USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 965 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A1057 ASN : amide:sc= -0.173 X(o=-0.91,f=-0.66) USER MOD Set 1.2: A1206 HIS : no HD1:sc= -0.741 X(o=-0.91,f=-0.66) USER MOD Set 2.1: A1122 LYS NZ :NH3+ -153:sc= 1.15 (180deg=0) USER MOD Set 2.2: A1177 GLN : amide:sc= 0.952 K(o=2.1,f=-5.9!) USER MOD Set 3.1: A1094 LYS NZ :NH3+ -177:sc= 0.811 (180deg=0) USER MOD Set 3.2: A1098 GLN : amide:sc= 0.706 K(o=1.5,f=-4.1!) USER MOD Single : A1058 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A1060 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1063 THR OG1 : rot -49:sc= 1.24 USER MOD Single : A1065 SER OG : rot 180:sc= 0 USER MOD Single : A1066 ASN : amide:sc= 1.19 K(o=1.2,f=-0.014) USER MOD Single : A1069 SER OG : rot 180:sc= 0 USER MOD Single : A1070 HIS : no HD1:sc= -0.0265 X(o=-0.027,f=-0.055) USER MOD Single : A1071 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1072 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1079 THR OG1 : rot 82:sc= 0.0427 USER MOD Single : A1082 SER OG : rot -35:sc= 0.163 USER MOD Single : A1083 ASN : amide:sc=-0.00825 K(o=-0.0082,f=-0.87) USER MOD Single : A1084 SER OG : rot 180:sc= 0 USER MOD Single : A1086 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1090 THR OG1 : rot -47:sc= 0.965 USER MOD Single : A1093 THR OG1 : rot 180:sc= 0 USER MOD Single : A1095 TYR OH : rot 180:sc= 0 USER MOD Single : A1096 CYS SG : rot 81:sc= 0.338 USER MOD Single : A1097 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1102 THR OG1 : rot 180:sc= -0.0314 USER MOD Single : A1104 THR OG1 : rot 180:sc= 0 USER MOD Single : A1107 THR OG1 : rot 37:sc= 0.21 USER MOD Single : A1108 CYS SG : rot 180:sc= 0 USER MOD Single : A1112 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1117 CYS SG : rot 180:sc= 0 USER MOD Single : A1120 SER OG : rot 180:sc=-0.00478 USER MOD Single : A1121 CYS SG : rot 180:sc= -0.133 USER MOD Single : A1124 THR OG1 : rot 26:sc= 0.2 USER MOD Single : A1125 ASN : amide:sc= -0.156 K(o=-0.16,f=-1.6!) USER MOD Single : A1178 TYR OH : rot 180:sc= 0 USER MOD Single : A1179 LYS NZ :NH3+ 174:sc=-0.00743 (180deg=-0.0682) USER MOD Single : A1184 ASN : amide:sc= 0.317 K(o=0.32,f=-2.5!) USER MOD Single : A1188 MET CE :methyl 176:sc= -0.322 (180deg=-0.397) USER MOD Single : A1191 ASN : amide:sc= -0.064 X(o=-0.064,f=-0.027) USER