS A1159 "<>" O MET A1156 " d_HA=2.185 d_AD=3.062 a_DHA=144.143 symop: x,y,z a_YAH=148 1252 1689 "HH22 ARG A1182 "<>" O MET A1156 " d_HA=2.180 d_AD=2.975 a_DHA=134.612 symop: x,y,z a_YAH=99 623 698 " H TYR A1122 "<>" O LEU A1118 " d_HA=1.808 d_AD=2.818 a_DHA=172.580 symop: x,y,z a_YAH=167 623 677 " H TYR A1121 "<>" O LEU A1118 " d_HA=2.373 d_AD=3.032 a_DHA=121.932 symop: x,y,z a_YAH=90 642 712 " H ALA A1123 "<>" O ASP A1119 " d_HA=1.839 d_AD=2.824 a_DHA=162.935 symop: x,y,z a_YAH=163 654 726 " H LYS A1124 "<>" O ASN A1120 " d_HA=2.341 d_AD=3.240 a_DHA=147.407 symop: x,y,z a_YAH=121 1144 1199 " H LYS A1153 "<>" O THR A1149 " d_HA=2.272 d_AD=3.256 a_DHA=162.301 symop: x,y,z a_YAH=140 1193 2555 " HZ1 LYS A1233 "<>" O LYS A1153 " d_HA=2.010 d_AD=2.945 a_DHA=151.052 symop: x,y,z a_YAH=132 645 1305 " HE2 HIS A1159 "<>" OD1 ASP A1119 " d_HA=1.781 d_AD=2.790 a_DHA=167.489 symop: x,y,z a_YAH=119 573 647 " H ASP A1119 "<>" O ARG A1115 " d_HA=1.724 d_AD=2.720 a_DHA=167.288 symop: x,y,z a_YAH=167 597 659 " H ASN A1120 "<>" O ALA A1116 " d_HA=2.199 d_AD=3.199 a_DHA=168.356 symop: x,y,z a_YAH=146 607 664 "HD22 ASN A1120 "<>" O VAL A1117 " d_HA=1.926 d_AD=2.915 a_DHA=163.043 symop: x,y,z a_YAH=133 607 677 " H TYR A1121 "<>" O VAL A1117 " d_HA=2.374 d_AD=3.108 a_DHA=128.653 symop: x,y,z a_YAH=127 562 611 " H VAL A1117 "<>" OD1 ASN A1114 " d_HA=2.018 d_AD=2.984 a_DHA=158.005 symop: x,y,z a_YAH=124 3062 3072 " HZ2 LYS A1264 "<>" OE2 GLU A1265 " d_HA=1.692 d_AD=2.700 a_DHA=165.707 symop: x,y,z a_YAH=107 5138 5187 " H VAL B2117 "<>" OD1 ASN B2114 " d_HA=2.188 d_AD=3.151 a_DHA=158.052 symop: x,y,z a_YAH=125 5165 7184 " HE ARG B2115 "<>" OE1 GLU B2237 " d_HA=1.735 d_AD=2.749 a_DHA=170.065 symop: x,y,z a_YAH=122 5169 7115 "HH22 ARG B2115 "<>" O LYS B2233 " d_HA=2.093 d_AD=2.872 a_DHA=132.464 symop: x,y,z a_YAH=132 7106 7121 " H LYS B2233 "<>" OD1 ASP B2232 " d_HA=1.858 d_AD=2.776 a_DHA=148.664 symop: x,y,z a_YAH=91 7106 7133 " HZ3 LYS B2233 "<>" OD1 ASP B2232 " d_HA=1.916 d_AD=2.866 a_DHA=152.540 symop: x,y,z a_YAH=171 7092 9049 " H GLN B2231 "<>" O LYS B2353 " d_HA=1.865 d_AD=2.749 a_DHA=144.053 symop: x,y,z a_YAH=118 7108 9049 " H ASP B2232 "<>" O LYS B2353 " d_HA=2.388 d_AD=3.377 a_DHA=165.429 symop: x,y,z a_YAH=105 5173 5235 " H ASN B2120 "<>" O ALA B2116 " d_HA=2.163 d_AD=3.169 a_DHA=170.268 symop: x,y,z a_YAH=148 5183 5240 "HD22 ASN B2120 "<>" O VAL B2117 " d_HA=2.774 d_AD=3.720 a_DHA=156.195 symop: x,y,z a_YAH=124 5149 5223 " H ASP B2119 "<>" O ARG B2115 " d_HA=1.795 d_AD=2.802 a_DHA=170.381 symop: x,y,z a_YAH=168 5199 5253 " H TYR B2121 "<>" O LEU B2118 " d_HA=2.233 d_AD=3.049 a_DHA=136.571 symop: x,y,z a_YAH=96 5199 5274 " H TYR B2122 "<>" O LEU B2118 " d_HA=1.746 d_AD=2.759 a_DHA=177.185 symop: x,y,z a_YAH=170 5221 5881 " HE2 HIS B2159 "<>" OD1 ASP B2119 " d_HA=1.757 d_AD=2.777 a_DHA=171.485 symop: x,y,z a_YAH=122 5791 7145 " H PHE B2234 "<>" O HIS B2154 " d_HA=2.118 d_AD=3.038 a_DHA=149.902 symop: x,y,z a_YAH=119 5833 7137 " H MET B2156 "<>" O PHE B2234 " d_HA=1.826 d_AD=2.817 a_DHA=163.613 symop: x,y,z a_YAH=157 5666 5741 " HG SER B2150 "<>" O GLU B2146 " d_HA=1.822 d_AD=2.762 a_DHA=159.900 symop: x,y,z a_YAH=136 5666 5737 " H SER B2150 "<>" O GLU B2146 " d_HA=2.105 d_AD=3.037 a_DHA=151.026 symop: x,y,z a_YAH=140 5736 7074 " H PHE B2230 "<>" OG SER B2150 " d_HA=2.001 d_AD=2.963 a_DHA=157.065 symop: x,y,z a_YAH=110 a_YAH=128 5670 9136 "HE22 GLN B2357 "<>" OE1 GLU B2146 " d_HA=1.946 d_AD=2.897 a_DHA=152.675 symop: x,y,z a_YAH=144 5244 5324 " H GLN B2125 "<>" O TYR B2121 " d_HA=2.537 d_AD=3.197 a_DHA=122.569 symop: x,y,z a_YAH=134 5244 5330 "HE21 GLN B2125 "<>" O TYR B2121 " d_HA=2.143 d_AD=2.974 a_DHA=138.207 symop: x,y,z a_YAH=127 5808 6263 "HH12 ARG B2182 "<>" O PHE B2155 " d_HA=1.755 d_AD=2.739 a_DHA=162.699 symop: x,y,z a_YAH=150 5808 6265 "HH22 ARG B2182 "<>" O PHE B2155 " d_HA=2.362 d_AD=3.143 a_DHA=133.822 symop: x,y,z a_YAH=142 5681 5747 " H ALA B2151 "<>" O PHE B2147 " d_HA=1.810 d_AD=2.809 a_DHA=166.166 symop: x,y,z a_YAH=159 5611 5689 " H PHE B2147 "<>" O TYR B2143 " d_HA=1.820 d_AD=2.830 a_DHA=171.408 symop: x,y,z a_YAH=165 5632 5706 " H LEU B2148 "<>" O LEU B2144 " d_HA=2.026 d_AD=3.024 a_DHA=166.195 symop: x,y,z a_YAH=153 5637 5560 " H LEU B2144 "<>" O ILE B2140 " d_HA=2.591 d_AD=3.335 a_DHA=130.248 symop: x,y,z a_YAH=110 6269 5942 " H PHE B2163 "<>" O SER B2183 " d_HA=1.861 d_AD=2.867 a_DHA=171.133 symop: x,y,z a_YAH=166 5899 6272 " H SER B2183 "<>" O VAL B2161 " d_HA=1.957 d_AD=2.888 a_DHA=151.178 symop: x,y,z a_YAH=153 710 765 " H LYS A1126 "<>" O ALA A1123 " d_HA=1.910 d_AD=2.861 a_DHA=154.966 symop: x,y,z a_YAH=110 657 737 " HZ2 LYS A1124 "<>" OD1 ASN A1120 " d_HA=1.719 d_AD=2.739 a_DHA=175.728 symop: x,y,z a_YAH=169 5794 7132 " HZ2 LYS B2233 "<>" ND1 HIS B2154 " d_HA=1.850 d_AD=2.815 a_DHA=156.756 symop: x,y,z a_YAH=137 a_YAH=116 5734 5798 " H HIS B2154 "<>" O SER B2150 " d_HA=2.149 d_AD=3.007 a_DHA=140.881 symop: x,y,z a_YAH=146 5230 5314 " HZ3 LYS B2124 "<>" O ASN B2120 " d_HA=2.494 d_AD=3.284 a_DHA=133.720 symop: x,y,z a_YAH=131 5230 5302 " H LYS B2124 "<>" O ASN B2120 " d_HA=2.999 d_AD=3.764 a_DHA=133.162 symop: x,y,z a_YAH=98 5218 5288 " H ALA B2123 "<>" O ASP B2119 " d_HA=1.807 d_AD=2.789 a_DHA=161.950 symop: x,y,z a_YAH=159 5828 5875 " H HIS B2159 "<>" O MET B2156 " d_HA=2.121 d_AD=3.033 a_DHA=148.789 symop: x,y,z a_YAH=150 5828 6265 "HH22 ARG B2182 "<>" O MET B2156 " d_HA=2.231 d_AD=2.928 a_DHA=125.224 symop: x,y,z a_YAH=92 5745 5816 " H PHE B2155 "<>" O ALA B2151 " d_HA=1.863 d_AD=2.826 a_DHA=156.758 symop: x,y,z a_YAH=132 5745 5798 " H HIS B2154 "<>" O ALA B2151 " d_HA=2.497 d_AD=3.191 a_DHA=125.045 symop: x,y,z a_YAH=98 5724 5651 " H THR B2149 "<>" O GLU B2145 " d_HA=1.988 d_AD=2.950 a_DHA=156.213 symop: x,y,z a_YAH=149 ------------------------------------------------------------------------------- Total: 689 Symmetry: 0 Per residue: 1.2437 Mean SD Skew Kurtosis theta_1: 145.734 21.560 -0.682 2.357 theta_2: 132.153 22.335 -0.034 1.892 d_HA: 2.284 0.325 0.673 2.290 1620 1700 " H MET A 222 "<>" O GLU A 218 " d_HA=1.908 d_AD=2.898 a_DHA=165.327 symop: x,y,z a_YAH=152 1601 1679 " H ARG A 221 "<>" O ILE A 217 " d_HA=1.936 d_AD=2.893 a_DHA=155.828 symop: x,y,z a_YAH=156 1606 1551 " H ILE A 217 "<>" O TYR A 214 " d_HA=1.996 d_AD=2.729 a_DHA=126.779 symop: x,y,z a_YAH=116 1606 1527 " H ILE A 217 "<>" O ARG A 213 " d_HA=2.937 d_AD=3.843 a_DHA=148.881 symop: x,y,z a_YAH=124 1635 1714 " H ALA A 223 "<>" O GLN A 219 " d_HA=2.152 d_AD=3.097 a_DHA=153.970 symop: x,y,z a_YAH=154 1577 834 " H SER A 168 "<>" OE2 GLU A 215 " d_HA=2.247 d_AD=3.227 a_DHA=161.634 symop: y,x,-z+1 a_YAH=169 1587 1657 " H LEU A 220 "<>" O ASN A 216 " d_HA=1.945 d_AD=2.945 a_DHA=164.683 symop: x,y,z a_YAH=143 808 1576 "HH11 ARG A 166 "<>" OE1 GLU A 215 " d_HA=2.787 d_AD=3.792 a_DHA=173.027 symop: y,x,-z+1 a_YAH=118 1137 1535 " H ARG A 213 "<>" OD2 ASP A 188 " d_HA=2.508 d_AD=3.358 a_DHA=142.403 symop: x,y,z a_YAH=110 1137 1597 "HD22 ASN A 216 "<>" OD2 ASP A 188 " d_HA=1.766 d_AD=2.794 a_DHA=174.373 symop: x,y,z a_YAH=123 1136 1518 " H GLU A 212 "<>" OD1 ASP A 188 " d_HA=2.279 d_AD=3.089 a_DHA=136.255 symop: x,y,z a_YAH=93 1277 1347 " H ILE A 201 "<>" O ILE A 198 " d_HA=1.856 d_AD=2.725 a_DHA=142.272 symop: x,y,z a_YAH=111 1277 1366 " H ASP A 202 "<>" O ILE A 198 " d_HA=2.135 d_AD=2.983 a_DHA=139.919 symop: x,y,z a_YAH=123 1251 1326 " H LYS A 200 "<>" O LEU A 196 " d_HA=2.201 d_AD=3.012 a_DHA=135.123 symop: x,y,z a_YAH=136 1270 1347 " H ILE A 201 "<>" O GLY A 197 " d_HA=2.850 d_AD=3.608 a_DHA=132.395 symop: x,y,z a_YAH=117 1204 1271 " H GLY A 197 "<>" O HIS A 193 " d_HA=1.963 d_AD=2.956 a_DHA=169.656 symop: x,y,z a_YAH=168 791 847 " H ASP A 169 "<>" O ARG A 166 " d_HA=2.094 d_AD=2.772 a_DHA=122.555 symop: x,y,z a_YAH=102 791 859 " H LEU A 170 "<>" O ARG A 166 " d_HA=2.141 d_AD=3.124 a_DHA=160.745 symop: x,y,z a_YAH=157 1133 1190 " H ILE A 192 "<>" O ASP A 188 " d_HA=2.361 d_AD=3.378 a_DHA=175.920 symop: x,y,z a_YAH=143 1361 1403 " H VAL A 205 "<>" O ASP A 202 " d_HA=2.389 d_AD=3.169 a_DHA=133.235 symop: x,y,z a_YAH=112 1671 1723 " H GLY A 224 "<>" O ARG A 221 " d_HA=1.604 d_AD=2.595 a_DHA=170.051 symop: x,y,z a_YAH=142 1671 1731 " H ALA A 225 "<>" O ARG A 221 " d_HA=2.333 d_AD=3.050 a_DHA=127.999 symop: x,y,z a_YAH=122 1232 1304 " H ARG A 199 "<>" O ILE A 195 " d_HA=1.994 d_AD=2.997 a_DHA=168.974 symop: x,y,z a_YAH=166 1652 1731 " H ALA A 225 "<>" O LEU A 220 " d_HA=2.613 d_AD=3.488 a_DHA=146.522 symop: x,y,z a_YAH=140 1221 1282 " H ILE A 198 "<>" O CYS A 194 " d_HA=1.941 d_AD=2.709 a_DHA=130.637 symop: x,y,z a_YAH=141 1171 1237 " H ILE A 195 "<>" O THR A 191 " d_HA=1.839 d_AD=2.845 a_DHA=167.159 symop: x,y,z a_YAH=159 1185 1256 " H LEU A 196 "<>" O ILE A 192 " d_HA=1.999 d_AD=2.976 a_DHA=161.547 symop: x,y,z a_YAH=149 1190 1133 " H ILE A 192 "<>" O ASP A 188 " d_HA=2.361 d_AD=3.378 a_DHA=175.920 symop: x,y,z a_YAH=143 751 799 " H ARG A 166 "<>" O ASP A 163 " d_HA=2.179 d_AD=3.047 a_DHA=142.419 symop: x,y,z a_YAH=115 1156 1224 " H CYS A 194 "<>" O GLU A 190 " d_HA=1.841 d_AD=2.860 a_DHA=171.661 symop: x,y,z a_YAH=150 1145 1211 " H HIS A 193 "<>" O SER A 189 " d_HA=2.120 d_AD=3.132 a_DHA=174.010 symop: x,y,z a_YAH=172 754 781 " H THR A 165 "<>" OD1 ASP A 163 " d_HA=2.316 d_AD=3.300 a_DHA=162.361 symop: x,y,z a_YAH=114 755 810 "HH21 ARG A 166 "<>" OD2 ASP A 163 " d_HA=2.942 d_AD=3.775 a_DHA=139.405 symop: x,y,z a_YAH=144 1439 1744 " H ASP A 226 "<>" O ILE A 207 " d_HA=2.227 d_AD=3.120 a_DHA=145.276 symop: x,y,z a_YAH=118 1439 1757 " H GLN A 227 "<>" O ILE A 207 " d_HA=2.285 d_AD=3.227 a_DHA=155.067 symop: x,y,z a_YAH=147 1444 1743 " H ILE A 207 "<>" OD2 ASP A 226 " d_HA=1.637 d_AD=2.638 a_DHA=172.749 symop: x,y,z a_YAH=135 1029 1415 " H VAL A 181 "<>" O ARG A 206 " d_HA=1.776 d_AD=2.745 a_DHA=157.963 symop: x,y,z a_YAH=174 1046 62 " H ILE A 182 "<>" O VAL A 119 " d_HA=1.736 d_AD=2.701 a_DHA=158.435 symop: x,y,z a_YAH=146 1025 1463 " H ILE A 208 "<>" O VAL A 181 " d_HA=1.883 d_AD=2.887 a_DHA=167.224 symop: x,y,z a_YAH=168 100 1041 " H CYS A 121 "<>" O ILE A 182 " d_HA=1.795 d_AD=2.740 a_DHA=154.919 symop: x,y,z a_YAH=165 109 421 " H GLY A 122 "<>" O LEU A 142 " d_HA=2.071 d_AD=2.766 a_DHA=124.199 symop: x,y,z a_YAH=148 97 1081 " H ASP A 184 "<>" O CYS A 121 " d_HA=2.633 d_AD=3.531 a_DHA=148.557 symop: x,y,z a_YAH=124 1125 1160 " H SER A 187 "<>" OE1 GLU A 190 " d_HA=2.121 d_AD=3.091 a_DHA=157.173 symop: x,y,z a_YAH=155 2824 2873 " H GLU A 301 "<>" O ARG A 298 " d_HA=1.844 d_AD=2.842 a_DHA=170.538 symop: x,y,z a_YAH=146 1432 2007 "HH11 ARG A 206 "<>" O ILE A 243 " d_HA=1.827 d_AD=2.734 a_DHA=149.548 symop: -x+2,-x+y+1,-z+1 a_YAH=111 1433 1996 "HH12 ARG A 206 "<>" O SER A 242 " d_HA=1.577 d_AD=2.482 a_DHA=146.156 symop: -x+2,-x+y+1,-z+1 a_YAH=157 1064 1458 " H VAL A 183 "<>" O ILE A 208 " d_HA=1.710 d_AD=2.662 a_DHA=154.217 symop: x,y,z a_YAH=144 1479 1751 " H ALA A 209 "<>" O GLN A 227 " d_HA=1.828 d_AD=2.841 a_DHA=172.047 symop: x,y,z a_YAH=171 1060 1493 " H GLU A 210 "<>" O VAL A 183 " d_HA=1.958 d_AD=2.950 a_DHA=163.905 symop: x,y,z a_YAH=158 2817 3125 " H ILE A 317 "<>" O GLY A 297 " d_HA=2.106 d_AD=3.080 a_DHA=160.777 symop: x,y,z a_YAH=147 2801 2906 " H ILE A 303 "<>" O VAL A 296 " d_HA=1.913 d_AD=2.910 a_DHA=172.493 symop: x,y,z a_YAH=124 2832 2867 " H ARG A 298 "<>" O GLU A 301 " d_HA=2.963 d_AD=3.840 a_DHA=145.361 symop: x,y,z a_YAH=111 2065 2860 " H ASP A 300 "<>" OH TYR A 247 " d_HA=2.075 d_AD=3.052 a_DHA=161.814 symop: -x+2,-x+y+1,-z+1 a_YAH=123 a_YAH=123 2050 2108 " H MET A 250 "<>" O GLY A 246 " d_HA=1.604 d_AD=2.587 a_DHA=166.107 symop: x,y,z a_YAH=159 1925 1999 " H SER A 242 "<>" O LEU A 238 " d_HA=2.027 d_AD=2.759 a_DHA=128.225 symop: x,y,z a_YAH=126 1925 2003 " HG SER A 242 "<>" O LEU A 238 " d_HA=1.762 d_AD=2.648 a_DHA=148.041 symop: x,y,z a_YAH=133 1998 2095 " H ALA A 249 "<>" OG SER A 242 " d_HA=2.949 d_AD=3.668 a_DHA=128.161 symop: x,y,z a_YAH=139 a_YAH=110 2093 2162 " H GLN A 253 "<>" O ALA A 249 " d_HA=1.608 d_AD=2.582 a_DHA=163.594 symop: x,y,z a_YAH=151 1883 1949 " H MET A 239 "<>" O SER A 235 " d_HA=2.150 d_AD=3.158 a_DHA=177.972 symop: x,y,z a_YAH=171 1894 1964 " H SER A 240 "<>" O GLY A 236 " d_HA=2.018 d_AD=2.990 a_DHA=159.602 symop: x,y,z a_YAH=137 165 227 " H CYS A 130 "<>" O SER A 126 " d_HA=2.095 d_AD=2.968 a_DHA=143.064 symop: x,y,z a_YAH=111 172 1828 " HG SER A 126 "<>" O PHE A 232 " d_HA=2.803 d_AD=3.555 a_DHA=134.780 symop: -x+2,-x+y+1,-z+1 a_YAH=127 139 180 " H THR A 127 "<>" O SER A 124 " d_HA=1.748 d_AD=2.661 a_DHA=149.575 symop: x,y,z a_YAH=133 2522 3093 " H ALA A 314 "<>" OE1 GLU A 276 " d_HA=2.370 d_AD=3.350 a_DHA=162.848 symop: x,y,z a_YAH=142 2534 3047 " H GLY A 277 "<>" O PHE A 312 " d_HA=2.197 d_AD=3.109 a_DHA=149.738 symop: x,y,z a_YAH=135 3067 3113 " H ASP A 316 "<>" O ARG A 313 " d_HA=1.964 d_AD=2.897 a_DHA=151.855 symop: x,y,z a_YAH=142 3075 3112 " H ARG A 313 "<>" OD2 ASP A 316 " d_HA=1.799 d_AD=2.794 a_DHA=163.347 symop: x,y,z a_YAH=116 2381 3144 " H ILE A 318 "<>" O VAL A 267 " d_HA=2.067 d_AD=3.021 a_DHA=157.837 symop: x,y,z a_YAH=132 2416 3108 " H ILE A 269 "<>" O ASP A 316 " d_HA=2.061 d_AD=3.008 a_DHA=154.853 symop: x,y,z a_YAH=136 2805 2901 " H VAL A 296 "<>" O ILE A 303 " d_HA=2.841 d_AD=3.794 a_DHA=160.231 symop: x,y,z a_YAH=93 2385 3139 " H VAL A 267 "<>" O ILE A 318 " d_HA=1.750 d_AD=2.684 a_DHA=150.351 symop: x,y,z a_YAH=143 2794 3163 " H LEU A 319 "<>" O GLY A 295 " d_HA=1.969 d_AD=2.915 a_DHA=153.044 symop: x,y,z a_YAH=142 2818 3120 " H GLY A 297 "<>" O ILE A 317 " d_HA=1.819 d_AD=2.796 a_DHA=158.083 symop: x,y,z a_YAH=159 2084 2371 " H GLU A 248 "<>" OE2 GLU A 266 " d_HA=1.838 d_AD=2.743 a_DHA=145.279 symop: -x+2,-x+y+1,-z+1 a_YAH=170 2057 2128 " H PHE A 251 "<>" O TYR A 247 " d_HA=2.096 d_AD=3.093 a_DHA=171.089 symop: x,y,z a_YAH=168 2078 2144 " H VAL A 252 "<>" O GLU A 248 " d_HA=2.261 d_AD=3.266 a_DHA=171.894 symop: x,y,z a_YAH=148 1988 2082 " HE ARG A 241 "<>" OE1 GLU A 248 " d_HA=1.789 d_AD=2.759 a_DHA=154.937 symop: x,y,z a_YAH=125 1901 1980 " H ARG A 241 "<>" O ARG A 237 " d_HA=1.658 d_AD=2.649 a_DHA=164.291 symop: x,y,z a_YAH=173 1864 1930 " H LEU A 238 "<>" O ILE A 234 " d_HA=1.852 d_AD=2.865 a_DHA=172.496 symop: x,y,z a_YAH=154 1848 1909 " H ARG A 237 "<>" O VAL A 233 " d_HA=2.275 d_AD=3.208 a_DHA=152.337 symop: x,y,z a_YAH=134 1814 1886 " H SER A 235 "<>" O PRO A 231 " d_HA=2.239 d_AD=3.249 a_DHA=175.892 symop: x,y,z a_YAH=153 1828 1895 " H GLY A 236 "<>" O PHE A 232 " d_HA=2.233 d_AD=3.196 a_DHA=158.587 symop: x,y,z a_YAH=174 154 1543 " HE ARG A 213 "<>" OE1 GLU A 125 " d_HA=2.823 d_AD=3.500 a_DHA=123.675 symop: -x+2,-x+y+1,-z+1 a_YAH=95 2499 2544 " H VAL A 278 "<>" O LEU A 275 " d_HA=2.907 d_AD=3.583 a_DHA=123.983 symop: x,y,z a_YAH=148 2540 3055 " H PHE A 312 "<>" O VAL A 278 " d_HA=2.485 d_AD=3.389 a_DHA=148.456 symop: x,y,z a_YAH=112 2556 2616 " H ALA A 283 "<>" O SER A 279 " d_HA=1.919 d_AD=2.920 a_DHA=170.456 symop: x,y,z a_YAH=158 2558 2607 " H ASP A 282 "<>" OG SER A 279 " d_HA=1.904 d_AD=2.881 a_DHA=163.373 symop: x,y,z a_YAH=156 a_YAH=92 2588 2979 " H LEU A 281 "<>" O ARG A 308 " d_HA=2.510 d_AD=3.453 a_DHA=158.543 symop: x,y,z a_YAH=110 3024 2965 " H TYR A 310 "<>" O PRO A 307 " d_HA=1.988 d_AD=2.874 a_DHA=142.965 symop: x,y,z a_YAH=142 2571 3015 " H VAL A 280 "<>" O TYR A 310 " d_HA=2.556 d_AD=3.290 a_DHA=129.674 symop: x,y,z a_YAH=129 2780 3158 " H ILE A 294 "<>" O LEU A 319 " d_HA=2.155 d_AD=3.052 a_DHA=147.808 symop: x,y,z a_YAH=138 2350 3178 " H GLY A 320 "<>" O VAL A 265 " d_HA=2.318 d_AD=3.261 a_DHA=153.045 symop: x,y,z a_YAH=145 2354 3177 " H VAL A 265 "<>" O GLY A 320 " d_HA=2.081 d_AD=2.968 a_DHA=144.719 symop: x,y,z a_YAH=158 282 1918 "HH11 ARG A 237 "<>" OE1 GLU A 133 " d_HA=2.055 d_AD=2.779 a_DHA=125.641 symop: -x+2,-x+y+1,-z+1 a_YAH=134 1803 1869 " H ILE A 234 "<>" O SER A 230 " d_HA=2.543 d_AD=3.503 a_DHA=157.236 symop: x,y,z a_YAH=144 1784 1810 " HG SER A 230 "<>" O ILE A 229 " d_HA=1.709 d_AD=2.675 a_DHA=171.084 symop: x,y,z a_YAH=98 1784 2169 "HE22 GLN A 253 "<>" O ILE A 229 " d_HA=2.279 d_AD=2.987 a_DHA=125.915 symop: -x+2,-x+y+1,-z+1 a_YAH=98 1518 1136 " H GLU A 212 "<>" OD1 ASP A 188 " d_HA=2.279 d_AD=3.089 a_DHA=136.255 symop: x,y,z a_YAH=93 1527 1606 " H ILE A 217 "<>" O ARG A 213 " d_HA=2.937 d_AD=3.843 a_DHA=148.881 symop: x,y,z a_YAH=124 1535 1137 " H ARG A 213 "<>" OD2 ASP A 188 " d_HA=2.508 d_AD=3.358 a_DHA=142.403 symop: x,y,z a_YAH=110 2614 3406 " HH TYR A 333 "<>" O ALA A 283 " d_HA=1.951 d_AD=2.783 a_DHA=142.441 symop: x,y,z a_YAH=136 2567 2629 " H ASP A 284 "<>" O VAL A 280 " d_HA=2.454 d_AD=3.463 a_DHA=176.338 symop: x,y,z a_YAH=133 3261 3339 " H LEU A 330 "<>" O GLU A 326 " d_HA=1.899 d_AD=2.874 a_DHA=160.489 symop: x,y,z a_YAH=149 2737 3189 " H ILE A 321 "<>" O ILE A 292 " d_HA=2.108 d_AD=3.032 a_DHA=148.180 symop: x,y,z a_YAH=144 2742 3184 " H ILE A 292 "<>" O ILE A 321 " d_HA=2.311 d_AD=3.100 a_DHA=134.054 symop: x,y,z a_YAH=170 2309 3204 " H GLY A 322 "<>" O ARG A 263 " d_HA=2.170 d_AD=3.187 a_DHA=169.966 symop: x,y,z a_YAH=150 2317 3203 " H ARG A 263 "<>" O GLY A 322 " d_HA=1.808 d_AD=2.796 a_DHA=162.322 symop: x,y,z a_YAH=145 2140 2222 " H ALA A 257 "<>" O VAL A 252 " d_HA=1.787 d_AD=2.706 a_DHA=149.851 symop: x,y,z a_YAH=133 2140 2206 " H LEU A 256 "<>" O VAL A 252 " d_HA=2.073 d_AD=2.873 a_DHA=134.500 symop: x,y,z a_YAH=143 2156 2251 " H GLU A 259 "<>" O GLN A 253 " d_HA=2.302 d_AD=3.267 a_DHA=157.524 symop: x,y,z a_YAH=159 2173 2263 " H SER A 260 "<>" O ASP A 254 " d_HA=2.580 d_AD=3.457 a_DHA=144.786 symop: x,y,z a_YAH=117 2103 2178 " H ASP A 254 "<>" O MET A 250 " d_HA=1.993 d_AD=2.832 a_DHA=139.539 symop: x,y,z a_YAH=158 2120 2189 " H VAL A 255 "<>" O PHE A 251 " d_HA=2.045 d_AD=3.053 a_DHA=174.641 symop: x,y,z a_YAH=151 2162 2093 " H GLN A 253 "<>" O ALA A 249 " d_HA=1.608 d_AD=2.582 a_DHA=163.594 symop: x,y,z a_YAH=151 1551 1606 " H ILE A 217 "<>" O TYR A 214 " d_HA=1.996 d_AD=2.729 a_DHA=126.779 symop: x,y,z a_YAH=116 2466 2524 " H GLU A 276 "<>" O SER A 273 " d_HA=2.264 d_AD=3.199 a_DHA=155.269 symop: x,y,z a_YAH=101 2483 3429 " H LYS A 274 "<>" O SER A 335 " d_HA=2.185 d_AD=3.155 a_DHA=157.184 symop: x,y,z a_YAH=124 2624 2688 " H VAL A 288 "<>" O ASP A 284 " d_HA=2.034 d_AD=3.045 a_DHA=163.311 symop: x,y,z a_YAH=170 2627 2677 " H ASP A 287 "<>" OD1 ASP A 284 " d_HA=2.294 d_AD=3.145 a_DHA=139.442 symop: x,y,z a_YAH=139 2636 2704 " H THR A 289 "<>" O ILE A 285 " d_HA=1.874 d_AD=2.872 a_DHA=168.801 symop: x,y,z a_YAH=168 2636 2715 " H GLY A 290 "<>" O ILE A 285 " d_HA=2.845 d_AD=3.766 a_DHA=149.715 symop: x,y,z a_YAH=132 2655 2715 " H GLY A 290 "<>" O HIS A 286 " d_HA=2.188 d_AD=2.941 a_DHA=128.738 symop: x,y,z a_YAH=108 2700 3327 "HH11 ARG A 329 "<>" O THR A 289 " d_HA=2.270 d_AD=3.129 a_DHA=138.877 symop: x,y,z a_YAH=137 3210 3281 " H ILE A 327 "<>" O LYS A 323 " d_HA=1.964 d_AD=2.914 a_DHA=157.022 symop: x,y,z a_YAH=141 3216 3265 " H LYS A 323 "<>" OE1 GLU A 326 " d_HA=1.827 d_AD=2.838 a_DHA=166.985 symop: x,y,z a_YAH=150 3353 3436 " HG SER A 335 "<>" O LYS A 331 " d_HA=1.705 d_AD=2.607 a_DHA=150.534 symop: x,y,z a_YAH=123 3375 3432 " H SER A 335 "<>" O ASN A 332 " d_HA=2.154 d_AD=3.035 a_DHA=143.259 symop: x,y,z a_YAH=106 3334 3415 " H ILE A 334 "<>" O LEU A 330 " d_HA=1.979 d_AD=2.996 a_DHA=172.378 symop: x,y,z a_YAH=169 3339 3261 " H LEU A 330 "<>" O GLU A 326 " d_HA=1.899 d_AD=2.874 a_DHA=160.489 symop: x,y,z a_YAH=149 3310 3398 " H TYR A 333 "<>" O ARG A 329 " d_HA=1.787 d_AD=2.775 a_DHA=163.225 symop: x,y,z a_YAH=160 2901 2805 " H VAL A 296 "<>" O ILE A 303 " d_HA=2.841 d_AD=3.794 a_DHA=160.231 symop: x,y,z a_YAH=93 2882 2925 " H ILE A 304 "<>" O LEU A 302 " d_HA=2.394 d_AD=3.186 a_DHA=134.653 symop: x,y,z a_YAH=90 3276 3359 " H LYS A 331 "<>" O ILE A 327 " d_HA=1.685 d_AD=2.675 a_DHA=165.073 symop: x,y,z a_YAH=157 3295 3380 " H ASN A 332 "<>" O GLU A 328 " d_HA=2.107 d_AD=3.051 a_DHA=154.754 symop: x,y,z a_YAH=153 3299 3384 "HD21 ASN A 332 "<>" OE1 GLU A 328 " d_HA=2.047 d_AD=2.715 a_DHA=121.462 symop: x,y,z a_YAH=136 3232 3301 " H GLU A 328 "<>" O PRO A 324 " d_HA=1.652 d_AD=2.634 a_DHA=163.092 symop: x,y,z a_YAH=148 3246 3318 " H ARG A 329 "<>" O GLU A 325 " d_HA=1.611 d_AD=2.607 a_DHA=167.428 symop: x,y,z a_YAH=168 2979 2588 " H LEU A 281 "<>" O ARG A 308 " d_HA=2.510 d_AD=3.453 a_DHA=158.543 symop: x,y,z a_YAH=110 2965 3024 " H TYR A 310 "<>" O PRO A 307 " d_HA=1.988 d_AD=2.874 a_DHA=142.965 symop: x,y,z a_YAH=142 293 337 " H GLY A 136 "<>" O LEU A 134 " d_HA=1.724 d_AD=2.549 a_DHA=135.865 symop: x,y,z a_YAH=120 254 320 " H ARG A 135 "<>" O ARG A 132 " d_HA=2.628 d_AD=3.277 a_DHA=121.865 symop: x,y,z a_YAH=130 209 284 " H GLU A 133 "<>" O GLU A 129 " d_HA=2.893 d_AD=3.839 a_DHA=155.184 symop: x,y,z a_YAH=166 209 262 " H ARG A 132 "<>" O GLU A 129 " d_HA=2.209 d_AD=3.067 a_DHA=141.115 symop: x,y,z a_YAH=101 975 1365 " H GLY A 177 "<>" OD2 ASP A 202 " d_HA=2.134 d_AD=3.129 a_DHA=163.525 symop: x,y,z a_YAH=152 29 999 " H ARG A 179 "<>" O HIS A 117 " d_HA=1.794 d_AD=2.708 a_DHA=148.561 symop: x,y,z a_YAH=133 29 1017 " H ALA A 180 "<>" O HIS A 117 " d_HA=2.826 d_AD=3.745 a_DHA=152.799 symop: x,y,z a_YAH=134 42 920 " HE2 HIS A 117 "<>" O ASN A 174 " d_HA=1.844 d_AD=2.859 a_DHA=166.464 symop: x,y,z a_YAH=149 934 983 " H ALA A 178 "<>" O VAL A 175 " d_HA=2.145 d_AD=3.138 a_DHA=163.206 symop: x,y,z a_YAH=142 62 1046 " H ILE A 182 "<>" O VAL A 119 " d_HA=1.736 d_AD=2.701 a_DHA=158.435 symop: x,y,z a_YAH=146 46 393 " H PHE A 140 "<>" O VAL A 118 " d_HA=2.080 d_AD=3.024 a_DHA=153.643 symop: x,y,z a_YAH=146 50 354 " H VAL A 118 "<>" O GLU A 138 " d_HA=1.821 d_AD=2.805 a_DHA=161.028 symop: x,y,z a_YAH=173 66 1015 " H VAL A 119 "<>" O ALA A 180 " d_HA=2.056 d_AD=2.995 a_DHA=152.740 symop: x,y,z a_YAH=139 83 385 " H ILE A 120 "<>" O PHE A 140 " d_HA=1.904 d_AD=2.732 a_DHA=138.877 symop: x,y,z a_YAH=167 176 240 " H LEU A 131 "<>" O THR A 127 " d_HA=1.631 d_AD=2.633 a_DHA=170.575 symop: x,y,z a_YAH=166 235 298 " H LEU A 134 "<>" O LEU A 131 " d_HA=2.809 d_AD=3.683 a_DHA=145.893 symop: x,y,z a_YAH=97 78 426 " H LEU A 142 "<>" O ILE A 120 " d_HA=2.281 d_AD=3.160 a_DHA=144.765 symop: x,y,z a_YAH=136 409 677 " H VAL A 141 "<>" O ASN A 158 " d_HA=1.826 d_AD=2.729 a_DHA=146.393 symop: x,y,z a_YAH=156 369 682 " H ASN A 158 "<>" O VAL A 139 " d_HA=1.751 d_AD=2.752 a_DHA=166.693 symop: x,y,z a_YAH=169 369 687 "HD22 ASN A 158 "<>" O VAL A 139 " d_HA=2.470 d_AD=3.417 a_DHA=155.822 symop: x,y,z a_YAH=119 590 652 " H SER A 155 "<>" O VAL A 152 " d_HA=2.314 d_AD=3.162 a_DHA=140.618 symop: x,y,z a_YAH=107 606 661 " H GLY A 156 "<>" O LEU A 153 " d_HA=1.815 d_AD=2.661 a_DHA=139.156 symop: x,y,z a_YAH=143 815 879 " H GLU A 171 "<>" O VAL A 167 " d_HA=2.071 d_AD=3.071 a_DHA=166.960 symop: x,y,z a_YAH=159 859 791 " H LEU A 170 "<>" O ARG A 166 " d_HA=2.141 d_AD=3.124 a_DHA=160.745 symop: x,y,z a_YAH=157 831 894 " H LYS A 172 "<>" O SER A 168 " d_HA=2.149 d_AD=3.105 a_DHA=157.836 symop: x,y,z a_YAH=136 842 912 " H ALA A 173 "<>" O ASP A 169 " d_HA=2.025 d_AD=2.827 a_DHA=135.029 symop: x,y,z a_YAH=141 854 938 " H VAL A 175 "<>" O LEU A 170 " d_HA=1.983 d_AD=2.981 a_DHA=165.322 symop: x,y,z a_YAH=160 873 925 " H ASN A 174 "<>" O GLU A 171 " d_HA=1.837 d_AD=2.720 a_DHA=145.115 symop: x,y,z a_YAH=115 405 715 " H VAL A 160 "<>" O VAL A 141 " d_HA=1.770 d_AD=2.766 a_DHA=165.152 symop: x,y,z a_YAH=167 442 711 " H ALA A 143 "<>" O VAL A 160 " d_HA=2.328 d_AD=3.251 a_DHA=153.420 symop: x,y,z a_YAH=156 522 611 " H LEU A 153 "<>" O ARG A 149 " d_HA=2.521 d_AD=3.508 a_DHA=165.622 symop: x,y,z a_YAH=149 506 594 " H VAL A 152 "<>" O VAL A 148 " d_HA=2.272 d_AD=3.222 a_DHA=155.283 symop: x,y,z a_YAH=139 546 633 " H ARG A 154 "<>" O LYS A 150 " d_HA=1.855 d_AD=2.852 a_DHA=166.167 symop: x,y,z a_YAH=162 834 1577 " H SER A 168 "<>" OE2 GLU A 215 " d_HA=2.247 d_AD=3.227 a_DHA=161.634 symop: y,x,-z+1 a_YAH=169 838 845 " HG SER A 168 "<>" OD1 ASP A 169 " d_HA=1.660 d_AD=2.565 a_DHA=152.531 symop: x,y,z a_YAH=137 847 791 " H ASP A 169 "<>" O ARG A 166 " d_HA=2.094 d_AD=2.772 a_DHA=122.555 symop: x,y,z a_YAH=102 756 846 " H ASP A 163 "<>" OD2 ASP A 169 " d_HA=2.040 d_AD=2.940 a_DHA=147.878 symop: x,y,z a_YAH=124 440 745 " H GLY A 162 "<>" O ALA A 143 " d_HA=1.946 d_AD=2.942 a_DHA=160.941 symop: x,y,z a_YAH=121 465 510 " H VAL A 148 "<>" O ASP A 145 " d_HA=2.236 d_AD=3.255 a_DHA=172.647 symop: x,y,z a_YAH=131 477 530 " H ARG A 149 "<>" O GLU A 146 " d_HA=1.957 d_AD=2.851 a_DHA=144.316 symop: x,y,z a_YAH=127 562 727 " HZ1 LYS A 150 "<>" O HIS A 161 " d_HA=2.377 d_AD=3.267 a_DHA=145.366 symop: -y+2,x-y+1,z a_YAH=157 495 740 " HE2 HIS A 161 "<>" OD1 ASN A 147 " d_HA=1.751 d_AD=2.785 a_DHA=178.307 symop: -y+2,x-y+1,z a_YAH=123 ------------------------------------------------------------------------------- Total: 205 Symmetry: 0 Per residue: 0.9276 Mean SD Skew Kurtosis theta_1: 141.022 21.915 -0.572 2.195 theta_2: 132.509 23.311 -0.048 1.841 d_HA: 2.307 0.298 0.205 2.260 3230 3302 " H LYS B 95 "<>" O LEU B 91 " d_HA=1.891 d_AD=2.875 a_DHA=161.850 symop: x,y,z a_YAH=166 1208 1272 " H GLU A 80 "<>" O GLU A 76 " d_HA=2.285 d_AD=3.266 a_DHA=162.079 symop: x,y,z a_YAH=149 1168 1242 " H LEU A 78 "<>" O VAL A 74 " d_HA=2.047 d_AD=3.052 a_DHA=171.579 symop: x,y,z a_YAH=173 1228 1154 " H ASN A 77 "<>" O THR A 73 " d_HA=1.876 d_AD=2.849 a_DHA=160.559 symop: x,y,z a_YAH=153 267 1200 " HE ARG A 75 "<>" OG1 THR A 19 " d_HA=2.079 d_AD=3.036 a_DHA=155.708 symop: x,y,z a_YAH=137 a_YAH=121 797 840 " H LEU A 55 "<>" O GLU A 52 " d_HA=2.875 d_AD=3.519 a_DHA=122.452 symop: x,y,z a_YAH=98 797 863 " H TYR A 56 "<>" O GLU A 52 " d_HA=2.061 d_AD=3.042 a_DHA=162.014 symop: x,y,z a_YAH=145 435 1111 "HH21 ARG A 70 "<>" OE1 GLN A 29 " d_HA=1.672 d_AD=2.606 a_DHA=150.551 symop: x,y,z a_YAH=142 384 453 " H LEU A 30 "<>" O ILE A 26 " d_HA=2.167 d_AD=3.174 a_DHA=171.501 symop: x,y,z a_YAH=151 431 497 " H THR A 33 "<>" O GLN A 29 " d_HA=2.192 d_AD=3.027 a_DHA=139.310 symop: x,y,z a_YAH=152 612 676 " H SER A 45 "<>" O LEU A 41 " d_HA=1.830 d_AD=2.690 a_DHA=140.149 symop: x,y,z a_YAH=130 638 714 " H ARG A 47 "<>" O GLU A 43 " d_HA=2.236 d_AD=3.133 a_DHA=146.693 symop: x,y,z a_YAH=153 638 690 " H LYS A 46 "<>" O GLU A 43 " d_HA=2.052 d_AD=2.884 a_DHA=137.764 symop: x,y,z a_YAH=95 737 653 " H HIS A 48 "<>" O PHE A 44 " d_HA=2.401 d_AD=3.188 a_DHA=134.167 symop: x,y,z a_YAH=137 478 10062 " HG1 THR F 73 "<>" O GLU A 32 " d_HA=2.400 d_AD=3.207 a_DHA=139.758 symop: x+1/2,-y+3/2,-z+7/4 a_YAH=124 559 632 " H GLY A 42 "<>" O ALA A 38 " d_HA=2.632 d_AD=3.357 a_DHA=128.369 symop: x,y,z a_YAH=116 569 644 " H GLU A 43 "<>" O ILE A 39 " d_HA=2.015 d_AD=2.986 a_DHA=159.590 symop: x,y,z a_YAH=176 4603 4680 " H ARG C 70 "<>" O GLU C 66 " d_HA=2.826 d_AD=3.574 a_DHA=130.450 symop: x,y,z a_YAH=129 9897 4552 "HD21 ASN F 64 "<>" O GLU C 63 " d_HA=2.379 d_AD=3.364 a_DHA=163.168 symop: x,y,z a_YAH=144 4570 4623 " H LEU C 67 "<>" OD1 ASN C 64 " d_HA=2.296 d_AD=3.220 a_DHA=150.579 symop: x,y,z a_YAH=128 4623 4567 " H LEU C 67 "<>" O ASN C 64 " d_HA=2.731 d_AD=3.394 a_DHA=122.990 symop: x,y,z a_YAH=90 9242 9307 " H SER F 27 "<>" O ARG F 24 " d_HA=2.146 d_AD=3.002 a_DHA=141.552 symop: x,y,z a_YAH=102 9242 9321 " H GLN F 28 "<>" O ARG F 24 " d_HA=2.234 d_AD=3.228 a_DHA=165.164 symop: x,y,z a_YAH=147 9518 9443 " H LEU F 41 "<>" O GLN F 37 " d_HA=2.715 d_AD=3.694 a_DHA=162.878 symop: x,y,z a_YAH=113 9460 9533 " H GLY F 42 "<>" O ALA F 38 " d_HA=2.610 d_AD=3.419 a_DHA=137.026 symop: x,y,z a_YAH=130 9470 9545 " H GLU F 43 "<>" O ILE F 39 " d_HA=1.929 d_AD=2.935 a_DHA=167.885 symop: x,y,z a_YAH=147 9500 9436 " H TRP F 40 "<>" O GLY F 36 " d_HA=2.468 d_AD=3.405 a_DHA=153.425 symop: x,y,z a_YAH=131 4168 4224 " H GLU C 43 "<>" O TRP C 40 " d_HA=2.062 d_AD=2.716 a_DHA=120.054 symop: x,y,z a_YAH=117 4168 4241 " H PHE C 44 "<>" O TRP C 40 " d_HA=2.163 d_AD=3.162 a_DHA=168.450 symop: x,y,z a_YAH=161 1783 1704 " H GLN A 111 "<>" O GLU A 107 " d_HA=2.112 d_AD=3.114 a_DHA=168.951 symop: x,y,z a_YAH=161 3182 3252 " H SER B 92 "<>" O GLU B 88 " d_HA=2.610 d_AD=3.527 a_DHA=150.780 symop: x,y,z a_YAH=110 3168 3235 " H LEU B 91 "<>" O PRO B 87 " d_HA=2.101 d_AD=3.063 a_DHA=157.258 symop: x,y,z a_YAH=144 3168 3218 " H VAL B 90 "<>" O PRO B 87 " d_HA=2.810 d_AD=3.564 a_DHA=131.330 symop: x,y,z a_YAH=94 3197 3266 " H GLN B 93 "<>" O MET B 89 " d_HA=2.326 d_AD=3.218 a_DHA=145.881 symop: x,y,z a_YAH=120 3214 3282 " H ILE B 94 "<>" O VAL B 90 " d_HA=2.021 d_AD=3.012 a_DHA=164.111 symop: x,y,z a_YAH=151 1223 1282 " H GLY A 81 "<>" O ASN A 77 " d_HA=1.827 d_AD=2.839 a_DHA=174.595 symop: x,y,z a_YAH=156 1256 1292 " H VAL A 82 "<>" O ALA A 79 " d_HA=2.344 d_AD=3.304 a_DHA=157.034 symop: x,y,z a_YAH=108 1256 1309 " H LEU A 83 "<>" O ALA A 79 " d_HA=1.977 d_AD=2.960 a_DHA=163.765 symop: x,y,z a_YAH=160 146 214 " H GLN A 15 "<>" O ALA A 11 " d_HA=2.075 d_AD=3.049 a_DHA=160.085 symop: x,y,z a_YAH=142 161 117 " H ILE A 12 "<>" O GLU A 9 " d_HA=2.851 d_AD=3.548 a_DHA=126.810 symop: x,y,z a_YAH=92 246 317 " H ALA A 22 "<>" O LEU A 18 " d_HA=1.679 d_AD=2.686 a_DHA=172.188 symop: x,y,z a_YAH=172 1184 1258 " H ALA A 79 "<>" O ARG A 75 " d_HA=2.274 d_AD=3.221 a_DHA=156.022 symop: x,y,z a_YAH=134 208 269 " H THR A 19 "<>" O GLN A 15 " d_HA=1.757 d_AD=2.745 a_DHA=162.434 symop: x,y,z a_YAH=158 156 228 " H SER A 16 "<>" O ILE A 12 " d_HA=1.883 d_AD=2.884 a_DHA=166.668 symop: x,y,z a_YAH=167 232 780 " HG SER A 16 "<>" O GLN A 51 " d_HA=2.292 d_AD=3.135 a_DHA=144.524 symop: x,y,z a_YAH=146 298 370 " H LEU A 25 "<>" O GLN A 21 " d_HA=2.277 d_AD=3.130 a_DHA=140.475 symop: x,y,z a_YAH=150 315 370 " H LEU A 25 "<>" O ALA A 22 " d_HA=2.056 d_AD=2.808 a_DHA=128.784 symop: x,y,z a_YAH=117 315 389 " H ILE A 26 "<>" O ALA A 22 " d_HA=2.271 d_AD=3.265 a_DHA=168.349 symop: x,y,z a_YAH=161 265 329 " H VAL A 23 "<>" O THR A 19 " d_HA=2.153 d_AD=3.112 a_DHA=157.815 symop: x,y,z a_YAH=151 279 349 " H ARG A 24 "<>" O LEU A 20 " d_HA=1.841 d_AD=2.734 a_DHA=143.744 symop: x,y,z a_YAH=153 225 284 " H LEU A 20 "<>" O SER A 16 " d_HA=2.134 d_AD=3.121 a_DHA=163.367 symop: x,y,z a_YAH=144 341 420 " H GLN A 28 "<>" O ARG A 24 " d_HA=2.456 d_AD=3.398 a_DHA=154.919 symop: x,y,z a_YAH=134 365 437 " H GLN A 29 "<>" O LEU A 25 " d_HA=1.911 d_AD=2.849 a_DHA=153.088 symop: x,y,z a_YAH=169 325 406 " H SER A 27 "<>" O VAL A 23 " d_HA=1.854 d_AD=2.786 a_DHA=151.705 symop: x,y,z a_YAH=122 747 803 " H GLU A 52 "<>" O PRO A 49 " d_HA=2.428 d_AD=3.210 a_DHA=133.860 symop: x,y,z a_YAH=104 414 474 " HG SER A 31 "<>" O GLN A 28 " d_HA=1.518 d_AD=2.489 a_DHA=166.783 symop: x,y,z a_YAH=122 414 484 " H GLU A 32 "<>" O GLN A 28 " d_HA=2.638 d_AD=3.581 a_DHA=153.808 symop: x,y,z a_YAH=166 403 470 " H SER A 31 "<>" O SER A 27 " d_HA=2.121 d_AD=3.127 a_DHA=172.055 symop: x,y,z a_YAH=155 10182 10230 " H GLU F 84 "<>" O GLY F 81 " d_HA=2.163 d_AD=3.159 a_DHA=164.598 symop: x,y,z a_YAH=158 10124 10173 " H GLU F 80 "<>" O ASN F 77 " d_HA=1.906 d_AD=2.758 a_DHA=139.641 symop: x,y,z a_YAH=123 10124 10183 " H GLY F 81 "<>" O ASN F 77 " d_HA=2.460 d_AD=3.413 a_DHA=156.097 symop: x,y,z a_YAH=159 10055 10115 " H GLU F 76 "<>" O THR F 73 " d_HA=1.859 d_AD=2.819 a_DHA=158.235 symop: x,y,z a_YAH=122 10055 10129 " H ASN F 77 "<>" O THR F 73 " d_HA=2.059 d_AD=3.051 a_DHA=164.932 symop: x,y,z a_YAH=170 10109 10173 " H GLU F 80 "<>" O GLU F 76 " d_HA=2.306 d_AD=3.035 a_DHA=127.773 symop: x,y,z a_YAH=139 701 8857 " HZ2 LYS A 46 "<>" O LEU E 109 " d_HA=2.961 d_AD=3.780 a_DHA=137.445 symop: x+1/2,-y+3/2,-z+7/4 a_YAH=144 10138 10183 " H GLY F 81 "<>" O LEU F 78 " d_HA=2.212 d_AD=2.989 a_DHA=132.144 symop: x,y,z a_YAH=126 10138 10193 " H VAL F 82 "<>" O LEU F 78 " d_HA=2.608 d_AD=3.258 a_DHA=122.307 symop: x,y,z a_YAH=148 10069 10143 " H LEU F 78 "<>" O VAL F 74 " d_HA=2.197 d_AD=3.104 a_DHA=149.322 symop: x,y,z a_YAH=171 9993 10059 " H THR F 73 "<>" O ARG F 70 " d_HA=1.730 d_AD=2.672 a_DHA=153.363 symop: x,y,z a_YAH=132 9993 10073 " H VAL F 74 "<>" O ARG F 70 " d_HA=2.025 d_AD=2.973 a_DHA=155.480 symop: x,y,z a_YAH=147 10017 10093 " H ARG F 75 "<>" O ILE F 71 " d_HA=1.826 d_AD=2.822 a_DHA=169.105 symop: x,y,z a_YAH=144 9924 9979 " H LEU F 69 "<>" O GLU F 66 " d_HA=1.877 d_AD=2.657 a_DHA=131.102 symop: x,y,z a_YAH=108 9924 10001 " H ARG F 70 "<>" O GLU F 66 " d_HA=2.165 d_AD=3.113 a_DHA=154.909 symop: x,y,z a_YAH=154 9939 10001 " H ARG F 70 "<>" O LEU F 67 " d_HA=2.845 d_AD=3.477 a_DHA=120.908 symop: x,y,z a_YAH=95 9939 10022 " H ILE F 71 "<>" O LEU F 67 " d_HA=2.235 d_AD=3.235 a_DHA=170.017 symop: x,y,z a_YAH=163 9958 10041 " H LEU F 72 "<>" O VAL F 68 " d_HA=2.367 d_AD=3.208 a_DHA=140.040 symop: x,y,z a_YAH=138 9902 9979 " H LEU F 69 "<>" O LYS F 65 " d_HA=2.658 d_AD=3.467 a_DHA=136.636 symop: x,y,z a_YAH=127 4607 9919 " HZ2 LYS F 65 "<>" OE1 GLU C 66 " d_HA=2.410 d_AD=3.105 a_DHA=124.282 symop: x,y,z a_YAH=99 4608 9920 " HZ3 LYS F 65 "<>" OE2 GLU C 66 " d_HA=2.394 d_AD=3.145 a_DHA=130.035 symop: x,y,z a_YAH=95 7117 7187 " H VAL E 6 "<>" O PHE E 3 " d_HA=2.422 d_AD=3.302 a_DHA=145.769 symop: x,y,z a_YAH=105 7117 7201 " H ALA E 7 "<>" O PHE E 3 " d_HA=2.861 d_AD=3.795 a_DHA=154.910 symop: x,y,z a_YAH=135 7139 7215 " H LYS E 8 "<>" O LYS E 4 " d_HA=2.086 d_AD=3.096 a_DHA=176.317 symop: x,y,z a_YAH=167 9199 9271 " H LEU F 25 "<>" O GLN F 21 " d_HA=1.884 d_AD=2.902 a_DHA=178.604 symop: x,y,z a_YAH=167 9216 9290 " H ILE F 26 "<>" O ALA F 22 " d_HA=2.208 d_AD=3.193 a_DHA=162.156 symop: x,y,z a_YAH=152 9888 9962 " H VAL F 68 "<>" O ASN F 64 " d_HA=2.209 d_AD=3.186 a_DHA=161.293 symop: x,y,z a_YAH=151 9891 9930 " H GLU F 66 "<>" OD1 ASN F 64 " d_HA=2.628 d_AD=3.298 a_DHA=123.383 symop: x,y,z a_YAH=157 9891 9944 " H LEU F 67 "<>" OD1 ASN F 64 " d_HA=2.234 d_AD=3.238 a_DHA=168.421 symop: x,y,z a_YAH=141 4576 9873 "HD21 ASN C 64 "<>" O GLU F 63 " d_HA=2.359 d_AD=3.328 a_DHA=158.925 symop: x,y,z a_YAH=168 3964 4033 " H LEU C 30 "<>" O ILE C 26 " d_HA=2.208 d_AD=3.145 a_DHA=153.081 symop: x,y,z a_YAH=131 7161 7237 " H GLU E 9 "<>" O LYS E 5 " d_HA=2.432 d_AD=3.418 a_DHA=164.646 symop: x,y,z a_YAH=135 7235 9212 "HE22 GLN F 21 "<>" OE1 GLU E 9 " d_HA=2.254 d_AD=3.097 a_DHA=139.057 symop: x,y,z a_YAH=96 4122 4197 " H LEU C 41 "<>" O GLN C 37 " d_HA=2.135 d_AD=3.113 a_DHA=163.356 symop: x,y,z a_YAH=153 9489 9562 " H PHE F 44 "<>" O TRP F 40 " d_HA=2.011 d_AD=3.028 a_DHA=174.373 symop: x,y,z a_YAH=170 9513 9581 " HG SER F 45 "<>" O LEU F 41 " d_HA=1.500 d_AD=2.474 a_DHA=169.287 symop: x,y,z a_YAH=163 9513 9577 " H SER F 45 "<>" O LEU F 41 " d_HA=2.211 d_AD=3.129 a_DHA=149.676 symop: x,y,z a_YAH=134 9532 9591 " H LYS F 46 "<>" O GLY F 42 " d_HA=2.696 d_AD=3.522 a_DHA=138.697 symop: x,y,z a_YAH=151 4139 4212 " H GLY C 42 "<>" O ALA C 38 " d_HA=2.533 d_AD=3.280 a_DHA=130.692 symop: x,y,z a_YAH=118 4149 4224 " H GLU C 43 "<>" O ILE C 39 " d_HA=1.930 d_AD=2.848 a_DHA=148.992 symop: x,y,z a_YAH=150 4149 4212 " H GLY C 42 "<>" O ILE C 39 " d_HA=1.939 d_AD=2.615 a_DHA=121.827 symop: x,y,z a_YAH=105 1685 1766 " H THR A 110 "<>" O LEU A 106 " d_HA=2.492 d_AD=3.229 a_DHA=129.153 symop: x,y,z a_YAH=167 1685 1748 " H LEU A 109 "<>" O LEU A 106 " d_HA=1.970 d_AD=2.858 a_DHA=144.367 symop: x,y,z a_YAH=107 1719 4280 " HZ1 LYS C 46 "<>" O ARG A 108 " d_HA=2.986 d_AD=3.988 a_DHA=167.637 symop: x,y+1,z a_YAH=129 3114 3154 " H LEU B 86 "<>" O GLU B 84 " d_HA=2.273 d_AD=3.144 a_DHA=143.034 symop: x,y,z a_YAH=93 1304 1363 " H LEU A 86 "<>" O LEU A 83 " d_HA=2.538 d_AD=3.524 a_DHA=164.302 symop: x,y,z a_YAH=94 3149 3202 " H MET B 89 "<>" O LEU B 86 " d_HA=1.828 d_AD=2.730 a_DHA=145.403 symop: x,y,z a_YAH=115 3149 3218 " H VAL B 90 "<>" O LEU B 86 " d_HA=2.136 d_AD=3.046 a_DHA=148.105 symop: x,y,z a_YAH=166 85 148 " H ALA A 11 "<>" O ALA A 7 " d_HA=2.465 d_AD=3.208 a_DHA=129.842 symop: x,y,z a_YAH=125 95 161 " H ILE A 12 "<>" O LYS A 8 " d_HA=2.386 d_AD=3.321 a_DHA=153.661 symop: x,y,z a_YAH=158 95 148 " H ALA A 11 "<>" O LYS A 8 " d_HA=1.821 d_AD=2.609 a_DHA=132.054 symop: x,y,z a_YAH=121 132 194 " H LEU A 14 "<>" O THR A 10 " d_HA=2.114 d_AD=3.126 a_DHA=175.997 symop: x,y,z a_YAH=162 179 117 " H THR A 13 "<>" O GLU A 9 " d_HA=2.398 d_AD=3.363 a_DHA=158.974 symop: x,y,z a_YAH=139 175 238 " H ALA A 17 "<>" O THR A 13 " d_HA=1.914 d_AD=2.727 a_DHA=134.781 symop: x,y,z a_YAH=149 189 251 " H LEU A 18 "<>" O LEU A 14 " d_HA=1.940 d_AD=2.946 a_DHA=169.358 symop: x,y,z a_YAH=170 236 304 " H GLN A 21 "<>" O ALA A 17 " d_HA=1.835 d_AD=2.838 a_DHA=167.977 symop: x,y,z a_YAH=139 311 1912 "HE22 GLN A 21 "<>" OE1 GLU B 9 " d_HA=1.885 d_AD=2.893 a_DHA=165.240 symop: x,y,z a_YAH=140 8721 8762 "HH11 ARG E 103 "<>" O ARG E 102 " d_HA=2.958 d_AD=3.748 a_DHA=135.512 symop: x,y,z a_YAH=92 8745 8824 " H GLU E 107 "<>" O ARG E 103 " d_HA=2.121 d_AD=3.024 a_DHA=146.912 symop: x,y,z a_YAH=147 10157 10210 " H LEU F 83 "<>" O ALA F 79 " d_HA=2.613 d_AD=3.538 a_DHA=152.236 symop: x,y,z a_YAH=109 8672 10104 "HH21 ARG F 75 "<>" OD1 ASN E 98 " d_HA=2.049 d_AD=2.916 a_DHA=142.046 symop: x,y,z a_YAH=115 8672 10101 " HE ARG F 75 "<>" OD1 ASN E 98 " d_HA=2.013 d_AD=2.933 a_DHA=149.071 symop: x,y,z a_YAH=136 8678 10036 "HD21 ASN E 98 "<>" O LEU F 72 " d_HA=1.652 d_AD=2.644 a_DHA=166.940 symop: x,y,z a_YAH=141 8669 8729 " H ARG E 102 "<>" O ASN E 98 " d_HA=2.449 d_AD=3.442 a_DHA=166.922 symop: x,y,z a_YAH=118 8704 8753 " H ARG E 103 "<>" O HIS E 101 " d_HA=1.808 d_AD=2.651 a_DHA=137.683 symop: x,y,z a_YAH=101 8704 8785 " H LEU E 105 "<>" O HIS E 101 " d_HA=1.800 d_AD=2.801 a_DHA=170.225 symop: x,y,z a_YAH=158 8769 8841 " H ARG E 108 "<>" O SER E 104 " d_HA=2.593 d_AD=3.505 a_DHA=151.228 symop: x,y,z a_YAH=139 8818 8880 " H THR E 110 "<>" O GLU E 107 " d_HA=1.895 d_AD=2.867 a_DHA=157.422 symop: x,y,z a_YAH=156 10239 10312 " H MET F 89 "<>" O PHE F 85 " d_HA=1.778 d_AD=2.760 a_DHA=161.830 symop: x,y,z a_YAH=155 10189 10247 " H PHE F 85 "<>" O VAL F 82 " d_HA=2.436 d_AD=3.257 a_DHA=137.362 symop: x,y,z a_YAH=143 10085 10159 " H ALA F 79 "<>" O ARG F 75 " d_HA=2.534 d_AD=3.539 a_DHA=176.615 symop: x,y,z a_YAH=123 9168 10102 "HH11 ARG F 75 "<>" OG1 THR F 19 " d_HA=2.014 d_AD=3.017 a_DHA=166.893 symop: x,y,z a_YAH=143 a_YAH=102 10307 10382 "HE21 GLN F 93 "<>" O MET F 89 " d_HA=2.519 d_AD=3.277 a_DHA=131.814 symop: x,y,z a_YAH=143 10307 10376 " H GLN F 93 "<>" O MET F 89 " d_HA=2.662 d_AD=3.633 a_DHA=161.251 symop: x,y,z a_YAH=104 7183 7250 " H THR E 10 "<>" O VAL E 6 " d_HA=1.694 d_AD=2.679 a_DHA=164.455 symop: x,y,z a_YAH=157 7199 7262 " H ALA E 11 "<>" O ALA E 7 " d_HA=1.932 d_AD=2.704 a_DHA=130.755 symop: x,y,z a_YAH=137 9137 9205 " H GLN F 21 "<>" O ALA F 17 " d_HA=1.910 d_AD=2.921 a_DHA=170.972 symop: x,y,z a_YAH=159 9147 9218 " H ALA F 22 "<>" O LEU F 18 " d_HA=1.858 d_AD=2.841 a_DHA=163.330 symop: x,y,z a_YAH=144 9166 9230 " H VAL F 23 "<>" O THR F 19 " d_HA=1.873 d_AD=2.819 a_DHA=153.673 symop: x,y,z a_YAH=149 9776 9825 " H MET F 60 "<>" O LEU F 57 " d_HA=2.199 d_AD=2.865 a_DHA=121.320 symop: x,y,z a_YAH=100 9776 9842 " H MET F 61 "<>" O LEU F 57 " d_HA=1.837 d_AD=2.824 a_DHA=161.567 symop: x,y,z a_YAH=157 9810 9859 " H LEU F 62 "<>" O ALA F 59 " d_HA=2.258 d_AD=3.226 a_DHA=159.347 symop: x,y,z a_YAH=97 9810 9879 " H GLU F 63 "<>" O ALA F 59 " d_HA=2.854 d_AD=3.743 a_DHA=146.510 symop: x,y,z a_YAH=131 9820 9893 " H ASN F 64 "<>" O MET F 60 " d_HA=1.667 d_AD=2.673 a_DHA=176.293 symop: x,y,z a_YAH=162 4134 9854 "HE21 GLN C 37 "<>" O LEU F 62 " d_HA=2.134 d_AD=2.785 a_DHA=120.072 symop: x,y,z a_YAH=133 4090 4134 "HE21 GLN C 37 "<>" OD1 ASN C 34 " d_HA=2.443 d_AD=3.216 a_DHA=132.447 symop: x,y,z a_YAH=110 4011 4064 " H GLU C 32 "<>" O GLN C 29 " d_HA=2.631 d_AD=3.537 a_DHA=149.542 symop: x,y,z a_YAH=101 4011 4077 " H THR C 33 "<>" O GLN C 29 " d_HA=2.628 d_AD=3.628 a_DHA=170.308 symop: x,y,z a_YAH=146 4075 4097 "HD22 ASN C 34 "<>" OG1 THR C 33 " d_HA=2.983 d_AD=3.908 a_DHA=152.721 symop: x,y,z a_YAH=117 a_YAH=101 7209 7262 " H ALA E 11 "<>" O LYS E 8 " d_HA=2.462 d_AD=3.139 a_DHA=123.744 symop: x,y,z a_YAH=95 7209 7275 " H ILE E 12 "<>" O LYS E 8 " d_HA=1.862 d_AD=2.812 a_DHA=155.651 symop: x,y,z a_YAH=157 7231 7293 " H THR E 13 "<>" O GLU E 9 " d_HA=1.915 d_AD=2.918 a_DHA=166.038 symop: x,y,z a_YAH=146 9180 9250 " H ARG F 24 "<>" O LEU F 20 " d_HA=1.819 d_AD=2.703 a_DHA=143.227 symop: x,y,z a_YAH=138 9625 9878 "HH12 ARG F 47 "<>" OE2 GLU F 63 " d_HA=1.673 d_AD=2.666 a_DHA=161.497 symop: x,y,z a_YAH=126 4087 4141 " H ALA C 38 "<>" O ASN C 34 " d_HA=1.999 d_AD=2.879 a_DHA=144.324 symop: x,y,z a_YAH=146 4115 4179 " H TRP C 40 "<>" O GLY C 36 " d_HA=2.512 d_AD=3.379 a_DHA=143.199 symop: x,y,z a_YAH=147 4115 4154 " H ILE C 39 "<>" O GLY C 36 " d_HA=2.006 d_AD=2.830 a_DHA=136.340 symop: x,y,z a_YAH=126 4028 4092 " H ASN C 34 "<>" O LEU C 30 " d_HA=1.784 d_AD=2.731 a_DHA=154.248 symop: x,y,z a_YAH=133 4050 3994 " H SER C 31 "<>" O GLN C 28 " d_HA=1.965 d_AD=2.840 a_DHA=143.441 symop: x,y,z a_YAH=110 4064 3994 " H GLU C 32 "<>" O GLN C 28 " d_HA=2.936 d_AD=3.735 a_DHA=136.816 symop: x,y,z a_YAH=154 9554 9638 " H HIS F 48 "<>" O PHE F 44 " d_HA=2.270 d_AD=3.115 a_DHA=140.377 symop: x,y,z a_YAH=162 9539 9591 " H LYS F 46 "<>" O GLU F 43 " d_HA=2.857 d_AD=3.665 a_DHA=137.103 symop: x,y,z a_YAH=97 9539 9615 " H ARG F 47 "<>" O GLU F 43 " d_HA=2.486 d_AD=3.486 a_DHA=169.191 symop: x,y,z a_YAH=143 2819 9624 "HH11 ARG F 47 "<>" OE2 GLU B 66 " d_HA=1.868 d_AD=2.845 a_DHA=156.995 symop: x,y+1,z a_YAH=165 4101 4154 " H ILE C 39 "<>" O PRO C 35 " d_HA=2.286 d_AD=3.145 a_DHA=141.391 symop: x,y,z a_YAH=146 3079 3137 " H PHE B 85 "<>" O VAL B 82 " d_HA=2.122 d_AD=2.917 a_DHA=134.612 symop: x,y,z a_YAH=135 1358 1411 " H MET A 89 "<>" O LEU A 86 " d_HA=2.283 d_AD=3.020 a_DHA=129.092 symop: x,y,z a_YAH=119 1358 1427 " H VAL A 90 "<>" O LEU A 86 " d_HA=1.933 d_AD=2.948 a_DHA=175.903 symop: x,y,z a_YAH=173 1876 1939 " H ALA B 11 "<>" O ALA B 7 " d_HA=2.445 d_AD=3.232 a_DHA=134.273 symop: x,y,z a_YAH=136 1980 2042 " H LEU B 18 "<>" O LEU B 14 " d_HA=1.906 d_AD=2.842 a_DHA=152.248 symop: x,y,z a_YAH=144 1816 1892 " H LYS B 8 "<>" O LYS B 4 " d_HA=1.895 d_AD=2.885 a_DHA=164.502 symop: x,y,z a_YAH=159 1838 1892 " H LYS B 8 "<>" O LYS B 5 " d_HA=2.442 d_AD=3.081 a_DHA=120.275 symop: x,y,z a_YAH=113 1838 1914 " H GLU B 9 "<>" O LYS B 5 " d_HA=2.345 d_AD=3.309 a_DHA=160.847 symop: x,y,z a_YAH=148 1860 1927 " H THR B 10 "<>" O VAL B 6 " d_HA=1.847 d_AD=2.847 a_DHA=168.895 symop: x,y,z a_YAH=166 1886 1939 " H ALA B 11 "<>" O LYS B 8 " d_HA=1.781 d_AD=2.561 a_DHA=131.092 symop: x,y,z a_YAH=114 1886 1952 " H ILE B 12 "<>" O LYS B 8 " d_HA=1.998 d_AD=2.941 a_DHA=155.021 symop: x,y,z a_YAH=156 1908 1970 " H THR B 13 "<>" O GLU B 9 " d_HA=2.101 d_AD=3.014 a_DHA=148.579 symop: x,y,z a_YAH=129 1908 1973 " HG1 THR B 13 "<>" O GLU B 9 " d_HA=2.340 d_AD=3.128 a_DHA=137.902 symop: x,y,z a_YAH=152 1923 1985 " H LEU B 14 "<>" O THR B 10 " d_HA=1.847 d_AD=2.842 a_DHA=166.115 symop: x,y,z a_YAH=160 1966 2029 " H ALA B 17 "<>" O THR B 13 " d_HA=1.831 d_AD=2.724 a_DHA=145.097 symop: x,y,z a_YAH=153 8505 8575 " H SER E 92 "<>" O GLU E 88 " d_HA=2.053 d_AD=3.056 a_DHA=169.073 symop: x,y,z a_YAH=159 8505 8558 " H LEU E 91 "<>" O GLU E 88 " d_HA=2.115 d_AD=2.902 a_DHA=132.431 symop: x,y,z a_YAH=130 8572 8647 " H GLN E 96 "<>" O SER E 92 " d_HA=1.986 d_AD=2.985 a_DHA=167.833 symop: x,y,z a_YAH=159 8619 8674 " H ASN E 98 "<>" O LYS E 95 " d_HA=2.537 d_AD=3.433 a_DHA=147.025 symop: x,y,z a_YAH=94 8641 8684 " H GLY E 99 "<>" O GLN E 96 " d_HA=1.746 d_AD=2.753 a_DHA=169.054 symop: x,y,z a_YAH=157 8641 8695 " H ASN E 100 "<>" O GLN E 96 " d_HA=2.841 d_AD=3.524 a_DHA=125.340 symop: x,y,z a_YAH=135 8472 8541 " H VAL E 90 "<>" O LEU E 86 " d_HA=2.499 d_AD=3.307 a_DHA=136.494 symop: x,y,z a_YAH=121 8491 8541 " H VAL E 90 "<>" O PRO E 87 " d_HA=2.724 d_AD=3.551 a_DHA=139.128 symop: x,y,z a_YAH=94 8491 8558 " H LEU E 91 "<>" O PRO E 87 " d_HA=2.199 d_AD=3.107 a_DHA=147.317 symop: x,y,z a_YAH=143 8537 8605 " H ILE E 94 "<>" O VAL E 90 " d_HA=2.827 d_AD=3.473 a_DHA=122.532 symop: x,y,z a_YAH=117 8553 8605 " H ILE E 94 "<>" O LEU E 91 " d_HA=2.303 d_AD=3.142 a_DHA=140.037 symop: x,y,z a_YAH=101 8553 8625 " H LYS E 95 "<>" O LEU E 91 " d_HA=2.033 d_AD=3.031 a_DHA=166.215 symop: x,y,z a_YAH=162 8583 8661 " H SER E 97 "<>" O GLN E 93 " d_HA=2.569 d_AD=3.439 a_DHA=144.186 symop: x,y,z a_YAH=122 8660 8715 " HD1 HIS E 101 "<>" OG SER E 97 " d_HA=2.530 d_AD=3.271 a_DHA=129.526 symop: x,y,z a_YAH=128 a_YAH=118 8658 8715 " HD1 HIS E 101 "<>" O SER E 97 " d_HA=2.044 d_AD=2.995 a_DHA=155.163 symop: x,y,z a_YAH=143 8690 8772 " H SER E 104 "<>" O ASN E 100 " d_HA=2.957 d_AD=3.766 a_DHA=138.232 symop: x,y,z a_YAH=124 10278 10345 " H LEU F 91 "<>" O PRO F 87 " d_HA=2.285 d_AD=3.260 a_DHA=159.089 symop: x,y,z a_YAH=151 10278 10328 " H VAL F 90 "<>" O PRO F 87 " d_HA=2.631 d_AD=3.572 a_DHA=153.690 symop: x,y,z a_YAH=107 10292 10362 " H SER F 92 "<>" O GLU F 88 " d_HA=1.997 d_AD=3.011 a_DHA=176.484 symop: x,y,z a_YAH=170 10259 10328 " H VAL F 90 "<>" O LEU F 86 " d_HA=2.505 d_AD=3.161 a_DHA=121.744 symop: x,y,z a_YAH=144 8665 9727 " HG SER E 97 "<>" OD1 ASP F 54 " d_HA=1.539 d_AD=2.441 a_DHA=146.430 symop: x,y,z a_YAH=98 9122 9728 "HE22 GLN F 15 "<>" OD2 ASP F 54 " d_HA=2.766 d_AD=3.601 a_DHA=140.714 symop: x,y,z a_YAH=96 9724 9801 " H GLU F 58 "<>" O ASP F 54 " d_HA=2.061 d_AD=3.079 a_DHA=175.572 symop: x,y,z a_YAH=170 9724 9781 " H LEU F 57 "<>" O ASP F 54 " d_HA=2.479 d_AD=3.156 a_DHA=123.271 symop: x,y,z a_YAH=111 8850 8894 "HH11 ARG E 108 "<>" OE1 GLN E 111 " d_HA=1.757 d_AD=2.728 a_DHA=157.404 symop: x,y,z a_YAH=163 10324 10392 " H ILE F 94 "<>" O VAL F 90 " d_HA=2.043 d_AD=2.923 a_DHA=144.442 symop: x,y,z a_YAH=139 7260 7328 " H GLN E 15 "<>" O ALA E 11 " d_HA=2.197 d_AD=2.993 a_DHA=134.089 symop: x,y,z a_YAH=136 7246 7308 " H LEU E 14 "<>" O THR E 10 " d_HA=2.182 d_AD=3.188 a_DHA=172.455 symop: x,y,z a_YAH=136 9076 9139 " H ALA F 17 "<>" O THR F 13 " d_HA=2.390 d_AD=3.145 a_DHA=130.415 symop: x,y,z a_YAH=132 9090 9152 " H LEU F 18 "<>" O LEU F 14 " d_HA=2.127 d_AD=3.008 a_DHA=144.017 symop: x,y,z a_YAH=159 9090 9139 " H ALA F 17 "<>" O LEU F 14 " d_HA=1.962 d_AD=2.678 a_DHA=125.043 symop: x,y,z a_YAH=104 9109 9170 " H THR F 19 "<>" O GLN F 15 " d_HA=2.059 d_AD=2.997 a_DHA=152.402 symop: x,y,z a_YAH=149 9109 9173 " HG1 THR F 19 "<>" O GLN F 15 " d_HA=2.019 d_AD=2.869 a_DHA=145.210 symop: x,y,z a_YAH=129 9126 9185 " H LEU F 20 "<>" O SER F 16 " d_HA=2.450 d_AD=3.327 a_DHA=144.209 symop: x,y,z a_YAH=115 9698 9764 " H TYR F 56 "<>" O GLU F 52 " d_HA=1.814 d_AD=2.648 a_DHA=137.382 symop: x,y,z a_YAH=139 9713 9781 " H LEU F 57 "<>" O SER F 53 " d_HA=2.444 d_AD=3.383 a_DHA=152.730 symop: x,y,z a_YAH=143 9736 9812 " H ALA F 59 "<>" O LEU F 55 " d_HA=2.055 d_AD=3.049 a_DHA=166.907 symop: x,y,z a_YAH=159 9755 9825 " H MET F 60 "<>" O TYR F 56 " d_HA=2.279 d_AD=3.099 a_DHA=136.467 symop: x,y,z a_YAH=128 7270 7328 " H GLN E 15 "<>" O ILE E 12 " d_HA=2.201 d_AD=2.887 a_DHA=123.431 symop: x,y,z a_YAH=93 7270 7342 " H SER E 16 "<>" O ILE E 12 " d_HA=1.954 d_AD=2.946 a_DHA=163.893 symop: x,y,z a_YAH=162 9648 9704 " H GLU F 52 "<>" O PRO F 49 " d_HA=2.301 d_AD=3.260 a_DHA=155.628 symop: x,y,z a_YAH=146 2952 4058 " HG1 THR B 73 "<>" O GLU C 32 " d_HA=2.193 d_AD=3.098 a_DHA=155.447 symop: x,y+1,z a_YAH=125 2814 2891 " H ARG B 70 "<>" O GLU B 66 " d_HA=2.466 d_AD=3.244 a_DHA=132.988 symop: x,y,z a_YAH=133 2864 2949 " H THR B 73 "<>" O LEU B 69 " d_HA=2.740 d_AD=3.531 a_DHA=135.507 symop: x,y,z a_YAH=119 2337 2788 "HD22 ASN B 64 "<>" OE1 GLN B 37 " d_HA=2.445 d_AD=3.113 a_DHA=122.982 symop: x,y,z a_YAH=122 2781 2834 " H LEU B 67 "<>" OD1 ASN B 64 " d_HA=2.042 d_AD=3.000 a_DHA=156.764 symop: x,y,z a_YAH=136 2778 2834 " H LEU B 67 "<>" O ASN B 64 " d_HA=2.725 d_AD=3.475 a_DHA=131.023 symop: x,y,z a_YAH=99 2778 2852 " H VAL B 68 "<>" O ASN B 64 " d_HA=2.488 d_AD=3.472 a_DHA=166.359 symop: x,y,z a_YAH=150 2792 2869 " H LEU B 69 "<>" O LYS B 65 " d_HA=2.240 d_AD=3.196 a_DHA=156.446 symop: x,y,z a_YAH=154 2395 2768 " HE1 TRP B 40 "<>" OE2 GLU B 63 " d_HA=1.908 d_AD=2.822 a_DHA=146.670 symop: x,y,z a_YAH=133 2710 2769 " H GLU B 63 "<>" O MET B 60 " d_HA=2.384 d_AD=3.222 a_DHA=139.343 symop: x,y,z a_YAH=110 2710 2783 " H ASN B 64 "<>" O MET B 60 " d_HA=1.772 d_AD=2.764 a_DHA=163.578 symop: x,y,z a_YAH=160 2727 2769 " H GLU B 63 "<>" O MET B 61 " d_HA=1.717 d_AD=2.587 a_DHA=141.213 symop: x,y,z a_YAH=105 2727 2783 " H ASN B 64 "<>" O MET B 61 " d_HA=2.650 d_AD=3.377 a_DHA=128.307 symop: x,y,z a_YAH=128 2666 2732 " H MET B 61 "<>" O LEU B 57 " d_HA=2.178 d_AD=2.947 a_DHA=130.515 symop: x,y,z a_YAH=147 2685 2732 " H MET B 61 "<>" O GLU B 58 " d_HA=2.219 d_AD=3.015 a_DHA=133.441 symop: x,y,z a_YAH=99 2685 2749 " H LEU B 62 "<>" O GLU B 58 " d_HA=2.541 d_AD=3.497 a_DHA=156.554 symop: x,y,z a_YAH=166 2517 2767 "HH22 ARG B 47 "<>" OE1 GLU B 63 " d_HA=2.062 d_AD=2.898 a_DHA=136.619 symop: x,y,z a_YAH=101 3047 3100 " H LEU B 83 "<>" O ALA B 79 " d_HA=2.125 d_AD=3.097 a_DHA=161.197 symop: x,y,z a_YAH=146 3047 3083 " H VAL B 82 "<>" O ALA B 79 " d_HA=2.813 d_AD=3.631 a_DHA=137.129 symop: x,y,z a_YAH=125 3014 3073 " H GLY B 81 "<>" O ASN B 77 " d_HA=2.218 d_AD=3.217 a_DHA=166.744 symop: x,y,z a_YAH=159 1377 1444 " H LEU A 91 "<>" O PRO A 87 " d_HA=2.311 d_AD=3.246 a_DHA=152.474 symop: x,y,z a_YAH=148 2975 3049 " H ALA B 79 "<>" O ARG B 75 " d_HA=2.258 d_AD=3.169 a_DHA=148.884 symop: x,y,z a_YAH=121 1406 1475 " H GLN A 93 "<>" O MET A 89 " d_HA=1.788 d_AD=2.795 a_DHA=170.340 symop: x,y,z a_YAH=166 1423 1491 " H ILE A 94 "<>" O VAL A 90 " d_HA=1.895 d_AD=2.829 a_DHA=151.809 symop: x,y,z a_YAH=142 1937 2005 " H GLN B 15 "<>" O ALA B 11 " d_HA=2.220 d_AD=3.136 a_DHA=149.864 symop: x,y,z a_YAH=127 1999 2060 " H THR B 19 "<>" O GLN B 15 " d_HA=1.887 d_AD=2.891 a_DHA=167.055 symop: x,y,z a_YAH=162 1999 2063 " HG1 THR B 19 "<>" O GLN B 15 " d_HA=1.783 d_AD=2.742 a_DHA=167.786 symop: x,y,z a_YAH=122 2058 2992 "HH11 ARG B 75 "<>" OG1 THR B 19 " d_HA=2.662 d_AD=3.606 a_DHA=155.447 symop: x,y,z a_YAH=121 a_YAH=132 1947 2019 " H SER B 16 "<>" O ILE B 12 " d_HA=2.031 d_AD=3.040 a_DHA=171.129 symop: x,y,z a_YAH=159 2016 2075 " H LEU B 20 "<>" O SER B 16 " d_HA=2.120 d_AD=3.120 a_DHA=167.074 symop: x,y,z a_YAH=132 2018 2610 " HG SER B 53 "<>" OG SER B 16 " d_HA=2.511 d_AD=3.455 a_DHA=164.865 symop: x,y,z a_YAH=102 a_YAH=99 2023 2571 " HG SER B 16 "<>" O GLN B 51 " d_HA=2.097 d_AD=3.059 a_DHA=169.171 symop: x,y,z a_YAH=119 2594 2538 " H GLU B 52 "<>" O PRO B 49 " d_HA=1.890 d_AD=2.841 a_DHA=154.003 symop: x,y,z a_YAH=129 8402 8460 " H PHE E 85 "<>" O VAL E 82 " d_HA=2.028 d_AD=2.900 a_DHA=141.880 symop: x,y,z a_YAH=154 8520 8589 " H GLN E 93 "<>" O MET E 89 " d_HA=2.574 d_AD=3.513 a_DHA=154.538 symop: x,y,z a_YAH=118 8370 8423 " H LEU E 83 "<>" O ALA E 79 " d_HA=2.401 d_AD=3.381 a_DHA=163.449 symop: x,y,z a_YAH=124 9033 9080 " H THR F 13 "<>" O THR F 10 " d_HA=1.770 d_AD=2.586 a_DHA=134.916 symop: x,y,z a_YAH=112 9033 9083 " HG1 THR F 13 "<>" O THR F 10 " d_HA=2.528 d_AD=3.163 a_DHA=123.072 symop: x,y,z a_YAH=95 9033 9095 " H LEU F 14 "<>" O THR F 10 " d_HA=1.922 d_AD=2.932 a_DHA=172.306 symop: x,y,z a_YAH=163 9047 9115 " H GLN F 15 "<>" O ALA F 11 " d_HA=1.924 d_AD=2.919 a_DHA=164.760 symop: x,y,z a_YAH=140 7303 7365 " H LEU E 18 "<>" O LEU E 14 " d_HA=1.975 d_AD=2.987 a_DHA=172.652 symop: x,y,z a_YAH=144 9057 9129 " H SER F 16 "<>" O ILE F 12 " d_HA=1.763 d_AD=2.765 a_DHA=167.428 symop: x,y,z a_YAH=153 9133 9681 " HG SER F 16 "<>" O GLN F 51 " d_HA=1.873 d_AD=2.853 a_DHA=176.154 symop: x,y,z a_YAH=153 7322 7386 " HG1 THR E 19 "<>" O GLN E 15 " d_HA=1.784 d_AD=2.734 a_DHA=162.888 symop: x,y,z a_YAH=125 7322 7383 " H THR E 19 "<>" O GLN E 15 " d_HA=2.085 d_AD=3.039 a_DHA=155.457 symop: x,y,z a_YAH=159 7381 7933 " HG SER E 53 "<>" OG1 THR E 19 " d_HA=1.984 d_AD=2.840 a_DHA=146.184 symop: x,y,z a_YAH=111 a_YAH=118 7289 7352 " H ALA E 17 "<>" O THR E 13 " d_HA=1.875 d_AD=2.880 a_DHA=167.542 symop: x,y,z a_YAH=163 7339 7398 " H LEU E 20 "<>" O SER E 16 " d_HA=2.321 d_AD=3.319 a_DHA=164.933 symop: x,y,z a_YAH=145 2945 3019 " H ASN B 77 "<>" O THR B 73 " d_HA=2.176 d_AD=3.154 a_DHA=162.620 symop: x,y,z a_YAH=134 7940 8318 "HH22 ARG E 75 "<>" OD1 ASP E 54 " d_HA=2.796 d_AD=3.700 a_DHA=148.172 symop: x,y,z a_YAH=147 7940 10452 " HG SER F 97 "<>" OD1 ASP E 54 " d_HA=1.460 d_AD=2.451 a_DHA=165.887 symop: x,y,z a_YAH=129 7940 10504 " HE2 HIS F 101 "<>" OD1 ASP E 54 " d_HA=1.906 d_AD=2.907 a_DHA=164.848 symop: x,y,z a_YAH=114 7926 7977 " H TYR E 56 "<>" O SER E 53 " d_HA=2.578 d_AD=3.330 a_DHA=130.748 symop: x,y,z a_YAH=95 7926 7994 " H LEU E 57 "<>" O SER E 53 " d_HA=2.213 d_AD=3.169 a_DHA=155.588 symop: x,y,z a_YAH=138 7928 8317 "HH21 ARG E 75 "<>" OG SER E 53 " d_HA=2.509 d_AD=3.376 a_DHA=144.198 symop: x,y,z a_YAH=152 a_YAH=93 7346 7894 " HG SER E 16 "<>" O GLN E 51 " d_HA=1.687 d_AD=2.658 a_DHA=171.339 symop: x,y,z a_YAH=122 2829 2891 " H ARG B 70 "<>" O LEU B 67 " d_HA=2.088 d_AD=2.777 a_DHA=123.225 symop: x,y,z a_YAH=102 2829 2912 " H ILE B 71 "<>" O LEU B 67 " d_HA=1.977 d_AD=2.973 a_DHA=164.786 symop: x,y,z a_YAH=168 2883 2963 " H VAL B 74 "<>" O ARG B 70 " d_HA=1.850 d_AD=2.857 a_DHA=168.169 symop: x,y,z a_YAH=162 2883 2949 " H THR B 73 "<>" O ARG B 70 " d_HA=2.188 d_AD=2.881 a_DHA=124.454 symop: x,y,z a_YAH=94 2848 2931 " H LEU B 72 "<>" O VAL B 68 " d_HA=2.123 d_AD=3.134 a_DHA=177.971 symop: x,y,z a_YAH=154 2907 2983 " H ARG B 75 "<>" O ILE B 71 " d_HA=1.776 d_AD=2.789 a_DHA=176.678 symop: x,y,z a_YAH=174 7937 8014 " H GLU E 58 "<>" O ASP E 54 " d_HA=1.787 d_AD=2.802 a_DHA=174.368 symop: x,y,z a_YAH=172 7911 7977 " H TYR E 56 "<>" O GLU E 52 " d_HA=2.291 d_AD=3.158 a_DHA=142.721 symop: x,y,z a_YAH=152 7949 8025 " H ALA E 59 "<>" O LEU E 55 " d_HA=2.683 d_AD=3.693 a_DHA=171.876 symop: x,y,z a_YAH=125 7861 7917 " H GLU E 52 "<>" O PRO E 49 " d_HA=2.165 d_AD=3.079 a_DHA=148.289 symop: x,y,z a_YAH=129 2298 2339 " H GLN B 37 "<>" O ASN B 34 " d_HA=1.773 d_AD=2.674 a_DHA=145.914 symop: x,y,z a_YAH=113 2298 2352 " H ALA B 38 "<>" O ASN B 34 " d_HA=2.192 d_AD=3.120 a_DHA=150.958 symop: x,y,z a_YAH=128 2333 2408 " H LEU B 41 "<>" O GLN B 37 " d_HA=2.191 d_AD=3.151 a_DHA=157.163 symop: x,y,z a_YAH=142 2326 2390 " H TRP B 40 "<>" O GLY B 36 " d_HA=2.569 d_AD=3.411 a_DHA=140.531 symop: x,y,z a_YAH=111 2379 2452 " H PHE B 44 "<>" O TRP B 40 " d_HA=1.860 d_AD=2.665 a_DHA=133.575 symop: x,y,z a_YAH=139 2626 2702 " H ALA B 59 "<>" O LEU B 55 " d_HA=1.986 d_AD=2.988 a_DHA=168.936 symop: x,y,z a_YAH=153 2645 2715 " H MET B 60 "<>" O TYR B 56 " d_HA=2.320 d_AD=3.249 a_DHA=151.966 symop: x,y,z a_YAH=126 2671 2603 " H LEU B 57 "<>" O SER B 53 " d_HA=1.732 d_AD=2.704 a_DHA=159.032 symop: x,y,z a_YAH=171 2999 3063 " H GLU B 80 "<>" O GLU B 76 " d_HA=2.089 d_AD=3.054 a_DHA=156.666 symop: x,y,z a_YAH=145 1458 1533 " H GLN A 96 "<>" O SER A 92 " d_HA=1.989 d_AD=2.967 a_DHA=160.490 symop: x,y,z a_YAH=160 1439 1511 " H LYS A 95 "<>" O LEU A 91 " d_HA=2.004 d_AD=3.012 a_DHA=170.023 symop: x,y,z a_YAH=154 2926 3005 " H GLU B 76 "<>" O LEU B 72 " d_HA=2.766 d_AD=3.556 a_DHA=135.555 symop: x,y,z a_YAH=125 1469 1547 " H SER A 97 "<>" O GLN A 93 " d_HA=1.957 d_AD=2.873 a_DHA=149.364 symop: x,y,z a_YAH=150 1486 1560 " H ASN A 98 "<>" O ILE A 94 " d_HA=1.680 d_AD=2.677 a_DHA=171.066 symop: x,y,z a_YAH=167 2588 2631 " H LEU B 55 "<>" O GLU B 52 " d_HA=2.569 d_AD=3.376 a_DHA=137.201 symop: x,y,z a_YAH=90 2588 2654 " H TYR B 56 "<>" O GLU B 52 " d_HA=1.964 d_AD=2.887 a_DHA=150.815 symop: x,y,z a_YAH=131 2603 2671 " H LEU B 57 "<>" O SER B 53 " d_HA=1.732 d_AD=2.704 a_DHA=159.032 symop: x,y,z a_YAH=171 8395 8443 " H GLU E 84 "<>" O GLY E 81 " d_HA=2.718 d_AD=3.670 a_DHA=156.453 symop: x,y,z a_YAH=111 8948 9002 " H LYS F 8 "<>" O LYS F 5 " d_HA=1.996 d_AD=2.680 a_DHA=122.598 symop: x,y,z a_YAH=165 8948 9024 " H GLU F 9 "<>" O LYS F 5 " d_HA=2.963 d_AD=3.741 a_DHA=135.243 symop: x,y,z a_YAH=99 8386 8322 " H GLU E 80 "<>" O GLU E 76 " d_HA=2.617 d_AD=3.299 a_DHA=125.350 symop: x,y,z a_YAH=149 8396 8337 " H GLY E 81 "<>" O ASN E 77 " d_HA=2.730 d_AD=3.740 a_DHA=174.627 symop: x,y,z a_YAH=133 8351 8406 " H VAL E 82 "<>" O LEU E 78 " d_HA=2.491 d_AD=3.478 a_DHA=165.635 symop: x,y,z a_YAH=157 8970 9040 " HG1 THR F 10 "<>" O VAL F 6 " d_HA=1.813 d_AD=2.723 a_DHA=154.686 symop: x,y,z a_YAH=157 8970 9037 " H THR F 10 "<>" O VAL F 6 " d_HA=2.101 d_AD=2.972 a_DHA=142.581 symop: x,y,z a_YAH=128 8986 9049 " H ALA F 11 "<>" O ALA F 7 " d_HA=1.888 d_AD=2.862 a_DHA=159.606 symop: x,y,z a_YAH=148 8986 9037 " H THR F 10 "<>" O ALA F 7 " d_HA=2.206 d_AD=2.932 a_DHA=126.995 symop: x,y,z a_YAH=111 8996 9062 " H ILE F 12 "<>" O LYS F 8 " d_HA=2.473 d_AD=3.353 a_DHA=145.291 symop: x,y,z a_YAH=156 9018 9083 " HG1 THR F 13 "<>" O GLU F 9 " d_HA=1.830 d_AD=2.623 a_DHA=137.053 symop: x,y,z a_YAH=140 8282 8356 " H LEU E 78 "<>" O VAL E 74 " d_HA=1.805 d_AD=2.753 a_DHA=152.821 symop: x,y,z a_YAH=176 8298 8372 " H ALA E 79 "<>" O ARG E 75 " d_HA=2.211 d_AD=3.217 a_DHA=171.901 symop: x,y,z a_YAH=138 8306 8230 " H ARG E 75 "<>" O ILE E 71 " d_HA=1.947 d_AD=2.878 a_DHA=152.067 symop: x,y,z a_YAH=166 7360 7431 " H ALA E 22 "<>" O LEU E 18 " d_HA=1.921 d_AD=2.842 a_DHA=149.080 symop: x,y,z a_YAH=129 7379 7443 " H VAL E 23 "<>" O THR E 19 " d_HA=2.049 d_AD=2.863 a_DHA=135.592 symop: x,y,z a_YAH=136 7350 7418 " H GLN E 21 "<>" O ALA E 17 " d_HA=1.976 d_AD=2.970 a_DHA=165.164 symop: x,y,z a_YAH=139 2959 3033 " H LEU B 78 "<>" O VAL B 74 " d_HA=1.740 d_AD=2.725 a_DHA=162.358 symop: x,y,z a_YAH=154 2194 2261 " H SER B 31 "<>" O SER B 27 " d_HA=1.968 d_AD=2.948 a_DHA=161.466 symop: x,y,z a_YAH=163 2222 2275 " H GLU B 32 "<>" O GLN B 29 " d_HA=2.306 d_AD=2.992 a_DHA=124.379 symop: x,y,z a_YAH=100 2239 2303 " H ASN B 34 "<>" O LEU B 30 " d_HA=1.870 d_AD=2.678 a_DHA=134.814 symop: x,y,z a_YAH=127 2239 2288 " H THR B 33 "<>" O LEU B 30 " d_HA=2.236 d_AD=3.116 a_DHA=145.144 symop: x,y,z a_YAH=101 2156 2228 " H GLN B 29 "<>" O LEU B 25 " d_HA=2.227 d_AD=3.220 a_DHA=165.849 symop: x,y,z a_YAH=138 2175 2244 " H LEU B 30 "<>" O ILE B 26 " d_HA=1.796 d_AD=2.789 a_DHA=165.865 symop: x,y,z a_YAH=166 2106 2180 " H ILE B 26 "<>" O ALA B 22 " d_HA=2.106 d_AD=3.088 a_DHA=162.335 symop: x,y,z a_YAH=165 7968 8038 " H MET E 60 "<>" O TYR E 56 " d_HA=1.968 d_AD=2.970 a_DHA=168.095 symop: x,y,z a_YAH=148 7844 7880 " H ILE E 50 "<>" O HIS E 48 " d_HA=2.652 d_AD=3.485 a_DHA=139.226 symop: x,y,z a_YAH=103 2312 2365 " H ILE B 39 "<>" O PRO B 35 " d_HA=1.800 d_AD=2.794 a_DHA=164.404 symop: x,y,z a_YAH=147 2350 2423 " H GLY B 42 "<>" O ALA B 38 " d_HA=2.086 d_AD=3.068 a_DHA=161.998 symop: x,y,z a_YAH=159 2116 2197 " H SER B 27 "<>" O VAL B 23 " d_HA=1.949 d_AD=2.953 a_DHA=169.093 symop: x,y,z a_YAH=143 2056 2120 " H VAL B 23 "<>" O THR B 19 " d_HA=1.996 d_AD=2.990 a_DHA=167.079 symop: x,y,z a_YAH=171 2360 2435 " H GLU B 43 "<>" O ILE B 39 " d_HA=1.892 d_AD=2.911 a_DHA=176.170 symop: x,y,z a_YAH=154 2403 2467 " H SER B 45 "<>" O LEU B 41 " d_HA=1.818 d_AD=2.799 a_DHA=161.540 symop: x,y,z a_YAH=160 2422 2481 " H LYS B 46 "<>" O GLY B 42 " d_HA=2.352 d_AD=3.217 a_DHA=141.991 symop: x,y,z a_YAH=164 2429 2514 "HH11 ARG B 47 "<>" O GLU B 43 " d_HA=2.566 d_AD=3.489 a_DHA=152.088 symop: x,y,z a_YAH=102 2444 2505 " H ARG B 47 "<>" O PHE B 44 " d_HA=2.830 d_AD=3.458 a_DHA=120.578 symop: x,y,z a_YAH=109 2444 2528 " H HIS B 48 "<>" O PHE B 44 " d_HA=2.535 d_AD=3.311 a_DHA=133.514 symop: x,y,z a_YAH=143 2521 2557 " H ILE B 50 "<>" O HIS B 48 " d_HA=2.705 d_AD=3.404 a_DHA=126.069 symop: x,y,z a_YAH=105 2538 2594 " H GLU B 52 "<>" O PRO B 49 " d_HA=1.890 d_AD=2.841 a_DHA=154.003 symop: x,y,z a_YAH=129 1505 1570 " H GLY A 99 "<>" O LYS A 95 " d_HA=1.808 d_AD=2.769 a_DHA=156.851 symop: x,y,z a_YAH=160 1564 2926 "HD21 ASN A 98 "<>" O LEU B 72 " d_HA=1.723 d_AD=2.724 a_DHA=167.793 symop: x,y,z a_YAH=124 1565 3003 "HD22 ASN A 98 "<>" OE1 GLU B 76 " d_HA=1.993 d_AD=2.926 a_DHA=149.946 symop: x,y,z a_YAH=137 1527 1581 " H ASN A 100 "<>" O GLN A 96 " d_HA=2.187 d_AD=3.192 a_DHA=169.603 symop: x,y,z a_YAH=154 1544 1597 " H HIS A 101 "<>" O SER A 97 " d_HA=2.097 d_AD=3.038 a_DHA=154.712 symop: x,y,z a_YAH=165 1555 1615 " H ARG A 102 "<>" O ASN A 98 " d_HA=2.377 d_AD=3.333 a_DHA=156.896 symop: x,y,z a_YAH=146 1558 2991 " HE ARG B 75 "<>" OD1 ASN A 98 " d_HA=2.150 d_AD=2.963 a_DHA=136.458 symop: x,y,z a_YAH=127 1558 2994 "HH21 ARG B 75 "<>" OD1 ASN A 98 " d_HA=2.052 d_AD=2.888 a_DHA=138.406 symop: x,y,z a_YAH=115 1546 2995 "HH22 ARG B 75 "<>" OG SER A 97 " d_HA=2.065 d_AD=3.040 a_DHA=159.984 symop: x,y,z a_YAH=94 a_YAH=153 1551 2618 " HG SER A 97 "<>" OD2 ASP B 54 " d_HA=2.056 d_AD=2.999 a_DHA=158.237 symop: x,y,z a_YAH=105 2614 2691 " H GLU B 58 "<>" O ASP B 54 " d_HA=2.303 d_AD=3.307 a_DHA=170.707 symop: x,y,z a_YAH=142 7412 7484 " H LEU E 25 "<>" O GLN E 21 " d_HA=1.942 d_AD=2.897 a_DHA=155.701 symop: x,y,z a_YAH=145 7429 7503 " H ILE E 26 "<>" O ALA E 22 " d_HA=2.792 d_AD=3.611 a_DHA=138.585 symop: x,y,z a_YAH=112 7393 7463 " H ARG E 24 "<>" O LEU E 20 " d_HA=1.836 d_AD=2.821 a_DHA=161.901 symop: x,y,z a_YAH=155 2217 2274 "HE21 GLN B 28 "<>" OE2 GLU B 32 " d_HA=1.882 d_AD=2.894 a_DHA=164.528 symop: x,y,z a_YAH=153 2205 2275 " H GLU B 32 "<>" O GLN B 28 " d_HA=2.286 d_AD=3.155 a_DHA=143.769 symop: x,y,z a_YAH=147 2205 2265 " HG SER B 31 "<>" O GLN B 28 " d_HA=1.756 d_AD=2.712 a_DHA=164.901 symop: x,y,z a_YAH=142 2132 2211 " H GLN B 28 "<>" O ARG B 24 " d_HA=1.970 d_AD=2.932 a_DHA=157.743 symop: x,y,z a_YAH=161 2089 2161 " H LEU B 25 "<>" O GLN B 21 " d_HA=2.128 d_AD=3.068 a_DHA=153.235 symop: x,y,z a_YAH=135 2037 2108 " H ALA B 22 "<>" O LEU B 18 " d_HA=1.874 d_AD=2.832 a_DHA=155.077 symop: x,y,z a_YAH=156 7767 7851 " H HIS E 48 "<>" O PHE E 44 " d_HA=1.740 d_AD=2.639 a_DHA=146.137 symop: x,y,z a_YAH=124 2070 2140 " H ARG B 24 "<>" O LEU B 20 " d_HA=1.738 d_AD=2.685 a_DHA=153.537 symop: x,y,z a_YAH=147 2027 2095 " H GLN B 21 "<>" O ALA B 17 " d_HA=2.138 d_AD=3.110 a_DHA=157.959 symop: x,y,z a_YAH=149 2075 2016 " H LEU B 20 "<>" O SER B 16 " d_HA=2.120 d_AD=3.120 a_DHA=167.074 symop: x,y,z a_YAH=132 1569 1639 " H ARG A 103 "<>" O GLY A 99 " d_HA=1.876 d_AD=2.865 a_DHA=163.949 symop: x,y,z a_YAH=163 1579 1649 "HH12 ARG A 103 "<>" OD1 ASN A 100 " d_HA=1.759 d_AD=2.704 a_DHA=152.039 symop: x,y,z a_YAH=134 1590 1671 " H LEU A 105 "<>" O HIS A 101 " d_HA=1.947 d_AD=2.857 a_DHA=148.276 symop: x,y,z a_YAH=146 1576 1658 " H SER A 104 "<>" O ASN A 100 " d_HA=2.306 d_AD=3.295 a_DHA=165.905 symop: x,y,z a_YAH=129 7479 7551 " H GLN E 29 "<>" O LEU E 25 " d_HA=2.922 d_AD=3.620 a_DHA=126.556 symop: x,y,z a_YAH=124 3 87 " H ALA A 7 "<>" O PHE A 3 " d_HA=2.419 d_AD=3.370 a_DHA=156.062 symop: x,y,z a_YAH=149 7439 7520 " H SER E 27 "<>" O VAL E 23 " d_HA=1.902 d_AD=2.903 a_DHA=166.277 symop: x,y,z a_YAH=164 7498 7551 " H GLN E 29 "<>" O ILE E 26 " d_HA=1.806 d_AD=2.713 a_DHA=146.732 symop: x,y,z a_YAH=137 7455 7534 " H GLN E 28 "<>" O ARG E 24 " d_HA=2.553 d_AD=3.558 a_DHA=172.956 symop: x,y,z a_YAH=156 69 136 " H THR A 10 "<>" O VAL A 6 " d_HA=1.962 d_AD=2.922 a_DHA=156.744 symop: x,y,z a_YAH=149 7524 7673 " HG SER E 27 "<>" O ALA E 38 " d_HA=2.860 d_AD=3.598 a_DHA=133.718 symop: x,y,z a_YAH=127 121 2102 "HE22 GLN B 21 "<>" OE1 GLU A 9 " d_HA=2.680 d_AD=3.690 a_DHA=170.803 symop: x,y,z a_YAH=105 7726 7790 " H SER E 45 "<>" O LEU E 41 " d_HA=1.740 d_AD=2.637 a_DHA=145.489 symop: x,y,z a_YAH=160 7726 7775 " H PHE E 44 "<>" O LEU E 41 " d_HA=2.108 d_AD=3.003 a_DHA=146.725 symop: x,y,z a_YAH=102 7745 7804 " H LYS E 46 "<>" O GLY E 42 " d_HA=2.566 d_AD=3.573 a_DHA=171.256 symop: x,y,z a_YAH=152 3945 4017 " H GLN C 29 "<>" O LEU C 25 " d_HA=1.937 d_AD=2.920 a_DHA=166.479 symop: x,y,z a_YAH=152 3994 4064 " H GLU C 32 "<>" O GLN C 28 " d_HA=2.936 d_AD=3.735 a_DHA=136.816 symop: x,y,z a_YAH=154 3994 4050 " H SER C 31 "<>" O GLN C 28 " d_HA=1.965 d_AD=2.840 a_DHA=143.441 symop: x,y,z a_YAH=110 1607 1690 " H LEU A 106 "<>" O ARG A 102 " d_HA=2.146 d_AD=2.982 a_DHA=138.619 symop: x,y,z a_YAH=143 1631 1690 " H LEU A 106 "<>" O ARG A 103 " d_HA=2.391 d_AD=3.193 a_DHA=135.510 symop: x,y,z a_YAH=107 1631 1710 " H GLU A 107 "<>" O ARG A 103 " d_HA=1.858 d_AD=2.870 a_DHA=173.058 symop: x,y,z a_YAH=159 1655 1727 " H ARG A 108 "<>" O SER A 104 " d_HA=1.930 d_AD=2.915 a_DHA=163.377 symop: x,y,z a_YAH=141 7609 7626 " H ASN E 34 "<>" OG1 THR E 33 " d_HA=1.879 d_AD=2.734 a_DHA=140.303 symop: x,y,z a_YAH=93 a_YAH=105 7517 7567 " H LEU E 30 "<>" O SER E 27 " d_HA=1.823 d_AD=2.699 a_DHA=142.460 symop: x,y,z a_YAH=110 7517 7584 " H SER E 31 "<>" O SER E 27 " d_HA=2.241 d_AD=2.980 a_DHA=128.591 symop: x,y,z a_YAH=159 47 123 " H GLU A 9 "<>" O LYS A 5 " d_HA=1.865 d_AD=2.810 a_DHA=155.501 symop: x,y,z a_YAH=173 7621 7662 " H GLN E 37 "<>" O ASN E 34 " d_HA=2.026 d_AD=2.963 a_DHA=152.259 symop: x,y,z a_YAH=124 7621 7675 " H ALA E 38 "<>" O ASN E 34 " d_HA=2.873 d_AD=3.709 a_DHA=140.782 symop: x,y,z a_YAH=119 7635 7688 " H ILE E 39 "<>" O PRO E 35 " d_HA=2.347 d_AD=3.163 a_DHA=136.798 symop: x,y,z a_YAH=140 7656 7731 " H LEU E 41 "<>" O GLN E 37 " d_HA=1.774 d_AD=2.789 a_DHA=177.254 symop: x,y,z a_YAH=162 7673 7746 " H GLY E 42 "<>" O ALA E 38 " d_HA=2.562 d_AD=3.453 a_DHA=146.589 symop: x,y,z a_YAH=114 117 161 " H ILE A 12 "<>" O GLU A 9 " d_HA=2.851 d_AD=3.548 a_DHA=126.810 symop: x,y,z a_YAH=92 117 179 " H THR A 13 "<>" O GLU A 9 " d_HA=2.398 d_AD=3.363 a_DHA=158.974 symop: x,y,z a_YAH=139 7649 7688 " H ILE E 39 "<>" O GLY E 36 " d_HA=2.123 d_AD=2.866 a_DHA=128.492 symop: x,y,z a_YAH=98 7649 7713 " H TRP E 40 "<>" O GLY E 36 " d_HA=1.743 d_AD=2.521 a_DHA=131.056 symop: x,y,z a_YAH=133 7683 7758 " H GLU E 43 "<>" O ILE E 39 " d_HA=1.742 d_AD=2.713 a_DHA=158.288 symop: x,y,z a_YAH=141 5379 5455 " H LYS D 8 "<>" O LYS D 4 " d_HA=2.371 d_AD=3.288 a_DHA=150.866 symop: x,y,z a_YAH=122 5357 5407 " H LYS D 5 "<>" O PHE D 3 " d_HA=2.240 d_AD=3.049 a_DHA=135.623 symop: x,y,z a_YAH=109 5357 5427 " H VAL D 6 "<>" O PHE D 3 " d_HA=2.825 d_AD=3.673 a_DHA=141.245 symop: x,y,z a_YAH=135 3895 3969 " H ILE C 26 "<>" O ALA C 22 " d_HA=2.522 d_AD=3.528 a_DHA=171.628 symop: x,y,z a_YAH=138 5401 5455 " H LYS D 8 "<>" O LYS D 5 " d_HA=2.631 d_AD=3.384 a_DHA=131.528 symop: x,y,z a_YAH=104 5401 5477 " H GLU D 9 "<>" O LYS D 5 " d_HA=2.176 d_AD=3.162 a_DHA=165.978 symop: x,y,z a_YAH=146 3905 3986 " H SER C 27 "<>" O VAL C 23 " d_HA=2.399 d_AD=3.251 a_DHA=141.722 symop: x,y,z a_YAH=134 3921 4000 " H GLN C 28 "<>" O ARG C 24 " d_HA=1.938 d_AD=2.923 a_DHA=162.861 symop: x,y,z a_YAH=160 3921 3986 " H SER C 27 "<>" O ARG C 24 " d_HA=2.176 d_AD=2.859 a_DHA=123.433 symop: x,y,z a_YAH=107 3921 3990 " HG SER C 27 "<>" O ARG C 24 " d_HA=1.845 d_AD=2.696 a_DHA=144.766 symop: x,y,z a_YAH=122 1704 1783 " H GLN A 111 "<>" O GLU A 107 " d_HA=2.112 d_AD=3.114 a_DHA=168.951 symop: x,y,z a_YAH=161 7581 7611 " H THR E 33 "<>" O SER E 31 " d_HA=2.073 d_AD=2.918 a_DHA=138.892 symop: x,y,z a_YAH=92 4788 4852 " H GLU C 80 "<>" O GLU C 76 " d_HA=2.045 d_AD=3.051 a_DHA=171.589 symop: x,y,z a_YAH=148 4803 4862 " H GLY C 81 "<>" O ASN C 77 " d_HA=2.109 d_AD=3.100 a_DHA=165.066 symop: x,y,z a_YAH=151 4734 4808 " H ASN C 77 "<>" O THR C 73 " d_HA=2.162 d_AD=3.090 a_DHA=151.218 symop: x,y,z a_YAH=150 4868 4926 " H PHE C 85 "<>" O VAL C 82 " d_HA=2.210 d_AD=3.009 a_DHA=134.479 symop: x,y,z a_YAH=147 4817 4872 " H VAL C 82 "<>" O LEU C 78 " d_HA=1.982 d_AD=2.821 a_DHA=138.093 symop: x,y,z a_YAH=162 4748 4822 " H LEU C 78 "<>" O VAL C 74 " d_HA=1.962 d_AD=2.966 a_DHA=168.285 symop: x,y,z a_YAH=169 4764 4838 " H ALA C 79 "<>" O ARG C 75 " d_HA=2.114 d_AD=3.071 a_DHA=155.735 symop: x,y,z a_YAH=152 4696 4772 " H ARG C 75 "<>" O ILE C 71 " d_HA=1.835 d_AD=2.848 a_DHA=176.836 symop: x,y,z a_YAH=157 4715 4794 " H GLU C 76 "<>" O LEU C 72 " d_HA=2.350 d_AD=3.350 a_DHA=169.630 symop: x,y,z a_YAH=150 4715 6918 "HD21 ASN D 98 "<>" O LEU C 72 " d_HA=2.258 d_AD=3.161 a_DHA=148.228 symop: x,y,z a_YAH=119 4752 4672 " H VAL C 74 "<>" O ARG C 70 " d_HA=1.918 d_AD=2.928 a_DHA=170.967 symop: x,y,z a_YAH=167 5439 5502 " H ALA D 11 "<>" O ALA D 7 " d_HA=2.234 d_AD=3.140 a_DHA=148.879 symop: x,y,z a_YAH=129 5423 5490 " H THR D 10 "<>" O VAL D 6 " d_HA=2.194 d_AD=3.063 a_DHA=143.287 symop: x,y,z a_YAH=142 3826 3897 " H ALA C 22 "<>" O LEU C 18 " d_HA=1.998 d_AD=2.974 a_DHA=160.756 symop: x,y,z a_YAH=145 3878 3950 " H LEU C 25 "<>" O GLN C 21 " d_HA=2.020 d_AD=3.005 a_DHA=163.674 symop: x,y,z a_YAH=168 3845 3909 " H VAL C 23 "<>" O THR C 19 " d_HA=2.081 d_AD=2.979 a_DHA=147.378 symop: x,y,z a_YAH=142 5449 5515 " H ILE D 12 "<>" O LYS D 8 " d_HA=2.057 d_AD=2.978 a_DHA=151.396 symop: x,y,z a_YAH=168 3891 5475 "HE22 GLN C 21 "<>" OE1 GLU D 9 " d_HA=2.386 d_AD=3.241 a_DHA=141.269 symop: x,y,z a_YAH=134 3859 3929 " H ARG C 24 "<>" O LEU C 20 " d_HA=1.867 d_AD=2.781 a_DHA=147.191 symop: x,y,z a_YAH=139 8322 8386 " H GLU E 80 "<>" O GLU E 76 " d_HA=2.617 d_AD=3.299 a_DHA=125.350 symop: x,y,z a_YAH=149 8337 8396 " H GLY E 81 "<>" O ASN E 77 " d_HA=2.730 d_AD=3.740 a_DHA=174.627 symop: x,y,z a_YAH=133 4836 4872 " H VAL C 82 "<>" O ALA C 79 " d_HA=2.309 d_AD=3.170 a_DHA=141.712 symop: x,y,z a_YAH=114 4836 4889 " H LEU C 83 "<>" O ALA C 79 " d_HA=2.137 d_AD=3.114 a_DHA=162.369 symop: x,y,z a_YAH=155 4918 4991 " H MET C 89 "<>" O PHE C 85 " d_HA=2.367 d_AD=3.276 a_DHA=149.619 symop: x,y,z a_YAH=127 4884 4943 " H LEU C 86 "<>" O LEU C 83 " d_HA=1.865 d_AD=2.881 a_DHA=174.423 symop: x,y,z a_YAH=152 4781 6912 "HH11 ARG C 75 "<>" OD1 ASN D 98 " d_HA=1.681 d_AD=2.532 a_DHA=139.412 symop: x,y,z a_YAH=172 4971 5041 " H SER C 92 "<>" O GLU C 88 " d_HA=2.531 d_AD=3.513 a_DHA=162.877 symop: x,y,z a_YAH=139 4971 5045 " HG SER C 92 "<>" O GLU C 88 " d_HA=2.336 d_AD=2.995 a_DHA=124.593 symop: x,y,z a_YAH=150 4938 5007 " H VAL C 90 "<>" O LEU C 86 " d_HA=1.991 d_AD=2.903 a_DHA=146.811 symop: x,y,z a_YAH=153 4986 5055 " H GLN C 93 "<>" O MET C 89 " d_HA=2.261 d_AD=3.041 a_DHA=132.203 symop: x,y,z a_YAH=126 3769 3831 " H LEU C 18 "<>" O LEU C 14 " d_HA=2.007 d_AD=3.008 a_DHA=169.558 symop: x,y,z a_YAH=165 3788 3849 " H THR C 19 "<>" O GLN C 15 " d_HA=2.312 d_AD=3.263 a_DHA=155.183 symop: x,y,z a_YAH=136 3816 3884 " H GLN C 21 "<>" O ALA C 17 " d_HA=1.880 d_AD=2.897 a_DHA=176.142 symop: x,y,z a_YAH=164 3805 3864 " H LEU C 20 "<>" O SER C 16 " d_HA=2.508 d_AD=3.292 a_DHA=134.293 symop: x,y,z a_YAH=122 10340 10412 " H LYS F 95 "<>" O LEU F 91 " d_HA=1.994 d_AD=2.981 a_DHA=162.140 symop: x,y,z a_YAH=155 10362 10292 " H SER F 92 "<>" O GLU F 88 " d_HA=1.997 d_AD=3.011 a_DHA=176.484 symop: x,y,z a_YAH=170 10376 10307 " H GLN F 93 "<>" O MET F 89 " d_HA=2.662 d_AD=3.633 a_DHA=161.251 symop: x,y,z a_YAH=104 10392 10324 " H ILE F 94 "<>" O VAL F 90 " d_HA=2.043 d_AD=2.923 a_DHA=144.442 symop: x,y,z a_YAH=139 10359 10434 " H GLN F 96 "<>" O SER F 92 " d_HA=2.027 d_AD=2.972 a_DHA=155.641 symop: x,y,z a_YAH=161 5038 5113 " H GLN C 96 "<>" O SER C 92 " d_HA=2.136 d_AD=3.101 a_DHA=159.978 symop: x,y,z a_YAH=128 5049 5127 " H SER C 97 "<>" O GLN C 93 " d_HA=1.888 d_AD=2.890 a_DHA=170.003 symop: x,y,z a_YAH=140 5486 5533 " H THR D 13 "<>" O THR D 10 " d_HA=2.064 d_AD=2.747 a_DHA=122.331 symop: x,y,z a_YAH=101 5486 5548 " H LEU D 14 "<>" O THR D 10 " d_HA=2.124 d_AD=3.120 a_DHA=169.389 symop: x,y,z a_YAH=167 5510 5568 " H GLN D 15 "<>" O ILE D 12 " d_HA=2.637 d_AD=3.381 a_DHA=130.707 symop: x,y,z a_YAH=114 5510 5582 " H SER D 16 "<>" O ILE D 12 " d_HA=2.436 d_AD=3.383 a_DHA=156.512 symop: x,y,z a_YAH=166 5471 5515 " H ILE D 12 "<>" O GLU D 9 " d_HA=2.538 d_AD=3.224 a_DHA=125.297 symop: x,y,z a_YAH=98 5471 5533 " H THR D 13 "<>" O GLU D 9 " d_HA=1.930 d_AD=2.796 a_DHA=141.202 symop: x,y,z a_YAH=148 8326 10466 "HD22 ASN F 98 "<>" OE1 GLU E 76 " d_HA=2.125 d_AD=3.053 a_DHA=150.213 symop: x,y,z a_YAH=132 5107 5161 " H ASN C 100 "<>" O GLN C 96 " d_HA=2.036 d_AD=3.000 a_DHA=158.147 symop: x,y,z a_YAH=152 8268 8342 " H ASN E 77 "<>" O THR E 73 " d_HA=2.236 d_AD=3.201 a_DHA=159.418 symop: x,y,z a_YAH=128 8268 8347 "HD22 ASN E 77 "<>" O THR E 73 " d_HA=2.400 d_AD=3.043 a_DHA=120.945 symop: x,y,z a_YAH=142 4792 6919 "HD22 ASN D 98 "<>" OE1 GLU C 76 " d_HA=2.069 d_AD=3.004 a_DHA=149.975 symop: x,y,z a_YAH=148 6731 6798 " H LEU D 91 "<>" O PRO D 87 " d_HA=2.370 d_AD=3.310 a_DHA=152.537 symop: x,y,z a_YAH=158 6760 6829 " H GLN D 93 "<>" O MET D 89 " d_HA=1.751 d_AD=2.667 a_DHA=149.146 symop: x,y,z a_YAH=152 6845 6793 " H ILE D 94 "<>" O LEU D 91 " d_HA=2.038 d_AD=2.776 a_DHA=127.301 symop: x,y,z a_YAH=103 6823 6901 " H SER D 97 "<>" O GLN D 93 " d_HA=1.689 d_AD=2.693 a_DHA=171.271 symop: x,y,z a_YAH=147 6840 6914 " H ASN D 98 "<>" O ILE D 94 " d_HA=1.937 d_AD=2.913 a_DHA=159.415 symop: x,y,z a_YAH=147 4957 5007 " H VAL C 90 "<>" O PRO C 87 " d_HA=2.914 d_AD=3.688 a_DHA=132.913 symop: x,y,z a_YAH=100 4957 5024 " H LEU C 91 "<>" O PRO C 87 " d_HA=2.613 d_AD=3.553 a_DHA=154.670 symop: x,y,z a_YAH=152 6658 6717 " H LEU D 86 "<>" O LEU D 83 " d_HA=2.789 d_AD=3.684 a_DHA=147.928 symop: x,y,z a_YAH=114 6712 6781 " H VAL D 90 "<>" O LEU D 86 " d_HA=1.693 d_AD=2.702 a_DHA=173.587 symop: x,y,z a_YAH=158 3800 6827 "HE21 GLN C 15 "<>" OE1 GLN D 93 " d_HA=2.486 d_AD=3.178 a_DHA=125.112 symop: x,y,z a_YAH=140 6777 6845 " H ILE D 94 "<>" O VAL D 90 " d_HA=2.412 d_AD=3.185 a_DHA=131.962 symop: x,y,z a_YAH=122 3726 3794 " H GLN C 15 "<>" O ALA C 11 " d_HA=2.381 d_AD=3.361 a_DHA=162.065 symop: x,y,z a_YAH=123 3736 3808 " H SER C 16 "<>" O ILE C 12 " d_HA=2.071 d_AD=3.050 a_DHA=164.203 symop: x,y,z a_YAH=136 3755 3818 " H ALA C 17 "<>" O THR C 13 " d_HA=1.753 d_AD=2.706 a_DHA=155.454 symop: x,y,z a_YAH=153 4394 4783 "HH21 ARG C 75 "<>" OG SER C 53 " d_HA=2.476 d_AD=3.443 a_DHA=158.161 symop: x,y,z a_YAH=146 a_YAH=99 10370 10448 " H SER F 97 "<>" O GLN F 93 " d_HA=2.165 d_AD=3.129 a_DHA=157.181 symop: x,y,z a_YAH=135 10428 10482 " H ASN F 100 "<>" O GLN F 96 " d_HA=1.902 d_AD=2.891 a_DHA=163.271 symop: x,y,z a_YAH=163 5085 5150 " H GLY C 99 "<>" O LYS C 95 " d_HA=1.866 d_AD=2.874 a_DHA=169.055 symop: x,y,z a_YAH=156 5019 5091 " H LYS C 95 "<>" O LEU C 91 " d_HA=1.843 d_AD=2.851 a_DHA=170.027 symop: x,y,z a_YAH=159 5066 5140 " H ASN C 98 "<>" O ILE C 94 " d_HA=1.653 d_AD=2.624 a_DHA=160.105 symop: x,y,z a_YAH=166 5003 5055 " H GLN C 93 "<>" O VAL C 90 " d_HA=2.143 d_AD=2.899 a_DHA=129.405 symop: x,y,z a_YAH=119 5003 5071 " H ILE C 94 "<>" O VAL C 90 " d_HA=1.853 d_AD=2.812 a_DHA=155.415 symop: x,y,z a_YAH=162 5529 5592 " H ALA D 17 "<>" O THR D 13 " d_HA=1.759 d_AD=2.654 a_DHA=145.329 symop: x,y,z a_YAH=154 3812 4360 " HG SER C 16 "<>" O GLN C 51 " d_HA=2.380 d_AD=3.285 a_DHA=155.112 symop: x,y,z a_YAH=149 8315 10459 "HH11 ARG E 75 "<>" OD1 ASN F 98 " d_HA=1.853 d_AD=2.846 a_DHA=165.543 symop: x,y,z a_YAH=134 8316 10447 "HH12 ARG E 75 "<>" OG SER F 97 " d_HA=2.065 d_AD=2.999 a_DHA=152.489 symop: x,y,z a_YAH=121 a_YAH=128 10387 10461 " H ASN F 98 "<>" O ILE F 94 " d_HA=1.770 d_AD=2.779 a_DHA=172.772 symop: x,y,z a_YAH=161 10406 10471 " H GLY F 99 "<>" O LYS F 95 " d_HA=2.169 d_AD=3.073 a_DHA=146.850 symop: x,y,z a_YAH=162 10456 10498 " H HIS F 101 "<>" O ASN F 98 " d_HA=2.608 d_AD=3.406 a_DHA=135.740 symop: x,y,z a_YAH=94 10456 10516 " H ARG F 102 "<>" O ASN F 98 " d_HA=1.988 d_AD=2.989 a_DHA=166.260 symop: x,y,z a_YAH=149 5135 5177 " H HIS C 101 "<>" O ASN C 98 " d_HA=2.218 d_AD=3.046 a_DHA=137.116 symop: x,y,z a_YAH=122 5135 5195 " H ARG C 102 "<>" O ASN C 98 " d_HA=2.053 d_AD=3.054 a_DHA=167.734 symop: x,y,z a_YAH=175 5124 5177 " H HIS C 101 "<>" O SER C 97 " d_HA=2.239 d_AD=3.125 a_DHA=144.235 symop: x,y,z a_YAH=158 5124 5181 " HD1 HIS C 101 "<>" O SER C 97 " d_HA=2.053 d_AD=2.979 a_DHA=151.755 symop: x,y,z a_YAH=106 5131 6180 " HG SER C 97 "<>" OD1 ASP D 54 " d_HA=1.831 d_AD=2.752 a_DHA=152.797 symop: x,y,z a_YAH=99 5562 5623 " H THR D 19 "<>" O GLN D 15 " d_HA=2.116 d_AD=3.098 a_DHA=164.365 symop: x,y,z a_YAH=163 5579 5638 " H LEU D 20 "<>" O SER D 16 " d_HA=2.535 d_AD=3.547 a_DHA=170.219 symop: x,y,z a_YAH=137 5586 6134 " HG SER D 16 "<>" O GLN D 51 " d_HA=2.031 d_AD=2.743 a_DHA=128.745 symop: x,y,z a_YAH=97 8249 8328 " H GLU E 76 "<>" O LEU E 72 " d_HA=2.769 d_AD=3.574 a_DHA=137.209 symop: x,y,z a_YAH=113 8249 10465 "HD21 ASN F 98 "<>" O LEU E 72 " d_HA=1.780 d_AD=2.775 a_DHA=167.757 symop: x,y,z a_YAH=131 5187 5270 " H LEU C 106 "<>" O ARG C 102 " d_HA=2.834 d_AD=3.818 a_DHA=163.390 symop: x,y,z a_YAH=126 5149 5219 " H ARG C 103 "<>" O GLY C 99 " d_HA=2.003 d_AD=2.885 a_DHA=143.826 symop: x,y,z a_YAH=161 5156 5238 " H SER C 104 "<>" O ASN C 100 " d_HA=2.302 d_AD=3.304 a_DHA=173.763 symop: x,y,z a_YAH=133 5156 5242 " HG SER C 104 "<>" O ASN C 100 " d_HA=2.119 d_AD=2.947 a_DHA=142.438 symop: x,y,z a_YAH=159 6166 6234 " H LEU D 57 "<>" O SER D 53 " d_HA=1.905 d_AD=2.883 a_DHA=161.815 symop: x,y,z a_YAH=153 6134 6169 " H SER D 53 "<>" O GLN D 51 " d_HA=2.428 d_AD=3.322 a_DHA=146.594 symop: x,y,z a_YAH=90 6151 6194 " H LEU D 55 "<>" O GLU D 52 " d_HA=2.574 d_AD=3.295 a_DHA=128.163 symop: x,y,z a_YAH=110 6151 6217 " H TYR D 56 "<>" O GLU D 52 " d_HA=2.058 d_AD=2.999 a_DHA=153.151 symop: x,y,z a_YAH=155 8230 8306 " H ARG E 75 "<>" O ILE E 71 " d_HA=1.947 d_AD=2.878 a_DHA=152.067 symop: x,y,z a_YAH=166 8230 8286 " H VAL E 74 "<>" O ILE E 71 " d_HA=2.579 d_AD=3.265 a_DHA=124.657 symop: x,y,z a_YAH=94 8187 8272 " H THR E 73 "<>" O LEU E 69 " d_HA=2.691 d_AD=3.406 a_DHA=127.942 symop: x,y,z a_YAH=133 8187 8275 " HG1 THR E 73 "<>" O LEU E 69 " d_HA=2.145 d_AD=3.119 a_DHA=175.331 symop: x,y,z a_YAH=154 8206 8286 " H VAL E 74 "<>" O ARG E 70 " d_HA=2.018 d_AD=2.917 a_DHA=146.069 symop: x,y,z a_YAH=152 8206 8272 " H THR E 73 "<>" O ARG E 70 " d_HA=2.099 d_AD=2.934 a_DHA=138.877 symop: x,y,z a_YAH=109 5211 5290 " H GLU C 107 "<>" O ARG C 103 " d_HA=1.860 d_AD=2.834 a_DHA=160.455 symop: x,y,z a_YAH=136 5246 5307 " H ARG C 108 "<>" O LEU C 105 " d_HA=1.962 d_AD=2.664 a_DHA=124.156 symop: x,y,z a_YAH=102 5246 5328 " H LEU C 109 "<>" O LEU C 105 " d_HA=2.085 d_AD=2.885 a_DHA=134.585 symop: x,y,z a_YAH=130 5265 5328 " H LEU C 109 "<>" O LEU C 106 " d_HA=2.427 d_AD=3.069 a_DHA=120.803 symop: x,y,z a_YAH=96 5265 5347 " H THR C 110 "<>" O LEU C 106 " d_HA=2.272 d_AD=2.956 a_DHA=123.167 symop: x,y,z a_YAH=156 5235 5307 " H ARG C 108 "<>" O SER C 104 " d_HA=2.701 d_AD=3.471 a_DHA=133.126 symop: x,y,z a_YAH=91 6248 6295 " H MET D 61 "<>" O GLU D 58 " d_HA=2.038 d_AD=2.977 a_DHA=151.853 