MOD Single : A1196 ASN : amide:sc=-0.00716 X(o=-0.0072,f=-0.27) USER MOD Single : A1197 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1200 ASN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A1203 MET CE :methyl -173:sc=-0.00454 (180deg=-0.117) USER MOD Single : A1204 THR OG1 : rot 78:sc= 0.789 USER MOD Single : A1209 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1212 THR OG1 : rot 180:sc= 0 USER MOD Single : A1223 CYS SG : rot 180:sc= -0.262 USER MOD ----------------------------------------------------------------- ATOM 117 N VAL A1055 5.132 -0.751 12.971 1.00 1.43 N ATOM 118 CA VAL A1055 5.735 0.496 12.465 1.00 1.71 C ATOM 119 C VAL A1055 6.184 0.352 11.002 1.00 1.59 C ATOM 120 O VAL A1055 6.852 -0.618 10.638 1.00 1.90 O ATOM 121 CB VAL A1055 6.874 0.981 13.390 1.00 2.25 C ATOM 122 CG1 VAL A1055 8.021 -0.026 13.569 1.00 3.67 C ATOM 123 CG2 VAL A1055 7.461 2.314 12.910 1.00 3.10 C ATOM 0 HA VAL A1055 4.968 1.270 12.477 1.00 1.71 H new ATOM 0 HB VAL A1055 6.395 1.103 14.361 1.00 2.25 H new ATOM 0 HG11 VAL A1055 8.776 0.396 14.233 1.00 3.67 H new ATOM 0 HG12 VAL A1055 7.632 -0.948 14.002 1.00 3.67 H new ATOM 0 HG13 VAL A1055 8.470 -0.242 12.600 1.00 3.67 H new ATOM 0 HG21 VAL A1055 8.259 2.624 13.585 1.00 3.10 H new ATOM 0 HG22 VAL A1055 7.863 2.193 11.904 1.00 3.10 H new ATOM 0 HG23 VAL A1055 6.679 3.073 12.900 1.00 3.10 H new ATOM 133 N VAL A1056 5.822 1.309 10.139 1.00 1.30 N ATOM 134 CA VAL A1056 6.233 1.337 8.721 1.00 1.18 C ATOM 135 C VAL A1056 7.719 1.691 8.635 1.00 1.18 C ATOM 136 O VAL A1056 8.123 2.777 9.064 1.00 1.38 O ATOM 137 CB VAL A1056 5.375 2.326 7.903 1.00 1.17 C ATOM 138 CG1 VAL A1056 5.838 2.399 6.440 1.00 2.43 C ATOM 139 CG2 VAL A1056 3.898 1.905 7.897 1.00 1.98 C ATOM 0 H VAL A1056 5.229 2.096 10.404 1.00 1.30 H new ATOM 0 HA VAL A1056 6.074 0.349 8.288 1.00 1.18 H new ATOM 0 HB VAL A1056 5.492 3.298 8.381 1.00 1.17 H new ATOM 0 HG11 VAL A1056 5.211 3.105 5.895 1.00 2.43 H new ATOM 0 HG12 VAL A1056 6.875 2.731 6.403 1.00 2.43 H new ATOM 0 HG13 VAL A1056 5.756 1.413 5.983 1.00 2.43 H new ATOM 0 HG21 VAL A1056 3.318 2.620 7.313 1.00 1.98 H new ATOM 0 HG22 VAL A1056 3.804 0.914 7.454 1.00 1.98 H new ATOM 0 HG23 VAL A1056 3.522 1.882 8.920 1.00 1.98 H new ATOM 149 N ASN A1057 8.535 0.789 8.080 1.00 1.06 N ATOM 150 CA ASN A1057 9.998 0.879 8.124 1.00 1.10 C ATOM 151 C ASN A1057 10.642 