symop: x,y,z a_YAH=112 6248 6312 " H LEU D 62 "<>" O GLU D 58 " d_HA=2.746 d_AD=3.700 a_DHA=156.872 symop: x,y,z a_YAH=150 6177 6254 " H GLU D 58 "<>" O ASP D 54 " d_HA=2.018 d_AD=2.932 a_DHA=148.825 symop: x,y,z a_YAH=131 6189 6265 " H ALA D 59 "<>" O LEU D 55 " d_HA=1.777 d_AD=2.753 a_DHA=160.584 symop: x,y,z a_YAH=127 5284 5347 " H THR C 110 "<>" O GLU C 107 " d_HA=2.568 d_AD=3.513 a_DHA=153.958 symop: x,y,z a_YAH=102 6745 6815 " H SER D 92 "<>" O GLU D 88 " d_HA=2.425 d_AD=3.358 a_DHA=153.250 symop: x,y,z a_YAH=128 6812 6887 " H GLN D 96 "<>" O SER D 92 " d_HA=2.140 d_AD=3.124 a_DHA=164.230 symop: x,y,z a_YAH=134 6859 6924 " H GLY D 99 "<>" O LYS D 95 " d_HA=2.192 d_AD=2.990 a_DHA=134.404 symop: x,y,z a_YAH=143 6793 6845 " H ILE D 94 "<>" O LEU D 91 " d_HA=2.038 d_AD=2.776 a_DHA=127.301 symop: x,y,z a_YAH=103 6793 6865 " H LYS D 95 "<>" O LEU D 91 " d_HA=1.867 d_AD=2.870 a_DHA=168.336 symop: x,y,z a_YAH=171 6692 6765 " H MET D 89 "<>" O PHE D 85 " d_HA=2.548 d_AD=3.328 a_DHA=134.268 symop: x,y,z a_YAH=126 6642 6700 " H PHE D 85 "<>" O VAL D 82 " d_HA=1.888 d_AD=2.883 a_DHA=166.821 symop: x,y,z a_YAH=136 6562 6626 " H GLU D 80 "<>" O GLU D 76 " d_HA=1.952 d_AD=2.934 a_DHA=162.711 symop: x,y,z a_YAH=166 6591 6646 " H VAL D 82 "<>" O LEU D 78 " d_HA=1.742 d_AD=2.754 a_DHA=171.622 symop: x,y,z a_YAH=163 6610 6663 " H LEU D 83 "<>" O ALA D 79 " d_HA=1.718 d_AD=2.656 a_DHA=152.297 symop: x,y,z a_YAH=168 3665 3716 " H THR C 10 "<>" O ALA C 7 " d_HA=2.683 d_AD=3.327 a_DHA=121.349 symop: x,y,z a_YAH=100 3665 3728 " H ALA C 11 "<>" O ALA C 7 " d_HA=1.955 d_AD=2.942 a_DHA=164.072 symop: x,y,z a_YAH=172 3712 3774 " H LEU C 14 "<>" O THR C 10 " d_HA=2.492 d_AD=3.442 a_DHA=157.190 symop: x,y,z a_YAH=143 3712 3759 " H THR C 13 "<>" O THR C 10 " d_HA=1.805 d_AD=2.622 a_DHA=134.358 symop: x,y,z a_YAH=128 3675 3741 " H ILE C 12 "<>" O LYS C 8 " d_HA=2.476 d_AD=3.181 a_DHA=126.430 symop: x,y,z a_YAH=135 3697 3759 " H THR C 13 "<>" O GLU C 9 " d_HA=2.955 d_AD=3.725 a_DHA=132.968 symop: x,y,z a_YAH=115 10480 10551 "HH21 ARG F 103 "<>" OD1 ASN F 100 " d_HA=2.777 d_AD=3.633 a_DHA=142.012 symop: x,y,z a_YAH=159 5205 6566 "HH12 ARG C 102 "<>" OE1 GLU D 76 " d_HA=2.182 d_AD=3.181 a_DHA=162.126 symop: x,y,z a_YAH=174 5144 6489 "HD21 ASN C 98 "<>" O LEU D 72 " d_HA=2.440 d_AD=3.303 a_DHA=143.027 symop: x,y,z a_YAH=136 5145 6566 "HD22 ASN C 98 "<>" OE1 GLU D 76 " d_HA=2.343 d_AD=3.058 a_DHA=127.174 symop: x,y,z a_YAH=103 6538 6612 " H ALA D 79 "<>" O ARG D 75 " d_HA=2.417 d_AD=3.277 a_DHA=141.339 symop: x,y,z a_YAH=121 5600 5671 " H ALA D 22 "<>" O LEU D 18 " d_HA=1.860 d_AD=2.857 a_DHA=165.821 symop: x,y,z a_YAH=138 10452 7940 " HG SER F 97 "<>" OD1 ASP E 54 " d_HA=1.460 d_AD=2.451 a_DHA=165.887 symop: x,y,z a_YAH=129 10504 7940 " HE2 HIS F 101 "<>" OD1 ASP E 54 " d_HA=1.906 d_AD=2.907 a_DHA=164.848 symop: x,y,z a_YAH=114 10445 10498 " H HIS F 101 "<>" O SER F 97 " d_HA=2.311 d_AD=3.157 a_DHA=140.484 symop: x,y,z a_YAH=161 10470 10540 " H ARG F 103 "<>" O GLY F 99 " d_HA=1.831 d_AD=2.832 a_DHA=168.392 symop: x,y,z a_YAH=165 10477 10559 " H SER F 104 "<>" O ASN F 100 " d_HA=2.351 d_AD=3.331 a_DHA=163.274 symop: x,y,z a_YAH=120 10491 10572 " H LEU F 105 "<>" O HIS F 101 " d_HA=2.161 d_AD=3.020 a_DHA=141.981 symop: x,y,z a_YAH=155 5206 6510 "HH21 ARG C 102 "<>" OG1 THR D 73 " d_HA=2.690 d_AD=3.371 a_DHA=124.345 symop: x,y,z a_YAH=132 a_YAH=118 5138 6557 "HH21 ARG D 75 "<>" OD1 ASN C 98 " d_HA=2.399 d_AD=3.294 a_DHA=148.108 symop: x,y,z a_YAH=127 5138 6554 " HE ARG D 75 "<>" OD1 ASN C 98 " d_HA=2.220 d_AD=3.179 a_DHA=157.733 symop: x,y,z a_YAH=116 6489 6568 " H GLU D 76 "<>" O LEU D 72 " d_HA=2.357 d_AD=3.277 a_DHA=150.386 symop: x,y,z a_YAH=136 5590 5658 " H GLN D 21 "<>" O ALA D 17 " d_HA=2.441 d_AD=3.319 a_DHA=144.972 symop: x,y,z a_YAH=123 5619 5683 " H VAL D 23 "<>" O THR D 19 " d_HA=1.928 d_AD=2.913 a_DHA=162.912 symop: x,y,z a_YAH=154 10508 10572 " H LEU F 105 "<>" O ARG F 102 " d_HA=2.656 d_AD=3.382 a_DHA=128.935 symop: x,y,z a_YAH=96 10508 10591 " H LEU F 106 "<>" O ARG F 102 " d_HA=2.607 d_AD=3.572 a_DHA=159.529 symop: x,y,z a_YAH=146 6411 6494 " H LEU D 72 "<>" O VAL D 68 " d_HA=2.065 d_AD=3.080 a_DHA=171.706 symop: x,y,z a_YAH=169 8115 8192 " H LEU E 69 "<>" O LYS E 65 " d_HA=2.466 d_AD=3.477 a_DHA=174.876 symop: x,y,z a_YAH=169 8152 8235 " H ILE E 71 "<>" O LEU E 67 " d_HA=1.798 d_AD=2.767 a_DHA=157.612 symop: x,y,z a_YAH=157 8171 8254 " H LEU E 72 "<>" O VAL E 68 " d_HA=1.985 d_AD=2.982 a_DHA=166.505 symop: x,y,z a_YAH=171 6229 6295 " H MET D 61 "<>" O LEU D 57 " d_HA=2.626 d_AD=3.260 a_DHA=120.121 symop: x,y,z a_YAH=134 6273 6346 " H ASN D 64 "<>" O MET D 60 " d_HA=1.683 d_AD=2.656 a_DHA=161.333 symop: x,y,z a_YAH=146 6208 6278 " H MET D 60 "<>" O TYR D 56 " d_HA=1.883 d_AD=2.792 a_DHA=147.105 symop: x,y,z a_YAH=145 7669 8104 "HE22 GLN E 37 "<>" OD1 ASN E 64 " d_HA=2.041 d_AD=2.853 a_DHA=135.287 symop: x,y,z a_YAH=161 6290 6372 " HZ2 LYS D 65 "<>" O MET D 61 " d_HA=2.627 d_AD=3.557 a_DHA=151.210 symop: x,y,z a_YAH=140 6307 6372 " HZ2 LYS D 65 "<>" O LEU D 62 " d_HA=2.291 d_AD=3.057 a_DHA=130.605 symop: x,y,z a_YAH=139 6263 6332 " H GLU D 63 "<>" O ALA D 59 " d_HA=2.603 d_AD=3.557 a_DHA=155.842 symop: x,y,z a_YAH=154 6007 6091 " H HIS D 48 "<>" O PHE D 44 " d_HA=2.242 d_AD=3.049 a_DHA=136.476 symop: x,y,z a_YAH=156 3605 3681 " H LYS C 8 "<>" O LYS C 4 " d_HA=2.132 d_AD=3.126 a_DHA=168.413 symop: x,y,z a_YAH=133 6577 6636 " H GLY D 81 "<>" O ASN D 77 " d_HA=2.043 d_AD=2.934 a_DHA=145.824 symop: x,y,z a_YAH=120 3585 3667 " H ALA C 7 "<>" O PHE C 3 " d_HA=1.731 d_AD=2.730 a_DHA=172.534 symop: x,y,z a_YAH=173 3627 3703 " H GLU C 9 "<>" O LYS C 5 " d_HA=1.726 d_AD=2.661 a_DHA=153.007 symop: x,y,z a_YAH=139 3649 3716 " H THR C 10 "<>" O VAL C 6 " d_HA=1.909 d_AD=2.840 a_DHA=150.828 symop: x,y,z a_YAH=141 6508 6568 " H GLU D 76 "<>" O THR D 73 " d_HA=2.637 d_AD=3.272 a_DHA=120.626 symop: x,y,z a_YAH=98 6508 6582 " H ASN D 77 "<>" O THR D 73 " d_HA=1.903 d_AD=2.906 a_DHA=170.321 symop: x,y,z a_YAH=163 6522 6596 " H LEU D 78 "<>" O VAL D 74 " d_HA=1.787 d_AD=2.704 a_DHA=148.597 symop: x,y,z a_YAH=160 3702 5713 "HH12 ARG D 24 "<>" OE2 GLU C 9 " d_HA=2.567 d_AD=3.270 a_DHA=126.368 symop: x,y,z a_YAH=100 3702 5715 "HH22 ARG D 24 "<>" OE2 GLU C 9 " d_HA=2.501 d_AD=3.267 a_DHA=131.068 symop: x,y,z a_YAH=116 8014 7937 " H GLU E 58 "<>" O ASP E 54 " d_HA=1.787 d_AD=2.802 a_DHA=174.368 symop: x,y,z a_YAH=172 10532 10611 " H GLU F 107 "<>" O ARG F 103 " d_HA=1.781 d_AD=2.789 a_DHA=174.884 symop: x,y,z a_YAH=158 10532 10591 " H LEU F 106 "<>" O ARG F 103 " d_HA=2.532 d_AD=3.220 a_DHA=125.018 symop: x,y,z a_YAH=120 6427 6512 " H THR D 73 "<>" O LEU D 69 " d_HA=2.589 d_AD=3.492 a_DHA=149.218 symop: x,y,z a_YAH=136 6446 6526 " H VAL D 74 "<>" O ARG D 70 " d_HA=2.221 d_AD=3.242 a_DHA=179.011 symop: x,y,z a_YAH=156 6470 6546 " H ARG D 75 "<>" O ILE D 71 " d_HA=1.854 d_AD=2.859 a_DHA=170.022 symop: x,y,z a_YAH=157 5669 5743 " H ILE D 26 "<>" O ALA D 22 " d_HA=2.115 d_AD=3.112 a_DHA=170.047 symop: x,y,z a_YAH=153 5633 5703 " H ARG D 24 "<>" O LEU D 20 " d_HA=1.927 d_AD=2.809 a_DHA=143.278 symop: x,y,z a_YAH=154 5652 5703 " H ARG D 24 "<>" O GLN D 21 " d_HA=2.374 d_AD=3.156 a_DHA=132.987 symop: x,y,z a_YAH=106 5652 5724 " H LEU D 25 "<>" O GLN D 21 " d_HA=2.334 d_AD=3.333 a_DHA=170.993 symop: x,y,z a_YAH=170 7989 8055 " H MET E 61 "<>" O LEU E 57 " d_HA=2.146 d_AD=2.971 a_DHA=136.612 symop: x,y,z a_YAH=139 8008 8055 " H MET E 61 "<>" O GLU E 58 " d_HA=2.211 d_AD=2.928 a_DHA=125.869 symop: x,y,z a_YAH=104 8008 8072 " H LEU E 62 "<>" O GLU E 58 " d_HA=2.758 d_AD=3.660 a_DHA=147.679 symop: x,y,z a_YAH=152 10556 10628 " H ARG F 108 "<>" O SER F 104 " d_HA=2.488 d_AD=3.194 a_DHA=126.172 symop: x,y,z a_YAH=123 10586 10649 " H LEU F 109 "<>" O LEU F 106 " d_HA=2.007 d_AD=2.944 a_DHA=153.065 symop: x,y,z a_YAH=126 10586 10667 " H THR F 110 "<>" O LEU F 106 " d_HA=2.186 d_AD=3.121 a_DHA=152.256 symop: x,y,z a_YAH=169 6377 6454 " H ARG D 70 "<>" O GLU D 66 " d_HA=2.133 d_AD=3.077 a_DHA=152.801 symop: x,y,z a_YAH=121 6377 10683 " H GLN F 111 "<>" O GLU D 66 " d_HA=2.146 d_AD=3.123 a_DHA=162.031 symop: -y+1/2,x+1/2,z+1/4 a_YAH=124 6392 6475 " H ILE D 71 "<>" O LEU D 67 " d_HA=1.931 d_AD=2.831 a_DHA=146.358 symop: x,y,z a_YAH=143 5679 5760 " H SER D 27 "<>" O VAL D 23 " d_HA=1.874 d_AD=2.856 a_DHA=164.027 symop: x,y,z a_YAH=134 8033 8106 " H ASN E 64 "<>" O MET E 60 " d_HA=2.050 d_AD=2.845 a_DHA=133.660 symop: x,y,z a_YAH=162 8101 8175 " H VAL E 68 "<>" O ASN E 64 " d_HA=2.477 d_AD=3.430 a_DHA=156.475 symop: x,y,z a_YAH=145 8101 8157 " H LEU E 67 "<>" O ASN E 64 " d_HA=2.910 d_AD=3.803 a_DHA=147.832 symop: x,y,z a_YAH=106 6355 6432 " H LEU D 69 "<>" O LYS D 65 " d_HA=2.000 d_AD=2.934 a_DHA=152.528 symop: x,y,z a_YAH=143 6341 6397 " H LEU D 67 "<>" O ASN D 64 " d_HA=1.936 d_AD=2.878 a_DHA=152.447 symop: x,y,z a_YAH=137 6341 6415 " H VAL D 68 "<>" O ASN D 64 " d_HA=2.285 d_AD=3.267 a_DHA=161.964 symop: x,y,z a_YAH=146 6351 6381 "HD22 ASN D 64 "<>" OE1 GLU D 66 " d_HA=2.605 d_AD=3.475 a_DHA=144.090 symop: x,y,z a_YAH=141 5966 6030 " H SER D 45 "<>" O LEU D 41 " d_HA=1.844 d_AD=2.844 a_DHA=168.820 symop: x,y,z a_YAH=168 5992 6068 " H ARG D 47 "<>" O GLU D 43 " d_HA=2.495 d_AD=3.463 a_DHA=160.634 symop: x,y,z a_YAH=153 5992 6044 " H LYS D 46 "<>" O GLU D 43 " d_HA=2.212 d_AD=3.092 a_DHA=144.931 symop: x,y,z a_YAH=97 6078 6330 "HH12 ARG D 47 "<>" OE1 GLU D 63 " d_HA=1.633 d_AD=2.638 a_DHA=163.967 symop: x,y,z a_YAH=150 5695 5774 " H GLN D 28 "<>" O ARG D 24 " d_HA=1.788 d_AD=2.764 a_DHA=161.427 symop: x,y,z a_YAH=163 5719 5791 " H GLN D 29 "<>" O LEU D 25 " d_HA=1.883 d_AD=2.898 a_DHA=178.600 symop: x,y,z a_YAH=169 6463 10681 "HH11 ARG D 70 "<>" OE1 GLN F 111 " d_HA=1.691 d_AD=2.664 a_DHA=157.615 symop: -y+1/2,x+1/2,z+1/4 a_YAH=161 8023 8092 " H GLU E 63 "<>" O ALA E 59 " d_HA=2.656 d_AD=3.665 a_DHA=171.674 symop: x,y,z a_YAH=156 5909 6344 "HE22 GLN D 37 "<>" OD1 ASN D 64 " d_HA=2.422 d_AD=3.064 a_DHA=120.425 symop: x,y,z a_YAH=113 5896 5971 " H LEU D 41 "<>" O GLN D 37 " d_HA=1.930 d_AD=2.936 a_DHA=172.610 symop: x,y,z a_YAH=149 5913 5986 " H GLY D 42 "<>" O ALA D 38 " d_HA=2.136 d_AD=3.072 a_DHA=152.680 symop: x,y,z a_YAH=128 8086 8121 " H LYS E 65 "<>" O GLU E 63 " d_HA=2.970 d_AD=3.740 a_DHA=132.908 symop: x,y,z a_YAH=92 5923 5998 " H GLU D 43 "<>" O ILE D 39 " d_HA=2.013 d_AD=2.973 a_DHA=157.757 symop: x,y,z a_YAH=150 5942 6015 " H PHE D 44 "<>" O TRP D 40 " d_HA=1.938 d_AD=2.895 a_DHA=154.957 symop: x,y,z a_YAH=141 5785 5854 " HG1 THR D 33 "<>" O GLN D 29 " d_HA=2.811 d_AD=3.456 a_DHA=125.347 symop: x,y,z a_YAH=162 5768 5824 " H SER D 31 "<>" O GLN D 28 " d_HA=2.248 d_AD=3.141 a_DHA=146.447 symop: x,y,z a_YAH=111 5768 5838 " H GLU D 32 "<>" O GLN D 28 " d_HA=2.451 d_AD=3.437 a_DHA=164.343 symop: x,y,z a_YAH=161 5802 5851 " H THR D 33 "<>" O LEU D 30 " d_HA=2.093 d_AD=3.014 a_DHA=149.877 symop: x,y,z a_YAH=114 5802 5866 " H ASN D 34 "<>" O LEU D 30 " d_HA=1.717 d_AD=2.625 a_DHA=146.946 symop: x,y,z a_YAH=165 5757 5807 " H LEU D 30 "<>" O SER D 27 " d_HA=2.298 d_AD=3.137 a_DHA=139.708 symop: x,y,z a_YAH=104 5757 5824 " H SER D 31 "<>" O SER D 27 " d_HA=2.422 d_AD=3.088 a_DHA=122.634 symop: x,y,z a_YAH=141 3398 3481 " H LEU B 106 "<>" O ARG B 102 " d_HA=2.015 d_AD=3.023 a_DHA=174.010 symop: x,y,z a_YAH=154 3422 3501 " H GLU B 107 "<>" O ARG B 103 " d_HA=1.626 d_AD=2.580 a_DHA=158.044 symop: x,y,z a_YAH=168 3446 3518 " H ARG B 108 "<>" O SER B 104 " d_HA=1.918 d_AD=2.897 a_DHA=160.908 symop: x,y,z a_YAH=127 5861 5902 " H GLN D 37 "<>" O ASN D 34 " d_HA=2.295 d_AD=3.037 a_DHA=129.318 symop: x,y,z a_YAH=102 5861 5915 " H ALA D 38 "<>" O ASN D 34 " d_HA=2.470 d_AD=3.334 a_DHA=143.673 symop: x,y,z a_YAH=141 5864 5902 " H GLN D 37 "<>" OD1 ASN D 34 " d_HA=2.280 d_AD=3.151 a_DHA=143.724 symop: x,y,z a_YAH=119 5875 5915 " H ALA D 38 "<>" O PRO D 35 " d_HA=2.959 d_AD=3.664 a_DHA=127.942 symop: x,y,z a_YAH=92 5875 5928 " H ILE D 39 "<>" O PRO D 35 " d_HA=2.514 d_AD=3.423 a_DHA=150.209 symop: x,y,z a_YAH=136 3457 3539 " H LEU B 109 "<>" O LEU B 105 " d_HA=2.112 d_AD=2.836 a_DHA=126.590 symop: x,y,z a_YAH=137 5889 5953 " H TRP D 40 "<>" O GLY D 36 " d_HA=2.179 d_AD=3.019 a_DHA=139.265 symop: x,y,z a_YAH=126 936 1018 " HZ2 LYS A 65 "<>" O MET A 61 " d_HA=2.368 d_AD=3.363 a_DHA=164.331 symop: x,y,z a_YAH=148 953 7001 " HE ARG D 103 "<>" O LEU A 62 " d_HA=1.978 d_AD=2.967 a_DHA=164.839 symop: x+1/2,-y+3/2,-z+7/4 a_YAH=175 6985 7064 " H GLU D 107 "<>" O ARG D 103 " d_HA=1.902 d_AD=2.899 a_DHA=168.627 symop: x,y,z a_YAH=149 6923 6993 " H ARG D 103 "<>" O GLY D 99 " d_HA=2.058 d_AD=2.956 a_DHA=145.503 symop: x,y,z a_YAH=151 6930 6993 " H ARG D 103 "<>" O ASN D 100 " d_HA=2.357 d_AD=3.120 a_DHA=130.695 symop: x,y,z a_YAH=115 6930 7012 " H SER D 104 "<>" O ASN D 100 " d_HA=1.908 d_AD=2.866 a_DHA=158.463 symop: x,y,z a_YAH=169 6881 6924 " H GLY D 99 "<>" O GLN D 96 " d_HA=2.036 d_AD=2.807 a_DHA=131.006 symop: x,y,z a_YAH=110 6881 6935 " H ASN D 100 "<>" O GLN D 96 " d_HA=2.132 d_AD=3.083 a_DHA=154.323 symop: x,y,z a_YAH=158 6893 6933 "HE21 GLN D 96 "<>" OD1 ASN D 100 " d_HA=2.046 d_AD=3.062 a_DHA=173.225 symop: x,y,z a_YAH=141 6924 6859 " H GLY D 99 "<>" O LYS D 95 " d_HA=2.192 d_AD=2.990 a_DHA=134.404 symop: x,y,z a_YAH=143 6933 7003 "HH12 ARG D 103 "<>" OD1 ASN D 100 " d_HA=2.141 d_AD=3.142 a_DHA=169.743 symop: x,y,z a_YAH=128 7009 7081 " H ARG D 108 "<>" O SER D 104 " d_HA=2.153 d_AD=3.119 a_DHA=158.662 symop: x,y,z a_YAH=154 6898 6935 " H ASN D 100 "<>" O SER D 97 " d_HA=2.112 d_AD=2.798 a_DHA=122.653 symop: x,y,z a_YAH=117 6898 6951 " H HIS D 101 "<>" O SER D 97 " d_HA=1.862 d_AD=2.834 a_DHA=158.726 symop: x,y,z a_YAH=158 4403 4480 " H GLU C 58 "<>" O ASP C 54 " d_HA=2.509 d_AD=3.510 a_DHA=168.841 symop: x,y,z a_YAH=133 4406 6957 " HE2 HIS D 101 "<>" OD1 ASP C 54 " d_HA=1.785 d_AD=2.607 a_DHA=134.729 symop: x,y,z a_YAH=149 4407 6905 " HG SER D 97 "<>" OD2 ASP C 54 " d_HA=2.763 d_AD=3.646 a_DHA=150.568 symop: x,y,z a_YAH=109 4784 6900 "HH22 ARG C 75 "<>" OG SER D 97 " d_HA=2.384 d_AD=3.307 a_DHA=150.237 symop: x,y,z a_YAH=119 a_YAH=91 4377 4420 " H LEU C 55 "<>" O GLU C 52 " d_HA=2.394 d_AD=3.189 a_DHA=134.575 symop: x,y,z a_YAH=111 4377 4443 " H TYR C 56 "<>" O GLU C 52 " d_HA=1.818 d_AD=2.821 a_DHA=168.506 symop: x,y,z a_YAH=159 3346 3406 " H ARG B 102 "<>" O ASN B 98 " d_HA=2.071 d_AD=3.006 a_DHA=151.959 symop: x,y,z a_YAH=145 3318 3372 " H ASN B 100 "<>" O GLN B 96 " d_HA=2.293 d_AD=3.293 a_DHA=168.702 symop: x,y,z a_YAH=133 3335 3388 " H HIS B 101 "<>" O SER B 97 " d_HA=2.126 d_AD=3.070 a_DHA=155.547 symop: x,y,z a_YAH=170 3360 3430 " H ARG B 103 "<>" O GLY B 99 " d_HA=2.039 d_AD=3.012 a_DHA=160.608 symop: x,y,z a_YAH=166 3360 3406 " H ARG B 102 "<>" O GLY B 99 " d_HA=2.476 d_AD=3.115 a_DHA=120.382 symop: x,y,z a_YAH=113 1073 1158 " H THR A 73 "<>" O LEU A 69 " d_HA=2.545 d_AD=3.375 a_DHA=138.700 symop: x,y,z a_YAH=118 3367 3449 " H SER B 104 "<>" O ASN B 100 " d_HA=2.410 d_AD=3.382 a_DHA=162.371 symop: x,y,z a_YAH=130 3381 3462 " H LEU B 105 "<>" O HIS B 101 " d_HA=2.047 d_AD=2.933 a_DHA=145.039 symop: x,y,z a_YAH=124 1023 1100 " H ARG A 70 "<>" O GLU A 66 " d_HA=2.424 d_AD=3.303 a_DHA=144.990 symop: x,y,z a_YAH=129 1001 1078 " H LEU A 69 "<>" O LYS A 65 " d_HA=2.508 d_AD=3.467 a_DHA=156.857 symop: x,y,z a_YAH=138 875 941 " H MET A 61 "<>" O LEU A 57 " d_HA=2.330 d_AD=3.185 a_DHA=140.636 symop: x,y,z a_YAH=146 875 924 " H MET A 60 "<>" O LEU A 57 " d_HA=2.081 d_AD=2.842 a_DHA=129.597 symop: x,y,z a_YAH=104 987 1043 " H LEU A 67 "<>" O ASN A 64 " d_HA=2.164 d_AD=2.904 a_DHA=127.399 symop: x,y,z a_YAH=108 987 1061 " H VAL A 68 "<>" O ASN A 64 " d_HA=2.051 d_AD=3.006 a_DHA=156.110 symop: x,y,z a_YAH=157 990 1043 " H LEU A 67 "<>" OD1 ASN A 64 " d_HA=2.052 d_AD=2.942 a_DHA=143.653 symop: x,y,z a_YAH=151 919 978 " H GLU A 63 "<>" O MET A 60 " d_HA=1.677 d_AD=2.656 a_DHA=162.542 symop: x,y,z a_YAH=126 919 992 " H ASN A 64 "<>" O MET A 60 " d_HA=1.774 d_AD=2.744 a_DHA=159.007 symop: x,y,z a_YAH=164 894 941 " H MET A 61 "<>" O GLU A 58 " d_HA=2.435 d_AD=3.185 a_DHA=129.686 symop: x,y,z a_YAH=92 909 958 " H LEU A 62 "<>" O ALA A 59 " d_HA=2.473 d_AD=3.449 a_DHA=162.540 symop: x,y,z a_YAH=101 977 6978 "HH11 ARG D 102 "<>" OE2 GLU A 63 " d_HA=2.919 d_AD=3.730 a_DHA=137.108 symop: x+1/2,-y+3/2,-z+7/4 a_YAH=124 6961 7044 " H LEU D 106 "<>" O ARG D 102 " d_HA=2.361 d_AD=3.329 a_DHA=161.294 symop: x,y,z a_YAH=128 7020 7103 " H LEU D 109 "<>" O LEU D 105 " d_HA=2.265 d_AD=3.060 a_DHA=134.087 symop: x,y,z a_YAH=162 6909 6969 " H ARG D 102 "<>" O ASN D 98 " d_HA=2.208 d_AD=3.153 a_DHA=155.088 symop: x,y,z a_YAH=140 6944 7025 " H LEU D 105 "<>" O HIS D 101 " d_HA=1.901 d_AD=2.892 a_DHA=166.426 symop: x,y,z a_YAH=142 9332 9398 " H THR F 33 "<>" O GLN F 29 " d_HA=2.791 d_AD=3.798 a_DHA=173.026 symop: x,y,z a_YAH=134 4474 4538 " H LEU C 62 "<>" O GLU C 58 " d_HA=2.922 d_AD=3.717 a_DHA=135.639 symop: x,y,z a_YAH=137 4455 4521 " H MET C 61 "<>" O LEU C 57 " d_HA=1.744 d_AD=2.703 a_DHA=155.750 symop: x,y,z a_YAH=147 4489 4538 " H LEU C 62 "<>" O ALA C 59 " d_HA=1.984 d_AD=2.868 a_DHA=143.782 symop: x,y,z a_YAH=109 4489 4558 " H GLU C 63 "<>" O ALA C 59 " d_HA=2.842 d_AD=3.656 a_DHA=137.760 symop: x,y,z a_YAH=130 4415 4491 " H ALA C 59 "<>" O LEU C 55 " d_HA=1.799 d_AD=2.735 a_DHA=153.169 symop: x,y,z a_YAH=162 4434 4504 " H MET C 60 "<>" O TYR C 56 " d_HA=2.080 d_AD=3.058 a_DHA=159.840 symop: x,y,z a_YAH=144 4392 4460 " H LEU C 57 "<>" O SER C 53 " d_HA=2.149 d_AD=3.138 a_DHA=163.456 symop: x,y,z a_YAH=147 4327 4383 " H GLU C 52 "<>" O PRO C 49 " d_HA=1.873 d_AD=2.811 a_DHA=151.321 symop: x,y,z a_YAH=128 3302 3230 " H LYS B 95 "<>" O LEU B 91 " d_HA=1.891 d_AD=2.875 a_DHA=161.850 symop: x,y,z a_YAH=166 3249 3324 " H GLN B 96 "<>" O SER B 92 " d_HA=2.073 d_AD=3.062 a_DHA=165.384 symop: x,y,z a_YAH=141 1212 3356 "HD22 ASN B 98 "<>" OE1 GLU A 76 " d_HA=2.381 d_AD=3.373 a_DHA=164.565 symop: x,y,z a_YAH=129 3277 3351 " H ASN B 98 "<>" O ILE B 94 " d_HA=1.797 d_AD=2.810 a_DHA=173.824 symop: x,y,z a_YAH=152 3260 3338 " H SER B 97 "<>" O GLN B 93 " d_HA=1.788 d_AD=2.637 a_DHA=138.631 symop: x,y,z a_YAH=154 3296 3361 " H GLY B 99 "<>" O LYS B 95 " d_HA=2.119 d_AD=3.106 a_DHA=163.095 symop: x,y,z a_YAH=171 1116 1192 " H ARG A 75 "<>" O ILE A 71 " d_HA=2.002 d_AD=2.994 a_DHA=163.361 symop: x,y,z a_YAH=154 1135 3355 "HD21 ASN B 98 "<>" O LEU A 72 " d_HA=1.666 d_AD=2.642 a_DHA=161.946 symop: x,y,z a_YAH=123 1135 1214 " H GLU A 76 "<>" O LEU A 72 " d_HA=2.608 d_AD=3.416 a_DHA=137.358 symop: x,y,z a_YAH=129 1201 3349 "HH11 ARG A 75 "<>" OD1 ASN B 98 " d_HA=1.645 d_AD=2.625 a_DHA=162.822 symop: x,y,z a_YAH=144 1204 3337 "HH22 ARG A 75 "<>" OG SER B 97 " d_HA=2.894 d_AD=3.759 a_DHA=143.048 symop: x,y,z a_YAH=96 a_YAH=99 3337 3392 " HD1 HIS B 101 "<>" OG SER B 97 " d_HA=1.930 d_AD=2.794 a_DHA=142.631 symop: x,y,z a_YAH=148 a_YAH=95 826 1204 "HH22 ARG A 75 "<>" OD1 ASP A 54 " d_HA=2.589 d_AD=3.415 a_DHA=137.825 symop: x,y,z a_YAH=146 1092 1158 " H THR A 73 "<>" O ARG A 70 " d_HA=1.871 d_AD=2.642 a_DHA=130.155 symop: x,y,z a_YAH=124 1092 1172 " H VAL A 74 "<>" O ARG A 70 " d_HA=2.181 d_AD=3.178 a_DHA=165.921 symop: x,y,z a_YAH=151 1038 1121 " H ILE A 71 "<>" O LEU A 67 " d_HA=1.983 d_AD=2.975 a_DHA=163.755 symop: x,y,z a_YAH=169 1057 1140 " H LEU A 72 "<>" O VAL A 68 " d_HA=1.953 d_AD=2.915 a_DHA=155.956 symop: x,y,z a_YAH=142 812 880 " H LEU A 57 "<>" O SER A 53 " d_HA=1.906 d_AD=2.910 a_DHA=169.129 symop: x,y,z a_YAH=162 823 900 " H GLU A 58 "<>" O ASP A 54 " d_HA=1.982 d_AD=2.978 a_DHA=167.464 symop: x,y,z a_YAH=162 835 911 " H ALA A 59 "<>" O LEU A 55 " d_HA=1.873 d_AD=2.793 a_DHA=149.540 symop: x,y,z a_YAH=133 840 797 " H LEU A 55 "<>" O GLU A 52 " d_HA=2.875 d_AD=3.519 a_DHA=122.452 symop: x,y,z a_YAH=98 863 797 " H TYR A 56 "<>" O GLU A 52 " d_HA=2.061 d_AD=3.042 a_DHA=162.014 symop: x,y,z a_YAH=145 854 924 " H MET A 60 "<>" O TYR A 56 " d_HA=2.413 d_AD=3.169 a_DHA=130.266 symop: x,y,z a_YAH=126 542 617 " H LEU A 41 "<>" O GLN A 37 " d_HA=1.958 d_AD=2.950 a_DHA=168.408 symop: x,y,z a_YAH=167 588 661 " H PHE A 44 "<>" O TRP A 40 " d_HA=1.728 d_AD=2.722 a_DHA=166.903 symop: x,y,z a_YAH=147 604 976 " HE1 TRP A 40 "<>" OE1 GLU A 63 " d_HA=1.835 d_AD=2.847 a_DHA=167.138 symop: x,y,z a_YAH=153 726 976 "HH22 ARG A 47 "<>" OE1 GLU A 63 " d_HA=1.962 d_AD=2.950 a_DHA=161.138 symop: x,y,z a_YAH=95 510 536 " H GLY A 36 "<>" OD1 ASN A 34 " d_HA=2.237 d_AD=3.128 a_DHA=145.045 symop: x,y,z a_YAH=129 507 548 " H GLN A 37 "<>" O ASN A 34 " d_HA=2.835 d_AD=3.681 a_DHA=142.053 symop: x,y,z a_YAH=93 507 561 " H ALA A 38 "<>" O ASN A 34 " d_HA=2.223 d_AD=3.181 a_DHA=159.026 symop: x,y,z a_YAH=133 535 599 " H TRP A 40 "<>" O GLY A 36 " d_HA=2.431 d_AD=3.408 a_DHA=162.353 symop: x,y,z a_YAH=126 643 723 "HH11 ARG A 47 "<>" OE2 GLU A 43 " d_HA=1.678 d_AD=2.690 a_DHA=167.992 symop: x,y,z a_YAH=110 643 6980 "HH21 ARG D 102 "<>" OE2 GLU A 43 " d_HA=2.973 d_AD=3.734 a_DHA=131.829 symop: x+1/2,-y+3/2,-z+7/4 a_YAH=164 4581 4658 " H LEU C 69 "<>" O LYS C 65 " d_HA=2.169 d_AD=3.077 a_DHA=147.996 symop: x,y,z a_YAH=156 4637 4720 " H LEU C 72 "<>" O VAL C 68 " d_HA=2.421 d_AD=3.397 a_DHA=161.910 symop: x,y,z a_YAH=143 4653 4738 " H THR C 73 "<>" O LEU C 69 " d_HA=2.233 d_AD=3.186 a_DHA=156.393 symop: x,y,z a_YAH=114 9336 10013 "HH22 ARG F 70 "<>" OE1 GLN F 29 " d_HA=1.849 d_AD=2.851 a_DHA=167.891 symop: x,y,z a_YAH=140 4552 9455 "HE21 GLN F 37 "<>" O GLU C 63 " d_HA=1.760 d_AD=2.677 a_DHA=150.065 symop: x,y,z a_YAH=110 4552 9897 "HD21 ASN F 64 "<>" O GLU C 63 " d_HA=2.379 d_AD=3.364 a_DHA=163.168 symop: x,y,z a_YAH=144 9456 9929 "HE22 GLN F 37 "<>" OE2 GLU F 66 " d_HA=2.283 d_AD=3.015 a_DHA=128.318 symop: x,y,z a_YAH=97 4499 4572 " H ASN C 64 "<>" O MET C 60 " d_HA=1.843 d_AD=2.794 a_DHA=155.198 symop: x,y,z a_YAH=158 4567 4641 " H VAL C 68 "<>" O ASN C 64 " d_HA=2.199 d_AD=3.202 a_DHA=169.852 symop: x,y,z a_YAH=148 4567 4623 " H LEU C 67 "<>" O ASN C 64 " d_HA=2.731 d_AD=3.394 a_DHA=122.990 symop: x,y,z a_YAH=90 9304 9354 " H LEU F 30 "<>" O SER F 27 " d_HA=2.119 d_AD=2.935 a_DHA=135.682 symop: x,y,z a_YAH=104 9315 9385 " H GLU F 32 "<>" O GLN F 28 " d_HA=2.835 d_AD=3.768 a_DHA=152.955 symop: x,y,z a_YAH=163 9315 9371 " H SER F 31 "<>" O GLN F 28 " d_HA=1.804 d_AD=2.603 a_DHA=133.683 symop: x,y,z a_YAH=105 9349 9413 " H ASN F 34 "<>" O LEU F 30 " d_HA=2.279 d_AD=3.170 a_DHA=145.553 symop: x,y,z a_YAH=125 9408 9449 " H GLN F 37 "<>" O ASN F 34 " d_HA=2.358 d_AD=3.110 a_DHA=130.546 symop: x,y,z a_YAH=104 9422 9462 " H ALA F 38 "<>" O PRO F 35 " d_HA=2.207 d_AD=3.127 a_DHA=151.245 symop: x,y,z a_YAH=100 9422 9475 " H ILE F 39 "<>" O PRO F 35 " d_HA=1.814 d_AD=2.823 a_DHA=170.198 symop: x,y,z a_YAH=160 9436 9500 " H TRP F 40 "<>" O GLY F 36 " d_HA=2.468 d_AD=3.405 a_DHA=153.425 symop: x,y,z a_YAH=131 4304 4557 "HH12 ARG C 47 "<>" OE2 GLU C 63 " d_HA=2.771 d_AD=3.566 a_DHA=135.254 symop: x,y,z a_YAH=152 4306 4557 "HH22 ARG C 47 "<>" OE2 GLU C 63 " d_HA=2.092 d_AD=3.083 a_DHA=159.681 symop: x,y,z a_YAH=116 4218 4270 " H LYS C 46 "<>" O GLU C 43 " d_HA=2.338 d_AD=3.235 a_DHA=147.110 symop: x,y,z a_YAH=115 4218 4294 " H ARG C 47 "<>" O GLU C 43 " d_HA=2.177 d_AD=3.192 a_DHA=175.896 symop: x,y,z a_YAH=159 1154 1214 " H GLU A 76 "<>" O THR A 73 " d_HA=2.507 d_AD=3.219 a_DHA=127.395 symop: x,y,z a_YAH=97 1154 1228 " H ASN A 77 "<>" O THR A 73 " d_HA=1.876 d_AD=2.849 a_DHA=160.559 symop: x,y,z a_YAH=153 220 826 "HE21 GLN A 15 "<>" OD1 ASP A 54 " d_HA=2.926 d_AD=3.634 a_DHA=127.707 symop: x,y,z a_YAH=117 1200 267 " HE ARG A 75 "<>" OG1 THR A 19 " d_HA=2.079 d_AD=3.036 a_DHA=155.708 symop: x,y,z a_YAH=137 a_YAH=121 1111 435 "HH21 ARG A 70 "<>" OE1 GLN A 29 " d_HA=1.672 d_AD=2.606 a_DHA=150.551 symop: x,y,z a_YAH=142 653 737 " H HIS A 48 "<>" O PHE A 44 " d_HA=2.401 d_AD=3.188 a_DHA=134.167 symop: x,y,z a_YAH=137 521 574 " H ILE A 39 "<>" O PRO A 35 " d_HA=2.000 d_AD=2.937 a_DHA=151.740 symop: x,y,z a_YAH=145 4680 4603 " H ARG C 70 "<>" O GLU C 66 " d_HA=2.826 d_AD=3.574 a_DHA=130.450 symop: x,y,z a_YAH=129 4672 4752 " H VAL C 74 "<>" O ARG C 70 " d_HA=1.918 d_AD=2.928 a_DHA=170.967 symop: x,y,z a_YAH=167 9266 9338 " H GLN F 29 "<>" O LEU F 25 " d_HA=2.013 d_AD=3.010 a_DHA=168.011 symop: x,y,z a_YAH=162 4618 4701 " H ILE C 71 "<>" O LEU C 67 " d_HA=2.068 d_AD=3.001 a_DHA=151.564 symop: x,y,z a_YAH=154 4618 4680 " H ARG C 70 "<>" O LEU C 67 " d_HA=2.158 d_AD=2.983 a_DHA=136.481 symop: x,y,z a_YAH=107 9321 9242 " H GLN F 28 "<>" O ARG F 24 " d_HA=2.234 d_AD=3.228 a_DHA=165.164 symop: x,y,z a_YAH=147 9443 9518 " H LEU F 41 "<>" O GLN F 37 " d_HA=2.715 d_AD=3.694 a_DHA=162.878 symop: x,y,z a_YAH=113 4192 4256 " H SER C 45 "<>" O LEU C 41 " d_HA=2.663 d_AD=3.584 a_DHA=151.361 symop: x,y,z a_YAH=133 4241 4168 " H PHE C 44 "<>" O TRP C 40 " d_HA=2.163 d_AD=3.162 a_DHA=168.450 symop: x,y,z a_YAH=161 1776 4282 " HZ3 LYS C 46 "<>" O GLN A 111 " d_HA=1.826 d_AD=2.614 a_DHA=130.787 symop: x,y+1,z a_YAH=136 ------------------------------------------------------------------------------- Total: 937 Symmetry: 0 Per residue: 1.4371 Mean SD Skew Kurtosis theta_1: 141.825 21.194 -0.374 2.206 theta_2: 131.956 24.257 -0.083 1.772 d_HA: 2.383 0.311 0.144 2.075 5463 6260 " HZ3 LYS B 157 "<>" O THR B 107 " d_HA=2.386 d_AD=3.034 a_DHA=121.057 symop: x,y,z a_YAH=143 2057 2086 " H GLY A 172 "<>" OG SER A 170 " d_HA=2.938 d_AD=3.634 a_DHA=126.847 symop: x,y,z a_YAH=100 a_YAH=138 2046 2062 " HG SER A 170 "<>" OD1 ASP A 169 " d_HA=2.868 d_AD=3.781 a_DHA=157.186 symop: x,y,z a_YAH=122 2046 2102 "HD22 ASN A 173 "<>" OD1 ASP A 169 " d_HA=1.701 d_AD=2.709 a_DHA=166.768 symop: x,y,z a_YAH=116 3192 3975 " H ILE A 244 "<>" O GLY A 294 " d_HA=1.967 d_AD=2.968 a_DHA=167.496 symop: x,y,z a_YAH=161 2635 3177 " H THR A 243 "<>" O LEU A 209 " d_HA=1.948 d_AD=2.954 a_DHA=171.087 symop: x,y,z a_YAH=149 2929 4244 " H SER A 228 "<>" O TYR A 312 " d_HA=1.973 d_AD=2.949 a_DHA=161.685 symop: x,y,z a_YAH=154 4230 2920 "HH12 ARG A 227 "<>" O PRO A 311 " d_HA=1.854 d_AD=2.839 a_DHA=164.451 symop: x,y,z a_YAH=109 4230 2922 "HH22 ARG A 227 "<>" O PRO A 311 " d_HA=2.381 d_AD=3.248 a_DHA=143.901 symop: x,y,z a_YAH=138 7353 8596 "HD22 ASN B 309 "<>" O SER B 231 " d_HA=2.233 d_AD=3.188 a_DHA=156.844 symop: x,y,z a_YAH=131 7373 8600 " H TYR B 232 "<>" O TYR B 310 " d_HA=1.918 d_AD=2.903 a_DHA=162.402 symop: x,y,z a_YAH=114 8644 7319 " H TYR B 312 "<>" OG SER B 228 " d_HA=2.238 d_AD=3.010 a_DHA=131.875 symop: x,y,z a_YAH=125 a_YAH=123 7311 8621 "HH12 ARG B 227 "<>" O PRO B 311 " d_HA=1.845 d_AD=2.830 a_DHA=164.048 symop: x,y,z a_YAH=110 7313 8621 "HH22 ARG B 227 "<>" O PRO B 311 " d_HA=2.367 d_AD=3.237 a_DHA=144.032 symop: x,y,z a_YAH=139 6965 7454 " H ALA B 205 "<>" O LYS B 237 " d_HA=2.040 d_AD=3.009 a_DHA=160.248 symop: x,y,z a_YAH=156 8635 7320 " H SER B 228 "<>" O TYR B 312 " d_HA=1.986 d_AD=2.960 a_DHA=161.152 symop: x,y,z a_YAH=154 8672 7269 " H ILE B 314 "<>" O TRP B 226 " d_HA=2.026 d_AD=3.023 a_DHA=165.724 symop: x,y,z a_YAH=148 5507 5056 " HZ1 LYS B 79 "<>" OE1 GLU B 110 " d_HA=1.829 d_AD=2.833 a_DHA=166.832 symop: x,y,z a_YAH=175 6955 6912 " H ALA B 204 "<>" O ASP B 201 " d_HA=2.051 d_AD=2.934 a_DHA=144.038 symop: x,y,z a_YAH=129 7476 8467 " H MET B 300 "<>" O LEU B 238 " d_HA=1.922 d_AD=2.917 a_DHA=165.301 symop: x,y,z a_YAH=153 2066 2111 " H ILE A 174 "<>" O LEU A 171 " d_HA=2.380 d_AD=3.363 a_DHA=163.726 symop: x,y,z a_YAH=109 2055 2097 " H ASN A 173 "<>" O SER A 170 " d_HA=2.214 d_AD=3.107 a_DHA=146.373 symop: x,y,z a_YAH=114 3159 3999 " H LEU A 242 "<>" O TYR A 296 " d_HA=1.942 d_AD=2.853 a_DHA=148.201 symop: x,y,z a_YAH=117 3154 4008 " H TYR A 296 "<>" O LEU A 242 " d_HA=1.850 d_AD=2.823 a_DHA=159.405 symop: x,y,z a_YAH=162 3180 3986 " HG1 THR A 243 "<>" OE1 GLN A 295 " d_HA=1.768 d_AD=2.702 a_DHA=159.213 symop: x,y,z a_YAH=117 3994 3999 "HE21 GLN A 295 "<>" O TYR A 296 " d_HA=2.851 d_AD=3.756 a_DHA=150.273 symop: x,y,z a_YAH=145 2128 2155 " H GLY A 177 "<>" OD1 ASP A 175 " d_HA=2.077 d_AD=2.800 a_DHA=126.208 symop: x,y,z a_YAH=152 2128 2164 " H SER A 178 "<>" OD1 ASP A 175 " d_HA=1.982 d_AD=2.933 a_DHA=153.870 symop: x,y,z a_YAH=95 3123 4036 " H LEU A 240 "<>" O LEU A 298 " d_HA=1.902 d_AD=2.879 a_DHA=160.431 symop: x,y,z a_YAH=139 3118 4041 " H LEU A 298 "<>" O LEU A 240 " d_HA=1.819 d_AD=2.823 a_DHA=169.548 symop: x,y,z a_YAH=151 2640 3137 " H LEU A 209 "<>" O HIS A 241 " d_HA=1.979 d_AD=2.961 a_DHA=161.652 symop: x,y,z a_YAH=169 2600 2940 " H SER A 229 "<>" OE1 GLU A 207 " d_HA=1.788 d_AD=2.805 a_DHA=177.086 symop: x,y,z a_YAH=108 2600 2944 " HG SER A 229 "<>" OE1 GLU A 207 " d_HA=2.364 d_AD=3.233 a_DHA=149.008 symop: x,y,z a_YAH=120 2928 4253 " H TYR A 312 "<>" OG SER A 228 " d_HA=2.169 d_AD=2.935 a_DHA=131.118 symop: x,y,z a_YAH=124 a_YAH=122 2933 2948 " HG SER A 228 "<>" O ASN A 230 " d_HA=1.867 d_AD=2.771 a_DHA=152.288 symop: x,y,z a_YAH=152 2601 2953 " H ASN A 230 "<>" OE2 GLU A 207 " d_HA=2.141 d_AD=3.114 a_DHA=159.941 symop: x,y,z a_YAH=136 2601 2958 "HD22 ASN A 230 "<>" OE2 GLU A 207 " d_HA=2.744 d_AD=3.607 a_DHA=144.005 symop: x,y,z a_YAH=120 2601 2990 " HH TYR A 232 "<>" OE2 GLU A 207 " d_HA=1.664 d_AD=2.635 a_DHA=169.516 symop: x,y,z a_YAH=120 2982 4209 " H TYR A 232 "<>" O TYR A 310 " d_HA=1.941 d_AD=2.927 a_DHA=163.191 symop: x,y,z a_YAH=112 4177 4226 " HH TYR A 310 "<>" O SER A 307 " d_HA=2.773 d_AD=3.653 a_DHA=152.771 symop: x,y,z a_YAH=170 7385 7443 " H GLN B 236 "<>" O PRO B 233 " d_HA=1.976 d_AD=2.918 a_DHA=153.385 symop: x,y,z a_YAH=124 7364 8609 " H TYR B 310 "<>" O TYR B 232 " d_HA=1.890 d_AD=2.870 a_DHA=160.660 symop: x,y,z a_YAH=137 5214 5245 " H THR B 92 "<>" O GLY B 90 " d_HA=2.394 d_AD=3.109 a_DHA=126.860 symop: x,y,z a_YAH=105 5243 5289 " H PHE B 95 "<>" OG1 THR B 92 " d_HA=2.476 d_AD=3.452 a_DHA=161.757 symop: x,y,z a_YAH=129 a_YAH=95 5248 5270 " HG1 THR B 92 "<>" OE1 GLU B 94 " d_HA=1.579 d_AD=2.557 a_DHA=167.347 symop: x,y,z a_YAH=151 6943 7450 "HE22 GLN B 236 "<>" O ALA B 203 " d_HA=1.925 d_AD=2.799 a_DHA=142.022 symop: x,y,z a_YAH=137 7437 8652 " HH TYR B 312 "<>" O GLN B 236 " d_HA=1.711 d_AD=2.664 a_DHA=164.011 symop: x,y,z a_YAH=164 7449 7454 "HE21 GLN B 236 "<>" O LYS B 237 " d_HA=1.829 d_AD=2.837 a_DHA=175.403 symop: x,y,z a_YAH=136 5255 5326 " H GLN B 97 "<>" O SER B 93 " d_HA=2.120 d_AD=3.124 a_DHA=168.414 symop: x,y,z a_YAH=155 5255 5306 " H ILE B 96 "<>" O SER B 93 " d_HA=2.580 d_AD=3.266 a_DHA=124.635 symop: x,y,z a_YAH=101 5266 5339 " H ALA B 98 "<>" O GLU B 94 " d_HA=1.808 d_AD=2.821 a_DHA=174.180 symop: x,y,z a_YAH=163 6057 6915 "HH21 ARG B 143 "<>" OD1 ASP B 201 " d_HA=1.776 d_AD=2.801 a_DHA=177.425 symop: x,y,z a_YAH=120 6915 6945 " H ALA B 203 "<>" OD1 ASP B 201 " d_HA=2.262 d_AD=3.245 a_DHA=163.344 symop: x,y,z a_YAH=129 7481 8462 " H LEU B 238 "<>" O MET B 300 " d_HA=1.956 d_AD=2.963 a_DHA=170.400 symop: x,y,z a_YAH=163 7745 8691 " H LEU B 315 "<>" O LEU B 254 " d_HA=2.005 d_AD=2.981 a_DHA=160.901 symop: x,y,z a_YAH=158 7766 8229 " H ALA B 255 "<>" O HIS B 285 " d_HA=1.874 d_AD=2.888 a_DHA=174.910 symop: x,y,z a_YAH=168 5553 5538 " H THR B 113 "<>" OD1 ASN B 112 " d_HA=2.251 d_AD=3.064 a_DHA=136.226 symop: x,y,z a_YAH=92 4974 5567 " H THR B 114 "<>" O LEU B 75 " d_HA=1.844 d_AD=2.829 a_DHA=162.229 symop: x,y,z a_YAH=151 4995 5556 " HG1 THR B 113 "<>" OG1 THR B 76 " d_HA=1.887 d_AD=2.830 a_DHA=162.863 symop: x,y,z a_YAH=123 a_YAH=110 1301 1342 " H GLU A 126 "<>" O GLY A 123 " d_HA=2.707 d_AD=3.673 a_DHA=159.833 symop: x,y,z a_YAH=109 1340 2029 " HG SER A 167 "<>" OE1 GLU A 126 " d_HA=1.651 d_AD=2.627 a_DHA=166.794 symop: x,y,z a_YAH=160 1351 2035 " H ALA A 168 "<>" O TYR A 127 " d_HA=2.027 d_AD=2.998 a_DHA=159.140 symop: x,y,z a_YAH=151 1360 2033 " H TYR A 127 "<>" O ALA A 168 " d_HA=1.733 d_AD=2.741 a_DHA=174.020 symop: x,y,z a_YAH=169 1397 2008 " H TYR A 129 "<>" O THR A 166 " d_HA=2.001 d_AD=2.998 a_DHA=166.950 symop: x,y,z a_YAH=150 2125 2164 " H SER A 178 "<>" O ASP A 175 " d_HA=2.835 d_AD=3.520 a_DHA=124.963 symop: x,y,z a_YAH=97 2125 2168 " HG SER A 178 "<>" O ASP A 175 " d_HA=1.665 d_AD=2.636 a_DHA=168.671 symop: x,y,z a_YAH=154 2137 2177 " H LEU A 179 "<>" O GLN A 176 " d_HA=2.512 d_AD=3.272 a_DHA=131.517 symop: x,y,z a_YAH=100 2596 3144 " H HIS A 241 "<>" O GLU A 207 " d_HA=1.927 d_AD=2.879 a_DHA=154.332 symop: x,y,z a_YAH=161 2154 2196 " H ILE A 180 "<>" O GLY A 177 " d_HA=2.126 d_AD=3.115 a_DHA=165.013 symop: x,y,z a_YAH=111 2154 2628 "HH11 ARG A 208 "<>" O GLY A 177 " d_HA=1.975 d_AD=2.853 a_DHA=143.487 symop: y,z,x a_YAH=152 2161 2629 "HH12 ARG A 208 "<>" O SER A 178 " d_HA=2.017 d_AD=2.900 a_DHA=144.712 symop: y,z,x a_YAH=119 3046 4261 " HH TYR A 312 "<>" O GLN A 236 " d_HA=1.699 d_AD=2.651 a_DHA=164.013 symop: x,y,z a_YAH=162 4252 4112 " H ALA A 302 "<>" OH TYR A 312 " d_HA=2.058 d_AD=2.956 a_DHA=146.955 symop: x,y,z a_YAH=124 a_YAH=120 2572 3109 " H ASN A 239 "<>" O ALA A 205 " d_HA=1.855 d_AD=2.870 a_DHA=177.030 symop: x,y,z a_YAH=159 2602 3104 " H GLU A 207 "<>" O ASN A 239 " d_HA=1.956 d_AD=2.960 a_DHA=168.316 symop: x,y,z a_YAH=165 2994 3052 " H GLN A 236 "<>" O PRO A 233 " d_HA=1.962 d_AD=2.915 a_DHA=155.276 symop: x,y,z a_YAH=124 2973 4218 " H TYR A 310 "<>" O TYR A 232 " d_HA=1.885 d_AD=2.863 a_DHA=160.163 symop: x,y,z a_YAH=137 2962 4205 "HD22 ASN A 309 "<>" O SER A 231 " d_HA=2.353 d_AD=3.291 a_DHA=154.151 symop: x,y,z a_YAH=130 8568 8617 " HH TYR B 310 "<>" O SER B 307 " d_HA=2.782 d_AD=3.650 a_DHA=150.670 symop: x,y,z a_YAH=171 5187 5229 " H PHE B 91 "<>" O SER B 88 " d_HA=2.045 d_AD=3.014 a_DHA=159.238 symop: x,y,z a_YAH=149 7399 8495 " HZ1 LYS B 301 "<>" O TRP B 234 " d_HA=1.771 d_AD=2.780 a_DHA=171.334 symop: x,y,z a_YAH=140 8497 8501 " HZ3 LYS B 301 "<>" O ALA B 302 " d_HA=1.827 d_AD=2.690 a_DHA=140.301 symop: x,y,z a_YAH=161 8503 8643 " H ALA B 302 "<>" OH TYR B 312 " d_HA=2.077 d_AD=2.978 a_DHA=147.382 symop: x,y,z a_YAH=123 a_YAH=122 7774 7830 " H VAL B 259 "<>" O SER B 256 " d_HA=1.968 d_AD=2.853 a_DHA=143.627 symop: x,y,z a_YAH=146 7807 8516 " H ASN B 303 "<>" O ILE B 258 " d_HA=1.918 d_AD=2.880 a_DHA=157.242 symop: x,y,z a_YAH=127 7776 7812 " H ILE B 258 "<>" OG SER B 256 " d_HA=2.774 d_AD=3.774 a_DHA=171.921 symop: x,y,z a_YAH=102 a_YAH=108 7791 8220 " H LYS B 257 "<>" OD1 ASP B 284 " d_HA=2.891 d_AD=3.835 a_DHA=155.446 symop: x,y,z a_YAH=133 5241 5306 " H ILE B 96 "<>" O THR B 92 " d_HA=2.294 d_AD=3.200 a_DHA=147.993 symop: x,y,z a_YAH=147 6055 6164 "HH11 ARG B 143 "<>" OD2 ASP B 151 " d_HA=1.860 d_AD=2.856 a_DHA=164.099 symop: x,y,z a_YAH=110 6054 6916 " HE ARG B 143 "<>" OD2 ASP B 201 " d_HA=1.762 d_AD=2.767 a_DHA=168.294 symop: x,y,z a_YAH=112 7842 8485 " H LYS B 301 "<>" O ASP B 260 " d_HA=1.956 d_AD=2.946 a_DHA=162.028 symop: x,y,z a_YAH=158 7847 8479 " H ASP B 260 "<>" O LYS B 301 " d_HA=2.117 d_AD=2.911 a_DHA=134.076 symop: x,y,z a_YAH=173 7764 8236 " H HIS B 285 "<>" O ALA B 255 " d_HA=2.341 d_AD=3.284 a_DHA=154.162 symop: x,y,z a_YAH=143 4946 5600 " H ARG B 116 "<>" O GLN B 73 " d_HA=2.047 d_AD=3.054 a_DHA=168.234 symop: x,y,z a_YAH=160 4970 5582 " HG SER B 74 "<>" OE2 GLU B 115 " d_HA=1.936 d_AD=2.863 a_DHA=157.231 symop: x,y,z a_YAH=148 4979 5563 " H LEU B 75 "<>" O THR B 114 " d_HA=2.018 d_AD=2.969 a_DHA=155.373 symop: x,y,z a_YAH=121 470 4950 "HD22 ASN A 66 "<>" OE1 GLN B 73 " d_HA=2.023 d_AD=2.843 a_DHA=136.040 symop: y-1/2,-z+3/2,-x+2 a_YAH=109 4958 4963 "HE21 GLN B 73 "<>" O SER B 74 " d_HA=1.849 d_AD=2.850 a_DHA=169.091 symop: x,y,z a_YAH=133 413 1376 " H VAL A 128 "<>" O LEU A 63 " d_HA=1.879 d_AD=2.880 a_DHA=166.420 symop: x,y,z a_YAH=151 432 480 " H GLU A 67 "<>" O ASN A 64 " d_HA=2.138 d_AD=3.106 a_DHA=158.771 symop: x,y,z a_YAH=148 474 1293 " H ALA A 122 "<>" O GLU A 67 " d_HA=2.054 d_AD=3.027 a_DHA=159.539 symop: x,y,z a_YAH=146 460 4938 " H SER B 72 "<>" O ASN A 66 " d_HA=2.751 d_AD=3.735 a_DHA=163.097 symop: y-1/2,-z+3/2,-x+2 a_YAH=143 465 1301 " H ASN A 66 "<>" O GLY A 123 " d_HA=2.205 d_AD=3.085 a_DHA=144.268 symop: x,y,z a_YAH=112 465 1291 " H ASN A 66 "<>" O ALA A 122 " d_HA=2.390 d_AD=3.092 a_DHA=125.704 symop: x,y,z a_YAH=104 377 1418 " H TYR A 130 "<>" O GLN A 61 " d_HA=1.875 d_AD=2.882 a_DHA=169.272 symop: x,y,z a_YAH=156 383 1409 " H GLN A 61 "<>" O TYR A 130 " d_HA=1.837 d_AD=2.834 a_DHA=166.486 symop: x,y,z a_YAH=166 418 1372 " H LEU A 63 "<>" O VAL A 128 " d_HA=1.845 d_AD=2.832 a_DHA=163.223 symop: x,y,z a_YAH=154 1302 1341 " H GLY A 123 "<>" OE2 GLU A 126 " d_HA=1.961 d_AD=2.944 a_DHA=161.105 symop: x,y,z a_YAH=108 1436 1975 " H LYS A 131 "<>" O SER A 164 " d_HA=1.846 d_AD=2.850 a_DHA=169.240 symop: x,y,z a_YAH=155 1388 2012 " H THR A 166 "<>" O TYR A 129 " d_HA=1.987 d_AD=2.979 a_DHA=164.408 symop: x,y,z a_YAH=162 287 1447 " HZ2 LYS A 131 "<>" OE1 GLU A 54 " d_HA=1.843 d_AD=2.706 a_DHA=139.938 symop: x,y,z a_YAH=104 287 3605 "HD21 ASN A 269 "<>" OE1 GLU A 54 " d_HA=2.666 d_AD=3.648 a_DHA=163.544 symop: y,z,x a_YAH=164 288 1485 " HH TYR A 133 "<>" OE2 GLU A 54 " d_HA=1.725 d_AD=2.641 a_DHA=154.197 symop: x,y,z a_YAH=149 288 2216 " H GLU A 181 "<>" OE2 GLU A 54 " d_HA=2.023 d_AD=3.040 a_DHA=178.032 symop: x,y,z a_YAH=119 1446 2172 " HZ1 LYS A 131 "<>" O LEU A 179 " d_HA=2.000 d_AD=2.764 a_DHA=129.322 symop: x,y,z a_YAH=145 2564 2521 " H ALA A 204 "<>" O ASP A 201 " d_HA=1.985 d_AD=2.943 a_DHA=156.515 symop: x,y,z a_YAH=126 2214 2277 " HE ARG A 185 "<>" OE1 GLU A 181 " d_HA=1.742 d_AD=2.767 a_DHA=175.930 symop: x,y,z a_YAH=116 2215 2280 "HH21 ARG A 185 "<>" OE2 GLU A 181 " d_HA=1.699 d_AD=2.715 a_DHA=167.321 symop: x,y,z a_YAH=112 2552 3059 "HE22 GLN A 236 "<>" O ALA A 203 " d_HA=1.856 d_AD=2.784 a_DHA=149.487 symop: x,y,z a_YAH=151 2574 3063 " H ALA A 205 "<>" O LYS A 237 " d_HA=2.105 d_AD=3.062 a_DHA=157.866 symop: x,y,z a_YAH=158 3058 3063 "HE21 GLN A 236 "<>" O LYS A 237 " d_HA=1.865 d_AD=2.872 a_DHA=176.807 symop: x,y,z a_YAH=137 5163 5221 "HD22 ASN B 86 "<>" O PHE B 91 " d_HA=2.669 d_AD=3.603 a_DHA=154.595 symop: x,y,z a_YAH=148 5190 6163 " H SER B 88 "<>" OD1 ASP B 151 " d_HA=1.831 d_AD=2.794 a_DHA=156.175 symop: x,y,z a_YAH=142 8514 8532 " HG SER B 304 "<>" OD1 ASN B 303 " d_HA=2.227 d_AD=3.167 a_DHA=163.676 symop: x,y,z a_YAH=163 7785 8173 " H GLY B 281 "<>" O LYS B 257 " d_HA=2.065 d_AD=2.930 a_DHA=141.920 symop: x,y,z a_YAH=150 7785 8520 "HD21 ASN B 303 "<>" O LYS B 257 " d_HA=2.902 d_AD=3.862 a_DHA=160.947 symop: x,y,z a_YAH=120 7802 8179 " HZ2 LYS B 257 "<>" O VAL B 282 " d_HA=1.855 d_AD=2.866 a_DHA=169.621 symop: x,y,z a_YAH=127 5137 6177 " H ASP B 152 "<>" O VAL B 85 " d_HA=1.844 d_AD=2.845 a_DHA=167.281 symop: x,y,z a_YAH=134 5175 6149 " H PHE B 87 "<>" O SER B 150 " d_HA=1.884 d_AD=2.884 a_DHA=167.349 symop: x,y,z a_YAH=164 5194 6164 " HG SER B 88 "<>" OD2 ASP B 151 " d_HA=1.843 d_AD=2.756 a_DHA=153.951 symop: x,y,z a_YAH=103 6151 6088 " HG SER B 145 "<>" OG SER B 150 " d_HA=2.176 d_AD=3.096 a_DHA=157.709 symop: x,y,z a_YAH=99 a_YAH=141 6156 6164 " HG SER B 150 "<>" OD2 ASP B 151 " d_HA=1.727 d_AD=2.711 a_DHA=175.619 symop: x,y,z a_YAH=128 7845 8521 "HD22 ASN B 303 "<>" OD1 ASP B 260 " d_HA=1.817 d_AD=2.830 a_DHA=167.626 symop: x,y,z a_YAH=118 7845 8154 " H GLY B 279 "<>" OD1 ASP B 260 " d_HA=1.884 d_AD=2.904 a_DHA=177.065 symop: x,y,z a_YAH=152 6105 8153 " HE2 HIS B 146 "<>" O GLY B 279 " d_HA=1.921 d_AD=2.934 a_DHA=172.327 symop: x,y,z a_YAH=156 8163 8201 " H LYS B 283 "<>" OD1 ASP B 280 " d_HA=1.719 d_AD=2.734 a_DHA=168.792 symop: x,y,z a_YAH=128 8163 8183 " H VAL B 282 "<>" OD1 ASP B 280 " d_HA=1.932 d_AD=2.811 a_DHA=142.314 symop: x,y,z a_YAH=109 5577 5608 " HE ARG B 116 "<>" O GLU B 115 " d_HA=1.879 d_AD=2.791 a_DHA=147.327 symop: x,y,z a_YAH=140 4915 5631 " H VAL B 118 "<>" O PHE B 71 " d_HA=1.989 d_AD=2.967 a_DHA=160.008 symop: x,y,z a_YAH=159 4952 5592 " H GLN B 73 "<>" O ARG B 116 " d_HA=2.284 d_AD=3.156 a_DHA=143.481 symop: x,y,z a_YAH=171 489 4905 " H THR B 70 "<>" O THR A 68 " d_HA=2.400 d_AD=3.285 a_DHA=145.197 symop: y-1/2,-z+3/2,-x+2 a_YAH=128 493 4901 " H THR A 68 "<>" O THR B 70 " d_HA=1.877 d_AD=2.874 a_DHA=167.772 symop: y-1/2,-z+3/2,-x+2 a_YAH=143 496 1279 " HG1 THR A 68 "<>" OG1 THR A 121 " d_HA=1.893 d_AD=2.845 a_DHA=166.997 symop: x,y,z a_YAH=121 a_YAH=103 362 4870 " HG SER A 59 "<>" OE2 GLU B 67 " d_HA=1.589 d_AD=2.586 a_DHA=177.626 symop: y-1/2,-z+3/2,-x+2 a_YAH=170 504 1263 " H GLY A 69 "<>" O THR A 120 " d_HA=1.905 d_AD=2.905 a_DHA=169.841 symop: x,y,z a_YAH=150 1263 1284 " HG1 THR A 121 "<>" O THR A 120 " d_HA=1.917 d_AD=2.872 a_DHA=168.814 symop: x,y,z a_YAH=92 358 1452 " H SER A 59 "<>" O VAL A 132 " d_HA=2.650 d_AD=3.484 a_DHA=139.931 symop: x,y,z a_YAH=139 355 1456 " H VAL A 132 "<>" O SER A 59 " d_HA=2.005 d_AD=2.963 a_DHA=156.447 symop: x,y,z a_YAH=128 283 327 " H VAL A 57 "<>" O GLU A 54 " d_HA=1.958 d_AD=2.954 a_DHA=165.971 symop: x,y,z a_YAH=132 343 1452 " H VAL A 58 "<>" O VAL A 132 " d_HA=1.819 d_AD=2.827 a_DHA=173.269 symop: x,y,z a_YAH=168 1430 1978 " H SER A 164 "<>" O LYS A 131 " d_HA=1.958 d_AD=2.935 a_DHA=160.140 symop: x,y,z a_YAH=169 1477 1932 " H TYR A 133 "<>" O TRP A 162 " d_HA=1.801 d_AD=2.812 a_DHA=178.187 symop: x,y,z a_YAH=162 262 314 " H LEU A 52 "<>" OG SER A 56 " d_HA=1.904 d_AD=2.899 a_DHA=165.760 symop: x,y,z a_YAH=120 a_YAH=131 276 315 " H SER A 56 "<>" O GLY A 53 " d_HA=2.117 d_AD=3.096 a_DHA=161.705 symop: x,y,z a_YAH=128 238 2269 " H ARG A 185 "<>" O ILE A 51 " d_HA=2.123 d_AD=3.095 a_DHA=159.359 symop: x,y,z a_YAH=140 243 2261 " H ILE A 51 "<>" O ARG A 185 " d_HA=1.874 d_AD=2.885 a_DHA=173.563 symop: x,y,z a_YAH=156 2278 2285 "HH11 ARG A 185 "<>" O CYS A 186 " d_HA=2.425 d_AD=3.211 a_DHA=134.301 symop: x,y,z a_YAH=145 12 8172 " HG SER A 35 "<>" O GLY B 281 " d_HA=2.023 d_AD=2.907 a_DHA=148.396 symop: x,y,z a_YAH=154 3 35 " H LEU A 37 "<>" O SER A 35 " d_HA=2.214 d_AD=3.062 a_DHA=140.165 symop: x,y,z a_YAH=91 25 8179 "HD21 ASN A 36 "<>" O VAL B 282 " d_HA=2.914 d_AD=3.594 a_DHA=125.508 symop: x,y,z a_YAH=115 510 4884 " H THR B 68 "<>" O THR A 70 " d_HA=2.195 d_AD=3.157 a_DHA=158.208 symop: y-1/2,-z+3/2,-x+2 a_YAH=132 514 4880 " H THR A 70 "<>" O THR B 68 " d_HA=2.450 d_AD=3.228 a_DHA=133.126 symop: y-1/2,-z+3/2,-x+2 a_YAH=137 532 1236 " H PHE A 71 "<>" O VAL A 118 " d_HA=1.992 d_AD=2.965 a_DHA=160.080 symop: x,y,z a_YAH=162 503 1267 " H THR A 120 "<>" O GLY A 69 " d_HA=2.075 d_AD=3.072 a_DHA=166.003 symop: x,y,z a_YAH=151 503 1259 " HG SER A 119 "<>" O GLY A 69 " d_HA=1.737 d_AD=2.688 a_DHA=162.448 symop: x,y,z a_YAH=127 312 1491 " H ALA A 134 "<>" O SER A 56 " d_HA=1.786 d_AD=2.793 a_DHA=171.433 symop: x,y,z a_YAH=154 1468 1943 " H TRP A 162 "<>" O TYR A 133 " d_HA=1.890 d_AD=2.887 a_DHA=165.520 symop: x,y,z a_YAH=152 207 2300 " H VAL A 187 "<>" O GLY A 49 " d_HA=1.859 d_AD=2.823 a_DHA=156.831 symop: x,y,z a_YAH=150 214 1522 " H TYR A 136 "<>" O TRP A 50 " d_HA=1.827 d_AD=2.841 a_DHA=174.156 symop: x,y,z a_YAH=147 225 1513 " H TRP A 50 "<>" O TYR A 136 " d_HA=2.004 d_AD=2.993 a_DHA=163.558 symop: x,y,z a_YAH=156 702 1803 " H SER A 154 "<>" O SER A 82 " d_HA=1.831 d_AD=2.819 a_DHA=162.198 symop: x,y,z a_YAH=139 705 1800 " H SER A 82 "<>" O SER A 154 " d_HA=1.812 d_AD=2.812 a_DHA=167.791 symop: x,y,z a_YAH=155 709 1838 " HG SER A 82 "<>" OH TYR A 156 " d_HA=2.848 d_AD=3.518 a_DHA=127.413 symop: x,y,z a_YAH=113 a_YAH=129 1575 2250 " HZ2 LYS A 138 "<>" OE1 GLU A 184 " d_HA=1.805 d_AD=2.827 a_DHA=173.189 symop: x,y,z a_YAH=90 1847 2250 " HH TYR A 156 "<>" OE1 GLU A 184 " d_HA=1.715 d_AD=2.680 a_DHA=168.271 symop: x,y,z a_YAH=109 2287 2317 " H LEU A 188 "<>" SG CYS A 186 " d_HA=2.474 d_AD=3.464 a_DHA=165.984 symop: x,y,z a_YAH=115 a_YAH=120 772 830 "HD22 ASN A 86 "<>" O PHE A 91 " d_HA=2.760 d_AD=3.619 a_DHA=143.709 symop: x,y,z a_YAH=144 737 1781 " H ASN A 84 "<>" O ASP A 152 " d_HA=1.976 d_AD=2.813 a_DHA=138.122 symop: x,y,z a_YAH=144 750 1781 " H VAL A 85 "<>" O ASP A 152 " d_HA=2.062 d_AD=3.024 a_DHA=156.914 symop: x,y,z a_YAH=145 742 1784 "HD22 ASN A 84 "<>" OD1 ASP A 152 " d_HA=2.276 d_AD=3.258 a_DHA=161.597 symop: x,y,z a_YAH=108 1613 1784 "HE21 GLN A 140 "<>" OD1 ASP A 152 " d_HA=1.828 d_AD=2.839 a_DHA=167.535 symop: x,y,z a_YAH=101 184 2404 " HZ3 LYS A 46 "<>" OD2 ASP A 194 " d_HA=1.780 d_AD=2.670 a_DHA=142.450 symop: x,y,z a_YAH=149 799 1772 " H SER A 88 "<>" OD1 ASP A 151 " d_HA=1.852 d_AD=2.813 a_DHA=155.985 symop: x,y,z a_YAH=145 746 1786 " H ASP A 152 "<>" O VAL A 85 " d_HA=1.865 d_AD=2.863 a_DHA=166.639 symop: x,y,z a_YAH=133 784 1758 " H PHE A 87 "<>" O SER A 150 " d_HA=1.859 d_AD=2.871 a_DHA=172.951 symop: x,y,z a_YAH=159 1647 1761 " H SER A 150 "<>" O ARG A 143 " d_HA=1.945 d_AD=2.876 a_DHA=151.479 symop: x,y,z a_YAH=141 1647 1774 " H ASP A 151 "<>" O ARG A 143 " d_HA=2.226 d_AD=3.228 a_DHA=169.994 symop: x,y,z a_YAH=139 1690 1735 "HD22 ASN A 148 "<>" O SER A 145 " d_HA=2.033 d_AD=2.949 a_DHA=149.111 symop: x,y,z a_YAH=169 1690 1730 " H ASN A 148 "<>" O SER A 145 " d_HA=2.254 d_AD=3.231 a_DHA=160.758 symop: x,y,z a_YAH=113 63 1719 " H GLY A 147 "<>" OD1 ASP A 39 " d_HA=1.807 d_AD=2.813 a_DHA=167.013 symop: x,y,z a_YAH=132 1693 1725 " H SER A 145 "<>" O ASN A 148 " d_HA=1.835 d_AD=2.843 a_DHA=172.284 symop: x,y,z a_YAH=160 30 3728 "HE22 GLN A 276 "<>" O LEU A 37 " d_HA=2.384 d_AD=3.291 a_DHA=148.446 symop: x,y,z a_YAH=148 35 1718 " H LEU A 37 "<>" O GLY A 147 " d_HA=2.730 d_AD=3.507 a_DHA=133.588 symop: x,y,z a_YAH=108 7158 7197 " H GLY B 221 "<>" O ASN B 218 " d_HA=1.926 d_AD=2.927 a_DHA=168.019 symop: x,y,z a_YAH=135 4123 4141 " HG SER A 304 "<>" OD1 ASN A 303 " d_HA=2.195 d_AD=3.129 a_DHA=161.782 symop: x,y,z a_YAH=164 8759 8772 " HZ2 LYS B 318 "<>" OXT PHE B 319 " d_HA=1.659 d_AD=2.656 a_DHA=163.278 symop: x,y,z a_YAH=167 7162 7188 " H ALA B 220 "<>" ND2 ASN B 218 " d_HA=2.643 d_AD=3.558 a_DHA=151.128 symop: x,y,z a_YAH=93 a_YAH=93 a_YAH=100 4129 3394 "HD21 ASN A 303 "<>" O LYS A 257 " d_HA=2.684 d_AD=3.642 a_DHA=159.726 symop: x,y,z a_YAH=124 1714 3762 " HE2 HIS A 146 "<>" O GLY A 279 " d_HA=1.988 d_AD=2.998 a_DHA=169.857 symop: x,y,z a_YAH=156 524 1240 " H VAL A 118 "<>" O PHE A 71 " d_HA=1.942 d_AD=2.925 a_DHA=161.273 symop: x,y,z a_YAH=159 561 1201 " H GLN A 73 "<>" O ARG A 116 " d_HA=2.303 d_AD=3.188 a_DHA=145.380 symop: x,y,z a_YAH=172 676 1530 " HH TYR A 136 "<>" OE2 GLU A 80 " d_HA=1.685 d_AD=2.668 a_DHA=172.133 symop: x,y,z a_YAH=126 1499 1896 " H THR A 159 "<>" O THR A 135 " d_HA=2.051 d_AD=3.022 a_DHA=159.509 symop: x,y,z a_YAH=141 1499 1907 " H GLY A 160 "<>" O THR A 135 " d_HA=2.026 d_AD=2.967 a_DHA=153.174 symop: x,y,z a_YAH=157 1503 1906 " H THR A 135 "<>" O GLY A 160 " d_HA=1.912 d_AD=2.889 a_DHA=160.547 symop: x,y,z a_YAH=133 671 1839 " H TYR A 156 "<>" O GLU A 80 " d_HA=1.876 d_AD=2.873 a_DHA=165.175 symop: x,y,z a_YAH=161 677 1830 " H GLU A 80 "<>" O TYR A 156 " d_HA=2.169 d_AD=3.151 a_DHA=163.303 symop: x,y,z a_YAH=138 1534 1857 " H LYS A 157 "<>" O ARG A 137 " d_HA=2.005 d_AD=2.999 a_DHA=165.231 symop: x,y,z a_YAH=150 1542 1851 " H ARG A 137 "<>" O LYS A 157 " d_HA=1.786 d_AD=2.787 a_DHA=168.100 symop: x,y,z a_YAH=157 1580 1816 " H ILE A 155 "<>" O TYR A 139 " d_HA=1.956 d_AD=2.939 a_DHA=162.530 symop: x,y,z a_YAH=161 1589 1811 " H TYR A 139 "<>" O ILE A 155 " d_HA=1.928 d_AD=2.931 a_DHA=168.332 symop: x,y,z a_YAH=162 172 1558 " H LYS A 46 "<>" O LYS A 138 " d_HA=1.915 d_AD=2.894 a_DHA=160.331 symop: x,y,z a_YAH=168 188 1564 " H LYS A 138 "<>" O GLY A 47 " d_HA=2.221 d_AD=3.191 a_DHA=159.403 symop: x,y,z a_YAH=149 166 230 " HE1 TRP A 50 "<>" O LYS A 46 " d_HA=1.903 d_AD=2.922 a_DHA=172.902 symop: x,y,z a_YAH=122 166 2382 " HG SER A 192 "<>" O LYS A 46 " d_HA=2.846 d_AD=3.721 a_DHA=151.310 symop: x,y,z a_YAH=113 1620 1793 " H ALA A 141 "<>" O GLY A 153 " d_HA=1.894 d_AD=2.897 a_DHA=167.327 symop: x,y,z a_YAH=158 140 1601 " H ILE A 44 "<>" O GLN A 140 " d_HA=1.911 d_AD=2.897 a_DHA=162.562 symop: x,y,z a_YAH=147 135 1607 " H GLN A 140 "<>" O ILE A 44 " d_HA=1.908 d_AD=2.900 a_DHA=164.212 symop: x,y,z a_YAH=148 154 2417 " H ILE A 195 "<>" O ASP A 45 " d_HA=1.976 d_AD=2.972 a_DHA=165.657 symop: x,y,z a_YAH=148 796 838 " H PHE A 91 "<>" O SER A 88 " d_HA=2.329 d_AD=3.304 a_DHA=161.310 symop: x,y,z a_YAH=134 1664 1773 "HH11 ARG A 143 "<>" OD2 ASP A 151 " d_HA=1.847 d_AD=2.842 a_DHA=163.170 symop: x,y,z a_YAH=113 1618 1794 " H GLY A 153 "<>" O ALA A 141 " d_HA=2.040 d_AD=3.019 a_DHA=161.178 symop: x,y,z a_YAH=157 1655 1769 " H ARG A 143 "<>" O ASP A 151 " d_HA=1.841 d_AD=2.832 a_DHA=163.285 symop: x,y,z a_YAH=135 98 1633 " H ILE A 142 "<>" O TYR A 42 " d_HA=1.811 d_AD=2.823 a_DHA=172.528 symop: x,y,z a_YAH=161 803 1773 " HG SER A 88 "<>" OD2 ASP A 151 " d_HA=1.756 d_AD=2.690 a_DHA=157.861 symop: x,y,z a_YAH=104 1697 1760 " HG SER A 145 "<>" OG SER A 150 " d_HA=2.093 d_AD=3.052 a_DHA=169.276 symop: x,y,z a_YAH=98 a_YAH=138 1765 1773 " HG SER A 150 "<>" OD2 ASP A 151 " d_HA=1.746 d_AD=2.729 a_DHA=175.697 symop: x,y,z a_YAH=125 72 1676 " H ILE A 144 "<>" O GLY A 40 " d_HA=1.977 d_AD=2.976 a_DHA=167.543 symop: x,y,z a_YAH=149 107 1628 " H TYR A 42 "<>" O ILE A 142 " d_HA=1.827 d_AD=2.842 a_DHA=178.834 symop: x,y,z a_YAH=158 3008 4104 " HZ1 LYS A 301 "<>" O TRP A 234 " d_HA=1.787 d_AD=2.799 a_DHA=173.148 symop: x,y,z a_YAH=138 4106 4110 " HZ3 LYS A 301 "<>" O ALA A 302 " d_HA=1.825 d_AD=2.687 a_DHA=140.305 symop: x,y,z a_YAH=161 60 3675 " HZ1 LYS A 273 "<>" O ASP A 39 " d_HA=1.867 d_AD=2.724 a_DHA=139.904 symop: x,y,z a_YAH=141 64 1708 " H HIS A 146 "<>" OD2 ASP A 39 " d_HA=1.842 d_AD=2.766 a_DHA=148.909 symop: x,y,z a_YAH=115 65 3719 " H ASP A 39 "<>" OE1 GLN A 276 " d_HA=1.834 d_AD=2.825 a_DHA=164.257 symop: x,y,z a_YAH=129 73 1671 " H GLY A 40 "<>" O ILE A 144 " d_HA=2.100 d_AD=3.036 a_DHA=152.261 symop: x,y,z a_YAH=129 49 115 " HH TYR A 42 "<>" O SER A 38 " d_HA=1.714 d_AD=2.682 a_DHA=173.350 symop: x,y,z a_YAH=110 51 3677 " HZ3 LYS A 273 "<>" OG SER A 38 " d_HA=2.071 d_AD=2.981 a_DHA=148.707 symop: x,y,z a_YAH=137 a_YAH=90 106 3677 " HZ3 LYS A 273 "<>" OH TYR A 42 " d_HA=2.242 d_AD=2.920 a_DHA=123.195 symop: x,y,z a_YAH=148 a_YAH=94 7621 7654 "HE21 GLN B 249 "<>" O THR B 247 " d_HA=1.982 d_AD=2.975 a_DHA=164.455 symop: x,y,z a_YAH=151 7646 8760 " HZ3 LYS B 318 "<>" OE1 GLN B 249 " d_HA=1.867 d_AD=2.863 a_DHA=164.588 symop: x,y,z a_YAH=170 7104 7150 " H SER B 217 "<>" O ALA B 214 " d_HA=2.217 d_AD=3.116 a_DHA=146.985 symop: x,y,z a_YAH=103 7104 7154 " HG SER B 217 "<>" O ALA B 214 " d_HA=1.660 d_AD=2.637 a_DHA=175.491 symop: x,y,z a_YAH=147 7114 7163 " H ASN B 218 "<>" O LEU B 215 " d_HA=2.239 d_AD=3.161 a_DHA=150.573 symop: x,y,z a_YAH=112 3454 4130 "HD22 ASN A 303 "<>" OD1 ASP A 260 " d_HA=1.829 d_AD=2.841 a_DHA=167.898 symop: x,y,z a_YAH=120 3454 3763 " H GLY A 279 "<>" OD1 ASP A 260 " d_HA=1.878 d_AD=2.897 a_DHA=177.704 symop: x,y,z a_YAH=150 3456 4088 " H ASP A 260 "<>" O LYS A 301 " d_HA=2.133 d_AD=2.917 a_DHA=133.053 symop: x,y,z a_YAH=173 7203 8748 " H LYS B 318 "<>" O ASN B 222 " d_HA=1.872 d_AD=2.850 a_DHA=159.914 symop: x,y,z a_YAH=122 7245 8705 " H TYR B 224 "<>" O PHE B 316 " d_HA=1.895 d_AD=2.885 a_DHA=163.927 symop: x,y,z a_YAH=152 3416 4125 " H ASN A 303 "<>" O ILE A 258 " d_HA=1.910 d_AD=2.859 a_DHA=154.338 symop: x,y,z a_YAH=122 3439 3383 " H VAL A 259 "<>" O SER A 256 " d_HA=1.923 d_AD=2.782 a_DHA=140.248 symop: x,y,z a_YAH=145 3471 3732 " H PHE A 261 "<>" O SER A 277 " d_HA=1.933 d_AD=2.937 a_DHA=169.378 symop: x,y,z a_YAH=145 7659 8773 " H PHE B 319 "<>" O LYS B 250 " d_HA=1.932 d_AD=2.939 a_DHA=172.399 symop: x,y,z a_YAH=151 7710 8725 " H ARG B 252 "<>" O GLN B 317 " d_HA=1.853 d_AD=2.860 a_DHA=170.183 symop: x,y,z a_YAH=135 8731 7702 " H GLN B 317 "<>" O ARG B 252 " d_HA=1.960 d_AD=2.895 a_DHA=151.586 symop: x,y,z a_YAH=154 604 1165 " HG1 THR A 113 "<>" OG1 THR A 76 " d_HA=1.880 d_AD=2.815 a_DHA=160.498 symop: x,y,z a_YAH=115 a_YAH=124 555 1209 " H ARG A 116 "<>" O GLN A 73 " d_HA=2.123 d_AD=3.132 a_DHA=169.560 symop: x,y,z a_YAH=161 572 567 "HE21 GLN A 73 "<>" O SER A 74 " d_HA=1.864 d_AD=2.858 a_DHA=166.320 symop: x,y,z a_YAH=141 579 1191 " HG SER A 74 "<>" OE2 GLU A 115 " d_HA=2.550 d_AD=3.447 a_DHA=153.364 symop: x,y,z a_YAH=140 588 1172 " H LEU A 75 "<>" O THR A 114 " d_HA=1.944 d_AD=2.912 a_DHA=158.750 symop: x,y,z a_YAH=129 583 1176 " H THR A 114 "<>" O LEU A 75 " d_HA=1.849 d_AD=2.831 a_DHA=161.159 symop: x,y,z a_YAH=154 622 1144 " H LYS A 77 "<>" O ASN A 112 " d_HA=2.036 d_AD=3.023 a_DHA=162.457 symop: x,y,z a_YAH=164 1186 1217 " HE ARG A 116 "<>" O GLU A 115 " d_HA=1.869 d_AD=2.779 a_DHA=147.263 symop: x,y,z a_YAH=142 655 1112 " H LYS A 79 "<>" O GLU A 110 " d_HA=1.881 d_AD=2.797 a_DHA=148.229 symop: x,y,z a_YAH=138 616 1149 " H ASN A 112 "<>" O LYS A 77 " d_HA=1.952 d_AD=2.961 a_DHA=170.392 symop: x,y,z a_YAH=165 1154 1873 "HD22 ASN A 112 "<>" O LEU A 158 " d_HA=1.771 d_AD=2.777 a_DHA=170.929 symop: x,y,z a_YAH=164 1219 1892 "HH12 ARG A 116 "<>" O THR A 159 " d_HA=1.813 d_AD=2.754 a_DHA=151.828 symop: x,y,z a_YAH=147 665 1116 " HZ1 LYS A 79 "<>" OE1 GLU A 110 " d_HA=1.826 d_AD=2.829 a_DHA=166.200 symop: x,y,z a_YAH=175 871 880 " HG SER A 93 "<>" OE2 GLU A 94 " d_HA=2.372 d_AD=3.144 a_DHA=136.132 symop: y,z,x a_YAH=127 198 1899 " HG1 THR A 159 "<>" OD1 ASP A 48 " d_HA=1.720 d_AD=2.691 a_DHA=168.913 symop: x,y,z a_YAH=113 198 1551 "HH11 ARG A 137 "<>" OD1 ASP A 48 " d_HA=2.039 d_AD=2.984 a_DHA=153.652 symop: x,y,z a_YAH=93 864 935 " H GLN A 97 "<>" O SER A 93 " d_HA=2.103 d_AD=3.102 a_DHA=166.857 symop: x,y,z a_YAH=153 864 915 " H ILE A 96 "<>" O SER A 93 " d_HA=2.664 d_AD=3.324 a_DHA=122.699 symop: x,y,z a_YAH=101 157 189 " H GLY A 47 "<>" OD1 ASP A 45 " d_HA=1.885 d_AD=2.851 a_DHA=157.101 symop: x,y,z a_YAH=130 158 1553 "HH21 ARG A 137 "<>" OD2 ASP A 45 " d_HA=1.705 d_AD=2.703 a_DHA=162.331 symop: x,y,z a_YAH=126 823 854 " H THR A 92 "<>" O GLY A 90 " d_HA=2.407 d_AD=3.081 a_DHA=123.276 symop: x,y,z a_YAH=108 852 898 " H PHE A 95 "<>" OG1 THR A 92 " d_HA=2.288 d_AD=3.268 a_DHA=161.930 symop: x,y,z a_YAH=129 a_YAH=97 857 879 " HG1 THR A 92 "<>" OE1 GLU A 94 " d_HA=1.624 d_AD=2.605 a_DHA=169.743 symop: x,y,z a_YAH=139 850 915 " H ILE A 96 "<>" O THR A 92 " d_HA=2.135 d_AD=3.067 a_DHA=151.691 symop: x,y,z a_YAH=151 875 948 " H ALA A 98 "<>" O GLU A 94 " d_HA=1.774 d_AD=2.785 a_DHA=173.378 symop: x,y,z a_YAH=165 890 959 " H SER A 99 "<>" O PHE A 95 " d_HA=2.034 d_AD=2.998 a_DHA=158.077 symop: x,y,z a_YAH=138 890 963 " HG SER A 99 "<>" O PHE A 95 " d_HA=1.756 d_AD=2.699 a_DHA=161.073 symop: x,y,z a_YAH=154 910 971 " H VAL A 100 "<>" O ILE A 96 " d_HA=2.142 d_AD=3.123 a_DHA=161.292 symop: x,y,z a_YAH=149 159 2412 " H ASP A 45 "<>" O ILE A 195 " d_HA=2.030 d_AD=3.001 a_DHA=159.239 symop: x,y,z a_YAH=142 123 2446 " H VAL A 43 "<>" O LYS A 197 " d_HA=1.918 d_AD=2.928 a_DHA=172.007 symop: x,y,z a_YAH=150 119 2452 " H LYS A 197 "<>" O VAL A 43 " d_HA=1.914 d_AD=2.851 a_DHA=151.589 symop: x,y,z a_YAH=162 1663 2525 " HE ARG A 143 "<>" OD2 ASP A 201 " d_HA=1.778 d_AD=2.792 a_DHA=173.523 symop: x,y,z a_YAH=116 1666 2524 "HH21 ARG A 143 "<>" OD1 ASP A 201 " d_HA=1.780 d_AD=2.803 a_DHA=175.626 symop: x,y,z a_YAH=116 2524 2554 " H ALA A 203 "<>" OD1 ASP A 201 " d_HA=2.152 d_AD=3.137 a_DHA=163.337 symop: x,y,z a_YAH=132 2525 3080 " HZ2 LYS A 237 "<>" OD2 ASP A 201 " d_HA=1.731 d_AD=2.734 a_DHA=165.566 symop: x,y,z a_YAH=135 79 2488 " H ILE A 199 "<>" O LEU A 41 " d_HA=1.948 d_AD=2.925 a_DHA=159.749 symop: x,y,z a_YAH=173 7095 7604 " HG1 THR B 245 "<>" OD1 ASP B 213 " d_HA=2.543 d_AD=3.372 a_DHA=143.446 symop: x,y,z a_YAH=149 3090 4071 " H LEU A 238 "<>" O MET A 300 " d_HA=1.936 d_AD=2.948 a_DHA=173.563 symop: x,y,z a_YAH=163 2472 3676 " HZ2 LYS A 273 "<>" OE1 GLU A 198 " d_HA=1.765 d_AD=2.784 a_DHA=174.479 symop: x,y,z a_YAH=98 2473 3533 " HH TYR A 264 "<>" OE2 GLU A 198 " d_HA=1.620 d_AD=2.605 a_DHA=175.930 symop: x,y,z a_YAH=138 7636 8347 " H GLY B 248 "<>" OD1 ASP B 292 " d_HA=1.724 d_AD=2.700 a_DHA=158.871 symop: x,y,z a_YAH=129 7078 7138 " H ASN B 216 "<>" O THR B 212 " d_HA=2.025 d_AD=3.010 a_DHA=162.770 symop: x,y,z a_YAH=151 7080 7698 " HH TYR B 251 "<>" OG1 THR B 212 " d_HA=2.913 d_AD=3.732 a_DHA=143.966 symop: x,y,z a_YAH=147 a_YAH=95 7059 7119 " H LEU B 215 "<>" O LEU B 211 " d_HA=1.893 d_AD=2.870 a_DHA=160.663 symop: x,y,z a_YAH=148 4112 4252 " H ALA A 302 "<>" OH TYR A 312 " d_HA=2.058 d_AD=2.956 a_DHA=146.955 symop: x,y,z a_YAH=124 a_YAH=120 3451 4094 " H LYS A 301 "<>" O ASP A 260 " d_HA=1.964 d_AD=2.952 a_DHA=161.763 symop: x,y,z a_YAH=158 3463 3735 " H SER A 277 "<>" O PHE A 261 " d_HA=1.840 d_AD=2.840 a_DHA=166.618 symop: x,y,z a_YAH=170 3483 4059 " H VAL A 299 "<>" O ASN A 262 " d_HA=1.896 d_AD=2.862 a_DHA=157.461 symop: x,y,z a_YAH=169 3488 4055 " H ASN A 262 "<>" O VAL A 299 " d_HA=1.927 d_AD=2.918 a_DHA=163.868 symop: x,y,z a_YAH=152 3497 3686 " H LEU A 274 "<>" O ILE A 263 " d_HA=1.911 d_AD=2.853 a_DHA=153.373 symop: x,y,z a_YAH=158 3497 3706 " H GLU A 275 "<>" O ILE A 263 " d_HA=2.396 d_AD=3.364 a_DHA=160.073 symop: x,y,z a_YAH=137 3502 3700 " H ILE A 263 "<>" O GLU A 275 " d_HA=1.934 d_AD=2.937 a_DHA=167.336 symop: x,y,z a_YAH=155 7642 8330 " H LEU B 291 "<>" O GLN B 249 " d_HA=1.892 d_AD=2.888 a_DHA=166.124 symop: x,y,z a_YAH=156 7648 8325 " H GLN B 249 "<>" O LEU B 291 " d_HA=2.814 d_AD=3.561 a_DHA=131.066 symop: x,y,z a_YAH=134 7236 8713 " H PHE B 316 "<>" O TYR B 224 " d_HA=1.949 d_AD=2.927 a_DHA=160.666 symop: x,y,z a_YAH=159 7690 8295 " H TYR B 251 "<>" O ILE B 289 " d_HA=1.832 d_AD=2.847 a_DHA=177.142 symop: x,y,z a_YAH=154 7280 8667 " H TRP B 226 "<>" O ILE B 314 " d_HA=1.902 d_AD=2.887 a_DHA=162.244 symop: x,y,z a_YAH=152 667 1117 " HZ3 LYS A 79 "<>" OE2 GLU A 110 " d_HA=1.724 d_AD=2.689 a_DHA=155.494 symop: z,x,y a_YAH=121 942 1117 "HE22 GLN A 97 "<>" OE2 GLU A 110 " d_HA=1.848 d_AD=2.866 a_DHA=173.480 symop: z,x,y a_YAH=138 1072 1869 " HZ3 LYS A 157 "<>" O THR A 107 " d_HA=2.433 d_AD=3.084 a_DHA=121.404 symop: x,y,z a_YAH=144 1086 1868 " HZ2 LYS A 157 "<>" O ILE A 108 " d_HA=1.730 d_AD=2.745 a_DHA=172.857 symop: x,y,z a_YAH=124 941 988 "HE21 GLN A 97 "<>" OE2 GLU A 101 " d_HA=2.380 d_AD=3.239 a_DHA=142.293 symop: x,y,z a_YAH=113 988 1091 " H ILE A 108 "<>" OE2 GLU A 101 " d_HA=1.744 d_AD=2.765 a_DHA=174.827 symop: x,y,z a_YAH=119 988 1106 " H GLY A 109 "<>" OE2 GLU A 101 " d_HA=2.954 d_AD=3.844 a_DHA=146.960 symop: x,y,z a_YAH=165 929 989 " H GLU A 101 "<>" O GLN A 97 " d_HA=1.831 d_AD=2.839 a_DHA=170.491 symop: x,y,z a_YAH=165 946 1007 " H TYR A 102 "<>" O ALA A 98 " d_HA=1.926 d_AD=2.891 a_DHA=157.228 symop: x,y,z a_YAH=146 956 1020 " H GLY A 103 "<>" O SER A 99 " d_HA=1.938 d_AD=2.927 a_DHA=163.338 symop: x,y,z a_YAH=145 967 1034 " H PHE A 104 "<>" O VAL A 100 " d_HA=2.031 d_AD=3.026 a_DHA=165.699 symop: x,y,z a_YAH=152 6437 6453 " HG SER B 170 "<>" OD1 ASP B 169 " d_HA=2.922 d_AD=3.816 a_DHA=153.749 symop: x,y,z a_YAH=119 6437 6493 "HD22 ASN B 173 "<>" OD1 ASP B 169 " d_HA=1.707 d_AD=2.710 a_DHA=164.955 symop: x,y,z a_YAH=114 6448 6477 " H GLY B 172 "<>" OG SER B 170 " d_HA=2.917 d_AD=3.615 a_DHA=126.992 symop: x,y,z a_YAH=100 a_YAH=141 2521 2564 " H ALA A 204 "<>" O ASP A 201 " d_HA=1.985 d_AD=2.943 a_DHA=156.515 symop: x,y,z a_YAH=126 7578 8367 " H GLY B 294 "<>" O ILE B 244 " d_HA=1.994 d_AD=2.938 a_DHA=153.615 symop: x,y,z a_YAH=138 7583 8366 " H ILE B 244 "<>" O GLY B 294 " d_HA=1.981 d_AD=2.944 a_DHA=157.176 symop: x,y,z a_YAH=157 7048 7082 " H THR B 212 "<>" OD1 ASN B 210 " d_HA=2.442 d_AD=3.138 a_DHA=125.330 symop: x,y,z a_YAH=161 7048 7097 " H ASP B 213 "<>" OD1 ASN B 210 " d_HA=2.223 d_AD=3.233 a_DHA=172.862 symop: x,y,z a_YAH=120 7064 7564 " H LEU B 211 "<>" O THR B 243 " d_HA=1.902 d_AD=2.890 a_DHA=163.568 symop: x,y,z a_YAH=162 7026 7568 " H THR B 243 "<>" O LEU B 209 " d_HA=2.053 d_AD=3.046 a_DHA=165.205 symop: x,y,z a_YAH=151 7045 7106 " H ALA B 214 "<>" O ASN B 210 " d_HA=2.273 d_AD=3.213 a_DHA=153.709 symop: x,y,z a_YAH=135 3085 4076 " H MET A 300 "<>" O LEU A 238 " d_HA=1.928 d_AD=2.921 a_DHA=164.590 symop: x,y,z a_YAH=154 4036 3123 " H LEU A 240 "<>" O LEU A 298 " d_HA=1.902 d_AD=2.879 a_DHA=160.431 symop: x,y,z a_YAH=139 4041 3118 " H LEU A 298 "<>" O LEU A 240 " d_HA=1.819 d_AD=2.823 a_DHA=169.548 symop: x,y,z a_YAH=151 3516 4024 " H VAL A 297 "<>" O TYR A 264 " d_HA=1.861 d_AD=2.844 a_DHA=161.274 symop: x,y,z a_YAH=142 3525 4020 " H TYR A 264 "<>" O VAL A 297 " d_HA=1.924 d_AD=2.881 a_DHA=156.249 symop: x,y,z a_YAH=149 3540 3643 " H SER A 265 "<>" O VAL A 272 " d_HA=1.832 d_AD=2.800 a_DHA=157.921 symop: x,y,z a_YAH=163 8344 8407 " HH TYR B 296 "<>" O ASP B 292 " d_HA=1.686 d_AD=2.661 a_DHA=175.718 symop: x,y,z a_YAH=127 2889 4276 " H TRP A 226 "<>" O ILE A 314 " d_HA=1.900 d_AD=2.880 a_DHA=161.223 symop: x,y,z a_YAH=154 7269 8672 " H ILE B 314 "<>" O TRP B 226 " d_HA=2.026 d_AD=3.023 a_DHA=165.724 symop: x,y,z a_YAH=148 7320 8635 " H SER B 228 "<>" O TYR B 312 " d_HA=1.986 d_AD=2.960 a_DHA=161.152 symop: x,y,z a_YAH=154 2920 4230 "HH12 ARG A 227 "<>" O PRO A 311 " d_HA=1.854 d_AD=2.839 a_DHA=164.451 symop: x,y,z a_YAH=109 2922 4230 "HH22 ARG A 227 "<>" O PRO A 311 " d_HA=2.381 d_AD=3.248 a_DHA=143.901 symop: x,y,z a_YAH=138 2878 4281 " H ILE A 314 "<>" O TRP A 226 " d_HA=2.013 d_AD=3.012 a_DHA=166.270 symop: x,y,z a_YAH=149 645 987 " HG SER A 78 "<>" OE1 GLU A 101 " d_HA=1.613 d_AD=2.586 a_DHA=165.977 symop: y,z,x a_YAH=119 998 1047 " H GLY A 105 "<>" O TYR A 102 " d_HA=2.623 d_AD=3.498 a_DHA=144.755 symop: x,y,z a_YAH=93 6446 6488 " H ASN B 173 "<>" O SER B 170 " d_HA=2.269 d_AD=3.154 a_DHA=145.373 symop: x,y,z a_YAH=112 3596 3629 " H LEU A 271 "<>" O ASN A 269 " d_HA=2.415 d_AD=3.104 a_DHA=124.847 symop: x,y,z a_YAH=110 6457 6502 " H ILE B 174 "<>" O LEU B 171 " d_HA=2.461 d_AD=3.445 a_DHA=164.078 symop: x,y,z a_YAH=108 6516 6555 " H SER B 178 "<>" O ASP B 175 " d_HA=2.702 d_AD=3.446 a_DHA=130.091 symop: x,y,z a_YAH=101 6516 6559 " HG SER B 178 "<>" O ASP B 175 " d_HA=1.655 d_AD=2.631 a_DHA=171.692 symop: x,y,z a_YAH=160 6519 6546 " H GLY B 177 "<>" OD1 ASP B 175 " d_HA=2.079 d_AD=2.819 a_DHA=127.976 symop: x,y,z a_YAH=142 6519 7571 " HG1 THR B 243 "<>" OD1 ASP B 175 " d_HA=2.533 d_AD=3.501 a_DHA=177.017 symop: z,x,y a_YAH=144 3537 3647 " H VAL A 272 "<>" O SER A 265 " d_HA=1.840 d_AD=2.850 a_DHA=172.576 symop: x,y,z a_YAH=143 7956 8379 " H GLN B 295 "<>" OD1 ASN B 267 " d_HA=1.884 d_AD=2.896 a_DHA=175.518 symop: x,y,z a_YAH=121 6541 7956 "HE22 GLN B 176 "<>" OD1 ASN B 267 " d_HA=1.966 d_AD=2.935 a_DHA=158.872 symop: z,x,y a_YAH=136 7566 8386 "HE22 GLN B 295 "<>" OG1 THR B 243 " d_HA=2.913 d_AD=3.779 a_DHA=144.337 symop: x,y,z a_YAH=113 a_YAH=120 7031 7528 " H LEU B 209 "<>" O HIS B 241 " d_HA=2.048 d_AD=3.020 a_DHA=159.281 symop: x,y,z a_YAH=166 3999 3159 " H LEU A 242 "<>" O TYR A 296 " d_HA=1.942 d_AD=2.853 a_DHA=148.201 symop: x,y,z a_YAH=117 3999 3994 "HE21 GLN A 295 "<>" O TYR A 296 " d_HA=2.851 d_AD=3.756 a_DHA=150.273 symop: x,y,z a_YAH=145 3553 3982 " H ASN A 266 "<>" O GLN A 295 " d_HA=1.875 d_AD=2.848 a_DHA=159.708 symop: x,y,z a_YAH=140 4008 3154 " H TYR A 296 "<>" O LEU A 242 " d_HA=1.850 d_AD=2.823 a_DHA=159.405 symop: x,y,z a_YAH=162 3539 3567 " H ASN A 267 "<>" OG SER A 265 " d_HA=2.649 d_AD=3.651 a_DHA=172.627 symop: x,y,z a_YAH=132 a_YAH=103 3539 3572 "HD22 ASN A 267 "<>" OG SER A 265 " d_HA=2.568 d_AD=3.406 a_DHA=140.875 symop: x,y,z a_YAH=136 a_YAH=97 7930 7963 "HD22 ASN B 267 "<>" OG SER B 265 " d_HA=2.449 d_AD=3.312 a_DHA=143.724 symop: x,y,z a_YAH=137 a_YAH=99 7930 7958 " H ASN B 267 "<>" OG SER B 265 " d_HA=2.668 d_AD=3.668 a_DHA=171.072 symop: x,y,z a_YAH=132 a_YAH=102 7944 8373 " H ASN B 266 "<>" O GLN B 295 " d_HA=1.879 d_AD=2.858 a_DHA=160.696 symop: x,y,z a_YAH=145 7545 8399 " H TYR B 296 "<>" O LEU B 242 " d_HA=1.882 d_AD=2.850 a_DHA=158.139 symop: x,y,z a_YAH=149 7550 8390 " H LEU B 242 "<>" O TYR B 296 " d_HA=1.855 d_AD=2.830 a_DHA=160.262 symop: x,y,z a_YAH=123 8385 8390 "HE21 GLN B 295 "<>" O TYR B 296 " d_HA=2.576 d_AD=3.549 a_DHA=163.018 symop: x,y,z a_YAH=141 6987 7535 " H HIS B 241 "<>" O GLU B 207 " d_HA=1.968 d_AD=2.919 a_DHA=154.354 symop: x,y,z a_YAH=161 7509 8432 " H LEU B 298 "<>" O LEU B 240 " d_HA=1.820 d_AD=2.829 a_DHA=171.665 symop: x,y,z a_YAH=147 6991 7331 " H SER B 229 "<>" OE1 GLU B 207 " d_HA=1.778 d_AD=2.798 a_DHA=178.616 symop: x,y,z a_YAH=107 6991 7335 " HG SER B 229 "<>" OE1 GLU B 207 " d_HA=2.350 d_AD=3.214 a_DHA=148.382 symop: x,y,z a_YAH=120 6992 7344 " H ASN B 230 "<>" OE2 GLU B 207 " d_HA=2.148 d_AD=3.114 a_DHA=157.819 symop: x,y,z a_YAH=135 6992 7349 "HD22 ASN B 230 "<>" OE2 GLU B 207 " d_HA=2.674 d_AD=3.568 a_DHA=147.918 symop: x,y,z a_YAH=119 6992 7381 " HH TYR B 232 "<>" OE2 GLU B 207 " d_HA=1.645 d_AD=2.617 a_DHA=169.768 symop: x,y,z a_YAH=120 3354 4300 " H LEU A 315 "<>" O LEU A 254 " d_HA=1.972 d_AD=2.955 a_DHA=162.140 symop: x,y,z a_YAH=158 3359 4295 " H LEU A 254 "<>" O LEU A 315 " d_HA=1.951 d_AD=2.942 a_DHA=164.524 symop: x,y,z a_YAH=149 3375 3838 " H ALA A 255 "<>" O HIS A 285 " d_HA=1.894 d_AD=2.908 a_DHA=175.064 symop: x,y,z a_YAH=168 3335 3880 " H VAL A 287 "<>" O ILE A 253 " d_HA=2.226 d_AD=3.155 a_DHA=151.550 symop: x,y,z a_YAH=145 4016 3953 " HH TYR A 296 "<>" O ASP A 292 " d_HA=1.696 d_AD=2.669 a_DHA=175.424 symop: x,y,z a_YAH=124 7907 8415 " H VAL B 297 "<>" O TYR B 264 " d_HA=1.883 d_AD=2.872 a_DHA=162.829 symop: x,y,z a_YAH=144 7931 8034 " H SER B 265 "<>" O VAL B 272 " d_HA=1.844 d_AD=2.814 a_DHA=158.316 symop: x,y,z a_YAH=162 8411 7916 " H TYR B 264 "<>" O VAL B 297 " d_HA=1.940 d_AD=2.902 a_DHA=157.179 symop: x,y,z a_YAH=150 7514 8427 " H LEU B 240 "<>" O LEU B 298 " d_HA=1.908 d_AD=2.882 a_DHA=159.767 symop: x,y,z a_YAH=137 7319 8644 " H TYR B 312 "<>" OG SER B 228 " d_HA=2.238 d_AD=3.010 a_DHA=131.875 symop: x,y,z a_YAH=125 a_YAH=123 7324 7339 " HG SER B 228 "<>" O ASN B 230 " d_HA=1.814 d_AD=2.707 a_DHA=150.133 symop: x,y,z a_YAH=151 567 572 "HE21 GLN A 73 "<>" O SER A 74 " d_HA=1.864 d_AD=2.858 a_DHA=166.320 symop: x,y,z a_YAH=141 5692 5733 " H GLU B 126 "<>" O GLY B 123 " d_HA=2.726 d_AD=3.682 a_DHA=157.718 symop: x,y,z a_YAH=109 5751 6424 " H TYR B 127 "<>" O ALA B 168 " d_HA=1.746 d_AD=2.753 a_DHA=173.525 symop: x,y,z a_YAH=169 5731 6420 " HG SER B 167 "<>" OE1 GLU B 126 " d_HA=1.652 d_AD=2.628 a_DHA=167.015 symop: x,y,z a_YAH=158 4804 5767 " H VAL B 128 "<>" O LEU B 63 " d_HA=1.939 d_AD=2.938 a_DHA=166.424 symop: x,y,z a_YAH=150 5742 6426 " H ALA B 168 "<>" O TYR B 127 " d_HA=2.013 d_AD=2.988 a_DHA=160.156 symop: x,y,z a_YAH=152 5788 6399 " H TYR B 129 "<>" O THR B 166 " d_HA=1.978 d_AD=2.976 a_DHA=167.381 symop: x,y,z a_YAH=150 6528 6568 " H LEU B 179 "<>" O GLN B 176 " d_HA=2.416 d_AD=3.209 a_DHA=134.712 symop: x,y,z a_YAH=103 6545 6587 " H ILE B 180 "<>" O GLY B 177 " d_HA=2.146 d_AD=3.134 a_DHA=164.823 symop: x,y,z a_YAH=110 6545 7019 "HH11 ARG B 208 "<>" O GLY B 177 " d_HA=2.030 d_AD=2.934 a_DHA=147.391 symop: z,x,y a_YAH=152 6552 7020 "HH12 ARG B 208 "<>" O SER B 178 " d_HA=2.058 d_AD=2.939 a_DHA=144.524 symop: z,x,y a_YAH=120 2141 3584 " H PHE A 268 "<>" OE1 GLN A 176 " d_HA=1.815 d_AD=2.830 a_DHA=177.818 symop: y,z,x a_YAH=141 3548 3601 " H ASN A 269 "<>" O ASN A 266 " d_HA=2.376 d_AD=3.267 a_DHA=146.506 symop: x,y,z a_YAH=130 3562 3615 " H ASN A 270 "<>" O ASN A 267 " d_HA=2.113 d_AD=3.067 a_DHA=156.337 symop: x,y,z a_YAH=120 3562 3620 "HD22 ASN A 270 "<>" O ASN A 267 " d_HA=2.754 d_AD=3.551 a_DHA=136.684 symop: x,y,z a_YAH=151 6532 7975 " H PHE B 268 "<>" OE1 GLN B 176 " d_HA=1.805 d_AD=2.821 a_DHA=177.119 symop: z,x,y a_YAH=140 2150 3565 "HE22 GLN A 176 "<>" OD1 ASN A 267 " d_HA=1.974 d_AD=2.942 a_DHA=158.506 symop: y,z,x a_YAH=136 3565 3988 " H GLN A 295 "<>" OD1 ASN A 267 " d_HA=1.860 d_AD=2.872 a_DHA=174.702 symop: x,y,z a_YAH=120 7953 8011 "HD22 ASN B 270 "<>" O ASN B 267 " d_HA=2.379 d_AD=3.269 a_DHA=146.843 symop: x,y,z a_YAH=152 7953 8006 " H ASN B 270 "<>" O ASN B 267 " d_HA=2.100 d_AD=3.070 a_DHA=159.944 symop: x,y,z a_YAH=117 7939 7992 " H ASN B 269 "<>" O ASN B 266 " d_HA=2.300 d_AD=3.202 a_DHA=147.843 symop: x,y,z a_YAH=132 6993 7495 " H GLU B 207 "<>" O ASN B 239 " d_HA=1.957 d_AD=2.966 a_DHA=169.542 symop: x,y,z a_YAH=166 3373 3845 " H HIS A 285 "<>" O ALA A 255 " d_HA=2.394 d_AD=3.339 a_DHA=154.813 symop: x,y,z a_YAH=143 3975 3192 " H ILE A 244 "<>" O GLY A 294 " d_HA=1.967 d_AD=2.968 a_DHA=167.496 symop: x,y,z a_YAH=161 3976 3187 " H GLY A 294 "<>" O ILE A 244 " d_HA=1.899 d_AD=2.859 a_DHA=156.678 symop: x,y,z a_YAH=141 7928 8038 " H VAL B 272 "<>" O SER B 265 " d_HA=1.838 d_AD=2.844 a_DHA=170.816 symop: x,y,z a_YAH=147 6963 7500 " H ASN B 239 "<>" O ALA B 205 " d_HA=1.843 d_AD=2.858 a_DHA=175.568 symop: x,y,z a_YAH=159 3383 3439 " H VAL A 259 "<>" O SER A 256 " d_HA=1.923 d_AD=2.782 a_DHA=140.248 symop: x,y,z a_YAH=145 3385 3421 " H ILE A 258 "<>" OG SER A 256 " d_HA=2.732 d_AD=3.734 a_DHA=174.673 symop: x,y,z a_YAH=104 a_YAH=106 3734 3849 " HD1 HIS A 285 "<>" OG SER A 277 " d_HA=1.947 d_AD=2.953 a_DHA=170.337 symop: x,y,z a_YAH=115 a_YAH=137 559 4861 "HD22 ASN B 66 "<>" OE1 GLN A 73 " d_HA=2.134 d_AD=2.984 a_DHA=139.873 symop: y-1/2,-z+3/2,-x+2 a_YAH=110 5693 5732 " H GLY B 123 "<>" OE2 GLU B 126 " d_HA=1.950 d_AD=2.920 a_DHA=157.943 symop: x,y,z a_YAH=107 4823 4871 " H GLU B 67 "<>" O ASN B 64 " d_HA=2.047 d_AD=3.023 a_DHA=160.613 symop: x,y,z a_YAH=146 4856 5692 " H ASN B 66 "<>" O GLY B 123 " d_HA=2.082 d_AD=2.991 a_DHA=148.049 symop: x,y,z a_YAH=114 4856 5682 " H ASN B 66 "<>" O ALA B 122 " d_HA=2.493 d_AD=3.148 a_DHA=121.861 symop: x,y,z a_YAH=101 4865 5684 " H ALA B 122 "<>" O GLU B 67 " d_HA=2.031 d_AD=3.001 a_DHA=159.015 symop: x,y,z a_YAH=147 4870 362 " HG SER A 59 "<>" OE2 GLU B 67 " d_HA=1.589 d_AD=2.586 a_DHA=177.626 symop: -z+2,x+1/2,-y+3/2 a_YAH=170 389 4869 "HE21 GLN A 61 "<>" OE1 GLU B 67 " d_HA=1.733 d_AD=2.721 a_DHA=162.104 symop: y-1/2,-z+3/2,-x+2 a_YAH=138 390 4785 "HE22 GLN A 61 "<>" O ILE B 62 " d_HA=1.793 d_AD=2.777 a_DHA=161.409 symop: y-1/2,-z+3/2,-x+2 a_YAH=147 4828 4869 " H ASN B 64 "<>" OE1 GLU B 67 " d_HA=2.042 d_AD=2.995 a_DHA=155.450 symop: x,y,z a_YAH=138 4809 5763 " H LEU B 63 "<>" O VAL B 128 " d_HA=1.859 d_AD=2.844 a_DHA=162.976 symop: x,y,z a_YAH=152 5779 6403 " H THR B 166 "<>" O TYR B 129 " d_HA=1.967 d_AD=2.958 a_DHA=163.560 symop: x,y,z a_YAH=162 381 399 " H ILE A 62 "<>" OE1 GLN A 61 " d_HA=1.912 d_AD=2.796 a_DHA=143.158 symop: x,y,z a_YAH=143 4768 5809 " H TYR B 130 "<>" O GLN B 61 " d_HA=1.879 d_AD=2.884 a_DHA=168.530 symop: x,y,z a_YAH=154 4774 5800 " H GLN B 61 "<>" O TYR B 130 " d_HA=1.824 d_AD=2.823 a_DHA=167.780 symop: x,y,z a_YAH=167 5827 6366 " H LYS B 131 "<>" O SER B 164 " d_HA=1.856 d_AD=2.856 a_DHA=167.852 symop: x,y,z a_YAH=154 6605 6668 " HE ARG B 185 "<>" OE1 GLU B 181 " d_HA=1.749 d_AD=2.771 a_DHA=174.131 symop: x,y,z a_YAH=119 6606 6671 "HH21 ARG B 185 "<>" OE2 GLU B 181 " d_HA=1.710 d_AD=2.718 a_DHA=164.598 symop: x,y,z a_YAH=106 4678 5838 " HZ2 LYS B 131 "<>" OE1 GLU B 54 " d_HA=1.867 d_AD=2.708 a_DHA=137.377 symop: x,y,z a_YAH=104 4678 7996 "HD21 ASN B 269 "<>" OE1 GLU B 54 " d_HA=2.492 d_AD=3.494 a_DHA=169.461 symop: z,x,y a_YAH=166 4679 5876 " HH TYR B 133 "<>" OE2 GLU B 54 " d_HA=1.704 d_AD=2.632 a_DHA=156.330 symop: x,y,z a_YAH=150 4679 6607 " H GLU B 181 "<>" OE2 GLU B 54 " d_HA=2.002 d_AD=3.020 a_DHA=176.989 symop: x,y,z a_YAH=117 5837 6563 " HZ1 LYS B 131 "<>" O LEU B 179 " d_HA=1.977 d_AD=2.763 a_DHA=131.467 symop: x,y,z a_YAH=146 4680 6601 " H GLU B 54 "<>" O GLU B 181 " d_HA=2.872 d_AD=3.689 a_DHA=138.339 symop: x,y,z a_YAH=138 3411 3788 " HZ2 LYS A 257 "<>" O VAL A 282 " d_HA=1.932 d_AD=2.945 a_DHA=171.299 symop: x,y,z a_YAH=122 3772 3810 " H LYS A 283 "<>" OD1 ASP A 280 " d_HA=1.732 d_AD=2.744 a_DHA=167.851 symop: x,y,z a_YAH=128 3772 3792 " H VAL A 282 "<>" OD1 ASP A 280 " d_HA=2.057 d_AD=2.857 a_DHA=133.540 symop: x,y,z a_YAH=109 3394 3782 " H GLY A 281 "<>" O LYS A 257 " d_HA=2.060 d_AD=2.933 a_DHA=143.107 symop: x,y,z a_YAH=142 3394 4129 "HD21 ASN A 303 "<>" O LYS A 257 " d_HA=2.684 d_AD=3.642 a_DHA=159.726 symop: x,y,z a_YAH=124 4887 5670 " HG1 THR B 68 "<>" OG1 THR B 121 " d_HA=2.177 d_AD=3.092 a_DHA=157.661 symop: x,y,z a_YAH=115 a_YAH=105 4895 5654 " H GLY B 69 "<>" O THR B 120 " d_HA=1.896 d_AD=2.896 a_DHA=169.147 symop: x,y,z a_YAH=150 5654 5675 " HG1 THR B 121 "<>" O THR B 120 " d_HA=1.934 d_AD=2.886 a_DHA=167.483 symop: x,y,z a_YAH=93 394 4781 "HE22 GLN B 61 "<>" O ILE A 62 " d_HA=2.232 d_AD=3.041 a_DHA=135.759 symop: y-1/2,-z+3/2,-x+2 a_YAH=145 437 478 " H ASN A 64 "<>" OE1 GLU A 67 " d_HA=1.825 d_AD=2.777 a_DHA=153.986 symop: x,y,z a_YAH=139 478 4780 "HE21 GLN B 61 "<>" OE1 GLU A 67 " d_HA=1.715 d_AD=2.708 a_DHA=163.377 symop: y-1/2,-z+3/2,-x+2 a_YAH=127 479 4753 " HG SER B 59 "<>" OE2 GLU A 67 " d_HA=1.524 d_AD=2.525 a_DHA=179.331 symop: y-1/2,-z+3/2,-x+2 a_YAH=144 4772 4790 " H ILE B 62 "<>" OE1 GLN B 61 " d_HA=2.409 d_AD=3.080 a_DHA=122.803 symop: x,y,z a_YAH=112 4746 5847 " H VAL B 132 "<>" O SER B 59 " d_HA=1.935 d_AD=2.913 a_DHA=160.379 symop: x,y,z a_YAH=130 5821 6369 " H SER B 164 "<>" O LYS B 131 " d_HA=1.958 d_AD=2.931 a_DHA=159.181 symop: x,y,z a_YAH=171 5868 6323 " H TYR B 133 "<>" O TRP B 162 " d_HA=1.814 d_AD=2.828 a_DHA=178.399 symop: x,y,z a_YAH=162 4634 6652 " H ILE B 51 "<>" O ARG B 185 " d_HA=1.859 d_AD=2.869 a_DHA=172.479 symop: x,y,z a_YAH=157 6669 6676 "HH11 ARG B 185 "<>" O CYS B 186 " d_HA=2.232 d_AD=3.032 a_DHA=135.003 symop: x,y,z a_YAH=145 4734 5843 " H VAL B 58 "<>" O VAL B 132 " d_HA=1.839 d_AD=2.841 a_DHA=168.450 symop: x,y,z a_YAH=171 4749 5843 " H SER B 59 "<>" O VAL B 132 " d_HA=2.769 d_AD=3.568 a_DHA=136.391 symop: x,y,z a_YAH=139 4653 4705 " H LEU B 52 "<>" OG SER B 56 " d_HA=1.922 d_AD=2.907 a_DHA=162.711 symop: x,y,z a_YAH=120 a_YAH=131 4667 4706 " H SER B 56 "<>" O GLY B 53 " d_HA=2.149 d_AD=3.131 a_DHA=162.591 symop: x,y,z a_YAH=128 4629 6660 " H ARG B 185 "<>" O ILE B 51 " d_HA=2.070 d_AD=3.024 a_DHA=155.055 symop: x,y,z a_YAH=139 4674 4718 " H VAL B 57 "<>" O GLU B 54 " d_HA=1.962 d_AD=2.957 a_DHA=165.246 symop: x,y,z a_YAH=132 4403 6109 " HG SER B 35 "<>" O GLY B 147 " d_HA=1.920 d_AD=2.830 a_DHA=153.247 symop: x,y,z a_YAH=160 2086 2057 " H GLY A 172 "<>" OG SER A 170 " d_HA=2.938 d_AD=3.634 a_DHA=126.847 symop: x,y,z a_YAH=100 a_YAH=138 2767 2806 " H GLY A 221 "<>" O ASN A 218 " d_HA=1.921 d_AD=2.926 a_DHA=169.986 symop: x,y,z a_YAH=126 2770 2797 " H ALA A 220 "<>" OD1 ASN A 218 " d_HA=1.935 d_AD=2.934 a_DHA=167.857 symop: x,y,z a_YAH=135 4894 5658 " H THR B 120 "<>" O GLY B 69 " d_HA=2.122 d_AD=3.115 a_DHA=164.843 symop: x,y,z a_YAH=148 4894 5650 " HG SER B 119 "<>" O GLY B 69 " d_HA=1.751 d_AD=2.703 a_DHA=162.719 symop: x,y,z a_YAH=126 4923 5627 " H PHE B 71 "<>" O VAL B 118 " d_HA=2.006 d_AD=2.982 a_DHA=160.824 symop: x,y,z a_YAH=162 6678 6708 " H LEU B 188 "<>" SG CYS B 186 " d_HA=2.479 d_AD=3.471 a_DHA=167.148 symop: x,y,z a_YAH=114 a_YAH=133 5859 6334 " H TRP B 162 "<>" O TYR B 133 " d_HA=1.919 d_AD=2.916 a_DHA=165.850 symop: x,y,z a_YAH=151 5894 6297 " H THR B 135 "<>" O GLY B 160 " d_HA=1.905 d_AD=2.860 a_DHA=155.579 symop: x,y,z a_YAH=139 4598 6691 " H VAL B 187 "<>" O GLY B 49 " d_HA=1.873 d_AD=2.826 a_DHA=154.574 symop: x,y,z a_YAH=148 4605 5913 " H TYR B 136 "<>" O TRP B 50 " d_HA=1.824 d_AD=2.838 a_DHA=174.857 symop: x,y,z a_YAH=146 4616 5904 " H TRP B 50 "<>" O TYR B 136 " d_HA=2.020 d_AD=3.004 a_DHA=162.476 symop: x,y,z a_YAH=156 4575 6795 " HZ3 LYS B 46 "<>" OD2 ASP B 194 " d_HA=1.773 d_AD=2.669 a_DHA=143.363 symop: x,y,z a_YAH=146 4703 5882 " H ALA B 134 "<>" O SER B 56 " d_HA=1.788 d_AD=2.797 a_DHA=171.610 symop: x,y,z a_YAH=154 5966 6641 " HZ2 LYS B 138 "<>" OE1 GLU B 184 " d_HA=1.793 d_AD=2.772 a_DHA=158.591 symop: x,y,z a_YAH=99 6238 6641 " HH TYR B 156 "<>" OE1 GLU B 184 " d_HA=1.638 d_AD=2.597 a_DHA=164.630 symop: x,y,z a_YAH=107 4421 8119 "HE22 GLN B 276 "<>" O LEU B 37 " d_HA=2.002 d_AD=2.941 a_DHA=152.528 symop: x,y,z a_YAH=155 5096 6191 " H SER B 82 "<>" O SER B 154 " d_HA=1.842 d_AD=2.845 a_DHA=168.824 symop: x,y,z a_YAH=156 5133 6175 "HD22 ASN B 84 "<>" OD1 ASP B 152 " d_HA=2.189 d_AD=3.172 a_DHA=162.183 symop: x,y,z a_YAH=105 6004 6175 "HE21 GLN B 140 "<>" OD1 ASP B 152 " d_HA=1.823 d_AD=2.832 a_DHA=166.346 symop: x,y,z a_YAH=103 5374 5449 " H ILE B 106 "<>" O GLU B 101 " d_HA=2.711 d_AD=3.339 a_DHA=120.585 symop: x,y,z a_YAH=118 5389 5438 " H GLY B 105 "<>" O TYR B 102 " d_HA=2.537 d_AD=3.413 a_DHA=144.641 symop: x,y,z a_YAH=96 5398 5337 " H TYR B 102 "<>" O ALA B 98 " d_HA=1.940 d_AD=2.904 a_DHA=156.890 symop: x,y,z a_YAH=146 5093 6194 " H SER B 154 "<>" O SER B 82 " d_HA=1.850 d_AD=2.835 a_DHA=161.734 symop: x,y,z a_YAH=139 5128 6172 " H ASN B 84 "<>" O ASP B 152 " d_HA=1.970 d_AD=2.807 a_DHA=138.017 symop: x,y,z a_YAH=142 5141 6172 " H VAL B 85 "<>" O ASP B 152 " d_HA=2.055 d_AD=3.023 a_DHA=158.160 symop: x,y,z a_YAH=146 6177 5137 " H ASP B 152 "<>" O VAL B 85 " d_HA=1.844 d_AD=2.845 a_DHA=167.281 symop: x,y,z a_YAH=134 6038 6152 " H SER B 150 "<>" O ARG B 143 " d_HA=1.943 d_AD=2.884 a_DHA=153.204 symop: x,y,z a_YAH=142 6038 6165 " H ASP B 151 "<>" O ARG B 143 " d_HA=2.241 d_AD=3.246 a_DHA=171.296 symop: x,y,z a_YAH=138 6081 6121 " H ASN B 148 "<>" O SER B 145 " d_HA=2.271 d_AD=3.226 a_DHA=156.289 symop: x,y,z a_YAH=112 6081 6126 "HD22 ASN B 148 "<>" O SER B 145 " d_HA=2.113 d_AD=3.032 a_DHA=149.882 symop: x,y,z a_YAH=157 6084 6116 " H SER B 145 "<>" O ASN B 148 " d_HA=1.834 d_AD=2.839 a_DHA=170.025 symop: x,y,z a_YAH=168 2713 2759 " H SER A 217 "<>" O ALA A 214 " d_HA=2.569 d_AD=3.325 a_DHA=131.262 symop: x,y,z a_YAH=92 2713 2763 " HG SER A 217 "<>" O ALA A 214 " d_HA=1.597 d_AD=2.568 a_DHA=169.403 symop: x,y,z a_YAH=134 2723 2772 " H ASN A 218 "<>" O LEU A 215 " d_HA=2.173 d_AD=3.096 a_DHA=150.679 symop: x,y,z a_YAH=109 2777 2826 "HD22 ASN A 218 "<>" O LEU A 223 " d_HA=1.939 d_AD=2.798 a_DHA=140.850 symop: x,y,z a_YAH=133 2854 4314 " H TYR A 224 "<>" O PHE A 316 " d_HA=1.843 d_AD=2.847 a_DHA=169.073 symop: x,y,z a_YAH=150 2812 4357 " H LYS A 318 "<>" O ASN A 222 " d_HA=1.873 d_AD=2.839 a_DHA=157.191 symop: x,y,z a_YAH=128 3319 4334 " H ARG A 252 "<>" O GLN A 317 " d_HA=1.867 d_AD=2.870 a_DHA=168.649 symop: x,y,z a_YAH=132 3327 3895 " HE ARG A 252 "<>" OD1 ASP A 288 " d_HA=1.681 d_AD=2.695 a_DHA=169.613 symop: x,y,z a_YAH=136 3255 4369 " HZ3 LYS A 318 "<>" OE1 GLN A 249 " d_HA=1.862 d_AD=2.852 a_DHA=163.365 symop: x,y,z a_YAH=175 4368 4381 " HZ2 LYS A 318 "<>" OXT PHE A 319 " d_HA=1.658 d_AD=2.637 