1.329 6.795 1.00 1.03 C ATOM 152 O ASN A1057 11.651 2.040 6.831 1.00 1.12 O ATOM 153 CB ASN A1057 10.557 -0.404 8.769 1.00 1.15 C ATOM 154 CG ASN A1057 10.913 -1.490 7.784 1.00 1.19 C ATOM 155 OD1 ASN A1057 10.176 -2.430 7.553 1.00 2.45 O ATOM 156 ND2 ASN A1057 12.061 -1.383 7.167 1.00 1.71 N ATOM 0 H ASN A1057 8.194 -0.033 7.582 1.00 1.06 H new ATOM 0 HA ASN A1057 10.296 1.704 8.771 1.00 1.10 H new ATOM 0 HB2 ASN A1057 11.445 -0.149 9.347 1.00 1.15 H new ATOM 0 HB3 ASN A1057 9.821 -0.794 9.472 1.00 1.15 H new ATOM 0 HD21 ASN A1057 12.343 -2.090 6.488 1.00 1.71 H new ATOM 0 HD22 ASN A1057 12.675 -0.593 7.365 1.00 1.71 H new ATOM 163 N GLN A1058 10.081 0.962 5.636 1.00 0.95 N ATOM 164 CA GLN A1058 10.562 1.437 4.330 1.00 0.95 C ATOM 165 C GLN A1058 9.459 1.413 3.255 1.00 0.96 C ATOM 166 O GLN A1058 8.692 0.455 3.185 1.00 0.92 O ATOM 167 CB GLN A1058 11.771 0.574 3.904 1.00 0.92 C ATOM 168 CG GLN A1058 12.488 1.165 2.685 1.00 1.75 C ATOM 169 CD GLN A1058 13.732 0.405 2.232 1.00 2.38 C ATOM 170 OE1 GLN A1058 14.195 -0.574 2.815 1.00 2.98 O ATOM 171 NE2 GLN A1058 14.305 0.857 1.144 1.00 3.30 N ATOM 0 H GLN A1058 9.283 0.329 5.576 1.00 0.95 H new ATOM 0 HA GLN A1058 10.865 2.479 4.429 1.00 0.95 H new ATOM 0 HB2 GLN A1058 12.472 0.494 4.735 1.00 0.92 H new ATOM 0 HB3 GLN A1058 11.434 -0.436 3.673 1.00 0.92 H new ATOM 0 HG2 GLN A1058 11.784 1.206 1.854 1.00 1.75 H new ATOM 0 HG3 GLN A1058 12.772 2.192 2.913 1.00 1.75 H new ATOM 0 HE21 GLN A1058 13.918 1.669 0.663 1.00 3.30 H new ATOM 0 HE22 GLN A1058 15.138 0.397 0.777 1.00 3.30 H new ATOM 180 N VAL A1059 9.409 2.418 2.370 1.00 1.03 N ATOM 181 CA VAL A1059 8.527 2.451 1.186 1.00 1.01 C ATOM 182 C VAL A1059 9.312 2.730 -0.101 1.00 1.03 C ATOM 183 O VAL A1059 10.196 3.593 -0.132 1.00 1.18 O ATOM 184 CB VAL A1059 7.351 3.440 1.347 1.00 1.08 C ATOM 185 CG1 VAL A1059 6.425 3.008 2.487 1.00 1.07 C ATOM 186 CG2 VAL A1059 7.760 4.890 1.621 1.00 1.21 C ATOM 0 H VAL A1059 9.992 3.251 2.456 1.00 1.03 H new ATOM 0 HA VAL A1059 8.093 1.454 1.103 1.00 1.01 H new ATOM 0 HB VAL A1059 6.851 3.411 0.379 1.00 1.08 H new ATOM 0 HG11 VAL A1059 5.605 3.721 2.580 1.00 1.07 H new ATOM 0 HG12 VAL A1059 6.023 2.018 2.273 1.00 1.07 H new ATOM 0 HG13 VAL A1059 6.987 2.978 3.421 1.00 1.07 H new ATOM 0 HG21 VAL A1059 6.867 5.508 1.719 1.00 1.21 H new ATOM 0 HG22 VAL A1059 8.337 4.937 2.545 1.00 1.21 H new