a_DHA=159.019 symop: x,y,z a_YAH=174 3268 4382 " H PHE A 319 "<>" O LYS A 250 " d_HA=1.938 d_AD=2.941 a_DHA=170.085 symop: x,y,z a_YAH=152 3330 3896 "HH21 ARG A 252 "<>" OD2 ASP A 288 " d_HA=1.734 d_AD=2.735 a_DHA=162.139 symop: x,y,z a_YAH=101 3230 3263 "HE21 GLN A 249 "<>" O THR A 247 " d_HA=1.949 d_AD=2.951 a_DHA=167.078 symop: x,y,z a_YAH=152 5631 4915 " H VAL B 118 "<>" O PHE B 71 " d_HA=1.989 d_AD=2.967 a_DHA=160.008 symop: x,y,z a_YAH=159 5890 6287 " H THR B 159 "<>" O THR B 135 " d_HA=2.052 d_AD=3.025 a_DHA=160.234 symop: x,y,z a_YAH=141 5890 6298 " H GLY B 160 "<>" O THR B 135 " d_HA=2.020 d_AD=2.985 a_DHA=157.653 symop: x,y,z a_YAH=154 4589 6290 " HG1 THR B 159 "<>" OD1 ASP B 48 " d_HA=1.721 d_AD=2.692 a_DHA=169.623 symop: x,y,z a_YAH=113 4589 5942 "HH11 ARG B 137 "<>" OD1 ASP B 48 " d_HA=2.055 d_AD=3.009 a_DHA=155.365 symop: x,y,z a_YAH=91 4557 4621 " HE1 TRP B 50 "<>" O LYS B 46 " d_HA=1.928 d_AD=2.946 a_DHA=172.388 symop: x,y,z a_YAH=122 4557 6773 " HG SER B 192 "<>" O LYS B 46 " d_HA=2.897 d_AD=3.762 a_DHA=149.800 symop: x,y,z a_YAH=113 4563 5949 " H LYS B 46 "<>" O LYS B 138 " d_HA=1.922 d_AD=2.899 a_DHA=159.832 symop: x,y,z a_YAH=168 4579 5955 " H LYS B 138 "<>" O GLY B 47 " d_HA=2.214 d_AD=3.191 a_DHA=160.693 symop: x,y,z a_YAH=150 4545 6808 " H ILE B 195 "<>" O ASP B 45 " d_HA=1.948 d_AD=2.951 a_DHA=167.905 symop: x,y,z a_YAH=148 5925 6248 " H LYS B 157 "<>" O ARG B 137 " d_HA=2.021 d_AD=3.015 a_DHA=164.846 symop: x,y,z a_YAH=150 5933 6242 " H ARG B 137 "<>" O LYS B 157 " d_HA=1.794 d_AD=2.794 a_DHA=168.201 symop: x,y,z a_YAH=157 5971 6207 " H ILE B 155 "<>" O TYR B 139 " d_HA=1.945 d_AD=2.932 a_DHA=163.007 symop: x,y,z a_YAH=161 5980 6202 " H TYR B 139 "<>" O ILE B 155 " d_HA=1.946 d_AD=2.949 a_DHA=168.560 symop: x,y,z a_YAH=161 4526 5998 " H GLN B 140 "<>" O ILE B 44 " d_HA=1.925 d_AD=2.910 a_DHA=162.417 symop: x,y,z a_YAH=148 4531 5992 " H ILE B 44 "<>" O GLN B 140 " d_HA=1.905 d_AD=2.891 a_DHA=162.833 symop: x,y,z a_YAH=148 5067 5921 " HH TYR B 136 "<>" OE2 GLU B 80 " d_HA=1.691 d_AD=2.675 a_DHA=172.422 symop: x,y,z a_YAH=126 5062 6230 " H TYR B 156 "<>" O GLU B 80 " d_HA=1.833 d_AD=2.831 a_DHA=165.283 symop: x,y,z a_YAH=162 5068 6221 " H GLU B 80 "<>" O TYR B 156 " d_HA=2.128 d_AD=3.111 a_DHA=163.839 symop: x,y,z a_YAH=139 6011 6184 " H ALA B 141 "<>" O GLY B 153 " d_HA=1.908 d_AD=2.908 a_DHA=166.842 symop: x,y,z a_YAH=157 4489 6024 " H ILE B 142 "<>" O TYR B 42 " d_HA=1.821 d_AD=2.829 a_DHA=170.487 symop: x,y,z a_YAH=159 4498 6019 " H TYR B 42 "<>" O ILE B 142 " d_HA=1.832 d_AD=2.845 a_DHA=178.673 symop: x,y,z a_YAH=157 6009 6185 " H GLY B 153 "<>" O ALA B 141 " d_HA=2.032 d_AD=3.006 a_DHA=159.480 symop: x,y,z a_YAH=160 6046 6160 " H ARG B 143 "<>" O ASP B 151 " d_HA=1.820 d_AD=2.812 a_DHA=163.614 symop: x,y,z a_YAH=136 4463 6067 " H ILE B 144 "<>" O GLY B 40 " d_HA=2.036 d_AD=3.028 a_DHA=165.615 symop: x,y,z a_YAH=145 4440 4506 " HH TYR B 42 "<>" O SER B 38 " d_HA=1.710 d_AD=2.677 a_DHA=171.912 symop: x,y,z a_YAH=111 4451 8066 " HZ1 LYS B 273 "<>" O ASP B 39 " d_HA=1.851 d_AD=2.721 a_DHA=141.133 symop: x,y,z a_YAH=145 4454 6110 " H GLY B 147 "<>" OD1 ASP B 39 " d_HA=1.804 d_AD=2.821 a_DHA=172.574 symop: x,y,z a_YAH=136 4456 8110 " H ASP B 39 "<>" OE1 GLN B 276 " d_HA=1.795 d_AD=2.797 a_DHA=168.003 symop: x,y,z a_YAH=144 4464 6062 " H GLY B 40 "<>" O ILE B 144 " d_HA=2.134 d_AD=3.078 a_DHA=153.708 symop: x,y,z a_YAH=128 7883 8110 "HD21 ASN B 262 "<>" OE1 GLN B 276 " d_HA=2.681 d_AD=3.574 a_DHA=147.679 symop: x,y,z a_YAH=99 8125 8240 " HD1 HIS B 285 "<>" OG SER B 277 " d_HA=1.939 d_AD=2.943 a_DHA=169.476 symop: x,y,z a_YAH=113 a_YAH=138 5036 5378 " HG SER B 78 "<>" OE1 GLU B 101 " d_HA=1.555 d_AD=2.536 a_DHA=167.195 symop: z,x,y a_YAH=130 6088 6151 " HG SER B 145 "<>" OG SER B 150 " d_HA=2.176 d_AD=3.096 a_DHA=157.709 symop: x,y,z a_YAH=99 a_YAH=141 4455 6099 " H HIS B 146 "<>" OD2 ASP B 39 " d_HA=1.838 d_AD=2.784 a_DHA=152.605 symop: x,y,z a_YAH=110 7862 8123 " H PHE B 261 "<>" O SER B 277 " d_HA=1.928 d_AD=2.932 a_DHA=169.009 symop: x,y,z a_YAH=146 8229 7766 " H ALA B 255 "<>" O HIS B 285 " d_HA=1.874 d_AD=2.888 a_DHA=174.910 symop: x,y,z a_YAH=168 2701 2759 " H SER A 217 "<>" O ASP A 213 " d_HA=2.157 d_AD=2.925 a_DHA=131.290 symop: x,y,z a_YAH=140 2845 4322 " H PHE A 316 "<>" O TYR A 224 " d_HA=1.910 d_AD=2.891 a_DHA=161.442 symop: x,y,z a_YAH=161 2668 2728 " H LEU A 215 "<>" O LEU A 211 " d_HA=1.978 d_AD=2.968 a_DHA=164.376 symop: x,y,z a_YAH=147 2687 2747 " H ASN A 216 "<>" O THR A 212 " d_HA=1.915 d_AD=2.904 a_DHA=163.764 symop: x,y,z a_YAH=152 3311 4340 " H GLN A 317 "<>" O ARG A 252 " d_HA=1.945 d_AD=2.869 a_DHA=149.943 symop: x,y,z a_YAH=154 3340 3876 " H ILE A 253 "<>" O VAL A 287 " d_HA=2.158 d_AD=3.142 a_DHA=162.484 symop: x,y,z a_YAH=154 2694 3208 " HG1 THR A 212 "<>" OG1 THR A 245 " d_HA=2.571 d_AD=3.209 a_DHA=123.781 symop: x,y,z a_YAH=112 a_YAH=140 3290 3909 " H ILE A 289 "<>" O TYR A 251 " d_HA=2.172 d_AD=2.917 a_DHA=128.989 symop: x,y,z a_YAH=163 3299 3904 " H TYR A 251 "<>" O ILE A 289 " d_HA=1.826 d_AD=2.840 a_DHA=177.708 symop: x,y,z a_YAH=153 3245 3956 " H GLY A 248 "<>" OD1 ASP A 292 " d_HA=1.735 d_AD=2.713 a_DHA=159.834 symop: x,y,z a_YAH=130 3251 3939 " H LEU A 291 "<>" O GLN A 249 " d_HA=1.890 d_AD=2.890 a_DHA=167.802 symop: x,y,z a_YAH=158 3257 3934 " H GLN A 249 "<>" O LEU A 291 " d_HA=2.881 d_AD=3.605 a_DHA=129.194 symop: x,y,z a_YAH=134 5608 5577 " HE ARG B 116 "<>" O GLU B 115 " d_HA=1.879 d_AD=2.791 a_DHA=147.327 symop: x,y,z a_YAH=140 5610 6283 "HH12 ARG B 116 "<>" O THR B 159 " d_HA=1.803 d_AD=2.746 a_DHA=152.492 symop: x,y,z a_YAH=146 4548 4580 " H GLY B 47 "<>" OD1 ASP B 45 " d_HA=1.884 d_AD=2.842 a_DHA=155.332 symop: x,y,z a_YAH=128 4549 5944 "HH21 ARG B 137 "<>" OD2 ASP B 45 " d_HA=1.696 d_AD=2.694 a_DHA=162.073 symop: x,y,z a_YAH=127 4550 6803 " H ASP B 45 "<>" O ILE B 195 " d_HA=2.017 d_AD=2.992 a_DHA=159.621 symop: x,y,z a_YAH=142 5013 5535 " H LYS B 77 "<>" O ASN B 112 " d_HA=2.053 d_AD=3.037 a_DHA=162.073 symop: x,y,z a_YAH=164 5545 6264 "HD22 ASN B 112 "<>" O LEU B 158 " d_HA=1.783 d_AD=2.791 a_DHA=172.054 symop: x,y,z a_YAH=161 4510 6843 " H LYS B 197 "<>" O VAL B 43 " d_HA=1.935 d_AD=2.844 a_DHA=147.027 symop: x,y,z a_YAH=160 4514 6837 " H VAL B 43 "<>" O LYS B 197 " d_HA=1.889 d_AD=2.895 a_DHA=169.282 symop: x,y,z a_YAH=153 6863 8067 " HZ2 LYS B 273 "<>" OE1 GLU B 198 " d_HA=1.768 d_AD=2.791 a_DHA=177.165 symop: x,y,z a_YAH=95 5007 5540 " H ASN B 112 "<>" O LYS B 77 " d_HA=1.953 d_AD=2.968 a_DHA=174.076 symop: x,y,z a_YAH=162 5046 5503 " H LYS B 79 "<>" O GLU B 110 " d_HA=1.918 d_AD=2.833 a_DHA=147.972 symop: x,y,z a_YAH=140 5301 5362 " H VAL B 100 "<>" O ILE B 96 " d_HA=2.119 d_AD=3.099 a_DHA=161.310 symop: x,y,z a_YAH=150 4470 6879 " H ILE B 199 "<>" O LEU B 41 " d_HA=1.896 d_AD=2.883 a_DHA=162.154 symop: x,y,z a_YAH=174 6864 7924 " HH TYR B 264 "<>" OE2 GLU B 198 " d_HA=1.612 d_AD=2.596 a_DHA=175.159 symop: x,y,z a_YAH=137 7854 8126 " H SER B 277 "<>" O PHE B 261 " d_HA=1.835 d_AD=2.837 a_DHA=167.541 symop: x,y,z a_YAH=170 7874 8450 " H VAL B 299 "<>" O ASN B 262 " d_HA=1.912 d_AD=2.876 a_DHA=157.265 symop: x,y,z a_YAH=170 7879 8446 " H ASN B 262 "<>" O VAL B 299 " d_HA=1.933 d_AD=2.926 a_DHA=165.235 symop: x,y,z a_YAH=153 7893 8091 " H ILE B 263 "<>" O GLU B 275 " d_HA=1.939 d_AD=2.941 a_DHA=167.661 symop: x,y,z a_YAH=155 7726 8271 " H VAL B 287 "<>" O ILE B 253 " d_HA=2.211 d_AD=3.140 a_DHA=151.778 symop: x,y,z a_YAH=145 7731 8267 " H ILE B 253 "<>" O VAL B 287 " d_HA=2.176 d_AD=3.160 a_DHA=162.483 symop: x,y,z a_YAH=154 7718 8286 " HE ARG B 252 "<>" OD1 ASP B 288 " d_HA=1.686 d_AD=2.694 a_DHA=168.071 symop: x,y,z a_YAH=138 7721 8287 "HH21 ARG B 252 "<>" OD2 ASP B 288 " d_HA=1.742 d_AD=2.738 a_DHA=160.715 symop: x,y,z a_YAH=100 5056 5507 " HZ1 LYS B 79 "<>" OE1 GLU B 110 " d_HA=1.829 d_AD=2.833 a_DHA=166.832 symop: x,y,z a_YAH=175 5058 5508 " HZ3 LYS B 79 "<>" OE2 GLU B 110 " d_HA=1.741 d_AD=2.695 a_DHA=153.264 symop: y,z,x a_YAH=124 5326 5255 " H GLN B 97 "<>" O SER B 93 " d_HA=2.120 d_AD=3.124 a_DHA=168.414 symop: x,y,z a_YAH=155 5281 5350 " H SER B 99 "<>" O PHE B 95 " d_HA=2.025 d_AD=2.992 a_DHA=158.345 symop: x,y,z a_YAH=138 5281 5354 " HG SER B 99 "<>" O PHE B 95 " d_HA=1.750 d_AD=2.697 a_DHA=161.939 symop: x,y,z a_YAH=155 5306 5241 " H ILE B 96 "<>" O THR B 92 " d_HA=2.294 d_AD=3.200 a_DHA=147.993 symop: x,y,z a_YAH=147 5306 5255 " H ILE B 96 "<>" O SER B 93 " d_HA=2.580 d_AD=3.266 a_DHA=124.635 symop: x,y,z a_YAH=101 6916 6054 " HE ARG B 143 "<>" OD2 ASP B 201 " d_HA=1.762 d_AD=2.767 a_DHA=168.294 symop: x,y,z a_YAH=112 6916 7471 " HZ2 LYS B 237 "<>" OD2 ASP B 201 " d_HA=1.719 d_AD=2.726 a_DHA=166.854 symop: x,y,z a_YAH=144 2654 2715 " H ALA A 214 "<>" O ASN A 210 " d_HA=2.189 d_AD=3.155 a_DHA=158.623 symop: x,y,z a_YAH=139 2657 2691 " H THR A 212 "<>" OD1 ASN A 210 " d_HA=2.320 d_AD=2.997 a_DHA=123.164 symop: x,y,z a_YAH=157 2657 2706 " H ASP A 213 "<>" OD1 ASN A 210 " d_HA=2.036 d_AD=3.044 a_DHA=171.125 symop: x,y,z a_YAH=119 2673 3173 " H LEU A 211 "<>" O THR A 243 " d_HA=1.908 d_AD=2.884 a_DHA=160.261 symop: x,y,z a_YAH=157 3187 3976 " H GLY A 294 "<>" O ILE A 244 " d_HA=1.899 d_AD=2.859 a_DHA=156.678 symop: x,y,z a_YAH=141 3953 4016 " HH TYR A 296 "<>" O ASP A 292 " d_HA=1.696 d_AD=2.669 a_DHA=175.424 symop: x,y,z a_YAH=124 5538 5553 " H THR B 113 "<>" OD1 ASN B 112 " d_HA=2.251 d_AD=3.064 a_DHA=136.226 symop: x,y,z a_YAH=92 6260 5463 " HZ3 LYS B 157 "<>" O THR B 107 " d_HA=2.386 d_AD=3.034 a_DHA=121.057 symop: x,y,z a_YAH=143 5358 5425 " H PHE B 104 "<>" O VAL B 100 " d_HA=2.040 d_AD=3.026 a_DHA=162.855 symop: x,y,z a_YAH=152 7888 8077 " H LEU B 274 "<>" O ILE B 263 " d_HA=1.916 d_AD=2.863 a_DHA=154.351 symop: x,y,z a_YAH=158 7888 8097 " H GLU B 275 "<>" O ILE B 263 " d_HA=2.414 d_AD=3.383 a_DHA=160.113 symop: x,y,z a_YAH=137 8034 7931 " H SER B 265 "<>" O VAL B 272 " d_HA=1.844 d_AD=2.814 a_DHA=158.316 symop: x,y,z a_YAH=162 7681 8300 " H ILE B 289 "<>" O TYR B 251 " d_HA=2.261 d_AD=2.958 a_DHA=124.931 symop: x,y,z a_YAH=156 5477 6259 " HZ2 LYS B 157 "<>" O ILE B 108 " d_HA=1.727 d_AD=2.740 a_DHA=171.701 symop: x,y,z a_YAH=123 5320 5380 " H GLU B 101 "<>" O GLN B 97 " d_HA=1.833 d_AD=2.842 a_DHA=170.827 symop: x,y,z a_YAH=166 5379 5482 " H ILE B 108 "<>" OE2 GLU B 101 " d_HA=1.734 d_AD=2.749 a_DHA=171.210 symop: x,y,z a_YAH=122 5379 5497 " H GLY B 109 "<>" OE2 GLU B 101 " d_HA=2.869 d_AD=3.763 a_DHA=147.400 symop: x,y,z a_YAH=166 5337 5398 " H TYR B 102 "<>" O ALA B 98 " d_HA=1.940 d_AD=2.904 a_DHA=156.890 symop: x,y,z a_YAH=146 5347 5411 " H GLY B 103 "<>" O SER B 99 " d_HA=1.963 d_AD=2.964 a_DHA=167.297 symop: x,y,z a_YAH=146 7916 8411 " H TYR B 264 "<>" O VAL B 297 " d_HA=1.940 d_AD=2.902 a_DHA=157.179 symop: x,y,z a_YAH=150 7702 8731 " H GLN B 317 "<>" O ARG B 252 " d_HA=1.960 d_AD=2.895 a_DHA=151.586 symop: x,y,z a_YAH=154 5332 5379 "HE21 GLN B 97 "<>" OE2 GLU B 101 " d_HA=2.335 d_AD=3.179 a_DHA=139.998 symop: x,y,z a_YAH=107 5333 5508 "HE22 GLN B 97 "<>" OE2 GLU B 110 " d_HA=1.850 d_AD=2.868 a_DHA=173.209 symop: y,z,x a_YAH=136 5339 5266 " H ALA B 98 "<>" O GLU B 94 " d_HA=1.808 d_AD=2.821 a_DHA=174.180 symop: x,y,z a_YAH=163 6912 6955 " H ALA B 204 "<>" O ASP B 201 " d_HA=2.051 d_AD=2.934 a_DHA=144.038 symop: x,y,z a_YAH=129 7750 8686 " H LEU B 254 "<>" O LEU B 315 " d_HA=1.983 d_AD=2.973 a_DHA=164.122 symop: x,y,z a_YAH=150 ------------------------------------------------------------------------------- Total: 584 Symmetry: 0 Per residue: 1.0246 Mean SD Skew Kurtosis theta_1: 148.779 20.762 -0.996 3.033 theta_2: 136.487 21.475 -0.299 2.023 d_HA: 2.237 0.278 0.922 3.137 4065 6372 "HD22 ASN F 61 "<>" O THR D 135 " d_HA=2.593 d_AD=3.590 a_DHA=168.768 symop: x,y,z a_YAH=154 4067 6649 " HH TYR F 77 "<>" OG1 THR D 135 " d_HA=2.591 d_AD=3.296 a_DHA=130.009 symop: x,y,z a_YAH=103 a_YAH=111 5923 6354 " HE ARG F 60 "<>" OE2 GLU F 35 " d_HA=1.969 d_AD=2.980 a_DHA=165.950 symop: x,y,z a_YAH=168 4982 6346 " H ARG F 60 "<>" O ASN E 61 " d_HA=2.143 d_AD=3.026 a_DHA=143.581 symop: x,y,z a_YAH=149 4966 6362 " H ARG E 60 "<>" O ASN F 61 " d_HA=2.262 d_AD=2.977 a_DHA=125.923 symop: x,y,z a_YAH=127 4966 6365 " H ARG E 60 "<>" OD1 ASN F 61 " d_HA=2.048 d_AD=2.912 a_DHA=140.898 symop: x,y,z a_YAH=127 6653 6700 " H VAL F 81 "<>" O LEU F 78 " d_HA=2.409 d_AD=3.379 a_DHA=160.695 symop: x,y,z a_YAH=115 4053 6384 " H PHE F 62 "<>" OG1 THR D 134 " d_HA=2.160 d_AD=3.116 a_DHA=155.987 symop: x,y,z a_YAH=103 a_YAH=136 4058 4065 " HG1 THR D 134 "<>" O THR D 135 " d_HA=2.053 d_AD=3.027 a_DHA=173.255 symop: x,y,z a_YAH=127 4047 4542 "HE22 GLN D 133 "<>" OE1 GLU E 35 " d_HA=1.783 d_AD=2.761 a_DHA=158.006 symop: x,y,z a_YAH=131 4543 6371 "HD21 ASN F 61 "<>" OE2 GLU E 35 " d_HA=2.473 d_AD=3.392 a_DHA=149.543 symop: x,y,z a_YAH=94 4034 5546 " HZ2 LYS F 9 "<>" O GLN D 133 " d_HA=2.071 d_AD=2.833 a_DHA=129.253 symop: x,y,z a_YAH=172 4055 6376 " H THR D 134 "<>" O PHE F 62 " d_HA=2.080 d_AD=3.009 a_DHA=150.488 symop: x,y,z a_YAH=158 4038 4559 " H LYS E 36 "<>" OE1 GLN D 133 " d_HA=2.021 d_AD=2.860 a_DHA=138.072 symop: x,y,z a_YAH=144 4519 4580 " H ASP E 37 "<>" O ILE E 34 " d_HA=2.175 d_AD=3.038 a_DHA=142.012 symop: x,y,z a_YAH=125 4519 4592 " H ILE E 38 "<>" O ILE E 34 " d_HA=2.068 d_AD=3.067 a_DHA=167.369 symop: x,y,z a_YAH=155 4579 5860 " HZ3 LYS F 31 "<>" OD2 ASP E 37 " d_HA=2.288 d_AD=2.999 a_DHA=125.543 symop: x-y,x,z+1/3 a_YAH=101 4996 3620 " H THR C 134 "<>" O PHE E 62 " d_HA=2.174 d_AD=3.167 a_DHA=165.211 symop: x,y,z a_YAH=159 5004 3618 " H PHE E 62 "<>" OG1 THR C 134 " d_HA=2.054 d_AD=3.001 a_DHA=153.623 symop: x,y,z a_YAH=116 a_YAH=131 5232 5347 " H ILE E 83 "<>" O PHE E 76 " d_HA=1.864 d_AD=2.847 a_DHA=161.890 symop: x,y,z a_YAH=163 5316 5278 " H LEU E 78 "<>" O VAL E 81 " d_HA=1.827 d_AD=2.822 a_DHA=165.708 symop: x,y,z a_YAH=153 5767 5833 " H GLU F 30 "<>" O THR F 26 " d_HA=2.501 d_AD=3.188 a_DHA=124.820 symop: x,y,z a_YAH=146 5767 5813 " H LEU F 29 "<>" O THR F 26 " d_HA=2.326 d_AD=3.070 a_DHA=129.483 symop: x,y,z a_YAH=95 5017 6315 " H GLY E 63 "<>" O VAL F 58 " d_HA=1.805 d_AD=2.789 a_DHA=162.132 symop: x,y,z a_YAH=150 6332 6712 " H GLY F 59 "<>" O ALA F 82 " d_HA=2.002 d_AD=2.995 a_DHA=165.165 symop: x,y,z a_YAH=155 4951 5334 " H ALA E 82 "<>" O GLY E 59 " d_HA=1.888 d_AD=2.851 a_DHA=157.332 symop: x,y,z a_YAH=163 4952 5332 " H GLY E 59 "<>" O ALA E 82 " d_HA=2.178 d_AD=3.136 a_DHA=156.242 symop: x,y,z a_YAH=149 6658 6696 " H LEU F 78 "<>" O VAL F 81 " d_HA=1.764 d_AD=2.765 a_DHA=168.372 symop: x,y,z a_YAH=159 6331 6714 " H ALA F 82 "<>" O GLY F 59 " d_HA=1.956 d_AD=2.923 a_DHA=158.388 symop: x,y,z a_YAH=156 4935 6397 " H GLY F 63 "<>" O VAL E 58 " d_HA=1.719 d_AD=2.676 a_DHA=156.073 symop: x,y,z a_YAH=164 4939 6396 " H VAL E 58 "<>" O GLY F 63 " d_HA=1.900 d_AD=2.900 a_DHA=168.989 symop: x,y,z a_YAH=153 4538 4608 " H ALA E 39 "<>" O GLU E 35 " d_HA=1.965 d_AD=2.944 a_DHA=161.463 symop: x,y,z a_YAH=147 5498 6632 " H VAL F 7 "<>" O TYR F 77 " d_HA=2.093 d_AD=3.069 a_DHA=161.227 symop: x,y,z a_YAH=142 5494 6641 " H TYR F 77 "<>" O VAL F 7 " d_HA=1.917 d_AD=2.906 a_DHA=163.356 symop: x,y,z a_YAH=151 6612 6727 " H ILE F 83 "<>" O PHE F 76 " d_HA=1.722 d_AD=2.726 a_DHA=172.916 symop: x,y,z a_YAH=161 4020 6406 " H SER F 64 "<>" O THR D 132 " d_HA=1.936 d_AD=2.821 a_DHA=144.948 symop: x,y,z a_YAH=152 4020 6410 " HG SER F 64 "<>" O THR D 132 " d_HA=2.289 d_AD=3.075 a_DHA=137.991 symop: x,y,z a_YAH=128 4553 4618 " H ALA E 40 "<>" O LYS E 36 " d_HA=1.918 d_AD=2.903 a_DHA=162.508 symop: x,y,z a_YAH=133 5535 6591 " H LYS F 9 "<>" O TYR F 75 " d_HA=2.134 d_AD=2.931 a_DHA=134.158 symop: x,y,z a_YAH=140 5556 6591 " H ASN F 10 "<>" O TYR F 75 " d_HA=2.147 d_AD=3.023 a_DHA=143.512 symop: x,y,z a_YAH=153 5781 5848 " H LYS F 31 "<>" O GLN F 27 " d_HA=2.099 d_AD=3.095 a_DHA=165.793 symop: x,y,z a_YAH=175 5781 5833 " H GLU F 30 "<>" O GLN F 27 " d_HA=2.210 d_AD=3.136 a_DHA=151.512 symop: x,y,z a_YAH=115 5798 5873 " H TYR F 32 "<>" O ALA F 28 " d_HA=2.140 d_AD=3.087 a_DHA=154.976 symop: x,y,z a_YAH=132 5998 5933 " H ALA F 40 "<>" O LYS F 36 " d_HA=1.948 d_AD=2.908 a_DHA=156.427 symop: x,y,z a_YAH=136 5918 5972 " H ILE F 38 "<>" O GLU F 35 " d_HA=2.845 d_AD=3.485 a_DHA=121.361 symop: x,y,z a_YAH=94 5918 5988 " H ALA F 39 "<>" O GLU F 35 " d_HA=2.278 d_AD=3.262 a_DHA=164.404 symop: x,y,z a_YAH=143 5023 3589 " H THR C 132 "<>" O SER E 64 " d_HA=2.228 d_AD=3.174 a_DHA=153.728 symop: x,y,z a_YAH=137 5026 3585 " H SER E 64 "<>" O THR C 132 " d_HA=1.985 d_AD=2.885 a_DHA=147.163 symop: x,y,z a_YAH=164 5030 3585 " HG SER E 64 "<>" O THR C 132 " d_HA=2.295 d_AD=3.104 a_DHA=140.162 symop: x,y,z a_YAH=124 5240 5342 " H PHE E 76 "<>" O ILE E 83 " d_HA=1.991 d_AD=2.968 a_DHA=160.242 symop: x,y,z a_YAH=152 5746 5787 " H GLN F 27 "<>" O CYS F 24 " d_HA=2.218 d_AD=2.917 a_DHA=124.540 symop: x,y,z a_YAH=109 5746 5800 " H ALA F 28 "<>" O CYS F 24 " d_HA=2.261 d_AD=3.261 a_DHA=168.434 symop: x,y,z a_YAH=162 5757 5813 " H LEU F 29 "<>" O ALA F 25 " d_HA=2.418 d_AD=3.186 a_DHA=132.086 symop: x,y,z a_YAH=137 5967 6015 " H TYR F 41 "<>" O ILE F 38 " d_HA=2.364 d_AD=3.014 a_DHA=120.748 symop: x,y,z a_YAH=104 5967 6032 " H ILE F 42 "<>" O ILE F 38 " d_HA=2.423 d_AD=3.429 a_DHA=170.400 symop: x,y,z a_YAH=164 5016 6319 " H VAL F 58 "<>" O GLY E 63 " d_HA=1.902 d_AD=2.912 a_DHA=171.979 symop: x,y,z a_YAH=152 4916 5366 " H LEU E 84 "<>" O ILE E 57 " d_HA=1.930 d_AD=2.908 a_DHA=160.203 symop: x,y,z a_YAH=154 5734 5787 " H GLN F 27 "<>" O ASP F 23 " d_HA=2.530 d_AD=3.426 a_DHA=146.761 symop: x,y,z a_YAH=145 5734 5774 " HG1 THR F 26 "<>" O ASP F 23 " d_HA=1.730 d_AD=2.697 a_DHA=170.877 symop: x,y,z a_YAH=117 5708 5759 " H ALA F 25 "<>" O ALA F 21 " d_HA=2.120 d_AD=3.098 a_DHA=160.001 symop: x,y,z a_YAH=137 5718 5771 " H THR F 26 "<>" O VAL F 22 " d_HA=2.361 d_AD=3.322 a_DHA=157.464 symop: x,y,z a_YAH=149 6296 6746 " H LEU F 84 "<>" O ILE F 57 " d_HA=1.810 d_AD=2.824 a_DHA=174.123 symop: x,y,z a_YAH=157 6301 6741 " H ILE F 57 "<>" O LEU F 84 " d_HA=1.885 d_AD=2.875 a_DHA=163.604 symop: x,y,z a_YAH=155 4905 6423 " H TYR F 65 "<>" O CYS E 56 " d_HA=1.992 d_AD=3.000 a_DHA=169.378 symop: x,y,z a_YAH=165 4921 5361 " H ILE E 57 "<>" O LEU E 84 " d_HA=1.939 d_AD=2.939 a_DHA=166.370 symop: x,y,z a_YAH=151 5679 5739 " H ASP F 23 "<>" O GLN F 19 " d_HA=1.809 d_AD=2.820 a_DHA=171.099 symop: x,y,z a_YAH=171 6620 6722 " H PHE F 76 "<>" O ILE F 83 " d_HA=1.959 d_AD=2.955 a_DHA=164.394 symop: x,y,z a_YAH=153 6572 6765 " H LEU F 85 "<>" O ILE F 74 " d_HA=1.877 d_AD=2.893 a_DHA=178.498 symop: x,y,z a_YAH=171 3981 6439 " H VAL F 66 "<>" O LYS D 130 " d_HA=2.091 d_AD=3.096 a_DHA=171.851 symop: x,y,z a_YAH=162 4024 6403 " H THR D 132 "<>" O SER F 64 " d_HA=2.255 d_AD=3.186 a_DHA=151.761 symop: x,y,z a_YAH=136 4606 4672 " H LYS E 43 "<>" O ALA E 39 " d_HA=1.979 d_AD=2.964 a_DHA=161.251 symop: x,y,z a_YAH=158 5551 6600 " H TYR F 75 "<>" O ASN F 10 " d_HA=1.902 d_AD=2.857 a_DHA=155.307 symop: x,y,z a_YAH=163 5996 6074 " H LYS F 44 "<>" O ALA F 40 " d_HA=2.137 d_AD=3.099 a_DHA=156.887 symop: x,y,z a_YAH=149 6015 5955 " H TYR F 41 "<>" O ASP F 37 " d_HA=2.377 d_AD=3.308 a_DHA=151.804 symop: x,y,z a_YAH=137 5059 3546 " H VAL E 66 "<>" O LYS C 130 " d_HA=2.198 d_AD=3.197 a_DHA=167.513 symop: x,y,z a_YAH=163 5192 5385 " H LEU E 85 "<>" O ILE E 74 " d_HA=1.889 d_AD=2.881 a_DHA=164.521 symop: x,y,z a_YAH=168 5197 5380 " H ILE E 74 "<>" O LEU E 85 " d_HA=2.007 d_AD=2.949 a_DHA=152.412 symop: x,y,z a_YAH=151 6023 5785 " HH TYR F 41 "<>" OE1 GLN F 27 " d_HA=1.787 d_AD=2.721 a_DHA=159.600 symop: x,y,z a_YAH=138 6006 6096 " H GLU F 45 "<>" O TYR F 41 " d_HA=2.012 d_AD=3.009 a_DHA=167.210 symop: x,y,z a_YAH=147 5986 6052 " H LYS F 43 "<>" O ALA F 39 " d_HA=2.311 d_AD=3.300 a_DHA=163.768 symop: x,y,z a_YAH=154 6027 6113 " H PHE F 46 "<>" O ILE F 42 " d_HA=1.918 d_AD=2.919 a_DHA=168.026 symop: x,y,z a_YAH=161 5034 6288 " H CYS F 56 "<>" O TYR E 65 " d_HA=1.920 d_AD=2.917 a_DHA=168.006 symop: x,y,z a_YAH=161 5043 6285 " H TYR E 65 "<>" O CYS F 56 " d_HA=1.953 d_AD=2.946 a_DHA=165.348 symop: x,y,z a_YAH=154 5696 5749 " H CYS F 24 "<>" O ASP F 20 " d_HA=1.970 d_AD=2.947 a_DHA=159.550 symop: x,y,z a_YAH=144 6268 6787 " H PHE F 86 "<>" O HIS F 55 " d_HA=2.221 d_AD=3.207 a_DHA=163.946 symop: x,y,z a_YAH=159 4888 5407 " H PHE E 86 "<>" O HIS E 55 " d_HA=2.282 d_AD=3.238 a_DHA=156.161 symop: x,y,z a_YAH=145 4895 5399 " H HIS E 55 "<>" O PHE E 86 " d_HA=1.979 d_AD=2.933 a_DHA=155.525 symop: x,y,z a_YAH=161 4908 6414 " H CYS E 56 "<>" O TYR F 65 " d_HA=2.005 d_AD=3.006 a_DHA=169.107 symop: x,y,z a_YAH=168 5630 5701 " H ASP F 20 "<>" O GLU F 16 " d_HA=1.862 d_AD=2.869 a_DHA=169.880 symop: x,y,z a_YAH=159 5645 5710 " H ALA F 21 "<>" O MET F 17 " d_HA=2.140 d_AD=3.078 a_DHA=152.663 symop: x,y,z a_YAH=141 5662 5722 " H VAL F 22 "<>" O GLN F 18 " d_HA=2.344 d_AD=3.212 a_DHA=142.829 symop: x,y,z a_YAH=135 6577 6760 " H ILE F 74 "<>" O LEU F 85 " d_HA=1.922 d_AD=2.920 a_DHA=165.539 symop: x,y,z a_YAH=170 5615 5668 " H GLN F 18 "<>" O GLU F 15 " d_HA=2.297 d_AD=2.950 a_DHA=120.944 symop: x,y,z a_YAH=98 5615 5685 " H GLN F 19 "<>" O GLU F 15 " d_HA=1.820 d_AD=2.817 a_DHA=166.469 symop: x,y,z a_YAH=167 5587 5674 "HE21 GLN F 18 "<>" O MET F 13 " d_HA=2.021 d_AD=2.971 a_DHA=156.728 symop: x,y,z a_YAH=129 5575 6560 " H PHE F 73 "<>" O ASP F 12 " d_HA=2.065 d_AD=3.058 a_DHA=164.066 symop: x,y,z a_YAH=128 5580 6552 " H ASP F 12 "<>" O PHE F 73 " d_HA=1.797 d_AD=2.807 a_DHA=171.060 symop: x,y,z a_YAH=158 3999 6471 " HZ3 LYS D 130 "<>" NE2 HIS F 68 " d_HA=1.842 d_AD=2.790 a_DHA=153.359 symop: x,y,z a_YAH=134 a_YAH=119 3987 6435 " H LYS D 130 "<>" O VAL F 66 " d_HA=1.935 d_AD=2.933 a_DHA=166.295 symop: x,y,z a_YAH=154 3997 5579 " HZ1 LYS D 130 "<>" OD2 ASP F 12 " d_HA=1.816 d_AD=2.816 a_DHA=162.572 symop: x,y,z a_YAH=128 6095 6153 " HZ1 LYS F 48 "<>" OE2 GLU F 45 " d_HA=1.744 d_AD=2.714 a_DHA=155.044 symop: x,y,z a_YAH=92 3534 5078 " HG1 THR E 67 "<>" OG1 THR C 129 " d_HA=1.876 d_AD=2.840 a_DHA=169.714 symop: x,y,z a_YAH=130 a_YAH=119 5055 3552 " H LYS C 130 "<>" O VAL E 66 " d_HA=2.107 d_AD=2.966 a_DHA=141.019 symop: x,y,z a_YAH=156 5096 5102 " HD1 HIS E 68 "<>" O GLU E 69 " d_HA=1.752 d_AD=2.766 a_DHA=171.640 symop: x,y,z a_YAH=116 5180 4195 " H PHE E 73 "<>" O ASP E 12 " d_HA=1.939 d_AD=2.926 a_DHA=164.227 symop: x,y,z a_YAH=138 6090 6165 " H LYS F 49 "<>" O GLU F 45 " d_HA=2.244 d_AD=3.081 a_DHA=139.076 symop: x,y,z a_YAH=149 6046 6130 " H ASP F 47 "<>" O LYS F 43 " d_HA=2.185 d_AD=3.191 a_DHA=170.119 symop: x,y,z a_YAH=149 6068 6143 " H LYS F 48 "<>" O LYS F 44 " d_HA=2.354 d_AD=3.301 a_DHA=155.010 symop: x,y,z a_YAH=146 6063 6129 " HZ2 LYS F 43 "<>" OD2 ASP F 47 " d_HA=1.837 d_AD=2.857 a_DHA=169.682 symop: x,y,z a_YAH=121 6064 6244 " HZ3 LYS F 43 "<>" O TRP F 54 " d_HA=1.804 d_AD=2.729 a_DHA=149.033 symop: x,y,z a_YAH=141 5073 6062 " HZ1 LYS F 43 "<>" OG1 THR E 67 " d_HA=1.808 d_AD=2.781 a_DHA=159.284 symop: x,y,z a_YAH=127 a_YAH=125 5155 5425 " H LYS E 87 "<>" O HIS E 72 " d_HA=2.032 d_AD=2.962 a_DHA=152.019 symop: x,y,z a_YAH=160 5700 6176 " HZ2 LYS F 49 "<>" OD2 ASP F 20 " d_HA=1.938 d_AD=2.863 a_DHA=147.987 symop: x,y,z a_YAH=100 5700 6198 " HH TYR F 50 "<>" OD2 ASP F 20 " d_HA=2.193 d_AD=3.131 a_DHA=163.083 symop: x,y,z a_YAH=107 6105 6165 " H LYS F 49 "<>" O PHE F 46 " d_HA=2.487 d_AD=3.214 a_DHA=128.295 symop: x,y,z a_YAH=97 6105 6190 " H TYR F 50 "<>" O PHE F 46 " d_HA=1.969 d_AD=2.772 a_DHA=134.423 symop: x,y,z a_YAH=150 6105 6207 " H ASN F 51 "<>" O PHE F 46 " d_HA=2.752 d_AD=3.379 a_DHA=120.605 symop: x,y,z a_YAH=145 6230 6824 " H SER F 88 "<>" O THR F 53 " d_HA=1.909 d_AD=2.918 a_DHA=171.821 symop: x,y,z a_YAH=165 6275 6779 " H HIS F 55 "<>" O PHE F 86 " d_HA=2.048 d_AD=3.033 a_DHA=161.543 symop: x,y,z a_YAH=169 4850 5444 " H SER E 88 "<>" O THR E 53 " d_HA=2.279 d_AD=3.213 a_DHA=152.786 symop: x,y,z a_YAH=161 6535 6805 " H LYS F 87 "<>" O HIS F 72 " d_HA=2.144 d_AD=3.021 a_DHA=143.709 symop: x,y,z a_YAH=150 4901 6451 " HE2 HIS E 55 "<>" O THR F 67 " d_HA=2.195 d_AD=3.015 a_DHA=136.310 symop: x,y,z a_YAH=144 6488 6799 " H GLU F 69 "<>" O LYS F 87 " d_HA=2.015 d_AD=2.979 a_DHA=157.613 symop: x,y,z a_YAH=149 4682 6453 " HZ1 LYS E 43 "<>" OG1 THR F 67 " d_HA=1.899 d_AD=2.859 a_DHA=156.728 symop: x,y,z a_YAH=120 a_YAH=130 4683 4749 " HZ2 LYS E 43 "<>" OD2 ASP E 47 " d_HA=1.712 d_AD=2.732 a_DHA=173.301 symop: x,y,z a_YAH=106 4684 4864 " HZ3 LYS E 43 "<>" O TRP E 54 " d_HA=1.803 d_AD=2.741 a_DHA=151.650 symop: x,y,z a_YAH=134 4748 4875 " H TRP E 54 "<>" OD1 ASP E 47 " d_HA=1.756 d_AD=2.761 a_DHA=169.500 symop: x,y,z a_YAH=159 5604 5668 " H GLN F 18 "<>" O SER F 14 " d_HA=2.692 d_AD=3.594 a_DHA=148.054 symop: x,y,z a_YAH=101 5604 5650 " H MET F 17 "<>" O SER F 14 " d_HA=1.953 d_AD=2.792 a_DHA=138.323 symop: x,y,z a_YAH=167 5611 6511 " HG SER F 14 "<>" O ARG F 71 " d_HA=2.977 d_AD=3.615 a_DHA=124.450 symop: x,y,z a_YAH=124 6476 6482 " HD1 HIS F 68 "<>" O GLU F 69 " d_HA=1.751 d_AD=2.721 a_DHA=156.512 symop: x,y,z a_YAH=127 6482 6542 " H HIS F 72 "<>" O GLU F 69 " d_HA=2.358 d_AD=3.269 a_DHA=149.563 symop: x,y,z a_YAH=138 3946 6472 " H HIS F 68 "<>" O TYR D 128 " d_HA=1.780 d_AD=2.762 a_DHA=163.639 symop: x,y,z a_YAH=161 3955 6465 " H TYR D 128 "<>" O HIS F 68 " d_HA=1.910 d_AD=2.912 a_DHA=166.233 symop: x,y,z a_YAH=160 5578 6519 " H ARG F 71 "<>" OD1 ASP F 12 " d_HA=2.070 d_AD=3.000 a_DHA=150.563 symop: x,y,z a_YAH=121 3511 5092 " H HIS E 68 "<>" O TYR C 128 " d_HA=1.865 d_AD=2.870 a_DHA=170.235 symop: x,y,z a_YAH=156 3520 5085 " H TYR C 128 "<>" O HIS E 68 " d_HA=1.795 d_AD=2.769 a_DHA=158.922 symop: x,y,z a_YAH=169 5102 5162 " H HIS E 72 "<>" O GLU E 69 " d_HA=2.131 d_AD=3.047 a_DHA=149.529 symop: x,y,z a_YAH=138 6125 6207 " H ASN F 51 "<>" O ASP F 47 " d_HA=2.609 d_AD=3.279 a_DHA=123.860 symop: x,y,z a_YAH=106 6128 6255 " H TRP F 54 "<>" OD1 ASP F 47 " d_HA=2.133 d_AD=3.130 a_DHA=166.149 symop: x,y,z a_YAH=150 5108 5419 " H GLU E 69 "<>" O LYS E 87 " d_HA=1.967 d_AD=2.937 a_DHA=158.848 symop: x,y,z a_YAH=159 6202 6260 " HE1 TRP F 54 "<>" O ASN F 51 " d_HA=2.091 d_AD=2.856 a_DHA=130.269 symop: x,y,z a_YAH=138 6234 6833 " H THR F 53 "<>" OXT GLY F 89 " d_HA=1.767 d_AD=2.759 a_DHA=162.866 symop: x,y,z a_YAH=116 6237 6832 " HG1 THR F 53 "<>" O GLY F 89 " d_HA=1.582 d_AD=2.566 a_DHA=168.238 symop: x,y,z a_YAH=121 4854 5453 " H THR E 53 "<>" OXT GLY E 89 " d_HA=1.784 d_AD=2.734 a_DHA=153.400 symop: x,y,z a_YAH=159 4857 5453 " HG1 THR E 53 "<>" OXT GLY E 89 " d_HA=1.815 d_AD=2.800 a_DHA=171.705 symop: x,y,z a_YAH=112 3911 6501 " H THR F 70 "<>" O LEU D 126 " d_HA=1.941 d_AD=2.873 a_DHA=151.864 symop: x,y,z a_YAH=177 3911 6504 " HG1 THR F 70 "<>" O LEU D 126 " d_HA=1.752 d_AD=2.698 a_DHA=164.042 symop: x,y,z a_YAH=128 3476 5121 " H THR E 70 "<>" O LEU C 126 " d_HA=1.796 d_AD=2.779 a_DHA=161.343 symop: x,y,z a_YAH=157 2764 2807 " H ASN B 85 "<>" O TRP B 83 " d_HA=2.899 d_AD=3.543 a_DHA=122.187 symop: x,y,z a_YAH=101 2764 3683 " H SER D 111 "<>" O TRP B 83 " d_HA=2.116 d_AD=3.123 a_DHA=170.355 symop: x,y,z a_YAH=141 3687 3691 " HG SER D 111 "<>" O VAL D 112 " d_HA=2.223 d_AD=3.129 a_DHA=155.184 symop: x,y,z a_YAH=132 2788 2832 " H THR B 87 "<>" O ASN B 84 " d_HA=1.890 d_AD=2.861 a_DHA=159.839 symop: x,y,z a_YAH=141 2788 2847 " H ASP B 88 "<>" O ASN B 84 " d_HA=1.941 d_AD=2.902 a_DHA=156.765 symop: x,y,z a_YAH=145 2798 2830 "HD22 ASN B 84 "<>" OG1 THR B 87 " d_HA=2.482 d_AD=3.366 a_DHA=145.760 symop: x,y,z a_YAH=108 a_YAH=130 2793 2846 " H ASN B 84 "<>" OD2 ASP B 88 " d_HA=1.994 d_AD=3.007 a_DHA=172.524 symop: x,y,z a_YAH=125 2835 2845 " HG1 THR B 87 "<>" OD1 ASP B 88 " d_HA=2.466 d_AD=3.430 a_DHA=173.857 symop: x,y,z a_YAH=91 5785 6023 " HH TYR F 41 "<>" OE1 GLN F 27 " d_HA=1.787 d_AD=2.721 a_DHA=159.600 symop: x,y,z a_YAH=138 968 2644 " H GLY B 74 "<>" OE1 GLN A 69 " d_HA=1.854 d_AD=2.801 a_DHA=154.224 symop: x,y,z a_YAH=127 3866 3886 " H LYS D 123 "<>" OE1 GLU D 124 " d_HA=2.189 d_AD=3.146 a_DHA=154.943 symop: x,y,z a_YAH=147 3746 3731 " H VAL D 115 "<>" OD1 ASN D 114 " d_HA=2.181 d_AD=2.854 a_DHA=122.404 symop: x,y,z a_YAH=112 2735 3707 " H CYS B 81 "<>" O TYR D 113 " d_HA=2.442 d_AD=3.456 a_DHA=178.230 symop: x,y,z a_YAH=136 2732 3716 " H TYR D 113 "<>" O CYS B 81 " d_HA=1.942 d_AD=2.821 a_DHA=143.292 symop: x,y,z a_YAH=163 2775 3680 " H TRP B 83 "<>" O SER D 111 " d_HA=2.106 d_AD=3.025 a_DHA=149.150 symop: x,y,z a_YAH=174 684 741 " H GLN A 56 "<>" O THR A 53 " d_HA=1.984 d_AD=2.857 a_DHA=143.186 symop: x,y,z a_YAH=103 2845 3185 " H ALA B 110 "<>" OD1 ASP B 88 " d_HA=1.740 d_AD=2.739 a_DHA=166.694 symop: x,y,z a_YAH=144 752 797 " H TYR A 59 "<>" O LYS A 57 " d_HA=1.844 d_AD=2.766 a_DHA=149.383 symop: x,y,z a_YAH=108 826 3183 " HZ2 LYS A 60 "<>" O ALA B 110 " d_HA=1.947 d_AD=2.857 a_DHA=147.677 symop: x,y,z a_YAH=123 827 2846 " HZ3 LYS A 60 "<>" OD2 ASP B 88 " d_HA=1.853 d_AD=2.856 a_DHA=164.545 symop: x,y,z a_YAH=101 774 1589 " H VAL A 111 "<>" O PRO A 58 " d_HA=2.093 d_AD=3.003 a_DHA=148.498 symop: x,y,z a_YAH=149 3198 2383 " H VAL B 111 "<>" O PRO B 58 " d_HA=2.708 d_AD=3.412 a_DHA=127.377 symop: x,y,z a_YAH=153 3431 3451 " H LYS C 123 "<>" OE1 GLU C 124 " d_HA=1.806 d_AD=2.810 a_DHA=166.296 symop: x,y,z a_YAH=150 1017 3442 " HZ2 LYS C 123 "<>" O GLY A 72 " d_HA=2.074 d_AD=3.073 a_DHA=165.170 symop: x,y,z a_YAH=114 3397 3441 " HZ1 LYS C 123 "<>" O PRO C 121 " d_HA=1.786 d_AD=2.717 a_DHA=149.489 symop: x,y,z a_YAH=149 2573 2617 " H ASN B 71 "<>" O GLN B 69 " d_HA=2.315 d_AD=3.099 a_DHA=133.529 symop: x,y,z a_YAH=107 964 1008 " H ASN A 71 "<>" O GLN A 69 " d_HA=1.879 d_AD=2.824 a_DHA=154.053 symop: x,y,z a_YAH=94 2626 3877 " HZ2 LYS D 123 "<>" O GLY B 72 " d_HA=1.785 d_AD=2.776 a_DHA=163.185 symop: x,y,z a_YAH=134 970 2643 " H GLN A 69 "<>" O GLY B 74 " d_HA=2.068 d_AD=3.082 a_DHA=173.136 symop: x,y,z a_YAH=163 3832 3876 " HZ1 LYS D 123 "<>" O PRO D 121 " d_HA=1.785 d_AD=2.704 a_DHA=148.047 symop: x,y,z a_YAH=150 387 442 " H VAL A 37 "<>" O HIS A 34 " d_HA=2.796 d_AD=3.740 a_DHA=155.399 symop: x,y,z a_YAH=97 520 582 " H GLU A 46 "<>" O GLY A 42 " d_HA=1.942 d_AD=2.918 a_DHA=160.483 symop: x,y,z a_YAH=149 2710 3764 " H GLN D 116 "<>" O SER B 79 " d_HA=2.053 d_AD=2.986 a_DHA=151.535 symop: x,y,z a_YAH=120 560 621 " H LEU A 49 "<>" O VAL A 45 " d_HA=2.586 d_AD=3.403 a_DHA=137.502 symop: x,y,z a_YAH=135 576 621 " H LEU A 49 "<>" O GLU A 46 " d_HA=2.231 d_AD=2.976 a_DHA=129.066 symop: x,y,z a_YAH=105 576 639 " H THR A 50 "<>" O GLU A 46 " d_HA=2.233 d_AD=3.215 a_DHA=162.039 symop: x,y,z a_YAH=163 591 642 " HG1 THR A 50 "<>" O ASN A 47 " d_HA=2.034 d_AD=2.894 a_DHA=146.569 symop: x,y,z a_YAH=124 591 653 " H VAL A 51 "<>" O ASN A 47 " d_HA=2.750 d_AD=3.753 a_DHA=171.606 symop: x,y,z a_YAH=153 635 704 " H LYS A 54 "<>" O THR A 50 " d_HA=1.953 d_AD=2.929 a_DHA=159.948 symop: x,y,z a_YAH=164 635 688 " H THR A 53 "<>" O THR A 50 " d_HA=2.623 d_AD=3.326 a_DHA=126.471 symop: x,y,z a_YAH=106 831 2752 " H TYR B 82 "<>" O TYR A 61 " d_HA=1.852 d_AD=2.832 a_DHA=161.450 symop: x,y,z a_YAH=152 875 2721 " H VAL A 63 "<>" O SER B 80 " d_HA=2.243 d_AD=3.242 a_DHA=167.622 symop: x,y,z a_YAH=175 616 670 " H LEU A 52 "<>" O LEU A 49 " d_HA=2.857 d_AD=3.680 a_DHA=139.147 symop: x,y,z a_YAH=106 616 688 " H THR A 53 "<>" O LEU A 49 " d_HA=2.509 d_AD=3.444 a_DHA=153.305 symop: x,y,z a_YAH=153 665 848 " HH TYR A 61 "<>" O LEU A 52 " d_HA=2.855 d_AD=3.771 a_DHA=159.255 symop: x,y,z a_YAH=116 840 2743 " H TYR A 61 "<>" O TYR B 82 " d_HA=2.145 d_AD=3.111 a_DHA=159.031 symop: x,y,z a_YAH=135 857 1528 " H ILE A 62 "<>" O PHE A 107 " d_HA=2.015 d_AD=2.998 a_DHA=162.094 symop: x,y,z a_YAH=148 809 1560 " H LEU A 109 "<>" O LYS A 60 " d_HA=1.897 d_AD=2.894 a_DHA=166.092 symop: x,y,z a_YAH=148 725 769 " HZ2 LYS A 57 "<>" OE2 GLU A 55 " d_HA=1.813 d_AD=2.788 a_DHA=155.922 symop: x,y,z a_YAH=91 815 1555 " H LYS A 60 "<>" O LEU A 109 " d_HA=1.804 d_AD=2.785 a_DHA=160.814 symop: x,y,z a_YAH=171 1189 1221 "HD22 ASN A 84 "<>" OG1 THR A 87 " d_HA=2.884 d_AD=3.837 a_DHA=156.837 symop: x,y,z a_YAH=158 a_YAH=91 1236 1576 " H ALA A 110 "<>" OD1 ASP A 88 " d_HA=1.797 d_AD=2.811 a_DHA=174.668 symop: x,y,z a_YAH=118 1237 2434 " HZ1 LYS B 60 "<>" OD2 ASP A 88 " d_HA=2.987 d_AD=3.706 a_DHA=128.775 symop: x,y,z a_YAH=101 1226 1236 " HG1 THR A 87 "<>" OD1 ASP A 88 " d_HA=1.921 d_AD=2.854 a_DHA=158.497 symop: x,y,z a_YAH=127 1948 1991 "HE21 GLN B 33 "<>" O ALA B 31 " d_HA=1.800 d_AD=2.801 a_DHA=167.840 symop: x,y,z a_YAH=156 1967 3014 " H TYR B 32 "<>" OG1 THR B 99 " d_HA=1.865 d_AD=2.861 a_DHA=167.972 symop: x,y,z a_YAH=115 a_YAH=128 1066 1975 " HH TYR B 32 "<>" NE2 HIS A 76 " d_HA=1.997 d_AD=2.932 a_DHA=162.288 symop: x,y,z a_YAH=116 a_YAH=126 1046 3378 " H LEU A 75 "<>" O ILE C 120 " d_HA=1.998 d_AD=2.984 a_DHA=162.847 symop: x,y,z a_YAH=143 2979 3016 " H THR B 99 "<>" OD1 ASN B 97 " d_HA=1.935 d_AD=2.932 a_DHA=166.905 symop: x,y,z a_YAH=106 2979 3019 " HG1 THR B 99 "<>" OD1 ASN B 97 " d_HA=1.822 d_AD=2.743 a_DHA=156.754 symop: x,y,z a_YAH=134 2596 3012 " H LYS B 70 "<>" O THR B 99 " d_HA=1.786 d_AD=2.799 a_DHA=176.190 symop: x,y,z a_YAH=134 2556 3052 " H TYR B 101 "<>" O MET B 68 " d_HA=1.976 d_AD=2.948 a_DHA=158.964 symop: x,y,z a_YAH=167 1034 2579 " H GLN B 69 "<>" O GLY A 74 " d_HA=2.171 d_AD=3.176 a_DHA=169.163 symop: x,y,z a_YAH=160 2606 2965 " HZ1 LYS B 70 "<>" OE1 GLU B 96 " d_HA=1.669 d_AD=2.681 a_DHA=167.092 symop: x,y,z a_YAH=123 2607 2976 " HZ2 LYS B 70 "<>" O ASN B 97 " d_HA=1.887 d_AD=2.768 a_DHA=143.443 symop: x,y,z a_YAH=145 2981 3026 " H ASN B 97 "<>" O MET B 100 " d_HA=2.118 d_AD=3.098 a_DHA=162.294 symop: x,y,z a_YAH=151 928 2676 " H HIS B 76 "<>" O ILE A 67 " d_HA=1.989 d_AD=2.872 a_DHA=144.091 symop: x,y,z a_YAH=140 2650 3818 " H ILE D 120 "<>" O LEU B 75 " d_HA=1.894 d_AD=2.897 a_DHA=167.937 symop: x,y,z a_YAH=167 2655 3813 " H LEU B 75 "<>" O ILE D 120 " d_HA=2.078 d_AD=3.046 a_DHA=158.739 symop: x,y,z a_YAH=153 463 2672 "HD21 ASN A 38 "<>" ND1 HIS B 76 " d_HA=2.069 d_AD=2.983 a_DHA=149.707 symop: x,y,z a_YAH=138 a_YAH=109 416 478 "HD22 ASN A 39 "<>" O LYS A 36 " d_HA=1.941 d_AD=2.900 a_DHA=157.402 symop: x,y,z a_YAH=117 438 493 " H TRP A 40 "<>" O VAL A 37 " d_HA=2.130 d_AD=2.857 a_DHA=127.112 symop: x,y,z a_YAH=125 438 510 " H THR A 41 "<>" O VAL A 37 " d_HA=2.541 d_AD=3.517 a_DHA=161.844 symop: x,y,z a_YAH=150 454 513 " HG1 THR A 41 "<>" O ASN A 38 " d_HA=2.254 d_AD=2.909 a_DHA=124.217 symop: x,y,z a_YAH=117 454 521 " H GLY A 42 "<>" O ASN A 38 " d_HA=2.390 d_AD=3.362 a_DHA=160.395 symop: x,y,z a_YAH=138 468 533 " H GLN A 43 "<>" O ASN A 39 " d_HA=1.821 d_AD=2.816 a_DHA=166.593 symop: x,y,z a_YAH=161 482 548 " H VAL A 44 "<>" O TRP A 40 " d_HA=1.881 d_AD=2.869 a_DHA=164.353 symop: x,y,z a_YAH=155 506 564 " H VAL A 45 "<>" O THR A 41 " d_HA=2.356 d_AD=3.324 a_DHA=159.363 symop: x,y,z a_YAH=143 527 596 " H ASN A 47 "<>" O GLN A 43 " d_HA=2.050 d_AD=3.058 a_DHA=172.549 symop: x,y,z a_YAH=144 544 608 " H CYS A 48 "<>" O VAL A 44 " d_HA=2.415 d_AD=3.424 a_DHA=172.110 symop: x,y,z a_YAH=148 871 2724 " H SER B 80 "<>" O VAL A 63 " d_HA=2.533 d_AD=3.287 a_DHA=131.132 symop: x,y,z a_YAH=164 903 2700 " H ALA A 65 "<>" O ALA B 78 " d_HA=2.029 d_AD=3.014 a_DHA=163.400 symop: x,y,z a_YAH=145 852 1536 " H PHE A 107 "<>" O ILE A 62 " d_HA=1.854 d_AD=2.839 a_DHA=162.628 symop: x,y,z a_YAH=162 891 1501 " H THR A 64 "<>" O SER A 105 " d_HA=2.033 d_AD=3.039 a_DHA=169.786 symop: x,y,z a_YAH=159 1245 1549 " H GLY A 108 "<>" O GLY A 89 " d_HA=1.973 d_AD=2.946 a_DHA=159.675 symop: x,y,z a_YAH=142 92 157 " HG1 THR A 18 "<>" OD1 ASP A 14 " d_HA=2.753 d_AD=3.585 a_DHA=144.709 symop: x,y,z a_YAH=160 805 1219 " HH TYR A 59 "<>" O THR A 87 " d_HA=2.168 d_AD=3.131 a_DHA=170.882 symop: x,y,z a_YAH=140 1246 1548 " H GLY A 89 "<>" O GLY A 108 " d_HA=1.959 d_AD=2.957 a_DHA=166.834 symop: x,y,z a_YAH=161 1155 3248 " H SER C 111 "<>" O TRP A 83 " d_HA=2.163 d_AD=3.138 a_DHA=160.891 symop: x,y,z a_YAH=150 1155 1203 "HD22 ASN A 85 "<>" O TRP A 83 " d_HA=2.358 d_AD=3.175 a_DHA=137.177 symop: x,y,z a_YAH=126 1179 1212 " H ASP A 86 "<>" O ASN A 84 " d_HA=1.858 d_AD=2.793 a_DHA=152.318 symop: x,y,z a_YAH=102 1179 1238 " H ASP A 88 "<>" O ASN A 84 " d_HA=1.987 d_AD=2.964 a_DHA=161.348 symop: x,y,z a_YAH=159 1184 1237 " H ASN A 84 "<>" OD2 ASP A 88 " d_HA=1.805 d_AD=2.824 a_DHA=174.316 symop: x,y,z a_YAH=116 10 796 " H2 GLN A 9 "<>" OH TYR A 59 " d_HA=2.583 d_AD=3.468 a_DHA=145.795 symop: x,y,z a_YAH=133 a_YAH=118 5691 5737 "HE21 GLN F 19 "<>" OD1 ASP F 23 " d_HA=1.739 d_AD=2.725 a_DHA=158.961 symop: x,y,z a_YAH=138 1210 1223 " H THR A 87 "<>" OD1 ASP A 86 " d_HA=2.176 d_AD=2.904 a_DHA=127.217 symop: x,y,z a_YAH=123 2017 2041 " HZ1 LYS B 36 "<>" OD2 ASP B 35 " d_HA=1.703 d_AD=2.672 a_DHA=155.266 symop: x,y,z a_YAH=133 1979 2031 " H LYS B 36 "<>" O GLN B 33 " d_HA=2.350 d_AD=3.315 a_DHA=159.186 symop: x,y,z a_YAH=118 1979 2051 " H VAL B 37 "<>" O GLN B 33 " d_HA=2.577 d_AD=3.449 a_DHA=144.026 symop: x,y,z a_YAH=150 1996 2051 " H VAL B 37 "<>" O HIS B 34 " d_HA=2.690 d_AD=3.436 a_DHA=130.537 symop: x,y,z a_YAH=99 2072 3367 "HD21 ASN B 38 "<>" OD1 ASN C 119 " d_HA=1.937 d_AD=2.885 a_DHA=155.187 symop: x,y,z a_YAH=116 1041 3383 " H ILE C 120 "<>" O LEU A 75 " d_HA=1.966 d_AD=2.925 a_DHA=155.549 symop: x,y,z a_YAH=167 1071 2066 " HD1 HIS A 76 "<>" OD1 ASN B 38 " d_HA=1.895 d_AD=2.833 a_DHA=151.317 symop: x,y,z a_YAH=102 1901 1939 " H ASN B 30 "<>" O ILE B 27 " d_HA=2.947 d_AD=3.930 a_DHA=164.248 symop: x,y,z a_YAH=113 2561 3043 " H MET B 68 "<>" O TYR B 101 " d_HA=1.934 d_AD=2.950 a_DHA=177.411 symop: x,y,z a_YAH=166 1060 2542 " H ILE B 67 "<>" O HIS A 76 " d_HA=2.140 d_AD=3.098 a_DHA=156.507 symop: x,y,z a_YAH=141 1067 2537 " H HIS A 76 "<>" O ILE B 67 " d_HA=2.298 d_AD=3.195 a_DHA=147.122 symop: x,y,z a_YAH=150 2937 3067 " H CYS B 102 "<>" O TRP B 95 " d_HA=1.987 d_AD=2.811 a_DHA=136.395 symop: x,y,z a_YAH=145 2948 3064 " H TRP B 95 "<>" O CYS B 102 " d_HA=1.931 d_AD=2.924 a_DHA=165.544 symop: x,y,z a_YAH=139 2693 3785 " HG1 THR B 77 "<>" O THR D 118 " d_HA=1.796 d_AD=2.740 a_DHA=162.884 symop: x,y,z a_YAH=152 2669 933 " H ILE A 67 "<>" O HIS B 76 " d_HA=1.983 d_AD=2.995 a_DHA=171.618 symop: x,y,z a_YAH=146 2686 3789 " H THR D 118 "<>" O THR B 77 " d_HA=2.943 d_AD=3.706 a_DHA=133.258 symop: x,y,z a_YAH=106 407 422 " H LYS A 36 "<>" OD1 ASP A 35 " d_HA=1.866 d_AD=2.806 a_DHA=151.675 symop: x,y,z a_YAH=113 442 387 " H VAL A 37 "<>" O HIS A 34 " d_HA=2.796 d_AD=3.740 a_DHA=155.399 symop: x,y,z a_YAH=97 901 2702 " H ALA B 78 "<>" O ALA A 65 " d_HA=2.268 d_AD=3.161 a_DHA=145.800 symop: x,y,z a_YAH=148 933 2669 " H ILE A 67 "<>" O HIS B 76 " d_HA=1.983 d_AD=2.995 a_DHA=171.618 symop: x,y,z a_YAH=146 183 235 " H ILE A 23 "<>" O LYS A 20 " d_HA=1.854 d_AD=2.808 a_DHA=155.019 symop: x,y,z a_YAH=125 205 255 " H GLU A 24 "<>" O GLU A 21 " d_HA=2.687 d_AD=3.426 a_DHA=129.954 symop: x,y,z a_YAH=97 205 271 " HG1 THR A 25 "<>" O GLU A 21 " d_HA=2.493 d_AD=3.450 a_DHA=169.292 symop: x,y,z a_YAH=131 887 1504 " H SER A 105 "<>" O THR A 64 " d_HA=2.120 d_AD=3.106 a_DHA=163.311 symop: x,y,z a_YAH=155 916 1466 " H MET A 66 "<>" O ILE A 103 " d_HA=1.887 d_AD=2.896 a_DHA=171.972 symop: x,y,z a_YAH=162 128 189 " H LYS A 20 "<>" O LYS A 17 " d_HA=2.134 d_AD=2.842 a_DHA=125.241 symop: x,y,z a_YAH=105 128 211 " H GLU A 21 "<>" O LYS A 17 " d_HA=2.016 d_AD=2.980 a_DHA=157.871 symop: x,y,z a_YAH=161 164 222 " H ALA A 22 "<>" O ILE A 19 " d_HA=2.366 d_AD=3.250 a_DHA=145.458 symop: x,y,z a_YAH=98 1263 1516 " H VAL A 106 "<>" O CYS A 91 " d_HA=1.879 d_AD=2.880 a_DHA=168.470 symop: x,y,z a_YAH=158 101 169 " H ILE A 19 "<>" O VAL A 15 " d_HA=1.997 d_AD=2.941 a_DHA=153.657 symop: x,y,z a_YAH=157 117 189 " H LYS A 20 "<>" O SER A 16 " d_HA=2.429 d_AD=3.255 a_DHA=138.206 symop: x,y,z a_YAH=137 117 169 " H ILE A 19 "<>" O SER A 16 " d_HA=2.702 d_AD=3.332 a_DHA=120.320 symop: x,y,z a_YAH=95 89 157 " HG1 THR A 18 "<>" O ASP A 14 " d_HA=2.775 d_AD=3.392 a_DHA=122.364 symop: x,y,z a_YAH=101 89 134 " H LYS A 17 "<>" O ASP A 14 " d_HA=2.435 d_AD=3.120 a_DHA=123.972 symop: x,y,z a_YAH=110 89 154 " H THR A 18 "<>" O ASP A 14 " d_HA=2.166 d_AD=3.177 a_DHA=172.622 symop: x,y,z a_YAH=150 144 210 " HZ1 LYS A 17 "<>" OE2 GLU A 21 " d_HA=1.841 d_AD=2.713 a_DHA=139.836 symop: x,y,z a_YAH=158 1254 3335 "HE21 GLN C 116 "<>" OG SER A 90 " d_HA=2.573 d_AD=3.523 a_DHA=156.854 symop: x,y,z a_YAH=106 a_YAH=143 1266 1512 " H CYS A 91 "<>" O VAL A 106 " d_HA=1.978 d_AD=2.981 a_DHA=168.868 symop: x,y,z a_YAH=157 42 105 " H VAL A 15 "<>" O ILE A 11 " d_HA=1.865 d_AD=2.874 a_DHA=174.120 symop: x,y,z a_YAH=169 42 94 " H ASP A 14 "<>" O ILE A 11 " d_HA=2.567 d_AD=3.221 a_DHA=122.586 symop: x,y,z a_YAH=104 61 120 " H SER A 16 "<>" O VAL A 12 " d_HA=2.075 d_AD=2.864 a_DHA=132.769 symop: x,y,z a_YAH=124 22 65 " H VAL A 12 "<>" O PHE A 10 " d_HA=2.570 d_AD=3.271 a_DHA=126.365 symop: x,y,z a_YAH=107 1202 3245 "HD21 ASN A 85 "<>" O SER C 111 " d_HA=2.166 d_AD=2.948 a_DHA=132.486 symop: x,y,z a_YAH=113 4114 5261 " H TYR E 77 "<>" O VAL E 7 " d_HA=1.852 d_AD=2.860 a_DHA=172.065 symop: x,y,z a_YAH=157 4118 5252 " H VAL E 7 "<>" O TYR E 77 " d_HA=1.952 d_AD=2.896 a_DHA=152.635 symop: x,y,z a_YAH=146 4080 5293 " H GLY E 79 "<>" O LYS E 5 " d_HA=2.318 d_AD=3.313 a_DHA=167.210 symop: x,y,z a_YAH=154 2087 3495 "HD22 ASN B 39 "<>" O VAL C 127 " d_HA=2.297 d_AD=3.023 a_DHA=127.792 symop: -x+1,-y+1,z a_YAH=169 2025 2082 " H ASN B 39 "<>" O LYS B 36 " d_HA=2.114 d_AD=2.943 a_DHA=137.460 symop: x,y,z a_YAH=123 2025 2102 " H TRP B 40 "<>" O LYS B 36 " d_HA=2.154 d_AD=3.101 a_DHA=154.755 symop: x,y,z a_YAH=151 2063 2130 " H GLY B 42 "<>" O ASN B 38 " d_HA=2.221 d_AD=3.118 a_DHA=146.550 symop: x,y,z a_YAH=119 2077 2142 " H GLN B 43 "<>" O ASN B 39 " d_HA=2.051 d_AD=2.947 a_DHA=145.661 symop: x,y,z a_YAH=135 2047 2119 " H THR B 41 "<>" O VAL B 37 " d_HA=1.964 d_AD=2.955 a_DHA=165.518 symop: x,y,z a_YAH=156 2091 2157 " H VAL B 44 "<>" O TRP B 40 " d_HA=1.924 d_AD=2.933 a_DHA=173.501 symop: x,y,z a_YAH=173 1077 2122 " HG1 THR B 41 "<>" O THR A 77 " d_HA=2.766 d_AD=3.724 a_DHA=172.185 symop: x,y,z a_YAH=105 1081 3350 " H THR A 77 "<>" O THR C 118 " d_HA=1.921 d_AD=2.800 a_DHA=142.986 symop: x,y,z a_YAH=157 1839 1906 " H ILE B 27 "<>" O ILE B 23 " d_HA=1.928 d_AD=2.931 a_DHA=168.951 symop: x,y,z a_YAH=167 1839 1891 " H THR B 26 "<>" O ILE B 23 " d_HA=2.543 d_AD=3.203 a_DHA=122.692 symop: x,y,z a_YAH=102 1858 1921 " H GLY B 28 "<>" O GLU B 24 " d_HA=2.470 d_AD=3.179 a_DHA=126.793 symop: x,y,z a_YAH=110 2520 3080 " H ILE B 103 "<>" O MET B 66 " d_HA=2.123 d_AD=3.131 a_DHA=169.686 symop: x,y,z a_YAH=143 1093 2510 " H ALA A 78 "<>" O ALA B 65 " d_HA=2.357 d_AD=3.099 a_DHA=129.151 symop: x,y,z a_YAH=148 1079 3357 " HG1 THR C 118 "<>" OG1 THR A 77 " d_HA=1.927 d_AD=2.893 a_DHA=170.090 symop: x,y,z a_YAH=107 a_YAH=142 1862 2953 " HE1 TRP B 95 "<>" OE1 GLU B 24 " d_HA=1.813 d_AD=2.798 a_DHA=158.903 symop: x,y,z a_YAH=99 2525 3075 " H MET B 66 "<>" O ILE B 103 " d_HA=1.824 d_AD=2.830 a_DHA=170.132 symop: x,y,z a_YAH=158 2897 3098 " H VAL B 104 "<>" O VAL B 93 " d_HA=2.002 d_AD=3.011 a_DHA=170.850 symop: x,y,z a_YAH=153 2712 3764 " H GLN D 116 "<>" OG SER B 79 " d_HA=2.418 d_AD=3.090 a_DHA=122.874 symop: x,y,z a_YAH=110 a_YAH=110 3758 3792 " HG1 THR D 118 "<>" O GLN D 116 " d_HA=2.919 d_AD=3.861 a_DHA=164.845 symop: x,y,z a_YAH=140 3764 2710 " H GLN D 116 "<>" O SER B 79 " d_HA=2.053 d_AD=2.986 a_DHA=151.535 symop: x,y,z a_YAH=120 292 330 " H ASN A 30 "<>" O ILE A 27 " d_HA=2.083 d_AD=2.859 a_DHA=131.495 symop: x,y,z a_YAH=127 318 335 "HD22 ASN A 30 "<>" O GLY A 29 " d_HA=1.754 d_AD=2.770 a_DHA=175.381 symop: x,y,z a_YAH=111 3731 3746 " H VAL D 115 "<>" OD1 ASN D 114 " d_HA=2.181 d_AD=2.854 a_DHA=122.404 symop: x,y,z a_YAH=112 947 1443 " H TYR A 101 "<>" O MET A 68 " d_HA=1.884 d_AD=2.903 a_DHA=177.137 symop: x,y,z a_YAH=162 911 1471 " H ILE A 103 "<>" O MET A 66 " d_HA=2.370 d_AD=3.283 a_DHA=148.929 symop: x,y,z a_YAH=149 952 1434 " H MET A 68 "<>" O TYR A 101 " d_HA=2.082 d_AD=3.093 a_DHA=173.386 symop: x,y,z a_YAH=161 1288 1489 " H VAL A 104 "<>" O VAL A 93 " d_HA=2.051 d_AD=3.064 a_DHA=173.984 symop: x,y,z a_YAH=160 1339 1455 " H TRP A 95 "<>" O CYS A 102 " d_HA=1.996 d_AD=2.997 a_DHA=168.582 symop: x,y,z a_YAH=143 1292 1485 " H VAL A 93 "<>" O VAL A 104 " d_HA=1.912 d_AD=2.907 a_DHA=164.783 symop: x,y,z a_YAH=170 77 134 " H LYS A 17 "<>" O ASP A 13 " d_HA=2.530 d_AD=3.464 a_DHA=152.277 symop: x,y,z a_YAH=136 3293 1108 " HG SER A 79 "<>" O ASN C 114 " d_HA=1.949 d_AD=2.793 a_DHA=143.296 symop: x,y,z a_YAH=113 3280 3302 "HD21 ASN C 114 "<>" OH TYR C 113 " d_HA=2.341 d_AD=3.128 a_DHA=133.999 symop: x,y,z a_YAH=96 a_YAH=126 3303 4207 "HD22 ASN C 114 "<>" O MET E 13 " d_HA=1.768 d_AD=2.750 a_DHA=161.887 symop: -x+1,-y+1,z a_YAH=145 4235 4288 " H GLN E 18 "<>" O GLU E 15 " d_HA=2.107 d_AD=2.913 a_DHA=134.935 symop: x,y,z a_YAH=106 4235 4305 " H GLN E 19 "<>" O GLU E 15 " d_HA=1.913 d_AD=2.887 a_DHA=158.912 symop: x,y,z a_YAH=163 2115 2173 " H VAL B 45 "<>" O THR B 41 " d_HA=2.572 d_AD=3.549 a_DHA=161.271 symop: x,y,z a_YAH=138 2129 2191 " H GLU B 46 "<>" O GLY B 42 " d_HA=2.117 d_AD=3.107 a_DHA=163.712 symop: x,y,z a_YAH=145 1108 3293 " HG SER A 79 "<>" O ASN C 114 " d_HA=1.949 d_AD=2.793 a_DHA=143.296 symop: x,y,z a_YAH=113 1814 1877 " H THR B 25 "<>" O GLU B 21 " d_HA=1.819 d_AD=2.745 a_DHA=150.166 symop: x,y,z a_YAH=155 1814 1880 " HG1 THR B 25 "<>" O GLU B 21 " d_HA=1.681 d_AD=2.624 a_DHA=161.515 symop: x,y,z a_YAH=125 1829 1891 " H THR B 26 "<>" O ALA B 22 " d_HA=2.272 d_AD=3.181 a_DHA=149.135 symop: x,y,z a_YAH=141 1829 1894 " HG1 THR B 26 "<>" O ALA B 22 " d_HA=1.904 d_AD=2.865 a_DHA=169.739 symop: x,y,z a_YAH=156 2153 2205 " H ASN B 47 "<>" O VAL B 44 " d_HA=2.898 d_AD=3.703 a_DHA=137.537 symop: x,y,z a_YAH=100 2153 2217 " H CYS B 48 "<>" O VAL B 44 " d_HA=2.240 d_AD=3.253 a_DHA=176.791 symop: x,y,z a_YAH=149 1115 2480 " H SER A 80 "<>" O VAL B 63 " d_HA=2.509 d_AD=3.384 a_DHA=144.564 symop: x,y,z a_YAH=165 1792 1864 " H GLU B 24 "<>" O LYS B 20 " d_HA=1.957 d_AD=2.968 a_DHA=175.944 symop: x,y,z a_YAH=166 1773 1844 " H ILE B 23 "<>" O ILE B 19 " d_HA=1.935 d_AD=2.934 a_DHA=167.219 symop: x,y,z a_YAH=164 2496 3113 " H SER B 105 "<>" O THR B 64 " d_HA=1.878 d_AD=2.890 a_DHA=170.543 symop: x,y,z a_YAH=158 2500 3110 " H THR B 64 "<>" O SER B 105 " d_HA=1.940 d_AD=2.944 a_DHA=169.922 symop: x,y,z a_YAH=161 1726 1798 " H LYS B 20 "<>" O SER B 16 " d_HA=2.090 d_AD=3.042 a_DHA=155.382 symop: x,y,z a_YAH=136 2872 3125 " H VAL B 106 "<>" O CYS B 91 " d_HA=1.909 d_AD=2.911 a_DHA=169.203 symop: x,y,z a_YAH=144 2901 3094 " H VAL B 93 "<>" O VAL B 104 " d_HA=1.903 d_AD=2.901 a_DHA=167.201 symop: x,y,z a_YAH=155 2890 3112 " HG1 THR B 92 "<>" OG SER B 105 " d_HA=1.764 d_AD=2.692 a_DHA=159.293 symop: x,y,z a_YAH=149 a_YAH=90 987 1403 " H LYS A 70 "<>" O THR A 99 " d_HA=1.816 d_AD=2.824 a_DHA=171.465 symop: x,y,z a_YAH=144 1367 1422 " H MET A 100 "<>" O ASN A 97 " d_HA=2.720 d_AD=3.511 a_DHA=135.096 symop: x,y,z a_YAH=94 1370 1407 " H THR A 99 "<>" OD1 ASN A 97 " d_HA=1.886 d_AD=2.764 a_DHA=143.351 symop: x,y,z a_YAH=142 1370 1410 " HG1 THR A 99 "<>" OD1 ASN A 97 " d_HA=1.899 d_AD=2.831 a_DHA=159.727 symop: x,y,z a_YAH=144 1370 1422 " H MET A 100 "<>" OD1 ASN A 97 " d_HA=2.317 d_AD=3.106 a_DHA=133.873 symop: x,y,z a_YAH=110 1372 1417 " H ASN A 97 "<>" O MET A 100 " d_HA=2.117 d_AD=3.116 a_DHA=168.096 symop: x,y,z a_YAH=158 1328 1458 " H CYS A 102 "<>" O TRP A 95 " d_HA=1.956 d_AD=2.894 a_DHA=152.139 symop: x,y,z a_YAH=161 1323 1356 "HH21 ARG A 94 "<>" OE1 GLU A 96 " d_HA=2.825 d_AD=3.836 a_DHA=173.361 symop: x,y,z a_YAH=162 3552 5055 " H LYS C 130 "<>" O VAL E 66 " d_HA=2.107 d_AD=2.966 a_DHA=141.019 symop: x,y,z a_YAH=156 4195 5180 " H PHE E 73 "<>" O ASP E 12 " d_HA=1.939 d_AD=2.926 a_DHA=164.227 symop: x,y,z a_YAH=138 5042 6086 " HZ3 LYS F 44 "<>" OH TYR E 65 " d_HA=2.122 d_AD=3.089 a_DHA=157.476 symop: x,y,z a_YAH=104 a_YAH=139 3564 4174 " HZ3 LYS C 130 "<>" OD1 ASN E 10 " d_HA=2.716 d_AD=3.679 a_DHA=159.518 symop: x,y,z a_YAH=154 4200 5172 " H ASP E 12 "<>" O PHE E 73 " d_HA=1.902 d_AD=2.884 a_DHA=161.207 symop: x,y,z a_YAH=151 2185 2251 " HG1 THR B 50 "<>" O GLU B 46 " d_HA=1.688 d_AD=2.639 a_DHA=161.758 symop: x,y,z a_YAH=116 1119 2189 " HG SER A 80 "<>" OE1 GLU B 46 " d_HA=1.620 d_AD=2.598 a_DHA=169.188 symop: x,y,z a_YAH=103 2190 3562 " HZ1 LYS C 130 "<>" OE2 GLU B 46 " d_HA=1.739 d_AD=2.645 a_DHA=144.865 symop: -x+1,-y+1,z a_YAH=154 1101 3311 " H VAL C 115 "<>" O SER A 79 " d_HA=2.015 d_AD=2.817 a_DHA=134.943 symop: x,y,z a_YAH=99 2169 2230 " H LEU B 49 "<>" O VAL B 45 " d_HA=1.998 d_AD=3.012 a_DHA=174.295 symop: x,y,z a_YAH=166 1112 2484 " H VAL B 63 "<>" O SER A 80 " d_HA=2.117 d_AD=3.048 a_DHA=150.976 symop: x,y,z a_YAH=162 1737 1820 " H GLU B 21 "<>" O LYS B 17 " d_HA=2.462 d_AD=3.423 a_DHA=158.451 symop: x,y,z a_YAH=129 1759 1831 " H ALA B 22 "<>" O THR B 18 " d_HA=2.067 d_AD=3.073 a_DHA=171.178 symop: x,y,z a_YAH=156 2461 3145 " H PHE B 107 "<>" O ILE B 62 " d_HA=1.870 d_AD=2.868 a_DHA=167.738 symop: x,y,z a_YAH=156 2466 3137 " H ILE B 62 "<>" O PHE B 107 " d_HA=2.070 d_AD=3.028 a_DHA=156.367 symop: x,y,z a_YAH=144 1686 1743 " H LYS B 17 "<>" O ASP B 13 " d_HA=1.935 d_AD=2.932 a_DHA=164.320 symop: x,y,z a_YAH=163 1686 1733 " HG SER B 16 "<>" O ASP B 13 " d_HA=2.843 d_AD=3.443 a_DHA=120.759 symop: x,y,z a_YAH=111 1698 1763 " H THR B 18 "<>" O ASP B 14 " d_HA=2.140 d_AD=3.024 a_DHA=144.449 symop: x,y,z a_YAH=141 1698 1766 " HG1 THR B 18 "<>" O ASP B 14 " d_HA=1.749 d_AD=2.696 a_DHA=161.401 symop: x,y,z a_YAH=138 1710 1778 " H ILE B 19 "<>" O VAL B 15 " d_HA=1.807 d_AD=2.822 a_DHA=177.158 symop: x,y,z a_YAH=166 2854 3158 " H GLY B 108 "<>" O GLY B 89 " d_HA=1.829 d_AD=2.819 a_DHA=164.077 symop: x,y,z a_YAH=169 2875 3121 " H CYS B 91 "<>" O VAL B 106 " d_HA=1.916 d_AD=2.877 a_DHA=157.545 symop: x,y,z a_YAH=156 1670 1729 " H SER B 16 "<>" O VAL B 12 " d_HA=2.127 d_AD=3.097 a_DHA=158.259 symop: x,y,z a_YAH=144 1670 2879 " HG CYS B 91 "<>" O VAL B 12 " d_HA=2.743 d_AD=4.064 a_DHA=166.753 symop: x,y,z a_YAH=146 997 1367 " HZ1 LYS A 70 "<>" O ASN A 97 " d_HA=1.813 d_AD=2.740 a_DHA=149.863 symop: x,y,z a_YAH=143 3546 5059 " H VAL E 66 "<>" O LYS C 130 " d_HA=2.198 d_AD=3.197 a_DHA=167.513 symop: x,y,z a_YAH=163 4171 5220 " H TYR E 75 "<>" O ASN E 10 " d_HA=2.062 d_AD=2.975 a_DHA=149.232 symop: x,y,z a_YAH=150 3245 1202 "HD21 ASN A 85 "<>" O SER C 111 " d_HA=2.166 d_AD=2.948 a_DHA=132.486 symop: x,y,z a_YAH=113 3256 4187 " H ALA E 11 "<>" O VAL C 112 " d_HA=1.946 d_AD=2.939 a_DHA=165.648 symop: -x+1,-y+1,z a_YAH=136 3260 4149 " H VAL C 112 "<>" O LYS E 9 " d_HA=2.450 d_AD=3.378 a_DHA=152.844 symop: -x+1,-y+1,z a_YAH=129 2214 2262 " H VAL B 51 "<>" O CYS B 48 " d_HA=2.129 d_AD=3.034 a_DHA=147.633 symop: x,y,z a_YAH=106 2214 2279 " H LEU B 52 "<>" O CYS B 48 " d_HA=1.953 d_AD=2.941 a_DHA=164.068 symop: x,y,z a_YAH=172 2225 2297 " H THR B 53 "<>" O LEU B 49 " d_HA=2.131 d_AD=3.059 a_DHA=151.671 symop: x,y,z a_YAH=145 2225 2300 " HG1 THR B 53 "<>" O LEU B 49 " d_HA=1.718 d_AD=2.681 a_DHA=169.966 symop: x,y,z a_YAH=128 1123 3281 " H TYR C 113 "<>" O CYS A 81 " d_HA=1.930 d_AD=2.814 a_DHA=144.677 symop: x,y,z a_YAH=154 1134 2449 " H TYR B 61 "<>" O TYR A 82 " d_HA=1.923 d_AD=2.916 a_DHA=164.674 symop: x,y,z a_YAH=150 1143 2440 " H TYR A 82 "<>" O TYR B 61 " d_HA=1.984 d_AD=2.986 a_DHA=168.385 symop: x,y,z a_YAH=158 1166 3245 " H TRP A 83 "<>" O SER C 111 " d_HA=2.436 d_AD=3.417 a_DHA=163.502 symop: x,y,z a_YAH=140 4688 4763 " H LYS E 48 "<>" O LYS E 44 " d_HA=2.011 d_AD=2.972 a_DHA=156.727 symop: x,y,z a_YAH=156 1761 4774 " HZ2 LYS E 48 "<>" OG1 THR B 18 " d_HA=2.022 d_AD=2.941 a_DHA=148.967 symop: -y+1,x-y+1,z-1/3 a_YAH=135 a_YAH=111 2418 3169 " H LEU B 109 "<>" O LYS B 60 " d_HA=1.999 d_AD=2.970 a_DHA=158.922 symop: x,y,z a_YAH=153 4757 4827 " H ASN E 51 "<>" O LYS E 48 " d_HA=2.954 d_AD=3.928 a_DHA=162.218 symop: x,y,z a_YAH=94 4822 4880 " HE1 TRP E 54 "<>" O ASN E 51 " d_HA=2.134 d_AD=2.980 a_DHA=138.974 symop: x,y,z a_YAH=154 1651 1714 " H VAL B 15 "<>" O ILE B 11 " d_HA=2.377 d_AD=3.381 a_DHA=169.624 symop: x,y,z a_YAH=160 2855 3157 " H GLY B 89 "<>" O GLY B 108 " d_HA=2.084 d_AD=3.067 a_DHA=161.795 symop: x,y,z a_YAH=152 2847 2788 " H ASP B 88 "<>" O ASN B 84 " d_HA=1.941 d_AD=2.902 a_DHA=156.765 symop: x,y,z a_YAH=145 2832 2788 " H THR B 87 "<>" O ASN B 84 " d_HA=1.890 d_AD=2.861 a_DHA=159.839 symop: x,y,z a_YAH=141 5955 6015 " H TYR F 41 "<>" O ASP F 37 " d_HA=2.377 d_AD=3.308 a_DHA=151.804 symop: x,y,z a_YAH=137 5972 5918 " H ILE F 38 "<>" O GLU F 35 " d_HA=2.845 d_AD=3.485 a_DHA=121.361 symop: x,y,z a_YAH=94 5933 5998 " H ALA F 40 "<>" O LYS F 36 " d_HA=1.948 d_AD=2.908 a_DHA=156.427 symop: x,y,z a_YAH=136 3585 5026 " H SER E 64 "<>" O THR C 132 " d_HA=1.985 d_AD=2.885 a_DHA=147.163 symop: x,y,z a_YAH=164 3585 5030 " HG SER E 64 "<>" O THR C 132 " d_HA=2.295 d_AD=3.104 a_DHA=140.162 symop: x,y,z a_YAH=124 3589 5023 " H THR C 132 "<>" O SER E 64 " d_HA=2.228 d_AD=3.174 a_DHA=153.728 symop: x,y,z a_YAH=137 5860 4579 " HZ3 LYS F 31 "<>" OD2 ASP E 37 " d_HA=2.288 d_AD=2.999 a_DHA=125.543 symop: y,-x+y,z-1/3 a_YAH=101 5859 5872 " HZ2 LYS F 31 "<>" OH TYR F 32 " d_HA=2.701 d_AD=3.693 a_DHA=166.224 symop: x,y,z a_YAH=106 a_YAH=114 4155 5211 " H LYS E 9 "<>" O TYR E 75 " d_HA=2.249 d_AD=3.137 a_DHA=145.526 symop: x,y,z a_YAH=146 4176 5211 " H ASN E 10 "<>" O TYR E 75 " d_HA=2.137 d_AD=3.118 a_DHA=162.153 symop: x,y,z a_YAH=155 4575 4635 " H TYR E 41 "<>" O ASP E 37 " d_HA=2.042 d_AD=2.951 a_DHA=148.131 symop: x,y,z a_YAH=140 4480 5959 " HZ3 LYS E 31 "<>" OD2 ASP F 37 " d_HA=1.862 d_AD=2.818 a_DHA=152.295 symop: x-y,x,z+1/3 a_YAH=145 3248 1155 " H SER C 111 "<>" O TRP A 83 " d_HA=2.163 d_AD=3.138 a_DHA=160.891 symop: x,y,z a_YAH=150 4616 4694 " H LYS E 44 "<>" O ALA E 40 " d_HA=2.287 d_AD=3.210 a_DHA=150.782 symop: x,y,z a_YAH=134 4626 4694 " H LYS E 44 "<>" O TYR E 41 " d_HA=2.466 d_AD=3.113 a_DHA=121.052 symop: x,y,z a_YAH=107 4626 4716 " H GLU E 45 "<>" O TYR E 41 " d_HA=1.993 d_AD=3.005 a_DHA=174.791 symop: x,y,z a_YAH=164 2258 2313 " H LYS B 54 "<>" O VAL B 51 " d_HA=2.068 d_AD=2.955 a_DHA=144.810 symop: x,y,z a_YAH=105 2258 2335 " H GLU B 55 "<>" O VAL B 51 " d_HA=2.077 d_AD=3.048 a_DHA=159.692 symop: x,y,z a_YAH=153 2323 4715 " HZ1 LYS B 54 "<>" OE2 GLU E 45 " d_HA=2.842 d_AD=3.655 a_DHA=136.860 symop: -y+1,x-y+1,z-1/3 a_YAH=116 2293 2357 "HE22 GLN B 56 "<>" O THR B 53 " d_HA=2.332 d_AD=3.100 a_DHA=132.100 symop: x,y,z a_YAH=147 2307 2356 "HE21 GLN B 56 "<>" O LYS B 54 " d_HA=2.034 d_AD=2.979 a_DHA=154.239 symop: x,y,z a_YAH=116 1151 3226 " HH TYR A 82 "<>" O LEU C 110 " d_HA=2.160 d_AD=3.069 a_DHA=156.754 symop: x,y,z a_YAH=107 4666 4750 " H ASP E 47 "<>" O LYS E 43 " d_HA=1.869 d_AD=2.865 a_DHA=166.950 symop: x,y,z a_YAH=154 4672 4606 " H LYS E 43 "<>" O ALA E 39 " d_HA=1.979 d_AD=2.964 a_DHA=161.251 symop: x,y,z a_YAH=158 4647 4733 " H PHE E 46 "<>" O ILE E 42 " d_HA=2.227 d_AD=3.175 a_DHA=155.814 symop: x,y,z a_YAH=140 2274 2457 " HH TYR B 61 "<>" O LEU B 52 " d_HA=2.859 d_AD=3.721 a_DHA=149.905 symop: x,y,z a_YAH=127 2361 2406 " H TYR B 59 "<>" O LYS B 57 " d_HA=1.869 d_AD=2.762 a_DHA=144.901 symop: x,y,z a_YAH=107 2424 3164 " H LYS B 60 "<>" O LEU B 109 " d_HA=1.803 d_AD=2.742 a_DHA=152.238 symop: x,y,z a_YAH=173 4710 4785 " H LYS E 49 "<>" O GLU E 45 " d_HA=1.931 d_AD=2.938 a_DHA=170.921 symop: x,y,z a_YAH=148 4725 4810 " H TYR E 50 "<>" O PHE E 46 " d_HA=2.104 d_AD=2.981 a_DHA=143.994 symop: x,y,z a_YAH=134 2334 2378 " HZ2 LYS B 57 "<>" OE2 GLU B 55 " d_HA=1.747 d_AD=2.634 a_DHA=141.859 symop: x,y,z a_YAH=168 2383 3198 " H VAL B 111 "<>" O PRO B 58 " d_HA=2.708 d_AD=3.412 a_DHA=127.377 symop: x,y,z a_YAH=153 3185 2845 " H ALA B 110 "<>" OD1 ASP B 88 " d_HA=1.740 d_AD=2.739 a_DHA=166.694 symop: x,y,z a_YAH=144 1614 1656 " H ILE B 11 "<>" O GLN B 9 " d_HA=2.543 d_AD=3.289 a_DHA=130.925 symop: x,y,z a_YAH=106 1614 2379 " HZ3 LYS B 57 "<>" O GLN B 9 " d_HA=2.188 d_AD=3.025 a_DHA=139.138 symop: x,y,z a_YAH=154 2414 2828 " HH TYR B 59 "<>" O THR B 87 " d_HA=1.559 d_AD=2.537 a_DHA=172.969 symop: x,y,z a_YAH=165 5848 5781 " H LYS F 31 "<>" O GLN F 27 " d_HA=2.099 d_AD=3.095 a_DHA=165.793 symop: x,y,z a_YAH=175 5873 5798 " H TYR F 32 "<>" O ALA F 28 " d_HA=2.140 d_AD=3.087 a_DHA=154.976 symop: x,y,z a_YAH=132 5899 5972 " H ILE F 38 "<>" O ILE F 34 " d_HA=2.136 d_AD=3.088 a_DHA=155.139 symop: x,y,z a_YAH=162 5899 5960 " H ASP F 37 "<>" O ILE F 34 " d_HA=2.120 d_AD=2.994 a_DHA=143.927 symop: x,y,z a_YAH=117 3611 4985 "HE21 GLN C 133 "<>" OD1 ASN E 61 " d_HA=2.622 d_AD=3.380 a_DHA=131.858 symop: x,y,z a_YAH=167 3618 5004 " H PHE E 62 "<>" OG1 THR C 134 " d_HA=2.054 d_AD=3.001 a_DHA=153.623 symop: x,y,z a_YAH=116 a_YAH=131 3620 4996 " H THR C 134 "<>" O PHE E 62 " d_HA=2.174 d_AD=3.167 a_DHA=165.211 symop: x,y,z a_YAH=159 4462 5890 " H ASN F 33 "<>" O LYS E 31 " d_HA=2.469 d_AD=3.461 a_DHA=165.769 symop: x-y,x,z+1/3 a_YAH=125 4510 5842 " H ASN E 33 "<>" O LYS F 31 " d_HA=2.233 d_AD=3.241 a_DHA=172.747 symop: x-y,x,z+1/3 a_YAH=139 4447 5895 "HD22 ASN F 33 "<>" O GLU E 30 " d_HA=2.508 d_AD=3.470 a_DHA=159.616 symop: x-y,x,z+1/3 a_YAH=134 3603 5939 " H LYS F 36 "<>" OE1 GLN C 133 " d_HA=2.585 d_AD=3.572 a_DHA=165.202 symop: x,y,z a_YAH=99 4592 4519 " H ILE E 38 "<>" O ILE E 34 " d_HA=2.068 d_AD=3.067 a_DHA=167.369 symop: x,y,z a_YAH=155 4418 4493 " H TYR E 32 "<>" O ALA E 28 " d_HA=2.371 d_AD=3.298 a_DHA=151.900 symop: x,y,z a_YAH=137 4401 4468 " H LYS E 31 "<>" O GLN E 27 " d_HA=2.334 d_AD=3.329 a_DHA=165.800 symop: x,y,z a_YAH=152 4401 4453 " H GLU E 30 "<>" O GLN E 27 " d_HA=2.463 d_AD=3.339 a_DHA=144.547 symop: x,y,z a_YAH=99 4587 4652 " H ILE E 42 "<>" O ILE E 38 " d_HA=2.157 d_AD=3.167 a_DHA=174.090 symop: x,y,z a_YAH=163 4366 4420 " H ALA E 28 "<>" O CYS E 24 " d_HA=2.260 d_AD=3.106 a_DHA=140.276 symop: x,y,z a_YAH=130 4405 4643 " HH TYR E 41 "<>" OE1 GLN E 27 " d_HA=2.317 d_AD=3.105 a_DHA=137.808 symop: x,y,z a_YAH=103 4265 4330 " H ALA E 21 "<>" O MET E 17 " d_HA=2.189 d_AD=3.046 a_DHA=141.436 symop: x,y,z a_YAH=136 4316 4373 " HG CYS E 24 "<>" O ASP E 20 " d_HA=2.861 d_AD=3.822 a_DHA=126.929 symop: x,y,z a_YAH=142 4316 4369 " H CYS E 24 "<>" O ASP E 20 " d_HA=1.983 d_AD=2.944 a_DHA=156.836 symop: x,y,z a_YAH=130 4320 4796 " HZ2 LYS E 49 "<>" OD2 ASP E 20 " d_HA=1.709 d_AD=2.651 a_DHA=150.434 symop: x,y,z a_YAH=139 4320 4818 " HH TYR E 50 "<>" OD2 ASP E 20 " d_HA=1.582 d_AD=2.548 a_DHA=165.545 symop: x,y,z a_YAH=123 4515 5827 "HD22 ASN E 33 "<>" O GLU F 30 " d_HA=2.553 d_AD=3.393 a_DHA=140.643 symop: x-y,x,z+1/3 a_YAH=111 3630 4991 "HD21 ASN E 61 "<>" O THR C 135 " d_HA=1.772 d_AD=2.710 a_DHA=149.717 symop: x,y,z a_YAH=145 4377 4433 " H LEU E 29 "<>" O ALA E 25 " d_HA=2.246 d_AD=3.166 a_DHA=150.321 symop: x,y,z a_YAH=152 4387 4453 " H GLU E 30 "<>" O THR E 26 " d_HA=2.915 d_AD=3.606 a_DHA=126.122 symop: x,y,z a_YAH=133 4387 4433 " H LEU E 29 "<>" O THR E 26 " d_HA=2.851 d_AD=3.544 a_DHA=126.108 symop: x,y,z a_YAH=93 4328 4379 " H ALA E 25 "<>" O ALA E 21 " d_HA=2.138 d_AD=3.031 a_DHA=145.502 symop: x,y,z a_YAH=142 4338 4391 " H THR E 26 "<>" O VAL E 22 " d_HA=1.897 d_AD=2.822 a_DHA=149.786 symop: x,y,z a_YAH=139 4338 4394 " HG1 THR E 26 "<>" O VAL E 22 " d_HA=1.709 d_AD=2.677 a_DHA=169.847 symop: x,y,z a_YAH=138 4354 4407 " H GLN E 27 "<>" O ASP E 23 " d_HA=2.082 d_AD=3.081 a_DHA=165.240 symop: x,y,z a_YAH=155 4282 4342 " H VAL E 22 "<>" O GLN E 18 " d_HA=1.912 d_AD=2.912 a_DHA=166.558 symop: x,y,z a_YAH=159 4299 4359 " H ASP E 23 "<>" O GLN E 19 " d_HA=1.790 d_AD=2.787 a_DHA=166.384 symop: x,y,z a_YAH=161 4311 4358 "HE21 GLN E 19 "<>" OD2 ASP E 23 " d_HA=1.842 d_AD=2.854 a_DHA=167.152 symop: x,y,z a_YAH=93 4250 4321 " H ASP E 20 "<>" O GLU E 16 " d_HA=2.097 d_AD=3.087 a_DHA=164.940 symop: x,y,z a_YAH=153 5278 5316 " H LEU E 78 "<>" O VAL E 81 " d_HA=1.827 d_AD=2.822 a_DHA=165.708 symop: x,y,z a_YAH=153 5273 5320 " H VAL E 81 "<>" O LEU E 78 " d_HA=1.968 d_AD=2.947 a_DHA=161.290 symop: x,y,z a_YAH=126 ------------------------------------------------------------------------------- Total: 489 Symmetry: 0 Per residue: 1.1346 Mean SD Skew Kurtosis theta_1: 145.437 20.624 -0.743 2.660 theta_2: 134.986 23.981 -0.334 1.780 d_HA: 2.328 0.295 0.521 2.363 627 797 " H HIS A 43 "<>" O VAL A 57 " d_HA=2.781 d_AD=3.689 a_DHA=149.224 symop: x,y,z a_YAH=149 594 829 " H ALA A 59 "<>" O GLY A 41 " d_HA=2.708 d_AD=3.566 a_DHA=143.189 symop: x,y,z a_YAH=171 601 1334 " H GLY A 94 "<>" O LEU A 42 " d_HA=2.028 d_AD=2.769 a_DHA=128.158 symop: x,y,z a_YAH=157 551 883 " H LEU A 38 "<>" O GLY A 63 " d_HA=1.711 d_AD=2.663 a_DHA=158.211 symop: x,y,z a_YAH=111 2280 2227 " H VAL B 47 "<>" O GLY B 52 " d_HA=1.877 d_AD=2.824 a_DHA=154.525 symop: x,y,z a_YAH=106 2531 1957 " H VAL B 29 "<>" O ASP B 71 " d_HA=1.723 d_AD=2.722 a_DHA=167.195 symop: x,y,z a_YAH=157 2535 2575 " H ILE B 74 "<>" OD2 ASP B 71 " d_HA=2.620 d_AD=3.425 a_DHA=136.370 symop: x,y,z a_YAH=127 842 890 " H ASP A 60 "<>" O VAL A 64 " d_HA=2.247 d_AD=3.207 a_DHA=159.414 symop: x,y,z a_YAH=126 595 827 " H GLY A 41 "<>" O ALA A 59 " d_HA=2.814 d_AD=3.812 a_DHA=168.862 symop: x,y,z a_YAH=138 894 840 " H VAL A 64 "<>" OD1 ASP A 60 " d_HA=2.767 d_AD=3.435 a_DHA=123.773 symop: x,y,z a_YAH=112 837 884 " H GLY A 63 "<>" O ASP A 60 " d_HA=1.568 d_AD=2.516 a_DHA=159.043 symop: x,y,z a_YAH=143 1350 1368 " H GLY A 98 "<>" O GLY A 96 " d_HA=1.865 d_AD=2.595 a_DHA=125.383 symop: x,y,z a_YAH=119 2799 2970 " H VAL B 89 "<>" O ALA B 102 " d_HA=2.459 d_AD=3.405 a_DHA=155.758 symop: x,y,z a_YAH=161 2186 2304 " H LEU B 54 "<>" O PHE B 45 " d_HA=2.409 d_AD=3.450 a_DHA=168.651 symop: x,y,z a_YAH=155 2213 2779 " H HIS B 46 "<>" O VAL B 88 " d_HA=1.862 d_AD=2.630 a_DHA=130.412 symop: x,y,z a_YAH=135 2290 2319 " H GLY B 55 "<>" OD1 ASP B 53 " d_HA=2.218 d_AD=3.105 a_DHA=144.818 symop: x,y,z a_YAH=114 584 866 " HZ2 LYS A 61 "<>" OE2 GLU A 40 " d_HA=2.058 d_AD=2.994 a_DHA=150.445 symop: x,y,z a_YAH=141 2834 2927 " H GLU B 91 "<>" O ARG B 100 " d_HA=1.855 d_AD=2.849 a_DHA=164.925 symop: x,y,z a_YAH=167 1698 2833 " H ASP B 11 "<>" OE2 GLU B 91 " d_HA=1.833 d_AD=2.764 a_DHA=152.506 symop: x,y,z a_YAH=133 2795 2972 " H ALA B 102 "<>" O VAL B 89 " d_HA=2.917 d_AD=3.875 a_DHA=156.825 symop: x,y,z a_YAH=157 2162 2343 " H VAL B 57 "<>" O HIS B 43 " d_HA=2.150 d_AD=3.045 a_DHA=145.568 symop: x,y,z a_YAH=146 2179 2818 " H HIS B 90 "<>" O GLY B 44 " d_HA=1.947 d_AD=2.876 a_DHA=152.467 symop: x,y,z a_YAH=138 2194 2318 " H PHE B 45 "<>" O GLY B 55 " d_HA=2.415 d_AD=3.181 a_DHA=131.770 symop: x,y,z a_YAH=170 1865 1932 "HE21 GLN B 22 "<>" O GLY B 27 " d_HA=2.443 d_AD=3.442 a_DHA=162.688 symop: x,y,z a_YAH=129 1866 2591 "HE22 GLN B 22 "<>" OG SER B 75 " d_HA=2.171 d_AD=3.110 a_DHA=156.647 symop: x,y,z a_YAH=116 a_YAH=136 1892 1933 " H GLY B 27 "<>" O GLU B 24 " d_HA=2.164 d_AD=3.121 a_DHA=155.483 symop: x,y,z a_YAH=108 1548 1559 " H2 ALA B 1 "<>" OG1 THR B 2 " d_HA=2.854 d_AD=3.637 a_DHA=134.146 symop: x,y,z a_YAH=119 a_YAH=125 1548 1857 " H2 ALA B 1 "<>" OE1 GLN B 22 " d_HA=2.993 d_AD=3.657 a_DHA=123.686 symop: x,y,z a_YAH=136 1693 1730 " H VAL B 14 "<>" O ASP B 11 " d_HA=2.108 d_AD=2.929 a_DHA=136.283 symop: x,y,z a_YAH=162 2173 2811 " HD1 HIS B 43 "<>" O HIS B 90 " d_HA=1.695 d_AD=2.526 a_DHA=137.138 symop: x,y,z a_YAH=147 2143 2876 " H GLY B 94 "<>" O LEU B 42 " d_HA=1.641 d_AD=2.658 a_DHA=171.746 symop: x,y,z a_YAH=153 2169 2339 " H HIS B 43 "<>" O VAL B 57 " d_HA=2.676 d_AD=3.524 a_DHA=140.267 symop: x,y,z a_YAH=121 2630 2669 " H SER B 81 "<>" O GLY B 78 " d_HA=2.826 d_AD=3.778 a_DHA=155.194 symop: x,y,z a_YAH=90 2668 2701 " H ILE B 83 "<>" OG SER B 81 " d_HA=2.611 d_AD=3.597 a_DHA=165.270 symop: x,y,z a_YAH=102 a_YAH=105 2589 2682 " H ILE B 82 "<>" O SER B 75 " d_HA=2.831 d_AD=3.759 a_DHA=151.889 symop: x,y,z a_YAH=118 1557 1859 " H GLN B 22 "<>" O THR B 2 " d_HA=2.747 d_AD=3.389 a_DHA=121.463 symop: x,y,z a_YAH=148 2111 2168 " H THR B 39 "<>" NE2 HIS B 43 " d_HA=3.000 d_AD=3.750 a_DHA=132.212 symop: x,y,z a_YAH=146 a_YAH=91 2093 2425 " H LEU B 38 "<>" O GLY B 63 " d_HA=2.287 d_AD=3.215 a_DHA=152.912 symop: x,y,z a_YAH=109 2425 2082 " H GLY B 37 "<>" O GLY B 63 " d_HA=1.833 d_AD=2.703 a_DHA=141.668 symop: x,y,z a_YAH=167 2136 2371 " H ALA B 59 "<>" O GLY B 41 " d_HA=2.544 d_AD=3.450 a_DHA=148.788 symop: x,y,z a_YAH=154 2137 2369 " H GLY B 41 "<>" O ALA B 59 " d_HA=2.901 d_AD=3.689 a_DHA=135.501 symop: x,y,z a_YAH=115 2384 2432 " H ASP B 60 "<>" O VAL B 64 " d_HA=2.422 d_AD=3.349 a_DHA=149.947 symop: x,y,z a_YAH=117 22 311 " HG1 THR A 2 "<>" O GLN A 22 " d_HA=1.879 d_AD=2.675 a_DHA=137.677 symop: x,y,z a_YAH=153 350 391 " H GLY A 27 "<>" O GLU A 24 " d_HA=2.005 d_AD=3.001 a_DHA=165.911 symop: x,y,z a_YAH=132 19 1527 " H THR A 2 "<>" O GLN A 110 " d_HA=1.821 d_AD=2.790 a_DHA=157.444 symop: x,y,z a_YAH=127 324 1049 "HE22 GLN A 22 "<>" OG SER A 75 " d_HA=2.406 d_AD=3.364 a_DHA=156.209 symop: x,y,z a_YAH=112 a_YAH=120 1049 1080 " H SER A 77 "<>" OG SER A 75 " d_HA=2.873 d_AD=3.514 a_DHA=121.472 symop: x,y,z a_YAH=129 a_YAH=112 1058 1131 " HG SER A 81 "<>" O LEU A 76 " d_HA=1.886 d_AD=2.768 a_DHA=149.995 symop: x,y,z a_YAH=117 1047 1140 " H ILE A 82 "<>" O SER A 75 " d_HA=2.325 d_AD=3.299 a_DHA=163.317 symop: x,y,z a_YAH=171 1126 1159 " H ILE A 83 "<>" OG SER A 81 " d_HA=2.768 d_AD=3.675 a_DHA=148.908 symop: x,y,z a_YAH=123 a_YAH=113 2666 2738 " HE ARG B 85 "<>" O SER B 81 " d_HA=2.870 d_AD=3.677 a_DHA=135.948 symop: x,y,z a_YAH=146 2677 2730 " H ARG B 85 "<>" O ILE B 82 " d_HA=2.645 d_AD=3.568 a_DHA=152.665 symop: x,y,z a_YAH=95 1571 3061 " H ALA B 109 "<>" O LYS B 3 " d_HA=1.957 d_AD=2.947 a_DHA=162.197 symop: x,y,z a_YAH=141 1595 1818 " H ALA B 4 "<>" O PHE B 20 " d_HA=1.841 d_AD=2.697 a_DHA=139.866 symop: x,y,z a_YAH=151 2125 2409 " HZ3 LYS B 61 "<>" OE1 GLU B 40 " d_HA=2.944 d_AD=3.962 a_DHA=170.058 symop: x,y,z a_YAH=116 2379 2426 " H GLY B 63 "<>" O ASP B 60 " d_HA=2.200 d_AD=3.155 a_DHA=154.228 symop: x,y,z a_YAH=107 2382 2436 " H VAL B 64 "<>" OD1 ASP B 60 " d_HA=2.224 d_AD=3.014 a_DHA=134.182 symop: x,y,z a_YAH=155 296 433 " H LYS A 30 "<>" O GLU A 21 " d_HA=1.632 d_AD=2.600 a_DHA=164.068 symop: x,y,z a_YAH=145 411 994 " H ASP A 71 "<>" O VAL A 29 " d_HA=1.960 d_AD=2.723 a_DHA=128.923 symop: x,y,z a_YAH=141 415 989 " H VAL A 29 "<>" O ASP A 71 " d_HA=1.746 d_AD=2.481 a_DHA=125.884 symop: x,y,z a_YAH=177 15 317 " H GLN A 22 "<>" O THR A 2 " d_HA=2.029 d_AD=3.037 a_DHA=167.705 symop: x,y,z a_YAH=126 35 1527 " H LYS A 3 "<>" O GLN A 110 " d_HA=1.712 d_AD=2.654 a_DHA=151.575 symop: x,y,z a_YAH=150 29 1519 " H ALA A 109 "<>" O LYS A 3 " d_HA=2.066 d_AD=3.047 a_DHA=167.444 symop: x,y,z a_YAH=115 29 1534 " H GLN A 110 "<>" O LYS A 3 " d_HA=2.584 d_AD=3.553 a_DHA=159.561 symop: x,y,z a_YAH=97 1503 2715 " H ILE A 108 "<>" O GLY B 84 " d_HA=2.436 d_AD=3.302 a_DHA=142.151 symop: y,-x+y+1,z+1/6 a_YAH=112 1135 1188 " H ARG A 85 "<>" O ILE A 82 " d_HA=1.796 d_AD=2.608 a_DHA=135.488 symop: x,y,z a_YAH=117 1174 1472 " H GLY A 84 "<>" O ILE A 106 " d_HA=2.150 d_AD=2.897 a_DHA=127.963 symop: x,y,z a_YAH=123 2722 3019 " H ILE B 106 "<>" O ARG B 85 " d_HA=1.690 d_AD=2.697 a_DHA=169.163 symop: x,y,z a_YAH=171 2716 3014 " H GLY B 84 "<>" O ILE B 106 " d_HA=1.877 d_AD=2.751 a_DHA=143.003 symop: x,y,z a_YAH=145 1173 3045 " H ILE B 108 "<>" O GLY A 84 " d_HA=2.434 d_AD=3.374 a_DHA=154.738 symop: y,-x+y+1,z+1/6 a_YAH=103 1603 3034 " H GLY B 107 "<>" O VAL B 5 " d_HA=1.795 d_AD=2.783 a_DHA=164.458 symop: x,y,z a_YAH=173 1607 3033 " H VAL B 5 "<>" O GLY B 107 " d_HA=2.271 d_AD=3.176 a_DHA=146.635 symop: x,y,z a_YAH=128 301 481 " HE1 TRP A 32 "<>" OE2 GLU A 21 " d_HA=1.602 d_AD=2.575 a_DHA=155.425 symop: x,y,z a_YAH=134 453 955 " H VAL A 31 "<>" O ILE A 69 " d_HA=2.176 d_AD=3.191 a_DHA=163.697 symop: x,y,z a_YAH=141 262 476 " H TRP A 32 "<>" O ASN A 19 " d_HA=2.080 d_AD=2.955 a_DHA=142.791 symop: x,y,z a_YAH=152 51 284 " H PHE A 20 "<>" O ALA A 4 " d_HA=1.966 d_AD=2.975 a_DHA=165.833 symop: x,y,z a_YAH=157 53 276 " H ALA A 4 "<>" O PHE A 20 " d_HA=2.514 d_AD=3.295 a_DHA=133.688 symop: x,y,z a_YAH=142 65 1491 " H VAL A 5 "<>" O GLY A 107 " d_HA=2.026 d_AD=2.966 a_DHA=151.137 symop: x,y,z a_YAH=152 61 1492 " H GLY A 107 "<>" O VAL A 5 " d_HA=2.260 d_AD=3.278 a_DHA=174.671 symop: x,y,z a_YAH=143 1180 1477 " H ILE A 106 "<>" O ARG A 85 " d_HA=2.447 d_AD=3.428 a_DHA=159.960 symop: x,y,z a_YAH=132 1223 1449 " H LEU A 87 "<>" O GLY A 104 " d_HA=2.252 d_AD=3.066 a_DHA=138.143 symop: x,y,z a_YAH=153 2991 2765 " H LEU B 87 "<>" O GLY B 104 " d_HA=2.466 d_AD=3.432 a_DHA=155.897 symop: x,y,z a_YAH=147 2876 2143 " H GLY B 94 "<>" O LEU B 42 " d_HA=1.641 d_AD=2.658 a_DHA=171.746 symop: x,y,z a_YAH=153 449 960 " H ILE A 69 "<>" O VAL A 31 " d_HA=2.160 d_AD=3.170 a_DHA=168.726 symop: x,y,z a_YAH=142 267 465 " H ASN A 19 "<>" O TRP A 32 " d_HA=2.097 d_AD=3.071 a_DHA=159.404 symop: x,y,z a_YAH=160 490 928 " H GLY A 33 "<>" O VAL A 67 " d_HA=1.977 d_AD=2.883 a_DHA=147.397 symop: x,y,z a_YAH=141 77 248 " H ILE A 18 "<>" O ALA A 6 " d_HA=2.062 d_AD=2.891 a_DHA=138.034 symop: x,y,z a_YAH=128 79 243 " H ALA A 6 "<>" O ILE A 18 " d_HA=1.850 d_AD=2.844 a_DHA=162.802 symop: x,y,z a_YAH=143 1450 1218 " H GLY A 104 "<>" O LEU A 87 " d_HA=2.280 d_AD=3.109 a_DHA=137.356 symop: x,y,z a_YAH=147 1670 2980 " H LYS B 9 "<>" O SER B 103 " d_HA=1.559 d_AD=2.557 a_DHA=170.267 symop: x,y,z a_YAH=152 3061 1571 " H ALA B 109 "<>" O LYS B 3 " d_HA=1.957 d_AD=2.947 a_DHA=162.197 symop: x,y,z a_YAH=141 489 932 " H VAL A 67 "<>" O GLY A 33 " d_HA=1.774 d_AD=2.729 a_DHA=158.188 symop: x,y,z a_YAH=158 509 906 " H ALA A 35 "<>" O ALA A 65 " d_HA=2.353 d_AD=3.216 a_DHA=142.252 symop: x,y,z a_YAH=121 224 499 " H SER A 34 "<>" O ILE A 17 " d_HA=2.343 d_AD=3.312 a_DHA=160.441 symop: x,y,z a_YAH=176 229 496 " H ILE A 17 "<>" O SER A 34 " d_HA=2.294 d_AD=3.185 a_DHA=147.406 symop: x,y,z a_YAH=176 103 218 " H GLY A 16 "<>" O LEU A 8 " d_HA=1.904 d_AD=2.573 a_DHA=120.815 symop: x,y,z a_YAH=149 108 217 " H LEU A 8 "<>" O GLY A 16 " d_HA=1.822 d_AD=2.617 a_DHA=132.327 symop: x,y,z a_YAH=132 128 1438 " H LYS A 9 "<>" O SER A 103 " d_HA=2.121 d_AD=3.154 a_DHA=177.156 symop: x,y,z a_YAH=146 1932 1865 "HE21 GLN B 22 "<>" O GLY B 27 " d_HA=2.443 d_AD=3.442 a_DHA=162.688 symop: x,y,z a_YAH=129 1986 2520 " HZ2 LYS B 30 "<>" OE1 GLU B 70 " d_HA=1.823 d_AD=2.691 a_DHA=139.145 symop: x,y,z a_YAH=102 710 919 " HE2 HIS A 48 "<>" OD1 ASP A 66 " d_HA=1.950 d_AD=2.946 a_DHA=159.665 symop: y,-x+y+1,z+1/6 a_YAH=123 200 523 " H LYS A 36 "<>" O GLN A 15 " d_HA=1.950 d_AD=2.912 a_DHA=154.548 symop: x,y,z a_YAH=152 507 908 " H ALA A 65 "<>" O ALA A 35 " d_HA=1.804 d_AD=2.775 a_DHA=163.887 symop: x,y,z a_YAH=160 188 151 " H VAL A 14 "<>" O ASP A 11 " d_HA=2.240 d_AD=3.216 a_DHA=163.329 symop: x,y,z a_YAH=125 206 517 " H GLN A 15 "<>" O LYS A 36 " d_HA=2.114 d_AD=3.124 a_DHA=164.622 symop: x,y,z a_YAH=162 1859 1557 " H GLN B 22 "<>" O THR B 2 " d_HA=2.747 d_AD=3.389 a_DHA=121.463 symop: x,y,z a_YAH=148 1953 2536 " H ASP B 71 "<>" O VAL B 29 " d_HA=2.129 d_AD=3.114 a_DHA=168.037 symop: x,y,z a_YAH=141 1957 2531 " H VAL B 29 "<>" O ASP B 71 " d_HA=1.723 d_AD=2.722 a_DHA=167.195 symop: x,y,z a_YAH=157 1838 1975 " H LYS B 30 "<>" O GLU B 21 " d_HA=2.275 d_AD=3.056 a_DHA=133.162 symop: x,y,z a_YAH=139 1098 1114 " H HIS A 80 "<>" OD1 ASP A 79 " d_HA=1.980 d_AD=2.897 a_DHA=145.956 symop: x,y,z a_YAH=98 721 1198 "HH12 ARG A 85 "<>" O ALA A 50 " d_HA=2.240 d_AD=3.014 a_DHA=130.756 symop: x,y,z a_YAH=144 697 1196 " HE ARG A 85 "<>" O HIS A 48 " d_HA=1.953 d_AD=2.948 a_DHA=162.821 symop: x,y,z a_YAH=144 697 1199 "HH21 ARG A 85 "<>" O HIS A 48 " d_HA=2.678 d_AD=3.429 a_DHA=131.277 symop: x,y,z a_YAH=92 704 1204 " H HIS A 48 "<>" O THR A 86 " d_HA=1.841 d_AD=2.776 a_DHA=151.155 symop: x,y,z a_YAH=129 840 894 " H VAL A 64 "<>" OD1 ASP A 60 " d_HA=2.767 d_AD=3.435 a_DHA=123.773 symop: x,y,z a_YAH=112 540 883 " H GLY A 37 "<>" O GLY A 63 " d_HA=1.855 d_AD=2.642 a_DHA=131.744 symop: x,y,z a_YAH=159 883 551 " H LEU A 38 "<>" O GLY A 63 " d_HA=1.711 d_AD=2.663 a_DHA=158.211 symop: x,y,z a_YAH=111 1818 1595 " H ALA B 4 "<>" O PHE B 20 " d_HA=1.841 d_AD=2.697 a_DHA=139.866 symop: x,y,z a_YAH=151 1804 2018 " H TRP B 32 "<>" O ASN B 19 " d_HA=1.916 d_AD=2.886 a_DHA=163.356 symop: x,y,z a_YAH=153 1844 1969 " H GLU B 21 "<>" O LYS B 30 " d_HA=2.212 d_AD=3.186 a_DHA=158.691 symop: x,y,z a_YAH=150 1995 2497 " H VAL B 31 "<>" O ILE B 69 " d_HA=2.752 d_AD=3.601 a_DHA=143.267 symop: x,y,z a_YAH=112 1843 2023 " HE1 TRP B 32 "<>" OE2 GLU B 21 " d_HA=2.286 d_AD=3.204 a_DHA=146.936 symop: x,y,z a_YAH=109 1991 2502 " H ILE B 69 "<>" O VAL B 31 " d_HA=2.512 d_AD=3.527 a_DHA=170.550 symop: x,y,z a_YAH=150 1527 19 " H THR A 2 "<>" O GLN A 110 " d_HA=1.821 d_AD=2.790 a_DHA=157.444 symop: x,y,z a_YAH=127 1527 35 " H LYS A 3 "<>" O GLN A 110 " d_HA=1.712 d_AD=2.654 a_DHA=151.575 symop: x,y,z a_YAH=150 731 1198 "HH12 ARG A 85 "<>" O GLY A 51 " d_HA=2.889 d_AD=3.548 a_DHA=122.378 symop: x,y,z a_YAH=128 664 1241 " H VAL A 88 "<>" O HIS A 46 " d_HA=1.930 d_AD=2.910 a_DHA=159.226 symop: x,y,z a_YAH=162 685 738 " H VAL A 47 "<>" O GLY A 52 " d_HA=1.626 d_AD=2.622 a_DHA=163.259 symop: x,y,z a_YAH=144 1218 1450 " H GLY A 104 "<>" O LEU A 87 " d_HA=2.280 d_AD=3.109 a_DHA=137.356 symop: x,y,z a_YAH=147 671 1237 " H HIS A 46 "<>" O VAL A 88 " d_HA=2.517 d_AD=3.509 a_DHA=166.811 symop: x,y,z a_YAH=159 1253 1430 " H ALA A 102 "<>" O VAL A 89 " d_HA=2.629 d_AD=3.415 a_DHA=135.023 symop: x,y,z a_YAH=144 1257 1428 " H VAL A 89 "<>" O ALA A 102 " d_HA=2.596 d_AD=3.355 a_DHA=132.253 symop: x,y,z a_YAH=136 1292 1385 " H GLU A 91 "<>" O ARG A 100 " d_HA=2.091 d_AD=3.073 a_DHA=166.113 symop: x,y,z a_YAH=173 156 1291 " H ASP A 11 "<>" OE2 GLU A 91 " d_HA=2.146 d_AD=3.106 a_DHA=157.640 symop: x,y,z a_YAH=146 151 188 " H VAL A 14 "<>" O ASP A 11 " d_HA=2.240 d_AD=3.216 a_DHA=163.329 symop: x,y,z a_YAH=125 1593 1826 " H PHE B 20 "<>" O ALA B 4 " d_HA=1.561 d_AD=2.539 a_DHA=166.004 symop: x,y,z a_YAH=148 1809 2007 " H ASN B 19 "<>" O TRP B 32 " d_HA=1.897 d_AD=2.887 a_DHA=162.174 symop: x,y,z a_YAH=169 2031 2474 " H VAL B 67 "<>" O GLY B 33 " d_HA=1.779 d_AD=2.751 a_DHA=157.321 symop: x,y,z a_YAH=168 2032 2470 " H GLY B 33 "<>" O VAL B 67 " d_HA=2.647 d_AD=3.476 a_DHA=139.515 symop: x,y,z a_YAH=138 1534 29 " H GLN A 110 "<>" O LYS A 3 " d_HA=2.584 d_AD=3.553 a_DHA=159.561 symop: x,y,z a_YAH=97 989 415 " H VAL A 29 "<>" O ASP A 71 " d_HA=1.746 d_AD=2.481 a_DHA=125.884 symop: x,y,z a_YAH=177 992 1016 " H VAL A 73 "<>" OD1 ASP A 71 " d_HA=2.187 d_AD=2.909 a_DHA=127.023 symop: x,y,z a_YAH=124 992 1033 " H ILE A 74 "<>" OD1 ASP A 71 " d_HA=1.807 d_AD=2.789 a_DHA=162.255 symop: x,y,z a_YAH=144 644 762 " H LEU A 54 "<>" O PHE A 45 " d_HA=2.544 d_AD=3.292 a_DHA=129.655 symop: x,y,z a_YAH=132 748 777 " H GLY A 55 "<>" OD1 ASP A 53 " d_HA=2.113 d_AD=3.027 a_DHA=149.775 symop: x,y,z a_YAH=136 637 1276 " H HIS A 90 "<>" O GLY A 44 " d_HA=1.990 d_AD=2.931 a_DHA=153.200 symop: x,y,z a_YAH=142 652 776 " H PHE A 45 "<>" O GLY A 55 " d_HA=2.549 d_AD=3.579 a_DHA=176.322 symop: x,y,z a_YAH=127 631 1269 " HD1 HIS A 43 "<>" O HIS A 90 " d_HA=1.761 d_AD=2.671 a_DHA=146.624 symop: x,y,z a_YAH=128 1619 1790 " H ILE B 18 "<>" O ALA B 6 " d_HA=2.283 d_AD=3.260 a_DHA=157.613 symop: x,y,z a_YAH=148 1621 1785 " H ALA B 6 "<>" O ILE B 18 " d_HA=1.999 d_AD=2.985 a_DHA=159.573 symop: x,y,z a_YAH=154 1650 1759 " H LEU B 8 "<>" O GLY B 16 " d_HA=2.233 d_AD=2.906 a_DHA=123.779 symop: x,y,z a_YAH=135 1766 2041 " H SER B 34 "<>" O ILE B 17 " d_HA=2.326 d_AD=3.045 a_DHA=127.181 symop: x,y,z a_YAH=166 1771 2038 " H ILE B 17 "<>" O SER B 34 " d_HA=1.977 d_AD=2.986 a_DHA=174.415 symop: x,y,z a_YAH=140 2051 2448 " H ALA B 35 "<>" O ALA B 65 " d_HA=2.220 d_AD=3.151 a_DHA=151.769 symop: x,y,z a_YAH=142 2252 2462 " HE2 HIS B 48 "<>" OD2 ASP B 66 " d_HA=2.893 d_AD=3.689 a_DHA=136.166 symop: x-y+1,x,z-1/6 a_YAH=114 2738 2666 " HE ARG B 85 "<>" O SER B 81 " d_HA=2.870 d_AD=3.677 a_DHA=135.948 symop: x,y,z a_YAH=146 788 2543 " H ASN A 56 "<>" O SER B 72 " d_HA=2.834 d_AD=3.452 a_DHA=120.418 symop: -x+1,-y+1,z+1/2 a_YAH=132 620 801 " H VAL A 57 "<>" O HIS A 43 " d_HA=2.427 d_AD=3.318 a_DHA=145.481 symop: x,y,z a_YAH=144 620 793 "HD22 ASN A 56 "<>" O HIS A 43 " d_HA=2.457 d_AD=3.322 a_DHA=143.476 symop: x,y,z a_YAH=103 1645 1760 " H GLY B 16 "<>" O LEU B 8 " d_HA=2.361 d_AD=3.000 a_DHA=120.877 symop: x,y,z a_YAH=153 1742 2065 " H LYS B 36 "<>" O GLN B 15 " d_HA=2.239 d_AD=3.060 a_DHA=138.014 symop: x,y,z a_YAH=155 2049 2450 " H ALA B 65 "<>" O ALA B 35 " d_HA=2.784 d_AD=3.577 a_DHA=136.002 symop: x,y,z a_YAH=101 2257 2417 " H GLY B 49 "<>" OD2 ASP B 62 " d_HA=2.972 d_AD=3.968 a_DHA=161.410 symop: x-y+1,x,z-1/6 a_YAH=164 2246 2746 " H HIS B 48 "<>" O THR B 86 " d_HA=1.643 d_AD=2.635 a_DHA=166.973 symop: x,y,z a_YAH=165 2765 2991 " H LEU B 87 "<>" O GLY B 104 " d_HA=2.466 d_AD=3.432 a_DHA=155.897 symop: x,y,z a_YAH=147 2239 2265 " H ALA B 50 "<>" O HIS B 48 " d_HA=2.062 d_AD=2.943 a_DHA=144.435 symop: x,y,z a_YAH=93 1687 1726 " H GLY B 10 "<>" O VAL B 14 " d_HA=2.101 d_AD=2.887 a_DHA=131.012 symop: x,y,z a_YAH=166 1748 2059 " H GLN B 15 "<>" O LYS B 36 " d_HA=2.969 d_AD=3.711 a_DHA=130.863 symop: x,y,z a_YAH=135 2082 2425 " H GLY B 37 "<>" O GLY B 63 " d_HA=1.833 d_AD=2.703 a_DHA=141.668 symop: x,y,z a_YAH=167 2760 2992 " H GLY B 104 "<>" O LEU B 87 " d_HA=2.678 d_AD=3.581 a_DHA=147.413 symop: x,y,z a_YAH=146 2206 2783 " H VAL B 88 "<>" O HIS B 46 " d_HA=1.734 d_AD=2.593 a_DHA=141.131 symop: x,y,z a_YAH=141 2227 2280 " H VAL B 47 "<>" O GLY B 52 " d_HA=1.877 d_AD=2.824 a_DHA=154.525 symop: x,y,z a_YAH=106 1664 2983 " H SER B 103 "<>" O LYS B 9 " d_HA=1.902 d_AD=2.801 a_DHA=144.554 symop: x,y,z a_YAH=151 2970 2799 " H VAL B 89 "<>" O ALA B 102 " d_HA=2.459 d_AD=3.405 a_DHA=155.758 symop: x,y,z a_YAH=161 ------------------------------------------------------------------------------- Total: 169 Symmetry: 0 Per residue: 0.7682 Mean SD Skew Kurtosis theta_1: 144.120 20.497 -0.559 2.482 theta_2: 135.720 22.229 -0.157 2.097 d_HA: 2.374 0.350 0.054 2.002 2496 2527 " HE ARG A 191 "<>" OD2 ASP A 193 " d_HA=2.639 d_AD=3.605 a_DHA=158.871 symop: x,y,z a_YAH=164 2499 2527 "HH21 ARG A 191 "<>" OD2 ASP A 193 " d_HA=2.985 d_AD=3.868 a_DHA=146.518 symop: x,y,z a_YAH=131 