ATOM 0 HG23 VAL A1059 8.368 5.259 0.795 1.00 1.21 H new ATOM 196 N LYS A1060 9.010 1.990 -1.175 1.00 0.92 N ATOM 197 CA LYS A1060 9.763 2.025 -2.446 1.00 0.98 C ATOM 198 C LYS A1060 8.838 2.178 -3.656 1.00 0.92 C ATOM 199 O LYS A1060 7.798 1.520 -3.731 1.00 0.79 O ATOM 200 CB LYS A1060 10.612 0.750 -2.598 1.00 1.04 C ATOM 201 CG LYS A1060 11.606 0.509 -1.451 1.00 1.30 C ATOM 202 CD LYS A1060 12.553 -0.671 -1.715 1.00 1.22 C ATOM 203 CE LYS A1060 13.593 -0.318 -2.782 1.00 1.24 C ATOM 204 NZ LYS A1060 14.462 -1.469 -3.109 1.00 1.44 N ATOM 0 H LYS A1060 8.225 1.339 -1.191 1.00 0.92 H new ATOM 0 HA LYS A1060 10.415 2.898 -2.412 1.00 0.98 H new ATOM 0 HB2 LYS A1060 9.945 -0.109 -2.671 1.00 1.04 H new ATOM 0 HB3 LYS A1060 11.165 0.806 -3.536 1.00 1.04 H new ATOM 0 HG2 LYS A1060 12.195 1.412 -1.293 1.00 1.30 H new ATOM 0 HG3 LYS A1060 11.052 0.324 -0.531 1.00 1.30 H new ATOM 0 HD2 LYS A1060 13.057 -0.950 -0.790 1.00 1.22 H new ATOM 0 HD3 LYS A1060 11.977 -1.538 -2.038 1.00 1.22 H new ATOM 0 HE2 LYS A1060 13.086 0.021 -3.685 1.00 1.24 H new ATOM 0 HE3 LYS A1060 14.207 0.511 -2.430 1.00 1.24 H new ATOM 0 HZ1 LYS A1060 15.152 -1.188 -3.835 1.00 1.44 H new ATOM 0 HZ2 LYS A1060 14.966 -1.777 -2.253 1.00 1.44 H new ATOM 0 HZ3 LYS A1060 13.880 -2.252 -3.469 1.00 1.44 H new ATOM 218 N VAL A1061 9.215 3.032 -4.609 1.00 1.08 N ATOM 219 CA VAL A1061 8.391 3.344 -5.790 1.00 1.02 C ATOM 220 C VAL A1061 8.681 2.399 -6.965 1.00 0.90 C ATOM 221 O VAL A1061 9.838 2.081 -7.259 1.00 1.21 O ATOM 222 CB VAL A1061 8.576 4.818 -6.217 1.00 1.30 C ATOM 223 CG1 VAL A1061 7.432 5.263 -7.140 1.00 1.01 C ATOM 224 CG2 VAL A1061 8.622 5.802 -5.038 1.00 1.88 C ATOM 0 H VAL A1061 10.104 3.532 -4.588 1.00 1.08 H new ATOM 0 HA VAL A1061 7.351 3.192 -5.502 1.00 1.02 H new ATOM 0 HB VAL A1061 9.539 4.845 -6.728 1.00 1.30 H new ATOM 0 HG11 VAL A1061 7.581 6.303 -7.429 1.00 1.01 H new ATOM 0 HG12 VAL A1061 7.420 4.637 -8.032 1.00 1.01 H new ATOM 0 HG13 VAL A1061 6.482 5.165 -6.615 1.00 1.01 H new ATOM 0 HG21 VAL A1061 8.754 6.816 -5.415 1.00 1.88 H new ATOM 0 HG22 VAL A1061 7.689 5.742 -4.477 1.00 1.88 H new ATOM 0 HG23 VAL A1061 9.456 5.547 -4.384 1.00 1.88 H new ATOM 234 N LEU A1062 7.625 1.979 -7.669 1.00 0.76 N ATOM 235 CA LEU A1062 7.688 1.124 -8.866 1.00 0.80 C ATOM 236 C LEU A1062 7.342 1.909 -10.149 1.00 0.89 C ATOM 237 O LEU A1062 7.986 1.742 -11.182 1.00 1.67 