2472 2435 " H ALA A 190 "<>" O THR A 187 " d_HA=1.751 d_AD=2.748 a_DHA=167.587 symop: x,y,z a_YAH=131 2185 2138 " H ALA A 170 "<>" O LEU A 167 " d_HA=1.841 d_AD=2.805 a_DHA=158.416 symop: x,y,z a_YAH=124 1912 2198 " H MET A 171 "<>" O ALA A 150 " d_HA=1.891 d_AD=2.888 a_DHA=167.178 symop: x,y,z a_YAH=162 2127 2160 " H SER A 168 "<>" OD1 ASN A 166 " d_HA=2.065 d_AD=3.023 a_DHA=158.046 symop: x,y,z a_YAH=122 2127 2427 " HE ARG A 186 "<>" OD1 ASN A 166 " d_HA=2.495 d_AD=3.438 a_DHA=155.141 symop: x,y,z a_YAH=105 2127 2164 " HG SER A 168 "<>" OD1 ASN A 166 " d_HA=1.730 d_AD=2.683 a_DHA=166.530 symop: x,y,z a_YAH=153 1869 1914 " H ALA A 150 "<>" O LEU A 147 " d_HA=1.893 d_AD=2.863 a_DHA=158.644 symop: x,y,z a_YAH=135 1595 1650 " H ALA A 130 "<>" O LEU A 127 " d_HA=1.962 d_AD=2.914 a_DHA=155.186 symop: x,y,z a_YAH=138 1648 1926 " H VAL A 151 "<>" O ALA A 130 " d_HA=1.901 d_AD=2.915 a_DHA=174.350 symop: x,y,z a_YAH=161 1363 1663 " H ASN A 131 "<>" O ALA A 110 " d_HA=1.919 d_AD=2.903 a_DHA=163.439 symop: x,y,z a_YAH=163 1094 1123 "HD21 ASN A 91 "<>" OE2 GLU A 93 " d_HA=1.921 d_AD=2.915 a_DHA=162.245 symop: x,y,z a_YAH=117 1857 1600 " H LEU A 127 "<>" O ASP A 146 " d_HA=1.902 d_AD=2.756 a_DHA=139.497 symop: x,y,z a_YAH=147 1312 1365 " H ALA A 110 "<>" O LEU A 107 " d_HA=1.875 d_AD=2.826 a_DHA=154.563 symop: x,y,z a_YAH=141 1075 1378 " H ASN A 111 "<>" O ALA A 90 " d_HA=2.134 d_AD=3.083 a_DHA=156.326 symop: x,y,z a_YAH=133 786 1090 " H ASN A 91 "<>" O ALA A 70 " d_HA=2.296 d_AD=3.144 a_DHA=141.144 symop: x,y,z a_YAH=126 786 815 " H LEU A 72 "<>" O ALA A 70 " d_HA=2.565 d_AD=3.201 a_DHA=120.161 symop: x,y,z a_YAH=114 799 837 " H ARG A 73 "<>" OD1 ASN A 71 " d_HA=2.291 d_AD=3.224 a_DHA=153.021 symop: x,y,z a_YAH=156 1317 1581 " H LEU A 107 "<>" O ASN A 126 " d_HA=1.868 d_AD=2.780 a_DHA=147.809 symop: x,y,z a_YAH=149 1043 1300 " H LEU A 87 "<>" O ASP A 106 " d_HA=1.739 d_AD=2.723 a_DHA=161.374 symop: x,y,z a_YAH=167 708 1029 " H ASN A 86 "<>" O ALA A 65 " d_HA=2.431 d_AD=3.186 a_DHA=131.223 symop: x,y,z a_YAH=113 708 737 " H LEU A 67 "<>" O ALA A 65 " d_HA=2.328 d_AD=3.043 a_DHA=126.249 symop: x,y,z a_YAH=113 1014 1305 " H ASP A 106 "<>" O ALA A 85 " d_HA=2.070 d_AD=2.945 a_DHA=143.794 symop: x,y,z a_YAH=137 737 1024 " H LEU A 67 "<>" O ASN A 86 " d_HA=1.971 d_AD=2.825 a_DHA=139.646 symop: x,y,z a_YAH=159 110 193 " H ALA A 31 "<>" O LEU A 27 " d_HA=1.904 d_AD=2.876 a_DHA=158.991 symop: x,y,z a_YAH=147 53 115 " H LEU A 27 "<>" O VAL A 23 " d_HA=1.825 d_AD=2.837 a_DHA=174.450 symop: x,y,z a_YAH=162 69 137 " H ARG A 28 "<>" O GLY A 24 " d_HA=1.905 d_AD=2.888 a_DHA=162.034 symop: x,y,z a_YAH=153 405 702 " HD1 HIS A 64 "<>" OE1 GLU A 44 " d_HA=2.146 d_AD=3.101 a_DHA=154.114 symop: x,y,z a_YAH=136 42 82 " H GLU A 25 "<>" OD1 ASN A 22 " d_HA=2.968 d_AD=3.912 a_DHA=155.569 symop: x,y,z a_YAH=122 42 70 " H GLY A 24 "<>" OD1 ASN A 22 " d_HA=2.433 d_AD=3.334 a_DHA=148.240 symop: x,y,z a_YAH=140 82 39 " H GLU A 25 "<>" O ASN A 22 " d_HA=2.423 d_AD=3.071 a_DHA=121.151 symop: x,y,z a_YAH=112 2752 3020 " HE ARG A 208 "<>" O ALA A 228 " d_HA=2.434 d_AD=3.349 a_DHA=152.574 symop: x,y,z a_YAH=125 2755 3020 "HH21 ARG A 208 "<>" O ALA A 228 " d_HA=2.452 d_AD=3.392 a_DHA=155.542 symop: x,y,z a_YAH=131 2663 2744 " H ARG A 208 "<>" O PRO A 204 " d_HA=2.888 d_AD=3.695 a_DHA=137.467 symop: x,y,z a_YAH=131 2464 2760 " H GLY A 189 "<>" O THR A 209 " d_HA=2.690 d_AD=3.640 a_DHA=155.944 symop: x,y,z a_YAH=121 1900 2172 "HE21 GLN A 148 "<>" OE1 GLU A 169 " d_HA=1.998 d_AD=3.015 a_DHA=168.206 symop: x,y,z a_YAH=149 2174 2449 " H GLU A 169 "<>" O THR A 188 " d_HA=2.257 d_AD=3.209 a_DHA=156.049 symop: x,y,z a_YAH=138 1906 2157 " H GLY A 149 "<>" O SER A 168 " d_HA=2.015 d_AD=2.993 a_DHA=160.307 symop: x,y,z a_YAH=157 1860 1894 " H GLN A 148 "<>" OD1 ASP A 146 " d_HA=2.085 d_AD=3.076 a_DHA=164.076 symop: x,y,z a_YAH=146 1860 2134 "HD22 ASN A 166 "<>" OD1 ASP A 146 " d_HA=1.952 d_AD=2.922 a_DHA=155.958 symop: x,y,z a_YAH=114 1354 1614 " H GLU A 109 "<>" O LYS A 128 " d_HA=2.110 d_AD=3.095 a_DHA=162.757 symop: x,y,z a_YAH=159 1641 1888 " H ASP A 129 "<>" O GLN A 148 " d_HA=2.030 d_AD=3.034 a_DHA=170.909 symop: x,y,z a_YAH=160 3281 3323 " H GLY B 33 "<>" O TYR B 30 " d_HA=1.887 d_AD=2.851 a_DHA=157.755 symop: x,y,z a_YAH=116 3281 3369 "HH12 ARG B 35 "<>" O TYR B 30 " d_HA=1.711 d_AD=2.690 a_DHA=162.737 symop: x,y,z a_YAH=120 1584 1620 " H LYS A 128 "<>" OD1 ASN A 126 " d_HA=2.062 d_AD=2.954 a_DHA=146.014 symop: x,y,z a_YAH=150 1038 1077 " H ALA A 90 "<>" O LEU A 87 " d_HA=1.738 d_AD=2.712 a_DHA=159.149 symop: x,y,z a_YAH=146 1069 1331 " H GLY A 89 "<>" O HIS A 108 " d_HA=2.169 d_AD=3.144 a_DHA=159.890 symop: x,y,z a_YAH=157 3298 3648 " HH TYR B 30 "<>" O THR B 53 " d_HA=1.689 d_AD=2.653 a_DHA=167.230 symop: x,y,z a_YAH=127 1303 1338 " H HIS A 108 "<>" OD1 ASP A 106 " d_HA=2.142 d_AD=3.091 a_DHA=154.750 symop: x,y,z a_YAH=157 1303 1342 " HD1 HIS A 108 "<>" OD1 ASP A 106 " d_HA=1.774 d_AD=2.740 a_DHA=155.464 symop: x,y,z a_YAH=100 1027 1060 " H SER A 88 "<>" OD1 ASN A 86 " d_HA=2.382 d_AD=3.076 a_DHA=125.137 symop: x,y,z a_YAH=137 1027 1064 " HG SER A 88 "<>" OD1 ASN A 86 " d_HA=1.745 d_AD=2.691 a_DHA=162.554 symop: x,y,z a_YAH=129 732 788 " H ALA A 70 "<>" O LEU A 67 " d_HA=1.892 d_AD=2.821 a_DHA=150.287 symop: x,y,z a_YAH=140 770 1057 " H ARG A 69 "<>" O SER A 88 " d_HA=1.976 d_AD=2.982 a_DHA=169.414 symop: x,y,z a_YAH=158 488 751 " H ASN A 49 "<>" O SER A 68 " d_HA=1.951 d_AD=2.928 a_DHA=160.385 symop: x,y,z a_YAH=155 497 801 " H ASN A 71 "<>" O ALA A 50 " d_HA=2.016 d_AD=2.923 a_DHA=148.442 symop: x,y,z a_YAH=156 455 718 " H LEU A 47 "<>" O ASN A 66 " d_HA=1.905 d_AD=2.893 a_DHA=162.675 symop: x,y,z a_YAH=148 721 754 " H SER A 68 "<>" OD1 ASN A 66 " d_HA=2.234 d_AD=3.136 a_DHA=147.553 symop: x,y,z a_YAH=145 450 499 " H ALA A 50 "<>" O LEU A 47 " d_HA=1.860 d_AD=2.792 a_DHA=150.563 symop: x,y,z a_YAH=130 3910 3948 " H ARG B 73 "<>" OD1 ASN B 71 " d_HA=2.394 d_AD=3.197 a_DHA=135.818 symop: x,y,z a_YAH=149 3958 4233 "HH12 ARG B 73 "<>" OE1 GLU B 93 " d_HA=1.754 d_AD=2.697 a_DHA=150.302 symop: x,y,z a_YAH=121 3959 4248 "HH21 ARG B 73 "<>" OE1 GLU B 94 " d_HA=1.794 d_AD=2.808 a_DHA=166.662 symop: x,y,z a_YAH=140 416 723 " H ASN A 66 "<>" O ILE A 45 " d_HA=2.538 d_AD=3.173 a_DHA=120.704 symop: x,y,z a_YAH=134 439 728 "HD22 ASN A 66 "<>" OE1 GLU A 46 " d_HA=2.110 d_AD=2.967 a_DHA=140.470 symop: x,y,z a_YAH=127 4205 4234 "HD21 ASN B 91 "<>" OE2 GLU B 93 " d_HA=1.687 d_AD=2.680 a_DHA=162.493 symop: x,y,z a_YAH=123 4234 4494 "HD22 ASN B 111 "<>" OE2 GLU B 93 " d_HA=2.169 d_AD=2.895 a_DHA=127.650 symop: x,y,z a_YAH=100 2831 3047 " H GLY A 214 "<>" O GLY A 230 " d_HA=1.924 d_AD=2.906 a_DHA=161.180 symop: x,-y+2,-z+2 a_YAH=135 3076 2837 " H CYS A 232 "<>" O ALA A 215 " d_HA=1.989 d_AD=2.970 a_DHA=161.998 symop: x,-y+2,-z+2 a_YAH=143 2970 3022 " H ALA A 228 "<>" O ALA A 224 " d_HA=2.206 d_AD=3.135 a_DHA=151.149 symop: x,y,z a_YAH=122 2980 3041 " HD1 HIS A 229 "<>" O PHE A 225 " d_HA=1.750 d_AD=2.731 a_DHA=160.898 symop: x,y,z a_YAH=142 2980 3037 " H HIS A 229 "<>" O PHE A 225 " d_HA=2.534 d_AD=3.235 a_DHA=125.583 symop: x,y,z a_YAH=126 3002 2944 " H ALA A 226 "<>" O ALA A 222 " d_HA=2.305 d_AD=3.269 a_DHA=157.048 symop: x,y,z a_YAH=137 3000 3059 " H LEU A 231 "<>" O ALA A 226 " d_HA=2.235 d_AD=3.223 a_DHA=165.676 symop: x,y,z a_YAH=132 3000 3037 " H HIS A 229 "<>" O ALA A 226 " d_HA=2.092 d_AD=2.863 a_DHA=130.688 symop: x,y,z a_YAH=100 3000 3048 " H GLY A 230 "<>" O ALA A 226 " d_HA=2.383 d_AD=3.043 a_DHA=122.028 symop: x,y,z a_YAH=142 3010 3048 " H GLY A 230 "<>" O ALA A 227 " d_HA=2.383 d_AD=3.219 a_DHA=139.312 symop: x,y,z a_YAH=94 3267 3347 " HZ3 LYS B 34 "<>" ND1 HIS B 29 " d_HA=2.056 d_AD=2.992 a_DHA=151.499 symop: x,y,z a_YAH=149 a_YAH=103 1631 1892 " HZ2 LYS A 128 "<>" OE1 GLN A 148 " d_HA=2.878 d_AD=3.730 a_DHA=142.078 symop: x,y,z a_YAH=113 3180 3248 " H ARG B 28 "<>" O GLY B 24 " d_HA=1.846 d_AD=2.857 a_DHA=171.598 symop: x,y,z a_YAH=163 3187 3271 " H HIS B 29 "<>" O GLU B 25 " d_HA=1.912 d_AD=2.892 a_DHA=160.872 symop: x,y,z a_YAH=143 3202 3290 " H TYR B 30 "<>" O ILE B 26 " d_HA=1.863 d_AD=2.854 a_DHA=163.021 symop: x,y,z a_YAH=155 3221 3304 " H ALA B 31 "<>" O LEU B 27 " d_HA=1.780 d_AD=2.778 a_DHA=166.441 symop: x,y,z a_YAH=157 3240 3314 " H ALA B 32 "<>" O ARG B 28 " d_HA=1.938 d_AD=2.913 a_DHA=160.669 symop: x,y,z a_YAH=153 3264 3335 " H LYS B 34 "<>" O HIS B 29 " d_HA=2.024 d_AD=2.984 a_DHA=156.943 symop: x,y,z a_YAH=161 3329 3368 "HH11 ARG B 35 "<>" O LYS B 34 " d_HA=2.431 d_AD=3.341 a_DHA=150.164 symop: x,y,z a_YAH=123 3164 3226 " H LEU B 27 "<>" O VAL B 23 " d_HA=2.010 d_AD=3.016 a_DHA=169.987 symop: x,y,z a_YAH=155 3608 3912 " H ASN B 71 "<>" O ALA B 50 " d_HA=1.796 d_AD=2.804 a_DHA=173.171 symop: x,y,z a_YAH=155 3634 3907 " H LEU B 52 "<>" O ASN B 71 " d_HA=1.921 d_AD=2.876 a_DHA=155.442 symop: x,y,z a_YAH=142 3629 3671 " H ALA B 55 "<>" O LEU B 52 " d_HA=1.980 d_AD=2.925 a_DHA=153.661 symop: x,y,z a_YAH=142 3663 3940 " H GLY B 54 "<>" O ARG B 73 " d_HA=2.334 d_AD=3.226 a_DHA=146.166 symop: x,y,z a_YAH=145 3921 3977 " H ALA B 75 "<>" O LEU B 72 " d_HA=1.842 d_AD=2.778 a_DHA=151.986 symop: x,y,z a_YAH=155 3967 4229 " H SER B 74 "<>" O GLU B 93 " d_HA=1.889 d_AD=2.858 a_DHA=158.653 symop: x,y,z a_YAH=159 3561 3610 " H ALA B 50 "<>" O LEU B 47 " d_HA=1.960 d_AD=2.899 a_DHA=152.284 symop: x,y,z a_YAH=135 3599 3862 " H ASN B 49 "<>" O SER B 68 " d_HA=2.096 d_AD=3.038 a_DHA=154.104 symop: x,y,z a_YAH=154 3897 4201 " H ASN B 91 "<>" O ALA B 70 " d_HA=2.252 d_AD=3.137 a_DHA=145.796 symop: x,y,z a_YAH=135 3897 3926 " H LEU B 72 "<>" O ALA B 70 " d_HA=2.604 d_AD=3.264 a_DHA=122.493 symop: x,y,z a_YAH=111 3926 4196 " H LEU B 72 "<>" O ASN B 91 " d_HA=2.055 d_AD=2.857 a_DHA=134.148 symop: x,y,z a_YAH=154 4199 4235 " H GLU B 93 "<>" OD1 ASN B 91 " d_HA=2.702 d_AD=3.516 a_DHA=138.130 symop: x,y,z a_YAH=106 4250 4517 " H GLU B 94 "<>" O SER B 113 " d_HA=2.215 d_AD=3.177 a_DHA=157.416 symop: x,y,z a_YAH=154 3881 4168 " H ARG B 69 "<>" O SER B 88 " d_HA=1.984 d_AD=2.986 a_DHA=167.765 symop: x,y,z a_YAH=160 4186 4489 " H ASN B 111 "<>" O ALA B 90 " d_HA=2.051 d_AD=3.040 a_DHA=165.621 symop: x,y,z a_YAH=141 4215 4484 " H LEU B 92 "<>" O ASN B 111 " d_HA=1.802 d_AD=2.780 a_DHA=160.847 symop: x,y,z a_YAH=146 4487 4520 " H SER B 113 "<>" OD1 ASN B 111 " d_HA=2.245 d_AD=3.171 a_DHA=152.120 symop: x,y,z a_YAH=135 4487 4524 " HG SER B 113 "<>" OD1 ASN B 111 " d_HA=2.036 d_AD=2.914 a_DHA=150.032 symop: x,y,z a_YAH=142 4529 4802 " H GLY B 114 "<>" O SER B 133 " d_HA=1.971 d_AD=2.942 a_DHA=158.269 symop: x,y,z a_YAH=156 4474 4774 " H ASN B 131 "<>" O ALA B 110 " d_HA=1.918 d_AD=2.928 a_DHA=174.222 symop: x,y,z a_YAH=174 4772 4805 " H SER B 133 "<>" OD1 ASN B 131 " d_HA=1.838 d_AD=2.803 a_DHA=160.111 symop: x,y,z a_YAH=163 4772 4809 " HG SER B 133 "<>" OD1 ASN B 131 " d_HA=1.808 d_AD=2.743 a_DHA=161.818 symop: x,y,z a_YAH=137 4818 5068 " H ASP B 134 "<>" O ASP B 153 " d_HA=2.088 d_AD=3.062 a_DHA=159.553 symop: x,y,z a_YAH=155 5071 5373 "HH21 ARG B 174 "<>" OD1 ASP B 153 " d_HA=1.739 d_AD=2.689 a_DHA=150.656 symop: x,y,z a_YAH=93 5072 5347 " HG1 THR B 173 "<>" OD2 ASP B 153 " d_HA=1.832 d_AD=2.772 a_DHA=159.482 symop: x,y,z a_YAH=121 5072 5370 " HE ARG B 174 "<>" OD2 ASP B 153 " d_HA=2.261 d_AD=3.145 a_DHA=144.048 symop: x,y,z a_YAH=108 3073 2875 " H VAL A 217 "<>" O CYS A 232 " d_HA=2.361 d_AD=3.334 a_DHA=160.389 symop: x,-y+2,-z+2 a_YAH=131 2972 2915 " H ALA A 224 "<>" O ASP A 220 " d_HA=2.020 d_AD=3.013 a_DHA=164.363 symop: x,y,z a_YAH=140 2954 3012 " H ALA A 227 "<>" O VAL A 223 " d_HA=1.790 d_AD=2.790 a_DHA=167.163 symop: x,y,z a_YAH=159 6661 6950 "HD22 ASN C 66 "<>" OE1 GLU C 46 " d_HA=2.232 d_AD=3.168 a_DHA=152.000 symop: x,y,z a_YAH=123 6627 6924 " HD1 HIS C 64 "<>" OE1 GLU C 44 " d_HA=1.989 d_AD=2.935 a_DHA=152.071 symop: x,y,z a_YAH=146 6216 9088 "HH21 ARG C 216 "<>" OXT ALA B 234 " d_HA=1.670 d_AD=2.656 a_DHA=158.560 symop: x,-y+2,-z+2 a_YAH=154 6907 7210 " HD1 HIS C 63 "<>" OG SER C 83 " d_HA=2.332 d_AD=3.327 a_DHA=165.162 symop: x,y,z a_YAH=132 a_YAH=107 3351 3684 " H ASP B 56 "<>" O ARG B 35 " d_HA=2.146 d_AD=2.982 a_DHA=139.666 symop: x,y,z a_YAH=127 3397 3679 " H PHE B 37 "<>" O ASP B 56 " d_HA=1.947 d_AD=2.914 a_DHA=157.386 symop: x,y,z a_YAH=150 7506 7762 " H GLY C 104 "<>" O THR C 123 " d_HA=1.914 d_AD=2.914 a_DHA=166.419 symop: x,y,z a_YAH=168 3150 3207 " H ILE B 26 "<>" O ASN B 22 " d_HA=2.432 d_AD=3.412 a_DHA=161.412 symop: x,y,z a_YAH=152 3153 3193 " H GLU B 25 "<>" OD1 ASN B 22 " d_HA=2.267 d_AD=3.267 a_DHA=168.252 symop: x,y,z a_YAH=136 3153 3181 " H GLY B 24 "<>" OD1 ASN B 22 " d_HA=2.091 d_AD=2.934 a_DHA=139.499 symop: x,y,z a_YAH=141 3669 3990 " H ASP B 76 "<>" O ALA B 55 " d_HA=2.409 d_AD=3.338 a_DHA=153.035 symop: x,y,z a_YAH=113 3696 3985 " H LEU B 57 "<>" O ASP B 76 " d_HA=1.893 d_AD=2.817 a_DHA=148.912 symop: x,y,z a_YAH=147 7782 8052 " H GLN C 124 "<>" O ALA C 143 " d_HA=2.029 d_AD=3.020 a_DHA=164.297 symop: x,y,z a_YAH=150 7788 8052 "HE21 GLN C 124 "<>" O ALA C 143 " d_HA=2.830 d_AD=3.671 a_DHA=140.968 symop: x,y,z a_YAH=124 3975 4274 " H ASN B 96 "<>" O ALA B 75 " d_HA=2.000 d_AD=2.982 a_DHA=163.521 symop: x,y,z a_YAH=169 8063 8308 " H GLY C 144 "<>" O ASN C 163 " d_HA=1.745 d_AD=2.722 a_DHA=160.749 symop: x,y,z a_YAH=175 8069 8351 " H ASN C 166 "<>" O ALA C 145 " d_HA=1.979 d_AD=2.977 a_DHA=165.967 symop: x,y,z a_YAH=162 3550 3839 "HD22 ASN B 66 "<>" OE1 GLU B 46 " d_HA=1.849 d_AD=2.851 a_DHA=162.963 symop: x,y,z a_YAH=159 3566 3829 " H LEU B 47 "<>" O ASN B 66 " d_HA=1.854 d_AD=2.822 a_DHA=157.722 symop: x,y,z a_YAH=157 3843 3899 " H ALA B 70 "<>" O LEU B 67 " d_HA=1.854 d_AD=2.815 a_DHA=156.831 symop: x,y,z a_YAH=142 3848 4135 " H LEU B 67 "<>" O ASN B 86 " d_HA=1.832 d_AD=2.781 a_DHA=153.647 symop: x,y,z a_YAH=155 4210 4261 " H ALA B 95 "<>" O LEU B 92 " d_HA=1.852 d_AD=2.801 a_DHA=154.517 symop: x,y,z a_YAH=137 4259 4550 " H ASP B 116 "<>" O ALA B 95 " d_HA=1.976 d_AD=2.959 a_DHA=163.026 symop: x,y,z a_YAH=149 4535 4840 " H ASN B 136 "<>" O ALA B 115 " d_HA=1.939 d_AD=2.949 a_DHA=174.647 symop: x,y,z a_YAH=176 8327 8605 " H ASN C 164 "<>" O SER C 183 " d_HA=1.936 d_AD=2.924 a_DHA=162.446 symop: x,y,z a_YAH=147 3832 3865 " H SER B 68 "<>" OD1 ASN B 66 " d_HA=2.393 d_AD=3.304 a_DHA=149.474 symop: x,y,z a_YAH=137 4138 4171 " H SER B 88 "<>" OD1 ASN B 86 " d_HA=1.958 d_AD=2.872 a_DHA=148.788 symop: x,y,z a_YAH=160 4138 4175 " HG SER B 88 "<>" OD1 ASN B 86 " d_HA=1.691 d_AD=2.665 a_DHA=172.723 symop: x,y,z a_YAH=127 4149 4188 " H ALA B 90 "<>" O LEU B 87 " d_HA=1.766 d_AD=2.752 a_DHA=162.449 symop: x,y,z a_YAH=138 4498 4537 " H ALA B 115 "<>" O LEU B 112 " d_HA=1.926 d_AD=2.860 a_DHA=152.113 symop: x,y,z a_YAH=154 4503 4769 " H LEU B 112 "<>" O ASN B 131 " d_HA=1.791 d_AD=2.690 a_DHA=145.323 symop: x,y,z a_YAH=164 4825 5102 " H ASN B 156 "<>" O ALA B 135 " d_HA=1.920 d_AD=2.913 a_DHA=166.116 symop: x,y,z a_YAH=168 8617 8877 " H GLY C 184 "<>" OD2 ASP C 203 " d_HA=1.908 d_AD=2.812 a_DHA=145.698 symop: x,y,z a_YAH=99 7070 7360 "HH21 ARG C 73 "<>" OE2 GLU C 94 " d_HA=1.991 d_AD=2.811 a_DHA=134.574 symop: x,y,z a_YAH=98 7071 7344 "HH22 ARG C 73 "<>" OE1 GLU C 93 " d_HA=2.688 d_AD=3.332 a_DHA=121.834 symop: x,y,z a_YAH=126 4180 4442 " H GLY B 89 "<>" O HIS B 108 " d_HA=2.067 d_AD=3.028 a_DHA=156.378 symop: x,y,z a_YAH=155 4423 4476 " H ALA B 110 "<>" O LEU B 107 " d_HA=1.846 d_AD=2.799 a_DHA=154.795 symop: x,y,z a_YAH=144 4465 4725 " H GLU B 109 "<>" O LYS B 128 " d_HA=2.104 d_AD=3.077 a_DHA=159.723 symop: x,y,z a_YAH=152 4759 5037 " H VAL B 151 "<>" O ALA B 130 " d_HA=2.065 d_AD=3.003 a_DHA=152.528 symop: x,y,z a_YAH=163 4788 5033 " H LEU B 132 "<>" O VAL B 151 " d_HA=1.802 d_AD=2.726 a_DHA=149.664 symop: x,y,z a_YAH=155 4783 4827 " H ALA B 135 "<>" O LEU B 132 " d_HA=2.038 d_AD=2.983 a_DHA=154.308 symop: x,y,z a_YAH=132 5049 5089 " H ALA B 155 "<>" O LEU B 152 " d_HA=1.913 d_AD=2.885 a_DHA=159.287 symop: x,y,z a_YAH=138 4706 4761 " H ALA B 130 "<>" O LEU B 127 " d_HA=1.975 d_AD=2.942 a_DHA=158.750 symop: x,y,z a_YAH=131 4752 4999 " H ASP B 129 "<>" O GLN B 148 " d_HA=2.143 d_AD=3.078 a_DHA=152.958 symop: x,y,z a_YAH=139 5023 5309 " H MET B 171 "<>" O ALA B 150 " d_HA=1.982 d_AD=2.986 a_DHA=169.060 symop: x,y,z a_YAH=161 5054 5304 " H LEU B 152 "<>" O MET B 171 " d_HA=1.802 d_AD=2.770 a_DHA=158.765 symop: x,y,z a_YAH=143 5081 5340 " H GLY B 154 "<>" O THR B 173 " d_HA=2.405 d_AD=3.315 a_DHA=149.174 symop: x,y,z a_YAH=147 5321 5380 " H ALA B 175 "<>" O LEU B 172 " d_HA=2.062 d_AD=3.008 a_DHA=155.747 symop: x,y,z a_YAH=114 5362 5634 " H ARG B 174 "<>" O ASP B 193 " d_HA=2.032 d_AD=2.948 a_DHA=147.856 symop: x,y,z a_YAH=146 4742 5003 " HZ2 LYS B 128 "<>" OE1 GLN B 148 " d_HA=2.606 d_AD=3.548 a_DHA=154.746 symop: x,y,z a_YAH=100 5017 5268 " H GLY B 149 "<>" O SER B 168 " d_HA=2.187 d_AD=3.063 a_DHA=143.650 symop: x,y,z a_YAH=144 5294 5326 " H LEU B 172 "<>" O ALA B 170 " d_HA=2.756 d_AD=3.386 a_DHA=120.539 symop: x,y,z a_YAH=106 5294 5599 " H ARG B 191 "<>" O ALA B 170 " d_HA=2.011 d_AD=2.992 a_DHA=160.802 symop: x,y,z a_YAH=166 5326 5591 " H LEU B 172 "<>" O ARG B 191 " d_HA=2.078 d_AD=2.877 a_DHA=134.088 symop: x,y,z a_YAH=143 5615 5660 " H ALA B 195 "<>" O LEU B 192 " d_HA=1.822 d_AD=2.781 a_DHA=156.408 symop: x,y,z a_YAH=138 5651 5925 " H ASP B 194 "<>" O VAL B 213 " d_HA=2.078 d_AD=2.997 a_DHA=149.847 symop: x,y,z a_YAH=129 5011 5283 "HE21 GLN B 148 "<>" OE1 GLU B 169 " d_HA=1.890 d_AD=2.835 a_DHA=150.811 symop: x,y,z a_YAH=116 5607 5638 " HE ARG B 191 "<>" OD2 ASP B 193 " d_HA=2.850 d_AD=3.848 a_DHA=167.601 symop: x,y,z a_YAH=176 5638 5902 " HG SER B 211 "<>" OD2 ASP B 193 " d_HA=1.744 d_AD=2.652 a_DHA=151.199 symop: x,y,z a_YAH=95 5950 5906 " H ALA B 215 "<>" O LEU B 212 " d_HA=1.955 d_AD=2.903 a_DHA=155.368 symop: x,y,z a_YAH=118 6576 6612 " H GLN C 43 "<>" OD1 ASN C 41 " d_HA=1.768 d_AD=2.765 a_DHA=169.347 symop: x,y,z a_YAH=165 6240 6606 " HE2 HIS C 20 "<>" O GLN C 43 " d_HA=2.005 d_AD=2.978 a_DHA=156.936 symop: x,y,z a_YAH=139 6587 6643 " H ILE C 45 "<>" O LEU C 42 " d_HA=2.012 d_AD=2.948 a_DHA=152.623 symop: x,y,z a_YAH=137 6638 6945 " H ASN C 66 "<>" O ILE C 45 " d_HA=2.121 d_AD=3.061 a_DHA=153.734 symop: x,y,z a_YAH=142 6677 6940 " H LEU C 47 "<>" O ASN C 66 " d_HA=2.003 d_AD=2.993 a_DHA=163.418 symop: x,y,z a_YAH=140 6943 6976 " H SER C 68 "<>" OD1 ASN C 66 " d_HA=2.882 d_AD=3.738 a_DHA=142.931 symop: x,y,z a_YAH=131 6195 8822 " HE2 HIS C 198 "<>" O LEU B 233 " d_HA=2.186 d_AD=2.904 a_DHA=126.088 symop: x,-y+2,-z+2 a_YAH=143 6866 6903 " H HIS C 63 "<>" OD1 ASN C 61 " d_HA=1.950 d_AD=2.909 a_DHA=157.424 symop: x,y,z a_YAH=145 6629 6896 " H GLU C 44 "<>" O HIS C 63 " d_HA=2.030 d_AD=3.046 a_DHA=176.595 symop: x,y,z a_YAH=174 6877 6932 " H ALA C 65 "<>" O LEU C 62 " d_HA=1.917 d_AD=2.870 a_DHA=155.541 symop: x,y,z a_YAH=139 6920 7208 " H HIS C 64 "<>" O SER C 83 " d_HA=1.971 d_AD=2.976 a_DHA=170.511 symop: x,y,z a_YAH=160 6930 7251 " H ASN C 86 "<>" O ALA C 65 " d_HA=1.919 d_AD=2.917 a_DHA=167.820 symop: x,y,z a_YAH=169 6930 6959 " H LEU C 67 "<>" O ALA C 65 " d_HA=2.986 d_AD=3.668 a_DHA=125.191 symop: x,y,z a_YAH=94 6959 7246 " H LEU C 67 "<>" O ASN C 86 " d_HA=1.980 d_AD=2.790 a_DHA=134.563 symop: x,y,z a_YAH=153 7249 7286 " HG SER C 88 "<>" OD1 ASN C 86 " d_HA=2.233 d_AD=2.905 a_DHA=125.664 symop: x,y,z a_YAH=121 7249 7282 " H SER C 88 "<>" OD1 ASN C 86 " d_HA=2.040 d_AD=2.931 a_DHA=145.340 symop: x,y,z a_YAH=155 6184 9097 " H VAL C 217 "<>" O CYS B 232 " d_HA=1.998 d_AD=2.953 a_DHA=156.002 symop: x,-y+2,-z+2 a_YAH=159 7178 7211 " H SER C 83 "<>" OD1 ASN C 81 " d_HA=1.863 d_AD=2.760 a_DHA=146.008 symop: x,y,z a_YAH=157 7178 7215 " HG SER C 83 "<>" OD1 ASN C 81 " d_HA=1.799 d_AD=2.757 a_DHA=165.992 symop: x,y,z a_YAH=130 7189 7238 " H ALA C 85 "<>" O LEU C 82 " d_HA=1.774 d_AD=2.710 a_DHA=152.004 symop: x,y,z a_YAH=142 7226 7481 " H HIS C 84 "<>" O ARG C 103 " d_HA=1.950 d_AD=2.918 a_DHA=158.444 symop: x,y,z a_YAH=149 7236 7527 " H ASP C 106 "<>" O ALA C 85 " d_HA=2.156 d_AD=3.063 a_DHA=148.478 symop: x,y,z a_YAH=152 7265 7522 " H LEU C 87 "<>" O ASP C 106 " d_HA=1.783 d_AD=2.722 a_DHA=152.039 symop: x,y,z a_YAH=155 8769 9077 " H ARG C 216 "<>" O ALA C 195 " d_HA=1.875 d_AD=2.866 a_DHA=163.940 symop: x,y,z a_YAH=159 3155 3191 " H ASN B 22 "<>" OE1 GLU B 25 " d_HA=1.990 d_AD=2.986 a_DHA=164.498 symop: x,y,z a_YAH=147 3389 3448 " H ILE B 40 "<>" O PHE B 37 " d_HA=2.147 d_AD=3.074 a_DHA=150.935 symop: x,y,z a_YAH=145 3378 3415 " H GLN B 38 "<>" OD1 ASN B 36 " d_HA=2.249 d_AD=3.144 a_DHA=146.406 symop: x,y,z a_YAH=154 7451 7489 " H ARG C 103 "<>" OD1 ASN C 101 " d_HA=2.047 d_AD=2.990 a_DHA=153.439 symop: x,y,z a_YAH=138 7451 7497 " HE ARG C 103 "<>" OD1 ASN C 101 " d_HA=2.295 d_AD=3.221 a_DHA=150.501 symop: x,y,z a_YAH=106 7462 7514 " H ALA C 105 "<>" O LEU C 102 " d_HA=1.791 d_AD=2.721 a_DHA=150.926 symop: x,y,z a_YAH=155 7512 7808 " H ASN C 126 "<>" O ALA C 105 " d_HA=2.036 d_AD=2.960 a_DHA=150.551 symop: x,y,z a_YAH=143 7539 7803 " H LEU C 107 "<>" O ASN C 126 " d_HA=1.897 d_AD=2.744 a_DHA=138.899 symop: x,y,z a_YAH=131 3129 3495 " HE2 HIS B 20 "<>" O GLN B 43 " d_HA=2.260 d_AD=3.246 a_DHA=161.253 symop: x,y,z a_YAH=141 3138 3462 " H MET B 21 "<>" O ASN B 41 " d_HA=2.773 d_AD=3.567 a_DHA=135.311 symop: x,y,z a_YAH=159 3682 3713 " H SER B 58 "<>" OD1 ASP B 56 " d_HA=1.958 d_AD=2.915 a_DHA=155.429 symop: x,y,z a_YAH=151 3682 3717 " HG SER B 58 "<>" OD1 ASP B 56 " d_HA=1.708 d_AD=2.670 a_DHA=163.637 symop: x,y,z a_YAH=125 3691 3744 " H ALA B 60 "<>" O LEU B 57 " d_HA=1.870 d_AD=2.841 a_DHA=158.541 symop: x,y,z a_YAH=137 3988 4024 " H ARG B 78 "<>" OD1 ASP B 76 " d_HA=1.880 d_AD=2.869 a_DHA=162.357 symop: x,y,z a_YAH=168 3989 4032 " HE ARG B 78 "<>" OD2 ASP B 76 " d_HA=2.319 d_AD=3.301 a_DHA=161.381 symop: x,y,z a_YAH=106 7732 7769 " HG1 THR C 123 "<>" OD1 ASN C 121 " d_HA=2.035 d_AD=2.939 a_DHA=154.521 symop: x,y,z a_YAH=129 7732 7766 " H THR C 123 "<>" OD1 ASN C 121 " d_HA=2.026 d_AD=2.947 a_DHA=149.447 symop: x,y,z a_YAH=154 7743 7795 " H ALA C 125 "<>" O LEU C 122 " d_HA=2.040 d_AD=2.996 a_DHA=155.302 symop: x,y,z a_YAH=142 7793 8084 " H ASP C 146 "<>" O ALA C 125 " d_HA=1.944 d_AD=2.935 a_DHA=164.421 symop: x,y,z a_YAH=143 7793 7822 " H LEU C 127 "<>" O ALA C 125 " d_HA=2.434 d_AD=3.080 a_DHA=120.789 symop: x,y,z a_YAH=107 8198 8504 " H ASN C 176 "<>" O ALA C 155 " d_HA=2.214 d_AD=3.107 a_DHA=146.404 symop: x,y,z a_YAH=169 8192 8451 " H GLY C 154 "<>" O THR C 173 " d_HA=2.279 d_AD=3.228 a_DHA=156.061 symop: x,y,z a_YAH=152 8182 8481 " HE ARG C 174 "<>" OD1 ASP C 153 " d_HA=2.220 d_AD=3.087 a_DHA=141.502 symop: x,y,z a_YAH=122 8182 8458 " HG1 THR C 173 "<>" OD1 ASP C 153 " d_HA=2.000 d_AD=2.923 a_DHA=156.214 symop: x,y,z a_YAH=125 8183 8484 "HH21 ARG C 174 "<>" OD2 ASP C 153 " d_HA=1.793 d_AD=2.746 a_DHA=151.184 symop: x,y,z a_YAH=91 3527 3834 " H ASN B 66 "<>" O ILE B 45 " d_HA=2.422 d_AD=3.275 a_DHA=141.685 symop: x,y,z a_YAH=126 3476 3532 " H ILE B 45 "<>" O LEU B 42 " d_HA=2.150 d_AD=3.093 a_DHA=154.101 symop: x,y,z a_YAH=125 3997 4056 " H ALA B 80 "<>" O LEU B 77 " d_HA=1.839 d_AD=2.814 a_DHA=159.913 symop: x,y,z a_YAH=138 4002 4269 " H LEU B 77 "<>" O ASN B 96 " d_HA=1.868 d_AD=2.743 a_DHA=142.349 symop: x,y,z a_YAH=154 4272 4308 " H GLU B 98 "<>" OD1 ASN B 96 " d_HA=1.896 d_AD=2.867 a_DHA=158.920 symop: x,y,z a_YAH=161 4278 4307 "HD21 ASN B 96 "<>" OE2 GLU B 98 " d_HA=1.813 d_AD=2.837 a_DHA=173.352 symop: x,y,z a_YAH=121 4306 4588 "HE21 GLN B 118 "<>" OE1 GLU B 98 " d_HA=2.123 d_AD=2.935 a_DHA=135.601 symop: x,y,z a_YAH=134 8024 8054 " H ALA C 143 "<>" OD1 ASP C 141 " d_HA=2.195 d_AD=3.141 a_DHA=153.585 symop: x,y,z a_YAH=152 8033 8071 " H ALA C 145 "<>" O LEU C 142 " d_HA=1.958 d_AD=2.928 a_DHA=158.862 symop: x,y,z a_YAH=144 7640 7913 " H GLY C 114 "<>" O SER C 133 " d_HA=2.060 d_AD=3.046 a_DHA=162.042 symop: x,y,z a_YAH=160 7929 8179 " H ASP C 134 "<>" O ASP C 153 " d_HA=1.915 d_AD=2.894 a_DHA=161.095 symop: x,y,z a_YAH=158 3819 4140 " H ASN B 86 "<>" O ALA B 65 " d_HA=2.235 d_AD=3.053 a_DHA=136.941 symop: x,y,z a_YAH=145 4283 4329 " H ALA B 100 "<>" O LEU B 97 " d_HA=1.801 d_AD=2.759 a_DHA=155.510 symop: x,y,z a_YAH=142 4288 4545 " H LEU B 97 "<>" O ASP B 116 " d_HA=1.809 d_AD=2.738 a_DHA=149.654 symop: x,y,z a_YAH=133 4548 4582 " H GLN B 118 "<>" OD1 ASP B 116 " d_HA=2.023 d_AD=3.025 a_DHA=167.069 symop: x,y,z a_YAH=159 4562 4835 " H LEU B 117 "<>" O ASN B 136 " d_HA=2.140 d_AD=2.910 a_DHA=131.208 symop: x,y,z a_YAH=139 8278 8313 " H ASN C 163 "<>" OD1 ASN C 161 " d_HA=2.235 d_AD=3.208 a_DHA=159.860 symop: x,y,z a_YAH=148 8278 8318 "HD22 ASN C 163 "<>" OD1 ASN C 161 " d_HA=1.867 d_AD=2.804 a_DHA=152.504 symop: x,y,z a_YAH=140 8317 8578 "HD21 ASN C 163 "<>" OD2 ASP C 181 " d_HA=1.820 d_AD=2.729 a_DHA=145.138 symop: x,y,z a_YAH=111 8289 8338 " H ALA C 165 "<>" O LEU C 162 " d_HA=2.157 d_AD=3.142 a_DHA=161.963 symop: x,y,z a_YAH=128 7628 7361 " H GLU C 94 "<>" O SER C 113 " d_HA=1.985 d_AD=2.967 a_DHA=161.511 symop: x,y,z a_YAH=151 4125 4416 " H ASP B 106 "<>" O ALA B 85 " d_HA=2.170 d_AD=3.033 a_DHA=142.419 symop: x,y,z a_YAH=128 4154 4411 " H LEU B 87 "<>" O ASP B 106 " d_HA=1.730 d_AD=2.657 a_DHA=150.476 symop: x,y,z a_YAH=151 4854 5097 " H LEU B 137 "<>" O ASN B 156 " d_HA=1.914 d_AD=2.805 a_DHA=144.749 symop: x,y,z a_YAH=136 4838 4874 " H GLU B 138 "<>" OD1 ASN B 136 " d_HA=1.762 d_AD=2.739 a_DHA=162.031 symop: x,y,z a_YAH=145 5100 5137 " H HIS B 158 "<>" OD1 ASN B 156 " d_HA=1.677 d_AD=2.670 a_DHA=169.337 symop: x,y,z a_YAH=175 8577 8612 " HG SER C 183 "<>" OD1 ASP C 181 " d_HA=1.762 d_AD=2.725 a_DHA=164.463 symop: x,y,z a_YAH=131 8577 8608 " H SER C 183 "<>" OD1 ASP C 181 " d_HA=1.901 d_AD=2.900 a_DHA=164.991 symop: x,y,z a_YAH=146 8586 8625 " H ALA C 185 "<>" O LEU C 182 " d_HA=1.903 d_AD=2.908 a_DHA=167.780 symop: x,y,z a_YAH=136 7069 7344 "HH12 ARG C 73 "<>" OE1 GLU C 93 " d_HA=2.419 d_AD=3.139 a_DHA=127.543 symop: x,y,z a_YAH=99 7316 7345 "HD21 ASN C 91 "<>" OE2 GLU C 93 " d_HA=1.754 d_AD=2.746 a_DHA=161.207 symop: x,y,z a_YAH=128 4401 4697 " H ASN B 126 "<>" O ALA B 105 " d_HA=2.241 d_AD=3.209 a_DHA=160.137 symop: x,y,z a_YAH=146 4414 4453 " HD1 HIS B 108 "<>" OD1 ASP B 106 " d_HA=1.781 d_AD=2.748 a_DHA=155.184 symop: x,y,z a_YAH=91 4414 4449 " H HIS B 108 "<>" OD1 ASP B 106 " d_HA=1.863 d_AD=2.825 a_DHA=156.676 symop: x,y,z a_YAH=163 4428 4692 " H LEU B 107 "<>" O ASN B 126 " d_HA=1.776 d_AD=2.706 a_DHA=150.923 symop: x,y,z a_YAH=155 5087 5393 " H ASN B 176 "<>" O ALA B 155 " d_HA=2.140 d_AD=3.019 a_DHA=144.341 symop: x,y,z a_YAH=150 5116 5388 " H LEU B 157 "<>" O ASN B 176 " d_HA=2.004 d_AD=2.782 a_DHA=131.573 symop: x,y,z a_YAH=138 5391 5427 " H GLU B 178 "<>" OD1 ASN B 176 " d_HA=1.813 d_AD=2.808 a_DHA=167.246 symop: x,y,z a_YAH=162 5397 5425 "HD21 ASN B 176 "<>" OE1 GLU B 178 " d_HA=2.922 d_AD=3.711 a_DHA=134.319 symop: x,y,z a_YAH=119 4695 4731 " H LYS B 128 "<>" OD1 ASN B 126 " d_HA=1.856 d_AD=2.792 a_DHA=152.227 symop: x,y,z a_YAH=154 4711 4968 " H LEU B 127 "<>" O ASP B 146 " d_HA=1.945 d_AD=2.874 a_DHA=150.175 symop: x,y,z a_YAH=135 4985 5235 " H LEU B 147 "<>" O ASN B 166 " d_HA=2.414 d_AD=3.105 a_DHA=125.171 symop: x,y,z a_YAH=114 4980 5025 " H ALA B 150 "<>" O LEU B 147 " d_HA=1.833 d_AD=2.820 a_DHA=164.132 symop: x,y,z a_YAH=132 5378 5671 " H SER B 196 "<>" O ALA B 175 " d_HA=2.218 d_AD=3.159 a_DHA=155.080 symop: x,y,z a_YAH=134 5407 5668 " H LEU B 177 "<>" O SER B 196 " d_HA=2.088 d_AD=2.988 a_DHA=146.974 symop: x,y,z a_YAH=137 5684 5958 " H LEU B 197 "<>" O ARG B 216 " d_HA=2.031 d_AD=2.919 a_DHA=145.083 symop: x,y,z a_YAH=155 5977 9327 "HH21 ARG B 216 "<>" OXT ALA C 234 " d_HA=1.738 d_AD=2.697 a_DHA=152.816 symop: x,-y+2,-z+2 a_YAH=143 6351 6425 " H ALA C 32 "<>" O ARG C 28 " d_HA=1.976 d_AD=2.918 a_DHA=153.701 symop: x,y,z a_YAH=150 6375 6446 " H LYS C 34 "<>" O HIS C 29 " d_HA=1.964 d_AD=2.873 a_DHA=147.576 symop: x,y,z a_YAH=157 6392 6434 " H GLY C 33 "<>" O TYR C 30 " d_HA=2.068 d_AD=2.928 a_DHA=141.375 symop: x,y,z a_YAH=117 6392 6480 "HH12 ARG C 35 "<>" O TYR C 30 " d_HA=1.906 d_AD=2.844 a_DHA=152.816 symop: x,y,z a_YAH=137 4971 5005 " H GLN B 148 "<>" OD1 ASP B 146 " d_HA=1.933 d_AD=2.922 a_DHA=162.399 symop: x,y,z a_YAH=150 4971 5245 "HD22 ASN B 166 "<>" OD1 ASP B 146 " d_HA=2.614 d_AD=3.461 a_DHA=139.950 symop: x,y,z a_YAH=98 5249 5296 " H ALA B 170 "<>" O LEU B 167 " d_HA=1.812 d_AD=2.792 a_DHA=162.140 symop: x,y,z a_YAH=132 5620 5895 " H LEU B 192 "<>" O SER B 211 " d_HA=1.850 d_AD=2.776 a_DHA=149.809 symop: x,y,z a_YAH=157 5658 5966 " H ARG B 216 "<>" O ALA B 195 " d_HA=1.890 d_AD=2.878 a_DHA=163.454 symop: x,y,z a_YAH=170 5948 9298 " H CYS C 232 "<>" O ALA B 215 " d_HA=2.133 d_AD=3.102 a_DHA=159.381 symop: x,-y+2,-z+2 a_YAH=123 5986 9295 " H VAL B 217 "<>" O CYS C 232 " d_HA=1.959 d_AD=2.906 a_DHA=154.737 symop: x,-y+2,-z+2 a_YAH=156 5285 5560 " H GLU B 169 "<>" O THR B 188 " d_HA=2.111 d_AD=2.991 a_DHA=144.152 symop: x,y,z a_YAH=141 6010 6069 " H VAL B 223 "<>" O VAL B 219 " d_HA=1.903 d_AD=2.905 a_DHA=166.411 symop: x,y,z a_YAH=166 6026 6083 " H ALA B 224 "<>" O ASP B 220 " d_HA=1.890 d_AD=2.894 a_DHA=167.507 symop: x,y,z a_YAH=136 5762 5809 " H LEU B 206 "<>" O ASP B 203 " d_HA=2.176 d_AD=3.066 a_DHA=145.495 symop: x,y,z a_YAH=113 5762 5834 " H TRP B 207 "<>" O ASP B 203 " d_HA=2.870 d_AD=3.810 a_DHA=154.329 symop: x,y,z a_YAH=148 6249 6573 " H MET C 21 "<>" O ASN C 41 " d_HA=2.364 d_AD=3.223 a_DHA=141.977 symop: x,y,z a_YAH=159 9121 9180 " H VAL C 223 "<>" O VAL C 219 " d_HA=1.928 d_AD=2.927 a_DHA=164.750 symop: x,y,z a_YAH=161 6065 6123 " H ALA B 227 "<>" O VAL B 223 " d_HA=1.907 d_AD=2.917 a_DHA=170.993 symop: x,y,z a_YAH=157 6081 6133 " H ALA B 228 "<>" O ALA B 224 " d_HA=1.847 d_AD=2.837 a_DHA=163.106 symop: x,y,z a_YAH=155 5774 5855 " H ARG B 208 "<>" O PRO B 204 " d_HA=2.680 d_AD=3.512 a_DHA=139.271 symop: x,y,z a_YAH=134 6554 6868 " H ASN C 61 "<>" O ILE C 40 " d_HA=2.386 d_AD=3.260 a_DHA=144.906 symop: x,y,z a_YAH=124 6592 6863 " H LEU C 42 "<>" O ASN C 61 " d_HA=1.919 d_AD=2.896 a_DHA=160.486 symop: x,y,z a_YAH=164 6672 6721 " H ALA C 50 "<>" O LEU C 47 " d_HA=1.867 d_AD=2.828 a_DHA=156.432 symop: x,y,z a_YAH=137 9114 9153 " H ASP C 218 "<>" OE1 GLN C 221 " d_HA=2.281 d_AD=3.245 a_DHA=159.678 symop: x,y,z a_YAH=98 9125 2918 " H VAL C 219 "<>" OD1 ASP A 220 " d_HA=2.012 d_AD=2.866 a_DHA=139.019 symop: x,y,z a_YAH=96 9109 9168 " H ALA C 222 "<>" O ASP C 218 " d_HA=2.045 d_AD=2.936 a_DHA=144.680 symop: x,y,z a_YAH=138 6111 6170 " H LEU B 231 "<>" O ALA B 226 " d_HA=2.488 d_AD=3.456 a_DHA=160.266 symop: x,y,z a_YAH=128 6111 6148 " H HIS B 229 "<>" O ALA B 226 " d_HA=1.931 d_AD=2.816 a_DHA=143.377 symop: x,y,z a_YAH=113 6121 6159 " H GLY B 230 "<>" O ALA B 227 " d_HA=1.839 d_AD=2.787 a_DHA=153.979 symop: x,y,z a_YAH=119 5864 6131 "HH11 ARG B 208 "<>" O ALA B 228 " d_HA=1.813 d_AD=2.788 a_DHA=157.888 symop: x,y,z a_YAH=116 6853 7180 " H ASN C 81 "<>" O ALA C 60 " d_HA=2.125 d_AD=2.971 a_DHA=140.254 symop: x,y,z a_YAH=156 6882 7175 " H LEU C 62 "<>" O ASN C 81 " d_HA=1.870 d_AD=2.837 a_DHA=157.805 symop: x,y,z a_YAH=161 6954 7010 " H ALA C 70 "<>" O LEU C 67 " d_HA=1.812 d_AD=2.769 a_DHA=155.127 symop: x,y,z a_YAH=152 6187 9059 " H CYS B 232 "<>" O ALA C 215 " d_HA=2.176 d_AD=3.179 a_DHA=169.587 symop: x,-y+2,-z+2 a_YAH=122 9017 9061 " H ALA C 215 "<>" O LEU C 212 " d_HA=2.357 d_AD=3.304 a_DHA=156.514 symop: x,y,z a_YAH=113 6158 9053 " H GLY C 214 "<>" O GLY B 230 " d_HA=1.752 d_AD=2.719 a_DHA=158.244 symop: x,-y+2,-z+2 a_YAH=139 7165 7453 " H ASN C 101 "<>" O ALA C 80 " d_HA=2.654 d_AD=3.381 a_DHA=129.495 symop: x,y,z a_YAH=118 7194 7448 " H LEU C 82 "<>" O ASN C 101 " d_HA=1.807 d_AD=2.744 a_DHA=151.696 symop: x,y,z a_YAH=139 8779 8518 " H LEU C 177 "<>" O SER C 196 " d_HA=1.996 d_AD=2.889 a_DHA=145.518 symop: x,y,z a_YAH=155 8795 9069 " H LEU C 197 "<>" O ARG C 216 " d_HA=1.881 d_AD=2.820 a_DHA=151.996 symop: x,y,z a_YAH=143 8726 8771 " H ALA C 195 "<>" O LEU C 192 " d_HA=1.940 d_AD=2.938 a_DHA=168.882 symop: x,y,z a_YAH=130 8762 9036 " H ASP C 194 "<>" O VAL C 213 " d_HA=1.710 d_AD=2.685 a_DHA=160.536 symop: x,y,z a_YAH=154 8748 9040 " H VAL C 213 "<>" OD1 ASP C 193 " d_HA=1.891 d_AD=2.895 a_DHA=169.260 symop: x,y,z a_YAH=136 3413 3437 " HD1 HIS B 39 "<>" OE1 GLN B 38 " d_HA=1.852 d_AD=2.873 a_DHA=178.730 symop: x,y,z a_YAH=126 3433 3710 " H HIS B 39 "<>" O SER B 58 " d_HA=1.815 d_AD=2.818 a_DHA=168.257 symop: x,y,z a_YAH=168 7438 7734 " H ASN C 121 "<>" O ALA C 100 " d_HA=2.550 d_AD=3.182 a_DHA=120.797 symop: x,y,z a_YAH=132 7467 7729 " H LEU C 102 "<>" O ASN C 121 " d_HA=1.868 d_AD=2.784 a_DHA=147.561 symop: x,y,z a_YAH=157 8432 8491 " H ALA C 175 "<>" O LEU C 172 " d_HA=2.247 d_AD=3.178 a_DHA=153.158 symop: x,y,z a_YAH=104 8489 8782 " H SER C 196 "<>" O ALA C 175 " d_HA=2.222 d_AD=3.192 a_DHA=160.283 symop: x,y,z a_YAH=136 8473 8745 " H ARG C 174 "<>" O ASP C 193 " d_HA=2.142 d_AD=3.023 a_DHA=143.970 symop: x,y,z a_YAH=141 3465 3501 " H GLN B 43 "<>" OD1 ASN B 41 " d_HA=1.997 d_AD=3.001 a_DHA=172.689 symop: x,y,z a_YAH=162 3481 3752 " H LEU B 42 "<>" O ASN B 61 " d_HA=1.976 d_AD=2.964 a_DHA=163.460 symop: x,y,z a_YAH=145 3443 3757 " H ASN B 61 "<>" O ILE B 40 " d_HA=2.149 d_AD=3.025 a_DHA=144.248 symop: x,y,z a_YAH=143 3730 4016 " H TYR B 59 "<>" O ARG B 78 " d_HA=2.062 d_AD=3.069 a_DHA=170.095 symop: x,y,z a_YAH=163 7719 8026 " H ASP C 141 "<>" O ALA C 120 " d_HA=2.734 d_AD=3.404 a_DHA=124.575 symop: x,y,z a_YAH=117 7748 8021 " H LEU C 122 "<>" O ASP C 141 " d_HA=1.980 d_AD=2.820 a_DHA=137.913 symop: x,y,z a_YAH=130 8160 8200 " H ALA C 155 "<>" O LEU C 152 " d_HA=2.378 d_AD=3.326 a_DHA=155.963 symop: x,y,z a_YAH=113 3518 3785 " H GLU B 44 "<>" O HIS B 63 " d_HA=2.073 d_AD=3.070 a_DHA=167.154 symop: x,y,z a_YAH=160 3755 3792 " H HIS B 63 "<>" OD1 ASN B 61 " d_HA=1.798 d_AD=2.756 a_DHA=156.702 symop: x,y,z a_YAH=160 3742 3771 " H LEU B 62 "<>" O ALA B 60 " d_HA=2.589 d_AD=3.244 a_DHA=121.860 symop: x,y,z a_YAH=109 3742 4069 " H ASN B 81 "<>" O ALA B 60 " d_HA=2.086 d_AD=2.968 a_DHA=144.710 symop: x,y,z a_YAH=134 3771 4064 " H LEU B 62 "<>" O ASN B 81 " d_HA=1.828 d_AD=2.718 a_DHA=143.940 symop: x,y,z a_YAH=161 4054 4342 " H ASN B 101 "<>" O ALA B 80 " d_HA=2.135 d_AD=3.051 a_DHA=149.920 symop: x,y,z a_YAH=143 4045 4302 " H ASN B 79 "<>" O GLU B 98 " d_HA=2.033 d_AD=2.978 a_DHA=153.017 symop: x,y,z a_YAH=147 8011 8280 " H ASN C 161 "<>" O ALA C 140 " d_HA=2.016 d_AD=2.913 a_DHA=146.511 symop: x,y,z a_YAH=144 8038 8275 " H LEU C 142 "<>" O ASN C 161 " d_HA=2.130 d_AD=2.920 a_DHA=133.166 symop: x,y,z a_YAH=138 7883 7916 " H SER C 133 "<>" OD1 ASN C 131 " d_HA=1.903 d_AD=2.889 a_DHA=165.886 symop: x,y,z a_YAH=140 7883 7920 " HG SER C 133 "<>" OD1 ASN C 131 " d_HA=1.711 d_AD=2.664 a_DHA=165.935 symop: x,y,z a_YAH=144 7894 7938 " H ALA C 135 "<>" O LEU C 132 " d_HA=2.046 d_AD=2.991 a_DHA=154.176 symop: x,y,z a_YAH=123 7899 8144 " H LEU C 132 "<>" O VAL C 151 " d_HA=1.710 d_AD=2.694 a_DHA=163.113 symop: x,y,z a_YAH=170 3516 3813 " HD1 HIS B 64 "<>" OE1 GLU B 44 " d_HA=1.972 d_AD=2.944 a_DHA=156.227 symop: x,y,z a_YAH=142 3766 3821 " H ALA B 65 "<>" O LEU B 62 " d_HA=1.874 d_AD=2.825 a_DHA=155.352 symop: x,y,z a_YAH=131 3809 4097 " H HIS B 64 "<>" O SER B 83 " d_HA=2.083 d_AD=3.089 a_DHA=170.742 symop: x,y,z a_YAH=166 4067 4100 " H SER B 83 "<>" OD1 ASN B 81 " d_HA=2.149 d_AD=3.015 a_DHA=142.942 symop: x,y,z a_YAH=149 4067 4104 " HG SER B 83 "<>" OD1 ASN B 81 " d_HA=2.079 d_AD=3.034 a_DHA=165.949 symop: x,y,z a_YAH=137 4078 4127 " H ALA B 85 "<>" O LEU B 82 " d_HA=2.030 d_AD=2.966 a_DHA=152.489 symop: x,y,z a_YAH=132 4083 4337 " H LEU B 82 "<>" O ASN B 101 " d_HA=1.806 d_AD=2.725 a_DHA=148.865 symop: x,y,z a_YAH=155 4327 4623 " H ASN B 121 "<>" O ALA B 100 " d_HA=2.224 d_AD=3.015 a_DHA=134.464 symop: x,y,z a_YAH=144 4356 4618 " H LEU B 102 "<>" O ASN B 121 " d_HA=1.767 d_AD=2.709 a_DHA=151.897 symop: x,y,z a_YAH=156 4319 4576 " H ALA B 99 "<>" O GLN B 118 " d_HA=2.009 d_AD=2.978 a_DHA=157.278 symop: x,y,z a_YAH=162 4557 4610 " H ALA B 120 "<>" O LEU B 117 " d_HA=1.964 d_AD=2.908 a_DHA=153.572 symop: x,y,z a_YAH=131 4599 4868 " H GLU B 119 "<>" O GLU B 138 " d_HA=1.847 d_AD=2.844 a_DHA=165.790 symop: x,y,z a_YAH=165 8265 8579 " H ASP C 181 "<>" O ALA C 160 " d_HA=2.342 d_AD=3.281 a_DHA=154.626 symop: x,y,z a_YAH=138 8294 8574 " H LEU C 162 "<>" O ASP C 181 " d_HA=1.961 d_AD=2.837 a_DHA=142.489 symop: x,y,z a_YAH=139 7609 7648 " H ALA C 115 "<>" O LEU C 112 " d_HA=1.924 d_AD=2.886 a_DHA=157.454 symop: x,y,z a_YAH=150 7598 7631 " H SER C 113 "<>" OD1 ASN C 111 " d_HA=2.026 d_AD=2.971 a_DHA=154.992 symop: x,y,z a_YAH=155 7614 7880 " H LEU C 112 "<>" O ASN C 131 " d_HA=1.766 d_AD=2.708 a_DHA=152.809 symop: x,y,z a_YAH=156 4115 4370 " H HIS B 84 "<>" O ARG B 103 " d_HA=1.908 d_AD=2.858 a_DHA=154.921 symop: x,y,z a_YAH=146 4351 4403 " H ALA B 105 "<>" O LEU B 102 " d_HA=1.885 d_AD=2.854 a_DHA=158.578 symop: x,y,z a_YAH=138 4395 4651 " H GLY B 104 "<>" O THR B 123 " d_HA=2.054 d_AD=3.046 a_DHA=164.825 symop: x,y,z a_YAH=162 4608 4915 " H ASP B 141 "<>" O ALA B 120 " d_HA=2.350 d_AD=3.180 a_DHA=138.944 symop: x,y,z a_YAH=128 4637 4910 " H LEU B 122 "<>" O ASP B 141 " d_HA=1.808 d_AD=2.739 a_DHA=149.924 symop: x,y,z a_YAH=154 4849 4902 " H ALA B 140 "<>" O LEU B 137 " d_HA=1.838 d_AD=2.799 a_DHA=157.158 symop: x,y,z a_YAH=137 4872 5106 "HD21 ASN B 156 "<>" OE1 GLU B 138 " d_HA=2.439 d_AD=3.199 a_DHA=130.575 symop: x,y,z a_YAH=101 4889 5130 " H GLN B 139 "<>" O HIS B 158 " d_HA=1.976 d_AD=2.978 a_DHA=168.549 symop: x,y,z a_YAH=162 8564 8847 " H THR C 201 "<>" O ALA C 180 " d_HA=1.907 d_AD=2.915 a_DHA=172.130 symop: x,y,z a_YAH=167 8591 8843 " H LEU C 182 "<>" O THR C 201 " d_HA=2.022 d_AD=2.983 a_DHA=156.680 symop: x,y,z a_YAH=148 7310 7346 " H GLU C 93 "<>" OD1 ASN C 91 " d_HA=1.987 d_AD=2.924 a_DHA=153.406 symop: x,y,z a_YAH=134 7326 7595 " H LEU C 92 "<>" O ASN C 111 " d_HA=1.774 d_AD=2.752 a_DHA=161.117 symop: x,y,z a_YAH=176 4632 4684 " H ALA B 125 "<>" O LEU B 122 " d_HA=1.944 d_AD=2.900 a_DHA=155.368 symop: x,y,z a_YAH=130 4682 4973 " H ASP B 146 "<>" O ALA B 125 " d_HA=1.928 d_AD=2.920 a_DHA=164.468 symop: x,y,z a_YAH=161 5111 5156 " H ALA B 160 "<>" O LEU B 157 " d_HA=1.857 d_AD=2.796 a_DHA=153.142 symop: x,y,z a_YAH=125 5148 5421 " H GLY B 159 "<>" O GLU B 178 " d_HA=2.071 d_AD=3.000 a_DHA=150.296 symop: x,y,z a_YAH=149 5426 5675 " HG SER B 196 "<>" OE2 GLU B 178 " d_HA=2.079 d_AD=3.029 a_DHA=162.125 symop: x,y,z a_YAH=111 7021 7059 " H ARG C 73 "<>" OD1 ASN C 71 " d_HA=2.304 d_AD=3.240 a_DHA=153.718 symop: x,y,z a_YAH=150 4958 5240 " H ASN B 166 "<>" O ALA B 145 " d_HA=1.954 d_AD=2.910 a_DHA=156.246 symop: x,y,z a_YAH=160 5402 5455 " H ALA B 180 "<>" O LEU B 177 " d_HA=2.258 d_AD=3.191 a_DHA=153.050 symop: x,y,z a_YAH=122 5679 5724 " H ALA B 200 "<>" O LEU B 197 " d_HA=1.947 d_AD=2.917 a_DHA=160.925 symop: x,y,z a_YAH=147 5679 6051 "HE22 GLN B 221 "<>" O LEU B 197 " d_HA=1.756 d_AD=2.758 a_DHA=170.047 symop: x,y,z a_YAH=135 6298 6382 " H HIS C 29 "<>" O GLU C 25 " d_HA=1.984 d_AD=2.934 a_DHA=154.445 symop: x,y,z a_YAH=148 