O ATOM 238 CB LEU A1062 6.750 -0.087 -8.642 1.00 1.02 C ATOM 239 CG LEU A1062 7.118 -1.421 -9.321 1.00 1.14 C ATOM 240 CD1 LEU A1062 7.220 -1.338 -10.842 1.00 2.91 C ATOM 241 CD2 LEU A1062 8.408 -2.008 -8.756 1.00 1.93 C ATOM 0 H LEU A1062 6.670 2.231 -7.416 1.00 0.76 H new ATOM 0 HA LEU A1062 8.707 0.766 -9.014 1.00 0.80 H new ATOM 0 HB2 LEU A1062 6.685 -0.265 -7.569 1.00 1.02 H new ATOM 0 HB3 LEU A1062 5.753 0.196 -8.979 1.00 1.02 H new ATOM 0 HG LEU A1062 6.284 -2.084 -9.091 1.00 1.14 H new ATOM 0 HD11 LEU A1062 7.482 -2.317 -11.243 1.00 2.91 H new ATOM 0 HD12 LEU A1062 6.262 -1.022 -11.254 1.00 2.91 H new ATOM 0 HD13 LEU A1062 7.989 -0.616 -11.116 1.00 2.91 H new ATOM 0 HD21 LEU A1062 8.632 -2.948 -9.261 1.00 1.93 H new ATOM 0 HD22 LEU A1062 9.227 -1.306 -8.915 1.00 1.93 H new ATOM 0 HD23 LEU A1062 8.288 -2.190 -7.688 1.00 1.93 H new ATOM 253 N THR A1063 6.359 2.816 -10.085 1.00 0.64 N ATOM 254 CA THR A1063 5.839 3.573 -11.245 1.00 0.71 C ATOM 255 C THR A1063 6.709 4.794 -11.650 1.00 0.76 C ATOM 256 O THR A1063 6.189 5.797 -12.144 1.00 2.20 O ATOM 257 CB THR A1063 4.366 3.972 -11.018 1.00 0.79 C ATOM 258 OG1 THR A1063 3.841 4.686 -12.109 1.00 1.13 O ATOM 259 CG2 THR A1063 4.168 4.850 -9.783 1.00 0.69 C ATOM 0 H THR A1063 5.890 3.053 -9.211 1.00 0.64 H new ATOM 0 HA THR A1063 5.894 2.895 -12.097 1.00 0.71 H new ATOM 0 HB THR A1063 3.846 3.023 -10.885 1.00 0.79 H new ATOM 0 HG1 THR A1063 4.456 5.409 -12.353 1.00 1.13 H new ATOM 0 HG21 THR A1063 3.112 5.097 -9.678 1.00 0.69 H new ATOM 0 HG22 THR A1063 4.505 4.313 -8.897 1.00 0.69 H new ATOM 0 HG23 THR A1063 4.746 5.768 -9.893 1.00 0.69 H new ATOM 267 N GLU A1064 8.022 4.783 -11.415 1.00 1.46 N ATOM 268 CA GLU A1064 8.856 5.987 -11.590 1.00 1.74 C ATOM 269 C GLU A1064 8.926 6.450 -13.053 1.00 2.81 C ATOM 270 O GLU A1064 9.038 5.639 -13.971 1.00 4.26 O ATOM 271 CB GLU A1064 10.245 5.806 -10.968 1.00 2.70 C ATOM 272 CG GLU A1064 10.079 5.592 -9.463 1.00 3.81 C ATOM 273 CD GLU A1064 11.396 5.740 -8.707 1.00 5.08 C ATOM 274 OE1 GLU A1064 12.174 4.763 -8.624 1.00 5.70 O ATOM 275 OE2 GLU A1064 11.649 6.852 -8.181 1.00 5.99 O ATOM 0 H GLU A1064 8.536 3.959 -11.103 1.00 1.46 H new ATOM 0 HA GLU A1064 8.364 6.793 -11.045 1.00 1.74 H new ATOM 0 HB2 GLU A1064 10.753 4.953 -11.418 1.00 2.70 H new ATOM 0 HB3 GLU A1064 10.863 6.683 -11.160 1.00 2.70 H new ATOM 0 HG2 GLU A1064 9.357 6.310 -9.074 1.00 3.81 H new ATOM 0 HG3 GLU A1064 9.669 4.598 -9.283 1.00 3.81 H new ATOM 282 N SER A1065 8.787 7.760 -13.267 1.00 2.88 N ATOM 283 CA SER A1065 8.582 8.423 -14.577 1.00 3.88 C ATOM 284 C SER A1065 7.386 7.891 -15.408 1.00 3.56 C ATOM 285 O SER A1065 7.237 8.226 -16.588 1.00 4.38 O ATOM 286 CB SER A1065 9.877 8.434 -15.407 1.00 5.25 C ATOM 287 OG SER A1065 10.927 9.100 -14.725 1.00 5.85 O ATOM 0 H SER A1065 8.814 8.430 -12.498 1.00 2.88 H new ATOM 0 HA SER A1065 8.309 9.448 -14.326 1.00 3.88 H new ATOM 0 HB2 SER A1065 10.177 7.410 -15.628 1.00 5.25 H new ATOM 0 HB3 SER A1065 9.694 8.925 -16.363 1.00 5.25 H new ATOM 0 HG SER A1065 11.736 9.088 -15.278 1.00 5.85 H new ATOM 293 N ASN A1066 6.516 7.064 -14.821 1.00 2.85 N ATOM 294 CA ASN A1066 5.430 6.344 -15.496 1.00 2.94 C ATOM 295 C ASN A1066 4.036 6.867 -15.057 1.00 2.70 C ATOM 296 O ASN A1066 3.888 8.065 -14.805 1.00 3.22 O ATOM 297 CB ASN A1066 5.706 4.829 -15.337 1.00 3.43 C ATOM 298 CG ASN A1066 6.679 4.297 -16.375 1.00 4.61 C ATOM 299 OD1 ASN A1066 6.288 3.925 -17.470 1.00 5.07 O ATOM 300 ND2 ASN A1066 7.954 4.231 -16.089 1.00 5.83 N ATOM 0 H ASN A1066 6.550 6.869 -13.820 1.00 2.85 H new ATOM 0 HA ASN A1066 5.404 6.536 -16.569 1.00 2.94 H new ATOM 0 HB2 ASN A1066 6.105 4.639 -14.341 1.00 3.43 H new ATOM 0 HB3 ASN A1066 4.766 4.283 -15.413 1.00 3.43 H new ATOM 0 HD21 ASN A1066 8.613 3.871 -16.779 1.00 5.83 H new ATOM 0 HD22 ASN A1066 8.289 4.540 -15.176 1.00 5.83 H new ATOM 307 N ARG A1067 3.018 5.996 -14.962 1.00 2.23 N ATOM 308 CA ARG A1067 1.584 6.336 -14.840 1.00 2.03 C ATOM 309 C ARG A1067 1.190 7.265 -13.680 1.00 1.81 C ATOM 310 O ARG A1067 0.401 8.187 -13.911 1.00 2.07 O ATOM 311 CB ARG A1067 0.715 5.050 -14.881 1.00 1.77 C ATOM 312 CG ARG A1067 1.132 3.852 -13.999 1.00 3.22 C ATOM 313 CD ARG A1067 2.072 2.869 -14.723 1.00 4.81 C ATOM 314 NE ARG A1067 2.719 1.902 -13.814 1.00 6.45 N ATOM 315 CZ ARG A1067 3.766 1.142 -14.095 1.00 7.93 C ATOM 316 NH1 ARG A1067 4.425 1.192 -15.211 1.00 8.20 N ATOM 317 NH2 ARG A1067 4.198 0.282 -13.231 1.00 9.49 N ATOM 0 H ARG A1067 3.176 4.988 -14.968 1.00 2.23 H new ATOM 0 HA ARG A1067 1.376 6.951 -15.715 1.00 2.03 H new ATOM 0 HB2 ARG A1067 -0.302 5.328 -14.604 1.00 1.77 H new ATOM 0 HB3 ARG A1067 0.681 4.705 -15.914 1.00 1.77 H new ATOM 0 HG2 ARG A1067 1.626 4.224 -13.101 1.00 3.22 H new ATOM 0 HG3 ARG A1067 0.239 3.319 -13.674 1.00 3.22 H new ATOM 0 HD2 ARG A1067 1.505 2.324 -15.478 1.00 4.81 H new ATOM 0 HD3 ARG A1067 2.842 3.434 -15.249 1.00 4.81 H new ATOM 0 HE ARG A1067 2.321 1.811 -12.879 1.00 6.45 H new ATOM 0 HH11 ARG A1067 4.145 1.848 -15.940 1.00 8.20 H new ATOM 0 HH12 ARG A1067 5.224 0.575 -15.360 1.00 8.20 H new ATOM 0 HH21 ARG A1067 3.732 0.187 -12.329 1.00 9.49 H new ATOM 0 HH22 ARG A1067 5.005 -0.301 -13.452 1.00 9.49 H new ATOM 331 N ILE A1068 1.737 7.086 -12.478 1.00 1.43 N ATOM 332 CA ILE A1068 1.506 7.986 -11.323 1.00 1.23 C ATOM 333 C ILE A1068 2.817 8.311 -10.582 1.00 1.10 C ATOM 334 O ILE A1068 3.866 7.749 -10.902 1.00 1.21 O ATOM 335 CB ILE A1068 0.396 7.475 -10.350 1.00 0.98 C ATOM 336 CG1 ILE A1068 -0.489 6.293 -10.820 1.00 1.26 C ATOM 337 CG2 ILE A1068 -0.544 8.645 -10.005 1.00 1.67 C ATOM 338 CD1 ILE A1068 0.171 4.926 -10.602 1.00 1.18 C ATOM 0 H ILE A1068 2.361 6.308 -12.265 1.00 1.43 H new ATOM 0 HA ILE A1068 1.125 8.918 -11.741 1.00 1.23 H new ATOM 0 HB ILE A1068 0.963 7.085 -9.505 1.00 0.98 H new ATOM 0 HG12 ILE A1068 -1.438 6.322 -10.284 1.00 1.26 H new ATOM 0 HG13 ILE A1068 -0.717 6.416 -11.879 1.00 1.26 H new ATOM 0 HG21 ILE A1068 -1.323 8.298 -9.326 1.00 1.67 H new ATOM 0 HG22 ILE A1068 0.026 9.441 -9.527 1.00 1.67 H new ATOM 0 HG23 ILE A1068 -1.002 9.025 -10.918 1.00 1.67 H new ATOM 0 HD11 ILE A1068 -0.498 4.139 -10.951 1.00 1.18 H new ATOM 0 HD12 ILE A1068 1.107 4.881 -11.159 1.00 1.18 H new ATOM 0 HD13 ILE A1068 0.374 4.785 -9.540 1.00 1.18 H new ATOM 350 N SER A1069 2.764 9.216 -9.594 1.00 1.04 N ATOM 351 CA SER A1069 3.911 9.645 -8.774 1.00 1.08 C ATOM 352 C SER A1069 3.730 9.383 -7.272 1.00 0.85 C ATOM 353 O SER A1069 2.613 9.294 -6.755 1.00 0.71 O ATOM 354 CB SER A1069 4.262 11.116 -9.031 1.00 1.33 C ATOM 355 OG SER A1069 4.824 11.264 -10.322 1.00 1.91 O ATOM 0 H SER A1069 1.896 9.685 -9.334 1.00 1.04 H new ATOM 0 HA SER A1069 4.747 9.022 -9.093 1.00 1.08 H new ATOM 0 HB2 SER A1069 3.367 11.732 -8.943 1.00 1.33 H new ATOM 0 HB3 SER A1069 4.966 11.467 -8.277 1.00 1.33 H new ATOM 0 HG SER A1069 5.043 12.206 -10.477 1.00 1.91 H new ATOM 361 N HIS A1070 4.864 9.246 -6.578 1.00 0.98 N ATOM 362 CA HIS A1070 4.975 8.768 -5.194 1.00 1.05 C ATOM 363 C HIS A1070 4.125 9.500 -4.138 1.00 0.93 C ATOM 364 O HIS A1070 3.576 8.835 -3.255 1.00 0.94 O ATOM 365 CB HIS A1070 6.462 8.786 -4.802 1.00 1.34 C ATOM 366 