6313 6401 " H TYR C 30 "<>" O ILE C 26 " d_HA=1.789 d_AD=2.799 a_DHA=171.608 symop: x,y,z a_YAH=160 6332 6415 " H ALA C 31 "<>" O LEU C 27 " d_HA=1.854 d_AD=2.822 a_DHA=158.113 symop: x,y,z a_YAH=150 6378 6458 " HZ3 LYS C 34 "<>" ND1 HIS C 29 " d_HA=2.092 d_AD=3.057 a_DHA=157.160 symop: x,y,z a_YAH=130 a_YAH=116 5238 5271 " H SER B 168 "<>" OD1 ASN B 166 " d_HA=2.167 d_AD=3.066 a_DHA=147.793 symop: x,y,z a_YAH=109 5238 5275 " HG SER B 168 "<>" OD1 ASN B 166 " d_HA=1.827 d_AD=2.682 a_DHA=145.120 symop: x,y,z a_YAH=163 5238 5538 " HE ARG B 186 "<>" OD1 ASN B 166 " d_HA=2.003 d_AD=3.017 a_DHA=177.662 symop: x,y,z a_YAH=94 5238 5541 "HH21 ARG B 186 "<>" OD1 ASN B 166 " d_HA=2.911 d_AD=3.703 a_DHA=135.543 symop: x,y,z a_YAH=97 5225 5254 " H LEU B 167 "<>" O ALA B 165 " d_HA=2.217 d_AD=2.964 a_DHA=129.264 symop: x,y,z a_YAH=114 5225 5530 " H ARG B 186 "<>" O ALA B 165 " d_HA=2.156 d_AD=3.086 a_DHA=151.523 symop: x,y,z a_YAH=135 5711 9306 " HE2 HIS B 198 "<>" O LEU C 233 " d_HA=2.470 d_AD=3.319 a_DHA=140.637 symop: x,-y+2,-z+2 a_YAH=142 5711 5982 " HE2 HIS B 198 "<>" O VAL B 217 " d_HA=2.993 d_AD=3.655 a_DHA=123.679 symop: x,y,z a_YAH=97 5998 6044 " H GLN B 221 "<>" O ASP B 218 " d_HA=2.574 d_AD=3.216 a_DHA=120.879 symop: x,y,z a_YAH=95 5998 6057 " H ALA B 222 "<>" O ASP B 218 " d_HA=1.862 d_AD=2.826 a_DHA=156.563 symop: x,y,z a_YAH=153 6003 6042 " H ASP B 218 "<>" OE1 GLN B 221 " d_HA=2.096 d_AD=3.071 a_DHA=160.833 symop: x,y,z a_YAH=105 6038 6099 " H PHE B 225 "<>" O GLN B 221 " d_HA=1.747 d_AD=2.705 a_DHA=155.795 symop: x,y,z a_YAH=151 6057 5998 " H ALA B 222 "<>" O ASP B 218 " d_HA=1.862 d_AD=2.826 a_DHA=156.563 symop: x,y,z a_YAH=153 5548 5878 " HG1 THR B 209 "<>" OG1 THR B 187 " d_HA=1.730 d_AD=2.611 a_DHA=148.685 symop: x,y,z a_YAH=124 a_YAH=98 9137 9194 " H ALA C 224 "<>" O ASP C 220 " d_HA=1.950 d_AD=2.920 a_DHA=157.799 symop: x,y,z a_YAH=141 9166 9224 " H ALA C 226 "<>" O ALA C 222 " d_HA=2.061 d_AD=3.065 a_DHA=166.949 symop: x,y,z a_YAH=148 6055 6113 " H ALA B 226 "<>" O ALA B 222 " d_HA=2.199 d_AD=3.167 a_DHA=157.557 symop: x,y,z a_YAH=150 6091 6148 " H HIS B 229 "<>" O PHE B 225 " d_HA=2.622 d_AD=3.306 a_DHA=124.345 symop: x,y,z a_YAH=135 6091 6152 " HD1 HIS B 229 "<>" O PHE B 225 " d_HA=1.793 d_AD=2.803 a_DHA=170.279 symop: x,y,z a_YAH=144 5788 5855 " H ARG B 208 "<>" O VAL B 205 " d_HA=2.476 d_AD=3.157 a_DHA=123.960 symop: x,y,z a_YAH=92 5804 5875 " H THR B 209 "<>" O LEU B 206 " d_HA=1.967 d_AD=2.934 a_DHA=157.754 symop: x,y,z a_YAH=114 5804 5887 " H ALA B 210 "<>" O LEU B 206 " d_HA=2.006 d_AD=3.000 a_DHA=165.579 symop: x,y,z a_YAH=166 6500 6559 " H ILE C 40 "<>" O PHE C 37 " d_HA=2.227 d_AD=3.153 a_DHA=150.848 symop: x,y,z a_YAH=139 6719 7023 " H ASN C 71 "<>" O ALA C 50 " d_HA=1.902 d_AD=2.886 a_DHA=163.490 symop: x,y,z a_YAH=153 6745 7018 " H LEU C 52 "<>" O ASN C 71 " d_HA=1.932 d_AD=2.933 a_DHA=166.822 symop: x,y,z a_YAH=148 9149 9210 " H PHE C 225 "<>" O GLN C 221 " d_HA=1.843 d_AD=2.814 a_DHA=158.096 symop: x,y,z a_YAH=142 6544 6821 " H HIS C 39 "<>" O SER C 58 " d_HA=1.798 d_AD=2.807 a_DHA=170.921 symop: x,y,z a_YAH=162 6802 6855 " H ALA C 60 "<>" O LEU C 57 " d_HA=1.812 d_AD=2.784 a_DHA=158.630 symop: x,y,z a_YAH=140 7037 7307 " H LEU C 72 "<>" O ASN C 91 " d_HA=1.866 d_AD=2.774 a_DHA=146.716 symop: x,y,z a_YAH=161 7037 7008 " H LEU C 72 "<>" O ALA C 70 " d_HA=2.965 d_AD=3.612 a_DHA=122.212 symop: x,y,z a_YAH=101 6841 7127 " H TYR C 59 "<>" O ARG C 78 " d_HA=2.058 d_AD=3.036 a_DHA=160.739 symop: x,y,z a_YAH=146 7108 7167 " H ALA C 80 "<>" O LEU C 77 " d_HA=1.742 d_AD=2.719 a_DHA=160.664 symop: x,y,z a_YAH=143 8731 9006 " H LEU C 192 "<>" O SER C 211 " d_HA=1.855 d_AD=2.772 a_DHA=148.788 symop: x,y,z a_YAH=151 7156 7413 " H ASN C 79 "<>" O GLU C 98 " d_HA=1.973 d_AD=2.936 a_DHA=156.191 symop: x,y,z a_YAH=159 7394 7440 " H ALA C 100 "<>" O LEU C 97 " d_HA=1.907 d_AD=2.862 a_DHA=154.929 symop: x,y,z a_YAH=134 8437 8702 " H LEU C 172 "<>" O ARG C 191 " d_HA=1.958 d_AD=2.929 a_DHA=159.623 symop: x,y,z a_YAH=152 7430 7687 " H ALA C 99 "<>" O GLN C 118 " d_HA=2.137 d_AD=3.114 a_DHA=159.853 symop: x,y,z a_YAH=157 7668 7721 " H ALA C 120 "<>" O LEU C 117 " d_HA=1.960 d_AD=2.901 a_DHA=152.690 symop: x,y,z a_YAH=134 8165 8415 " H LEU C 152 "<>" O MET C 171 " d_HA=1.738 d_AD=2.717 a_DHA=160.606 symop: x,y,z a_YAH=170 8405 8710 " H ARG C 191 "<>" O ALA C 170 " d_HA=2.252 d_AD=3.234 a_DHA=162.477 symop: x,y,z a_YAH=149 7710 7979 " H GLU C 119 "<>" O GLU C 138 " d_HA=1.920 d_AD=2.914 a_DHA=163.756 symop: x,y,z a_YAH=161 7960 8013 " H ALA C 140 "<>" O LEU C 137 " d_HA=1.905 d_AD=2.873 a_DHA=158.442 symop: x,y,z a_YAH=136 8000 8241 " H GLN C 139 "<>" O HIS C 158 " d_HA=1.906 d_AD=2.880 a_DHA=159.434 symop: x,y,z a_YAH=160 7870 8148 " H VAL C 151 "<>" O ALA C 130 " d_HA=1.921 d_AD=2.893 a_DHA=158.964 symop: x,y,z a_YAH=169 8134 8420 " H MET C 171 "<>" O ALA C 150 " d_HA=2.251 d_AD=3.226 a_DHA=161.786 symop: x,y,z a_YAH=154 3796 4099 " HD1 HIS B 63 "<>" OG SER B 83 " d_HA=2.090 d_AD=3.104 a_DHA=171.390 symop: x,y,z a_YAH=136 a_YAH=100 4340 4378 " H ARG B 103 "<>" OD1 ASN B 101 " d_HA=1.990 d_AD=2.946 a_DHA=156.300 symop: x,y,z a_YAH=159 4340 4386 " HE ARG B 103 "<>" OD1 ASN B 101 " d_HA=2.994 d_AD=3.726 a_DHA=130.078 symop: x,y,z a_YAH=100 8259 8532 " H GLY C 159 "<>" O GLU C 178 " d_HA=2.019 d_AD=2.999 a_DHA=160.588 symop: x,y,z a_YAH=154 8222 8267 " H ALA C 160 "<>" O LEU C 157 " d_HA=1.929 d_AD=2.891 a_DHA=156.711 symop: x,y,z a_YAH=122 8227 8499 " H LEU C 157 "<>" O ASN C 176 " d_HA=2.056 d_AD=2.893 a_DHA=138.001 symop: x,y,z a_YAH=127 8518 8779 " H LEU C 177 "<>" O SER C 196 " d_HA=1.996 d_AD=2.889 a_DHA=145.518 symop: x,y,z a_YAH=155 7585 7885 " H ASN C 131 "<>" O ALA C 110 " d_HA=1.958 d_AD=2.954 a_DHA=167.294 symop: x,y,z a_YAH=158 4621 4655 " H THR B 123 "<>" OD1 ASN B 121 " d_HA=2.071 d_AD=3.035 a_DHA=158.556 symop: x,y,z a_YAH=152 4621 4658 " HG1 THR B 123 "<>" OD1 ASN B 121 " d_HA=2.251 d_AD=3.172 a_DHA=158.101 symop: x,y,z a_YAH=136 4900 5169 " H ASN B 161 "<>" O ALA B 140 " d_HA=2.206 d_AD=3.031 a_DHA=137.532 symop: x,y,z a_YAH=144 8513 8566 " H ALA C 180 "<>" O LEU C 177 " d_HA=1.961 d_AD=2.922 a_DHA=156.978 symop: x,y,z a_YAH=127 8553 8809 " H GLN C 179 "<>" O HIS C 198 " d_HA=2.402 d_AD=3.317 a_DHA=149.843 symop: x,y,z a_YAH=146 8790 8835 " H ALA C 200 "<>" O LEU C 197 " d_HA=1.931 d_AD=2.929 a_DHA=168.489 symop: x,y,z a_YAH=144 8790 9162 "HE22 GLN C 221 "<>" O LEU C 197 " d_HA=1.823 d_AD=2.837 a_DHA=177.328 symop: x,y,z a_YAH=132 7297 7600 " H ASN C 111 "<>" O ALA C 90 " d_HA=1.884 d_AD=2.868 a_DHA=163.748 symop: x,y,z a_YAH=165 4671 4941 " H GLN B 124 "<>" O ALA B 143 " d_HA=1.999 d_AD=2.991 a_DHA=165.280 symop: x,y,z a_YAH=163 4913 4943 " H ALA B 143 "<>" OD1 ASP B 141 " d_HA=2.014 d_AD=3.001 a_DHA=161.847 symop: x,y,z a_YAH=155 4922 4960 " H ALA B 145 "<>" O LEU B 142 " d_HA=2.155 d_AD=3.143 a_DHA=162.875 symop: x,y,z a_YAH=129 4927 5164 " H LEU B 142 "<>" O ASN B 161 " d_HA=1.959 d_AD=2.854 a_DHA=145.258 symop: x,y,z a_YAH=145 5154 5468 " H ASP B 181 "<>" O ALA B 160 " d_HA=2.433 d_AD=3.212 a_DHA=133.490 symop: x,y,z a_YAH=132 5167 5202 " H ASN B 163 "<>" OD1 ASN B 161 " d_HA=1.882 d_AD=2.874 a_DHA=163.353 symop: x,y,z a_YAH=160 5167 5207 "HD22 ASN B 163 "<>" OD1 ASN B 161 " d_HA=2.168 d_AD=3.122 a_DHA=157.186 symop: x,y,z a_YAH=119 8827 9113 " H GLY C 199 "<>" OD2 ASP C 218 " d_HA=1.922 d_AD=2.905 a_DHA=159.921 symop: x,y,z a_YAH=105 7008 7037 " H LEU C 72 "<>" O ALA C 70 " d_HA=2.965 d_AD=3.612 a_DHA=122.212 symop: x,y,z a_YAH=101 7008 7312 " H ASN C 91 "<>" O ALA C 70 " d_HA=1.941 d_AD=2.932 a_DHA=165.552 symop: x,y,z a_YAH=154 4952 5197 " H GLY B 144 "<>" O ASN B 163 " d_HA=1.783 d_AD=2.786 a_DHA=168.730 symop: x,y,z a_YAH=172 5178 5227 " H ALA B 165 "<>" O LEU B 162 " d_HA=2.065 d_AD=3.053 a_DHA=161.919 symop: x,y,z a_YAH=133 5183 5463 " H LEU B 162 "<>" O ASP B 181 " d_HA=2.000 d_AD=2.850 a_DHA=139.615 symop: x,y,z a_YAH=130 5453 5736 " H THR B 201 "<>" O ALA B 180 " d_HA=2.215 d_AD=2.944 a_DHA=127.334 symop: x,y,z a_YAH=129 5480 5732 " H LEU B 182 "<>" O THR B 201 " d_HA=2.018 d_AD=2.963 a_DHA=153.246 symop: x,y,z a_YAH=153 5442 5698 " H GLN B 179 "<>" O HIS B 198 " d_HA=2.404 d_AD=3.332 a_DHA=151.561 symop: x,y,z a_YAH=138 5716 6002 " H GLY B 199 "<>" OD2 ASP B 218 " d_HA=1.809 d_AD=2.834 a_DHA=177.550 symop: x,y,z a_YAH=124 6710 6973 " H ASN C 49 "<>" O SER C 68 " d_HA=2.225 d_AD=3.190 a_DHA=159.556 symop: x,y,z a_YAH=156 6261 6318 " H ILE C 26 "<>" O ASN C 22 " d_HA=2.126 d_AD=3.131 a_DHA=169.138 symop: x,y,z a_YAH=158 6275 6337 " H LEU C 27 "<>" O VAL C 23 " d_HA=1.981 d_AD=2.988 a_DHA=170.563 symop: x,y,z a_YAH=157 6291 6359 " H ARG C 28 "<>" O GLY C 24 " d_HA=2.003 d_AD=2.997 a_DHA=164.925 symop: x,y,z a_YAH=152 6264 6292 " H GLY C 24 "<>" OD1 ASN C 22 " d_HA=2.400 d_AD=3.125 a_DHA=128.022 symop: x,y,z a_YAH=137 6264 6304 " H GLU C 25 "<>" OD1 ASN C 22 " d_HA=2.165 d_AD=3.167 a_DHA=168.336 symop: x,y,z a_YAH=143 6266 6302 " H ASN C 22 "<>" OE1 GLU C 25 " d_HA=1.837 d_AD=2.856 a_DHA=174.024 symop: x,y,z a_YAH=148 5216 5494 " H ASN B 164 "<>" O SER B 183 " d_HA=1.794 d_AD=2.798 a_DHA=167.429 symop: x,y,z a_YAH=153 5475 5514 " H ALA B 185 "<>" O LEU B 182 " d_HA=2.257 d_AD=3.221 a_DHA=156.323 symop: x,y,z a_YAH=114 5506 5766 " H GLY B 184 "<>" OD2 ASP B 203 " d_HA=1.788 d_AD=2.704 a_DHA=147.369 symop: x,y,z a_YAH=111 6014 9141 " H VAL B 219 "<>" OD2 ASP C 220 " d_HA=1.750 d_AD=2.677 a_DHA=149.165 symop: x,y,z a_YAH=121 5546 5583 " H ALA B 190 "<>" O THR B 187 " d_HA=1.706 d_AD=2.680 a_DHA=161.797 symop: x,y,z a_YAH=134 5560 5285 " H GLU B 169 "<>" O THR B 188 " d_HA=2.111 d_AD=2.991 a_DHA=144.152 symop: x,y,z a_YAH=141 5541 5238 "HH21 ARG B 186 "<>" OD1 ASN B 166 " d_HA=2.911 d_AD=3.703 a_DHA=135.543 symop: x,y,z a_YAH=97 6440 6479 "HH11 ARG C 35 "<>" O LYS C 34 " d_HA=2.101 d_AD=3.056 a_DHA=157.011 symop: x,y,z a_YAH=117 9176 9234 " H ALA C 227 "<>" O VAL C 223 " d_HA=1.942 d_AD=2.939 a_DHA=165.777 symop: x,y,z a_YAH=151 9222 9281 " H LEU C 231 "<>" O ALA C 226 " d_HA=2.335 d_AD=3.238 a_DHA=148.089 symop: x,y,z a_YAH=138 9222 9259 " H HIS C 229 "<>" O ALA C 226 " d_HA=1.958 d_AD=2.828 a_DHA=141.784 symop: x,y,z a_YAH=105 6489 6526 " H GLN C 38 "<>" OD1 ASN C 36 " d_HA=2.193 d_AD=3.133 a_DHA=153.688 symop: x,y,z a_YAH=159 6462 6795 " H ASP C 56 "<>" O ARG C 35 " d_HA=2.294 d_AD=3.161 a_DHA=143.982 symop: x,y,z a_YAH=124 6508 6790 " H PHE C 37 "<>" O ASP C 56 " d_HA=2.008 d_AD=2.956 a_DHA=153.655 symop: x,y,z a_YAH=147 6740 6782 " H ALA C 55 "<>" O LEU C 52 " d_HA=2.093 d_AD=2.947 a_DHA=140.402 symop: x,y,z a_YAH=142 6409 6759 " HH TYR C 30 "<>" O THR C 53 " d_HA=1.786 d_AD=2.744 a_DHA=167.332 symop: x,y,z a_YAH=125 9192 9244 " H ALA C 228 "<>" O ALA C 224 " d_HA=1.827 d_AD=2.806 a_DHA=159.226 symop: x,y,z a_YAH=149 9202 9259 " H HIS C 229 "<>" O PHE C 225 " d_HA=2.704 d_AD=3.331 a_DHA=120.025 symop: x,y,z a_YAH=131 9202 9263 " HD1 HIS C 229 "<>" O PHE C 225 " d_HA=1.683 d_AD=2.697 a_DHA=177.387 symop: x,y,z a_YAH=145 6524 6548 " HD1 HIS C 39 "<>" OE1 GLN C 38 " d_HA=1.734 d_AD=2.741 a_DHA=169.768 symop: x,y,z a_YAH=139 6793 6828 " HG SER C 58 "<>" OD1 ASP C 56 " d_HA=1.601 d_AD=2.590 a_DHA=174.557 symop: x,y,z a_YAH=159 6793 6824 " H SER C 58 "<>" OD1 ASP C 56 " d_HA=2.596 d_AD=3.511 a_DHA=150.424 symop: x,y,z a_YAH=137 6807 7096 " H LEU C 57 "<>" O ASP C 76 " d_HA=1.950 d_AD=2.863 a_DHA=147.213 symop: x,y,z a_YAH=158 6780 6807 " H LEU C 57 "<>" O ALA C 55 " d_HA=2.402 d_AD=3.141 a_DHA=128.416 symop: x,y,z a_YAH=103 6780 7101 " H ASP C 76 "<>" O ALA C 55 " d_HA=2.210 d_AD=3.056 a_DHA=140.698 symop: x,y,z a_YAH=123 6774 7051 " H GLY C 54 "<>" O ARG C 73 " d_HA=2.186 d_AD=3.151 a_DHA=157.262 symop: x,y,z a_YAH=155 7032 7088 " H ALA C 75 "<>" O LEU C 72 " d_HA=1.811 d_AD=2.766 a_DHA=155.481 symop: x,y,z a_YAH=145 7059 7021 " H ARG C 73 "<>" OD1 ASN C 71 " d_HA=2.304 d_AD=3.240 a_DHA=153.718 symop: x,y,z a_YAH=150 8873 8920 " H LEU C 206 "<>" O ASP C 203 " d_HA=1.777 d_AD=2.771 a_DHA=164.801 symop: x,y,z a_YAH=130 8915 8986 " H THR C 209 "<>" O LEU C 206 " d_HA=2.014 d_AD=2.931 a_DHA=149.020 symop: x,y,z a_YAH=104 8915 8998 " H ALA C 210 "<>" O LEU C 206 " d_HA=1.870 d_AD=2.843 a_DHA=158.884 symop: x,y,z a_YAH=166 7099 7135 " H ARG C 78 "<>" OD1 ASP C 76 " d_HA=1.949 d_AD=2.872 a_DHA=149.126 symop: x,y,z a_YAH=152 7100 7144 "HH11 ARG C 78 "<>" OD2 ASP C 76 " d_HA=1.679 d_AD=2.671 a_DHA=160.074 symop: x,y,z a_YAH=117 7113 7380 " H LEU C 77 "<>" O ASN C 96 " d_HA=1.789 d_AD=2.724 a_DHA=151.220 symop: x,y,z a_YAH=155 7086 7385 " H ASN C 96 "<>" O ALA C 75 " d_HA=1.973 d_AD=2.894 a_DHA=150.535 symop: x,y,z a_YAH=141 7078 7340 " H SER C 74 "<>" O GLU C 93 " d_HA=1.892 d_AD=2.911 a_DHA=179.565 symop: x,y,z a_YAH=175 7321 7372 " H ALA C 95 "<>" O LEU C 92 " d_HA=1.858 d_AD=2.805 a_DHA=154.272 symop: x,y,z a_YAH=133 8659 8989 " HG1 THR C 209 "<>" OG1 THR C 187 " d_HA=1.888 d_AD=2.753 a_DHA=147.716 symop: x,y,z a_YAH=115 a_YAH=109 7383 7419 " H GLU C 98 "<>" OD1 ASN C 96 " d_HA=1.974 d_AD=2.934 a_DHA=156.272 symop: x,y,z a_YAH=158 7389 7418 "HD21 ASN C 96 "<>" OE2 GLU C 98 " d_HA=1.905 d_AD=2.937 a_DHA=176.497 symop: x,y,z a_YAH=125 7370 7661 " H ASP C 116 "<>" O ALA C 95 " d_HA=2.089 d_AD=2.980 a_DHA=146.229 symop: x,y,z a_YAH=142 7399 7656 " H LEU C 97 "<>" O ASP C 116 " d_HA=1.784 d_AD=2.713 a_DHA=149.950 symop: x,y,z a_YAH=155 7361 7628 " H GLU C 94 "<>" O SER C 113 " d_HA=1.985 d_AD=2.967 a_DHA=161.511 symop: x,y,z a_YAH=151 7646 7951 " H ASN C 136 "<>" O ALA C 115 " d_HA=1.944 d_AD=2.914 a_DHA=160.226 symop: x,y,z a_YAH=156 7648 7609 " H ALA C 115 "<>" O LEU C 112 " d_HA=1.924 d_AD=2.886 a_DHA=157.454 symop: x,y,z a_YAH=150 8396 8671 " H GLU C 169 "<>" O THR C 188 " d_HA=2.178 d_AD=3.068 a_DHA=146.285 symop: x,y,z a_YAH=141 8657 8694 " H ALA C 190 "<>" O THR C 187 " d_HA=2.156 d_AD=3.116 a_DHA=158.078 symop: x,y,z a_YAH=116 8686 8982 " H GLY C 189 "<>" O THR C 209 " d_HA=2.807 d_AD=3.747 a_DHA=154.380 symop: x,y,z a_YAH=142 8692 9009 " H SER C 211 "<>" O ALA C 190 " d_HA=2.136 d_AD=3.116 a_DHA=161.325 symop: x,y,z a_YAH=135 7417 7699 "HE21 GLN C 118 "<>" OE1 GLU C 98 " d_HA=2.498 d_AD=3.360 a_DHA=142.319 symop: x,y,z a_YAH=145 7659 7693 " H GLN C 118 "<>" OD1 ASP C 116 " d_HA=2.618 d_AD=3.600 a_DHA=164.163 symop: x,y,z a_YAH=131 7659 7956 "HD22 ASN C 136 "<>" OD1 ASP C 116 " d_HA=2.020 d_AD=3.008 a_DHA=163.367 symop: x,y,z a_YAH=140 7673 7946 " H LEU C 117 "<>" O ASN C 136 " d_HA=1.879 d_AD=2.771 a_DHA=144.635 symop: x,y,z a_YAH=147 7936 8213 " H ASN C 156 "<>" O ALA C 135 " d_HA=1.904 d_AD=2.891 a_DHA=164.695 symop: x,y,z a_YAH=156 8091 8136 " H ALA C 150 "<>" O LEU C 147 " d_HA=1.873 d_AD=2.846 a_DHA=159.754 symop: x,y,z a_YAH=130 8096 8346 " H LEU C 147 "<>" O ASN C 166 " d_HA=1.987 d_AD=2.824 a_DHA=138.022 symop: x,y,z a_YAH=145 8360 8407 " H ALA C 170 "<>" O LEU C 167 " d_HA=1.811 d_AD=2.780 a_DHA=158.761 symop: x,y,z a_YAH=126 8128 8379 " H GLY C 149 "<>" O SER C 168 " d_HA=2.085 d_AD=3.037 a_DHA=154.682 symop: x,y,z a_YAH=154 7949 7985 " H GLU C 138 "<>" OD1 ASN C 136 " d_HA=2.232 d_AD=3.206 a_DHA=161.622 symop: x,y,z a_YAH=120 7949 8218 "HD22 ASN C 156 "<>" OD1 ASN C 136 " d_HA=2.174 d_AD=3.075 a_DHA=148.103 symop: x,y,z a_YAH=140 7983 8217 "HD21 ASN C 156 "<>" OE1 GLU C 138 " d_HA=2.098 d_AD=2.959 a_DHA=140.211 symop: x,y,z a_YAH=122 7965 8208 " H LEU C 137 "<>" O ASN C 156 " d_HA=1.788 d_AD=2.696 a_DHA=147.000 symop: x,y,z a_YAH=147 8211 8248 " H HIS C 158 "<>" OD1 ASN C 156 " d_HA=1.912 d_AD=2.906 a_DHA=165.982 symop: x,y,z a_YAH=130 7822 8079 " H LEU C 127 "<>" O ASP C 146 " d_HA=2.117 d_AD=2.893 a_DHA=131.640 symop: x,y,z a_YAH=133 7822 7793 " H LEU C 127 "<>" O ALA C 125 " d_HA=2.434 d_AD=3.080 a_DHA=120.789 symop: x,y,z a_YAH=107 7817 7872 " H ALA C 130 "<>" O LEU C 127 " d_HA=1.886 d_AD=2.828 a_DHA=153.082 symop: x,y,z a_YAH=136 7863 8110 " H ASP C 129 "<>" O GLN C 148 " d_HA=2.096 d_AD=3.066 a_DHA=159.150 symop: x,y,z a_YAH=145 8502 8538 " H GLU C 178 "<>" OD1 ASN C 176 " d_HA=1.762 d_AD=2.733 a_DHA=159.625 symop: x,y,z a_YAH=173 7534 7587 " H ALA C 110 "<>" O LEU C 107 " d_HA=1.944 d_AD=2.895 a_DHA=154.634 symop: x,y,z a_YAH=136 7803 7539 " H LEU C 107 "<>" O ASN C 126 " d_HA=1.897 d_AD=2.744 a_DHA=138.899 symop: x,y,z a_YAH=131 7576 7836 " H GLU C 109 "<>" O LYS C 128 " d_HA=2.009 d_AD=3.001 a_DHA=163.383 symop: x,y,z a_YAH=159 1469 1733 "HD21 ASN A 136 "<>" OE1 GLN A 118 " d_HA=2.577 d_AD=3.457 a_DHA=144.141 symop: x,y,z a_YAH=93 1761 1995 "HD21 ASN A 156 "<>" OE1 GLU A 138 " d_HA=2.547 d_AD=3.353 a_DHA=135.738 symop: x,y,z a_YAH=103 7260 7299 " H ALA C 90 "<>" O LEU C 87 " d_HA=1.809 d_AD=2.769 a_DHA=155.813 symop: x,y,z a_YAH=150 7291 7553 " H GLY C 89 "<>" O HIS C 108 " d_HA=2.108 d_AD=3.052 a_DHA=153.454 symop: x,y,z a_YAH=158 6992 7279 " H ARG C 69 "<>" O SER C 88 " d_HA=1.890 d_AD=2.881 a_DHA=163.803 symop: x,y,z a_YAH=149 5206 5467 "HD21 ASN B 163 "<>" OD2 ASP B 181 " d_HA=1.834 d_AD=2.775 a_DHA=149.851 symop: x,y,z a_YAH=111 5466 5497 " H SER B 183 "<>" OD1 ASP B 181 " d_HA=1.930 d_AD=2.901 a_DHA=156.812 symop: x,y,z a_YAH=139 5466 5501 " HG SER B 183 "<>" OD1 ASP B 181 " d_HA=1.659 d_AD=2.613 a_DHA=160.031 symop: x,y,z a_YAH=134 2315 5739 " HG1 THR B 201 "<>" OE2 GLU A 178 " d_HA=2.276 d_AD=3.148 a_DHA=148.515 symop: x,y,z a_YAH=118 2605 2891 " H GLY A 199 "<>" OD2 ASP A 218 " d_HA=2.204 d_AD=3.171 a_DHA=158.191 symop: x,y,z a_YAH=97 2918 9125 " H VAL C 219 "<>" OD1 ASP A 220 " d_HA=2.012 d_AD=2.866 a_DHA=139.019 symop: x,y,z a_YAH=96 2903 6029 " H VAL A 219 "<>" OD1 ASP B 220 " d_HA=1.767 d_AD=2.672 a_DHA=145.511 symop: x,y,z a_YAH=117 5942 9269 " H GLY B 214 "<>" O GLY C 230 " d_HA=1.945 d_AD=2.900 a_DHA=155.601 symop: x,-y+2,-z+2 a_YAH=122 5637 5929 " H VAL B 213 "<>" OD1 ASP B 193 " d_HA=1.910 d_AD=2.893 a_DHA=161.793 symop: x,y,z a_YAH=135 5906 5950 " H ALA B 215 "<>" O LEU B 212 " d_HA=1.955 d_AD=2.903 a_DHA=155.368 symop: x,y,z a_YAH=118 5895 5620 " H LEU B 192 "<>" O SER B 211 " d_HA=1.850 d_AD=2.776 a_DHA=149.809 symop: x,y,z a_YAH=157 5902 5638 " HG SER B 211 "<>" OD2 ASP B 193 " d_HA=1.744 d_AD=2.652 a_DHA=151.199 symop: x,y,z a_YAH=95 5581 5898 " H SER B 211 "<>" O ALA B 190 " d_HA=2.258 d_AD=3.244 a_DHA=163.561 symop: x,y,z a_YAH=143 5283 5011 "HE21 GLN B 148 "<>" OE1 GLU B 169 " d_HA=1.890 d_AD=2.835 a_DHA=150.811 symop: x,y,z a_YAH=116 9232 9270 " H GLY C 230 "<>" O ALA C 227 " d_HA=2.075 d_AD=3.015 a_DHA=153.479 symop: x,y,z a_YAH=107 8975 9242 "HH11 ARG C 208 "<>" O ALA C 228 " d_HA=1.765 d_AD=2.774 a_DHA=168.579 symop: x,y,z a_YAH=122 8885 8945 " H TRP C 207 "<>" O PRO C 204 " d_HA=2.350 d_AD=3.010 a_DHA=121.861 symop: x,y,z a_YAH=113 8885 8966 " H ARG C 208 "<>" O PRO C 204 " d_HA=2.561 d_AD=3.539 a_DHA=162.317 symop: x,y,z a_YAH=149 302 326 " HD1 HIS A 39 "<>" OE1 GLN A 38 " d_HA=1.883 d_AD=2.902 a_DHA=175.356 symop: x,y,z a_YAH=110 322 599 " H HIS A 39 "<>" O SER A 58 " d_HA=2.005 d_AD=3.009 a_DHA=167.570 symop: x,y,z a_YAH=163 8336 8641 " H ARG C 186 "<>" O ALA C 165 " d_HA=1.808 d_AD=2.817 a_DHA=171.085 symop: x,y,z a_YAH=163 8365 8633 " H LEU C 167 "<>" O ARG C 186 " d_HA=2.283 d_AD=3.006 a_DHA=127.454 symop: x,y,z a_YAH=126 8386 8633 " HG SER C 168 "<>" O ARG C 186 " d_HA=2.678 d_AD=3.434 a_DHA=135.554 symop: x,y,z a_YAH=112 267 304 " H GLN A 38 "<>" OD1 ASN A 36 " d_HA=1.869 d_AD=2.830 a_DHA=157.227 symop: x,y,z a_YAH=158 571 606 " HG SER A 58 "<>" OD1 ASP A 56 " d_HA=1.656 d_AD=2.642 a_DHA=174.676 symop: x,y,z a_YAH=132 571 602 " H SER A 58 "<>" OD1 ASP A 56 " d_HA=1.904 d_AD=2.869 a_DHA=157.293 symop: x,y,z a_YAH=153 619 905 " H TYR A 59 "<>" O ARG A 78 " d_HA=1.955 d_AD=2.957 a_DHA=167.659 symop: x,y,z a_YAH=162 8351 8069 " H ASN C 166 "<>" O ALA C 145 " d_HA=1.979 d_AD=2.977 a_DHA=165.967 symop: x,y,z a_YAH=162 8349 8382 " H SER C 168 "<>" OD1 ASN C 166 " d_HA=2.607 d_AD=3.521 a_DHA=150.987 symop: x,y,z a_YAH=102 8349 8649 " HE ARG C 186 "<>" OD1 ASN C 166 " d_HA=1.906 d_AD=2.900 a_DHA=164.568 symop: x,y,z a_YAH=117 8349 8652 "HH21 ARG C 186 "<>" OD1 ASN C 166 " d_HA=2.769 d_AD=3.532 a_DHA=132.330 symop: x,y,z a_YAH=116 8122 8394 "HE21 GLN C 148 "<>" OE1 GLU C 169 " d_HA=1.963 d_AD=2.983 a_DHA=168.504 symop: x,y,z a_YAH=137 878 922 "HH11 ARG A 78 "<>" OD2 ASP A 76 " d_HA=1.958 d_AD=2.818 a_DHA=138.987 symop: x,y,z a_YAH=98 877 913 " H ARG A 78 "<>" OD1 ASP A 76 " d_HA=2.385 d_AD=3.307 a_DHA=150.401 symop: x,y,z a_YAH=149 934 1191 " H ASN A 79 "<>" O GLU A 98 " d_HA=1.999 d_AD=2.963 a_DHA=156.250 symop: x,y,z a_YAH=156 1208 1465 " H ALA A 99 "<>" O GLN A 118 " d_HA=1.964 d_AD=2.971 a_DHA=168.519 symop: x,y,z a_YAH=160 8082 8356 "HD22 ASN C 166 "<>" OD1 ASP C 146 " d_HA=1.817 d_AD=2.796 a_DHA=156.633 symop: x,y,z a_YAH=106 8082 8116 " H GLN C 148 "<>" OD1 ASP C 146 " d_HA=2.012 d_AD=2.967 a_DHA=155.019 symop: x,y,z a_YAH=136 7853 8114 " HZ2 LYS C 128 "<>" OE1 GLN C 148 " d_HA=2.287 d_AD=3.221 a_DHA=152.461 symop: x,y,z a_YAH=130 1167 1196 "HD21 ASN A 96 "<>" OE2 GLU A 98 " d_HA=1.994 d_AD=3.013 a_DHA=169.590 symop: x,y,z a_YAH=112 1161 1197 " H GLU A 98 "<>" OD1 ASN A 96 " d_HA=1.896 d_AD=2.835 a_DHA=152.058 symop: x,y,z a_YAH=172 1195 1477 "HE21 GLN A 118 "<>" OE1 GLU A 98 " d_HA=2.517 d_AD=3.372 a_DHA=141.335 symop: x,y,z a_YAH=142 1437 1477 "HE21 GLN A 118 "<>" OD1 ASP A 116 " d_HA=2.798 d_AD=3.438 a_DHA=121.327 symop: x,y,z a_YAH=99 1437 1471 " H GLN A 118 "<>" OD1 ASP A 116 " d_HA=2.586 d_AD=3.548 a_DHA=158.362 symop: x,y,z a_YAH=158 1488 1757 " H GLU A 119 "<>" O GLU A 138 " d_HA=1.986 d_AD=2.973 a_DHA=162.023 symop: x,y,z a_YAH=161 2095 2356 "HD21 ASN A 163 "<>" OD2 ASP A 181 " d_HA=2.052 d_AD=2.957 a_DHA=145.908 symop: x,y,z a_YAH=114 7806 7842 " H LYS C 128 "<>" OD1 ASN C 126 " d_HA=2.255 d_AD=3.181 a_DHA=151.381 symop: x,y,z a_YAH=138 1727 1763 " H GLU A 138 "<>" OD1 ASN A 136 " d_HA=1.811 d_AD=2.781 a_DHA=159.518 symop: x,y,z a_YAH=161 1738 1791 " H ALA A 140 "<>" O LEU A 137 " d_HA=1.971 d_AD=2.919 a_DHA=154.444 symop: x,y,z a_YAH=133 1778 2019 " H GLN A 139 "<>" O HIS A 158 " d_HA=1.942 d_AD=2.931 a_DHA=163.922 symop: x,y,z a_YAH=159 2000 2045 " H ALA A 160 "<>" O LEU A 157 " d_HA=1.845 d_AD=2.808 a_DHA=156.979 symop: x,y,z a_YAH=125 2043 2357 " H ASP A 181 "<>" O ALA A 160 " d_HA=2.244 d_AD=3.147 a_DHA=148.272 symop: x,y,z a_YAH=132 7286 7249 " HG SER C 88 "<>" OD1 ASN C 86 " d_HA=2.233 d_AD=2.905 a_DHA=125.664 symop: x,y,z a_YAH=121 7525 7560 " H HIS C 108 "<>" OD1 ASP C 106 " d_HA=2.217 d_AD=3.137 a_DHA=150.147 symop: x,y,z a_YAH=140 7525 7813 "HD22 ASN C 126 "<>" OD1 ASP C 106 " d_HA=2.050 d_AD=2.868 a_DHA=136.281 symop: x,y,z a_YAH=114 7525 7564 " HD1 HIS C 108 "<>" OD1 ASP C 106 " d_HA=1.752 d_AD=2.724 a_DHA=156.551 symop: x,y,z a_YAH=91 1989 2026 " H HIS A 158 "<>" OD1 ASN A 156 " d_HA=1.725 d_AD=2.715 a_DHA=166.211 symop: x,y,z a_YAH=159 2037 2310 " H GLY A 159 "<>" O GLU A 178 " d_HA=2.091 d_AD=3.062 a_DHA=158.588 symop: x,y,z a_YAH=147 2291 2344 " H ALA A 180 "<>" O LEU A 177 " d_HA=2.029 d_AD=2.984 a_DHA=156.621 symop: x,y,z a_YAH=126 2331 2587 " H GLN A 179 "<>" O HIS A 198 " d_HA=2.147 d_AD=3.114 a_DHA=158.680 symop: x,y,z a_YAH=149 2342 2625 " H THR A 201 "<>" O ALA A 180 " d_HA=2.125 d_AD=3.006 a_DHA=144.509 symop: x,y,z a_YAH=149 2611 2939 "HE21 GLN A 221 "<>" O ALA A 200 " d_HA=2.601 d_AD=3.259 a_DHA=122.808 symop: x,y,z a_YAH=134 2280 2316 " H GLU A 178 "<>" OD1 ASN A 176 " d_HA=1.814 d_AD=2.811 a_DHA=168.278 symop: x,y,z a_YAH=146 2286 2314 "HD21 ASN A 176 "<>" OE1 GLU A 178 " d_HA=2.351 d_AD=3.137 a_DHA=132.653 symop: x,y,z a_YAH=136 2573 2847 " H LEU A 197 "<>" O ARG A 216 " d_HA=1.974 d_AD=2.885 a_DHA=147.792 symop: x,y,z a_YAH=147 2568 2613 " H ALA A 200 "<>" O LEU A 197 " d_HA=1.827 d_AD=2.789 a_DHA=157.688 symop: x,y,z a_YAH=138 2568 2940 "HE22 GLN A 221 "<>" O LEU A 197 " d_HA=1.838 d_AD=2.841 a_DHA=169.589 symop: x,y,z a_YAH=135 2915 2972 " H ALA A 224 "<>" O ASP A 220 " d_HA=2.020 d_AD=3.013 a_DHA=164.363 symop: x,y,z a_YAH=140 2600 3084 " HE2 HIS A 198 "<>" O LEU A 233 " d_HA=1.682 d_AD=2.683 a_DHA=168.302 symop: x,-y+2,-z+2 a_YAH=137 2875 3073 " H VAL A 217 "<>" O CYS A 232 " d_HA=2.361 d_AD=3.334 a_DHA=160.389 symop: x,-y+2,-z+2 a_YAH=131 2892 2931 " H ASP A 218 "<>" OE1 GLN A 221 " d_HA=2.042 d_AD=3.007 a_DHA=158.154 symop: x,y,z a_YAH=110 2887 2946 " H ALA A 222 "<>" O ASP A 218 " d_HA=1.987 d_AD=2.865 a_DHA=142.817 symop: x,y,z a_YAH=137 2899 2958 " H VAL A 223 "<>" O VAL A 219 " d_HA=2.062 d_AD=3.057 a_DHA=163.573 symop: x,y,z a_YAH=168 2927 2988 " H PHE A 225 "<>" O GLN A 221 " d_HA=1.793 d_AD=2.692 a_DHA=145.440 symop: x,y,z a_YAH=150 2944 3002 " H ALA A 226 "<>" O ALA A 222 " d_HA=2.305 d_AD=3.269 a_DHA=157.048 symop: x,y,z a_YAH=137 278 337 " H ILE A 40 "<>" O PHE A 37 " d_HA=2.114 d_AD=3.043 a_DHA=150.259 symop: x,y,z a_YAH=137 332 646 " H ASN A 61 "<>" O ILE A 40 " d_HA=2.096 d_AD=3.069 a_DHA=161.361 symop: x,y,z a_YAH=141 631 958 " H ASN A 81 "<>" O ALA A 60 " d_HA=1.980 d_AD=2.948 a_DHA=159.940 symop: x,y,z a_YAH=159 286 568 " H PHE A 37 "<>" O ASP A 56 " d_HA=1.827 d_AD=2.809 a_DHA=160.722 symop: x,y,z a_YAH=165 580 633 " H ALA A 60 "<>" O LEU A 57 " d_HA=1.806 d_AD=2.761 a_DHA=155.425 symop: x,y,z a_YAH=140 943 1231 " H ASN A 101 "<>" O ALA A 80 " d_HA=2.116 d_AD=3.052 a_DHA=153.755 symop: x,y,z a_YAH=157 1229 1275 " HE ARG A 103 "<>" OD1 ASN A 101 " d_HA=2.564 d_AD=3.463 a_DHA=147.150 symop: x,y,z a_YAH=116 1229 1267 " H ARG A 103 "<>" OD1 ASN A 101 " d_HA=2.136 d_AD=3.043 a_DHA=148.067 symop: x,y,z a_YAH=139 558 879 " H ASP A 76 "<>" O ALA A 55 " d_HA=2.876 d_AD=3.495 a_DHA=120.675 symop: x,y,z a_YAH=102 585 874 " H LEU A 57 "<>" O ASP A 76 " d_HA=1.823 d_AD=2.782 a_DHA=155.099 symop: x,y,z a_YAH=157 891 1158 " H LEU A 77 "<>" O ASN A 96 " d_HA=1.802 d_AD=2.767 a_DHA=157.135 symop: x,y,z a_YAH=157 886 945 " H ALA A 80 "<>" O LEU A 77 " d_HA=1.794 d_AD=2.749 a_DHA=155.551 symop: x,y,z a_YAH=136 1172 1218 " H ALA A 100 "<>" O LEU A 97 " d_HA=1.787 d_AD=2.752 a_DHA=157.070 symop: x,y,z a_YAH=134 1216 1512 " H ASN A 121 "<>" O ALA A 100 " d_HA=2.416 d_AD=3.242 a_DHA=138.950 symop: x,y,z a_YAH=137 1245 1507 " H LEU A 102 "<>" O ASN A 121 " d_HA=1.786 d_AD=2.724 a_DHA=151.184 symop: x,y,z a_YAH=159 1497 1804 " H ASP A 141 "<>" O ALA A 120 " d_HA=2.312 d_AD=3.082 a_DHA=132.478 symop: x,y,z a_YAH=133 1510 1544 " H THR A 123 "<>" OD1 ASN A 121 " d_HA=1.990 d_AD=2.833 a_DHA=139.135 symop: x,y,z a_YAH=141 1510 1547 " HG1 THR A 123 "<>" OD1 ASN A 121 " d_HA=2.350 d_AD=3.112 a_DHA=135.574 symop: x,y,z a_YAH=118 1526 1799 " H LEU A 122 "<>" O ASP A 141 " d_HA=1.962 d_AD=2.837 a_DHA=141.846 symop: x,y,z a_YAH=131 1802 1832 " H ALA A 143 "<>" OD1 ASP A 141 " d_HA=2.093 d_AD=3.063 a_DHA=157.693 symop: x,y,z a_YAH=144 864 1163 " H ASN A 96 "<>" O ALA A 75 " d_HA=2.033 d_AD=2.918 a_DHA=145.411 symop: x,y,z a_YAH=131 1148 1439 " H ASP A 116 "<>" O ALA A 95 " d_HA=2.002 d_AD=2.965 a_DHA=158.572 symop: x,y,z a_YAH=146 1177 1434 " H LEU A 97 "<>" O ASP A 116 " d_HA=1.739 d_AD=2.656 a_DHA=147.987 symop: x,y,z a_YAH=154 1446 1499 " H ALA A 120 "<>" O LEU A 117 " d_HA=2.154 d_AD=3.073 a_DHA=149.244 symop: x,y,z a_YAH=129 1789 2058 " H ASN A 161 "<>" O ALA A 140 " d_HA=2.604 d_AD=3.295 a_DHA=125.734 symop: x,y,z a_YAH=133 1816 2053 " H LEU A 142 "<>" O ASN A 161 " d_HA=2.007 d_AD=2.919 a_DHA=147.638 symop: x,y,z a_YAH=139 2056 2091 " H ASN A 163 "<>" OD1 ASN A 161 " d_HA=2.144 d_AD=3.126 a_DHA=162.566 symop: x,y,z a_YAH=144 2056 2096 "HD22 ASN A 163 "<>" OD1 ASN A 161 " d_HA=1.908 d_AD=2.898 a_DHA=163.957 symop: x,y,z a_YAH=137 1424 1729 " H ASN A 136 "<>" O ALA A 115 " d_HA=2.038 d_AD=2.987 a_DHA=155.122 symop: x,y,z a_YAH=156 1451 1724 " H LEU A 117 "<>" O ASN A 136 " d_HA=1.801 d_AD=2.676 a_DHA=142.324 symop: x,y,z a_YAH=150 1743 1986 " H LEU A 137 "<>" O ASN A 156 " d_HA=1.802 d_AD=2.721 a_DHA=148.977 symop: x,y,z a_YAH=152 2072 2352 " H LEU A 162 "<>" O ASP A 181 " d_HA=2.034 d_AD=2.886 a_DHA=139.821 symop: x,y,z a_YAH=143 2355 2386 " H SER A 183 "<>" OD1 ASP A 181 " d_HA=1.812 d_AD=2.800 a_DHA=161.572 symop: x,y,z a_YAH=145 2355 2390 " HG SER A 183 "<>" OD1 ASP A 181 " d_HA=1.569 d_AD=2.546 a_DHA=165.484 symop: x,y,z a_YAH=128 2364 2403 " H ALA A 185 "<>" O LEU A 182 " d_HA=2.019 d_AD=2.998 a_DHA=160.356 symop: x,y,z a_YAH=120 2369 2621 " H LEU A 182 "<>" O THR A 201 " d_HA=1.969 d_AD=2.934 a_DHA=157.297 symop: x,y,z a_YAH=156 2395 2655 " H GLY A 184 "<>" OD2 ASP A 203 " d_HA=1.746 d_AD=2.703 a_DHA=154.304 symop: x,y,z a_YAH=110 1714 1991 " H ASN A 156 "<>" O ALA A 135 " d_HA=1.881 d_AD=2.869 a_DHA=165.271 symop: x,y,z a_YAH=160 1976 2282 " H ASN A 176 "<>" O ALA A 155 " d_HA=1.927 d_AD=2.902 a_DHA=160.522 symop: x,y,z a_YAH=158 2005 2277 " H LEU A 157 "<>" O ASN A 176 " d_HA=1.757 d_AD=2.680 a_DHA=149.279 symop: x,y,z a_YAH=150 2651 2698 " H LEU A 206 "<>" O ASP A 203 " d_HA=1.908 d_AD=2.890 a_DHA=161.090 symop: x,y,z a_YAH=121 2267 2560 " H SER A 196 "<>" O ALA A 175 " d_HA=2.012 d_AD=2.988 a_DHA=161.187 symop: x,y,z a_YAH=149 2296 2557 " H LEU A 177 "<>" O SER A 196 " d_HA=2.031 d_AD=2.934 a_DHA=147.289 symop: x,y,z a_YAH=149 2547 2855 " H ARG A 216 "<>" O ALA A 195 " d_HA=1.904 d_AD=2.917 a_DHA=173.640 symop: x,y,z a_YAH=173 2837 3076 " H CYS A 232 "<>" O ALA A 215 " d_HA=1.989 d_AD=2.970 a_DHA=161.998 symop: x,-y+2,-z+2 a_YAH=143 27 351 " H MET A 21 "<>" O ASN A 41 " d_HA=2.635 d_AD=3.446 a_DHA=136.835 symop: x,y,z a_YAH=148 354 390 " H GLN A 43 "<>" OD1 ASN A 41 " d_HA=1.852 d_AD=2.863 a_DHA=175.367 symop: x,y,z a_YAH=167 156 236 " HZ3 LYS A 34 "<>" ND1 HIS A 29 " d_HA=2.140 d_AD=3.095 a_DHA=155.224 symop: x,y,z a_YAH=137 a_YAH=113 370 641 " H LEU A 42 "<>" O ASN A 61 " d_HA=1.952 d_AD=2.866 a_DHA=148.312 symop: x,y,z a_YAH=160 644 681 " H HIS A 63 "<>" OD1 ASN A 61 " d_HA=1.801 d_AD=2.786 a_DHA=163.516 symop: x,y,z a_YAH=169 655 710 " H ALA A 65 "<>" O LEU A 62 " d_HA=1.835 d_AD=2.800 a_DHA=157.829 symop: x,y,z a_YAH=149 660 953 " H LEU A 62 "<>" O ASN A 81 " d_HA=1.904 d_AD=2.827 a_DHA=149.919 symop: x,y,z a_YAH=149 685 988 " HD1 HIS A 63 "<>" OG SER A 83 " d_HA=2.151 d_AD=3.153 a_DHA=167.242 symop: x,y,z a_YAH=128 a_YAH=112 956 993 " HG SER A 83 "<>" OD1 ASN A 81 " d_HA=1.851 d_AD=2.813 a_DHA=166.759 symop: x,y,z a_YAH=134 956 989 " H SER A 83 "<>" OD1 ASN A 81 " d_HA=1.948 d_AD=2.844 a_DHA=146.221 symop: x,y,z a_YAH=157 153 224 " H LYS A 34 "<>" O HIS A 29 " d_HA=2.003 d_AD=2.928 a_DHA=150.406 symop: x,y,z a_YAH=153 218 257 "HH11 ARG A 35 "<>" O LYS A 34 " d_HA=2.309 d_AD=3.214 a_DHA=148.759 symop: x,y,z a_YAH=115 967 1016 " H ALA A 85 "<>" O LEU A 82 " d_HA=1.882 d_AD=2.810 a_DHA=150.794 symop: x,y,z a_YAH=143 972 1226 " H LEU A 82 "<>" O ASN A 101 " d_HA=1.952 d_AD=2.821 a_DHA=141.861 symop: x,y,z a_YAH=143 1004 1259 " H HIS A 84 "<>" O ARG A 103 " d_HA=2.011 d_AD=3.003 a_DHA=165.277 symop: x,y,z a_YAH=149 1284 1540 " H GLY A 104 "<>" O THR A 123 " d_HA=2.071 d_AD=3.057 a_DHA=163.275 symop: x,y,z a_YAH=158 187 537 " HH TYR A 30 "<>" O THR A 53 " d_HA=1.732 d_AD=2.688 a_DHA=164.800 symop: x,y,z a_YAH=126 518 560 " H ALA A 55 "<>" O LEU A 52 " d_HA=2.045 d_AD=2.928 a_DHA=144.253 symop: x,y,z a_YAH=142 1240 1292 " H ALA A 105 "<>" O LEU A 102 " d_HA=1.768 d_AD=2.702 a_DHA=152.173 symop: x,y,z a_YAH=158 1521 1573 " H ALA A 125 "<>" O LEU A 122 " d_HA=1.845 d_AD=2.811 a_DHA=157.545 symop: x,y,z a_YAH=141 1560 1830 " H GLN A 124 "<>" O ALA A 143 " d_HA=2.113 d_AD=3.057 a_DHA=153.752 symop: x,y,z a_YAH=137 1566 1830 "HE21 GLN A 124 "<>" O ALA A 143 " d_HA=2.524 d_AD=3.364 a_DHA=140.318 symop: x,y,z a_YAH=127 552 829 " H GLY A 54 "<>" O ARG A 73 " d_HA=2.290 d_AD=3.166 a_DHA=143.543 symop: x,y,z a_YAH=149 856 1118 " H SER A 74 "<>" O GLU A 93 " d_HA=2.011 d_AD=2.997 a_DHA=162.215 symop: x,y,z a_YAH=156 810 866 " H ALA A 75 "<>" O LEU A 72 " d_HA=1.816 d_AD=2.750 a_DHA=151.703 symop: x,y,z a_YAH=147 1099 1150 " H ALA A 95 "<>" O LEU A 92 " d_HA=1.875 d_AD=2.803 a_DHA=150.313 symop: x,y,z a_YAH=147 1811 1849 " H ALA A 145 "<>" O LEU A 142 " d_HA=1.852 d_AD=2.821 a_DHA=158.414 symop: x,y,z a_YAH=145 1841 2086 " H GLY A 144 "<>" O ASN A 163 " d_HA=1.918 d_AD=2.875 a_DHA=156.011 symop: x,y,z a_YAH=172 2105 2383 " H ASN A 164 "<>" O SER A 183 " d_HA=1.921 d_AD=2.921 a_DHA=166.694 symop: x,y,z a_YAH=155 848 1137 "HH21 ARG A 73 "<>" OE1 GLU A 94 " d_HA=2.146 d_AD=3.155 a_DHA=167.059 symop: x,y,z a_YAH=117 1139 1406 " H GLU A 94 "<>" O SER A 113 " d_HA=2.219 d_AD=3.160 a_DHA=153.518 symop: x,y,z a_YAH=135 1387 1426 " H ALA A 115 "<>" O LEU A 112 " d_HA=1.831 d_AD=2.785 a_DHA=155.962 symop: x,y,z a_YAH=160 2067 2116 " H ALA A 165 "<>" O LEU A 162 " d_HA=1.910 d_AD=2.871 a_DHA=156.471 symop: x,y,z a_YAH=139 2114 2419 " H ARG A 186 "<>" O ALA A 165 " d_HA=1.961 d_AD=2.919 a_DHA=157.120 symop: x,y,z a_YAH=158 1418 1691 " H GLY A 114 "<>" O SER A 133 " d_HA=1.987 d_AD=2.941 a_DHA=154.484 symop: x,y,z a_YAH=161 1672 1716 " H ALA A 135 "<>" O LEU A 132 " d_HA=1.828 d_AD=2.792 a_DHA=157.803 symop: x,y,z a_YAH=143 1707 1957 " H ASP A 134 "<>" O ASP A 153 " d_HA=1.893 d_AD=2.894 a_DHA=166.754 symop: x,y,z a_YAH=155 1938 1978 " H ALA A 155 "<>" O LEU A 152 " d_HA=1.975 d_AD=2.936 a_DHA=157.311 symop: x,y,z a_YAH=132 1960 2236 " HG1 THR A 173 "<>" OD1 ASP A 153 " d_HA=2.280 d_AD=3.131 a_DHA=145.593 symop: x,y,z a_YAH=122 1960 2259 " HE ARG A 174 "<>" OD1 ASP A 153 " d_HA=1.825 d_AD=2.751 a_DHA=148.251 symop: x,y,z a_YAH=140 1970 2229 " H GLY A 154 "<>" O THR A 173 " d_HA=2.368 d_AD=3.308 a_DHA=153.757 symop: x,y,z a_YAH=152 2210 2269 " H ALA A 175 "<>" O LEU A 172 " d_HA=2.094 d_AD=3.053 a_DHA=158.065 symop: x,y,z a_YAH=119 2509 2784 " H LEU A 192 "<>" O SER A 211 " d_HA=1.948 d_AD=2.827 a_DHA=143.407 symop: x,y,z a_YAH=134 2677 2764 " H THR A 209 "<>" O VAL A 205 " d_HA=2.086 d_AD=2.977 a_DHA=146.541 symop: x,y,z a_YAH=150 2693 2776 " H ALA A 210 "<>" O LEU A 206 " d_HA=1.933 d_AD=2.949 a_DHA=169.141 symop: x,y,z a_YAH=160 2744 2663 " H ARG A 208 "<>" O PRO A 204 " d_HA=2.888 d_AD=3.695 a_DHA=137.467 symop: x,y,z a_YAH=131 2251 2523 " H ARG A 174 "<>" O ASP A 193 " d_HA=2.061 d_AD=2.988 a_DHA=149.953 symop: x,y,z a_YAH=146 2504 2549 " H ALA A 195 "<>" O LEU A 192 " d_HA=1.940 d_AD=2.935 a_DHA=166.749 symop: x,y,z a_YAH=133 2540 2814 " H ASP A 194 "<>" O VAL A 213 " d_HA=1.821 d_AD=2.751 a_DHA=151.116 symop: x,y,z a_YAH=138 2795 2839 " H ALA A 215 "<>" O LEU A 212 " d_HA=2.119 d_AD=3.080 a_DHA=158.732 symop: x,y,z a_YAH=118 39 82 " H GLU A 25 "<>" O ASN A 22 " d_HA=2.423 d_AD=3.071 a_DHA=121.151 symop: x,y,z a_YAH=112 39 96 " H ILE A 26 "<>" O ASN A 22 " d_HA=2.141 d_AD=3.144 a_DHA=168.202 symop: x,y,z a_YAH=157 44 80 " H ASN A 22 "<>" OE1 GLU A 25 " d_HA=1.740 d_AD=2.756 a_DHA=172.872 symop: x,y,z a_YAH=161 18 384 " HE2 HIS A 20 "<>" O GLN A 43 " d_HA=2.364 d_AD=3.355 a_DHA=162.125 symop: x,y,z a_YAH=143 129 203 " H ALA A 32 "<>" O ARG A 28 " d_HA=1.986 d_AD=2.924 a_DHA=152.877 symop: x,y,z a_YAH=146 76 160 " H HIS A 29 "<>" O GLU A 25 " d_HA=1.870 d_AD=2.840 a_DHA=158.429 symop: x,y,z a_YAH=154 91 179 " H TYR A 30 "<>" O ILE A 26 " d_HA=1.840 d_AD=2.855 a_DHA=175.570 symop: x,y,z a_YAH=166 365 421 " H ILE A 45 "<>" O LEU A 42 " d_HA=2.135 d_AD=3.102 a_DHA=158.419 symop: x,y,z a_YAH=140 407 674 " H GLU A 44 "<>" O HIS A 63 " d_HA=2.172 d_AD=3.186 a_DHA=178.032 symop: x,y,z a_YAH=153 698 986 " H HIS A 64 "<>" O SER A 83 " d_HA=2.062 d_AD=3.034 a_DHA=159.557 symop: x,y,z a_YAH=164 170 212 " H GLY A 33 "<>" O TYR A 30 " d_HA=2.015 d_AD=2.955 a_DHA=153.260 symop: x,y,z a_YAH=114 170 258 "HH12 ARG A 35 "<>" O TYR A 30 " d_HA=1.883 d_AD=2.835 a_DHA=155.483 symop: x,y,z a_YAH=133 193 110 " H ALA A 31 "<>" O LEU A 27 " d_HA=1.904 d_AD=2.876 a_DHA=158.991 symop: x,y,z a_YAH=147 523 796 " H LEU A 52 "<>" O ASN A 71 " d_HA=1.857 d_AD=2.858 a_DHA=166.992 symop: x,y,z a_YAH=156 1290 1586 " H ASN A 126 "<>" O ALA A 105 " d_HA=2.192 d_AD=3.137 a_DHA=155.075 symop: x,y,z a_YAH=146 837 799 " H ARG A 73 "<>" OD1 ASN A 71 " d_HA=2.291 d_AD=3.224 a_DHA=153.021 symop: x,y,z a_YAH=156 815 786 " H LEU A 72 "<>" O ALA A 70 " d_HA=2.565 d_AD=3.201 a_DHA=120.161 symop: x,y,z a_YAH=114 815 1085 " H LEU A 72 "<>" O ASN A 91 " d_HA=1.990 d_AD=2.874 a_DHA=143.461 symop: x,y,z a_YAH=149 1104 1373 " H LEU A 92 "<>" O ASN A 111 " d_HA=1.771 d_AD=2.682 a_DHA=147.910 symop: x,y,z a_YAH=169 1571 1862 " H ASP A 146 "<>" O ALA A 125 " d_HA=1.957 d_AD=2.918 a_DHA=157.248 symop: x,y,z a_YAH=154 1600 1857 " H LEU A 127 "<>" O ASP A 146 " d_HA=1.902 d_AD=2.756 a_DHA=139.497 symop: x,y,z a_YAH=147 1847 2129 " H ASN A 166 "<>" O ALA A 145 " d_HA=2.093 d_AD=3.069 a_DHA=161.482 symop: x,y,z a_YAH=154 1088 1124 " H GLU A 93 "<>" OD1 ASN A 91 " d_HA=2.099 d_AD=2.974 a_DHA=144.242 symop: x,y,z a_YAH=123 1123 1094 "HD21 ASN A 91 "<>" OE2 GLU A 93 " d_HA=1.921 d_AD=2.915 a_DHA=162.245 symop: x,y,z a_YAH=117 1376 1409 " H SER A 113 "<>" OD1 ASN A 111 " d_HA=1.880 d_AD=2.776 a_DHA=146.179 symop: x,y,z a_YAH=169 1376 1413 " HG SER A 113 "<>" OD1 ASN A 111 " d_HA=2.370 d_AD=3.064 a_DHA=128.502 symop: x,y,z a_YAH=135 1392 1658 " H LEU A 112 "<>" O ASN A 131 " d_HA=1.747 d_AD=2.641 a_DHA=144.617 symop: x,y,z a_YAH=153 1677 1922 " H LEU A 132 "<>" O VAL A 151 " d_HA=1.855 d_AD=2.810 a_DHA=155.140 symop: x,y,z a_YAH=165 1874 2124 " H LEU A 147 "<>" O ASN A 166 " d_HA=1.912 d_AD=2.824 a_DHA=148.001 symop: x,y,z a_YAH=145 2143 2411 " H LEU A 167 "<>" O ARG A 186 " d_HA=1.996 d_AD=2.833 a_DHA=138.154 symop: x,y,z a_YAH=143 1661 1694 " H SER A 133 "<>" OD1 ASN A 131 " d_HA=1.897 d_AD=2.864 a_DHA=159.626 symop: x,y,z a_YAH=163 1661 1698 " HG SER A 133 "<>" OD1 ASN A 131 " d_HA=1.915 d_AD=2.845 a_DHA=161.980 symop: x,y,z a_YAH=133 1943 2193 " H LEU A 152 "<>" O MET A 171 " d_HA=2.149 d_AD=3.089 a_DHA=153.218 symop: x,y,z a_YAH=119 2198 1912 " H MET A 171 "<>" O ALA A 150 " d_HA=1.891 d_AD=2.888 a_DHA=167.178 symop: x,y,z a_YAH=162 2138 2185 " H ALA A 170 "<>" O LEU A 167 " d_HA=1.841 d_AD=2.805 a_DHA=158.416 symop: x,y,z a_YAH=124 2183 2215 " H LEU A 172 "<>" O ALA A 170 " d_HA=2.625 d_AD=3.377 a_DHA=131.231 symop: x,y,z a_YAH=103 2183 2488 " H ARG A 191 "<>" O ALA A 170 " d_HA=2.078 d_AD=3.068 a_DHA=163.050 symop: x,y,z a_YAH=165 2435 2472 " H ALA A 190 "<>" O THR A 187 " d_HA=1.751 d_AD=2.748 a_DHA=167.587 symop: x,y,z a_YAH=131 2470 2787 " H SER A 211 "<>" O ALA A 190 " d_HA=2.042 d_AD=3.038 a_DHA=165.638 symop: x,y,z a_YAH=143 2526 2818 " H VAL A 213 "<>" OD1 ASP A 193 " d_HA=1.966 d_AD=2.943 a_DHA=159.748 symop: x,y,z a_YAH=139 2527 2496 " HE ARG A 191 "<>" OD2 ASP A 193 " d_HA=2.639 d_AD=3.605 a_DHA=158.871 symop: x,y,z a_YAH=164 2527 2499 "HH21 ARG A 191 "<>" OD2 ASP A 193 " d_HA=2.985 d_AD=3.868 a_DHA=146.518 symop: x,y,z a_YAH=131 ------------------------------------------------------------------------------- Total: 781 Symmetry: 0 Per residue: 1.2109 Mean SD Skew Kurtosis theta_1: 147.640 19.910 -1.009 3.188 theta_2: 138.982 20.299 -0.533 2.432 d_HA: 2.262 0.295 0.763 2.606 Outputted plot as X_SK_amber_skew_kurtosis_cbf.png =============================================================================== Job complete usr+sys time: 315.07 seconds wall clock time: 5 minutes 50.96 seconds (350.96 seconds total)