CG HIS A1070 7.073 10.163 -4.694 1.00 1.91 C ATOM 367 ND1 HIS A1070 7.128 10.948 -3.563 1.00 2.94 N ATOM 368 CD2 HIS A1070 7.688 10.865 -5.695 1.00 2.60 C ATOM 369 CE1 HIS A1070 7.754 12.093 -3.869 1.00 3.64 C ATOM 370 NE2 HIS A1070 8.095 12.097 -5.168 1.00 3.53 N ATOM 0 H HIS A1070 5.772 9.475 -6.983 1.00 0.98 H new ATOM 0 HA HIS A1070 4.555 7.762 -5.191 1.00 1.05 H new ATOM 0 HB2 HIS A1070 6.577 8.277 -3.845 1.00 1.34 H new ATOM 0 HB3 HIS A1070 7.024 8.211 -5.538 1.00 1.34 H new ATOM 0 HD2 HIS A1070 7.834 10.529 -6.711 1.00 2.60 H new ATOM 0 HE1 HIS A1070 7.955 12.894 -3.173 1.00 3.64 H new ATOM 0 HE2 HIS A1070 8.560 12.851 -5.673 1.00 3.53 H new ATOM 378 N HIS A1071 3.992 10.831 -4.194 1.00 0.92 N ATOM 379 CA HIS A1071 3.303 11.591 -3.142 1.00 0.93 C ATOM 380 C HIS A1071 1.776 11.493 -3.262 1.00 0.85 C ATOM 381 O HIS A1071 1.093 11.278 -2.260 1.00 0.92 O ATOM 382 CB HIS A1071 3.792 13.046 -3.134 1.00 1.01 C ATOM 383 CG HIS A1071 3.495 13.757 -1.839 1.00 1.81 C ATOM 384 ND1 HIS A1071 2.409 14.561 -1.561 1.00 3.35 N ATOM 385 CD2 HIS A1071 4.279 13.735 -0.717 1.00 2.41 C ATOM 386 CE1 HIS A1071 2.542 15.016 -0.305 1.00 3.94 C ATOM 387 NE2 HIS A1071 3.684 14.562 0.247 1.00 3.33 N ATOM 0 H HIS A1071 4.352 11.405 -4.957 1.00 0.92 H new ATOM 0 HA HIS A1071 3.556 11.144 -2.181 1.00 0.93 H new ATOM 0 HB2 HIS A1071 4.867 13.064 -3.314 1.00 1.01 H new ATOM 0 HB3 HIS A1071 3.322 13.587 -3.956 1.00 1.01 H new ATOM 0 HD2 HIS A1071 5.196 13.178 -0.595 1.00 2.41 H new ATOM 0 HE1 HIS A1071 1.831 15.658 0.194 1.00 3.94 H new ATOM 0 HE2 HIS A1071 4.043 14.776 1.177 1.00 3.33 H new ATOM 395 N LYS A1072 1.230 11.541 -4.488 1.00 0.77 N ATOM 396 CA LYS A1072 -0.198 11.281 -4.746 1.00 0.77 C ATOM 397 C LYS A1072 -0.587 9.861 -4.324 1.00 0.74 C ATOM 398 O LYS A1072 -1.632 9.690 -3.703 1.00 0.77 O ATOM 399 CB LYS A1072 -0.530 11.568 -6.224 1.00 0.82 C ATOM 400 CG LYS A1072 -2.037 11.409 -6.512 1.00 1.89 C ATOM 401 CD LYS A1072 -2.430 11.737 -7.960 1.00 2.79 C ATOM 402 CE LYS A1072 -2.296 13.232 -8.270 1.00 2.83 C ATOM 403 NZ LYS A1072 -2.699 13.530 -9.663 1.00 4.11 N ATOM 0 H LYS A1072 1.765 11.761 -5.328 1.00 0.77 H new ATOM 0 HA LYS A1072 -0.797 11.958 -4.137 1.00 0.77 H new ATOM 0 HB2 LYS A1072 -0.216 12.581 -6.477 1.00 0.82 H new ATOM 0 HB3 LYS A1072 0.036 10.890 -6.862 1.00 0.82 H new ATOM 0 HG2 LYS A1072 -2.334 10.384 -6.288 1.00 1.89 H new ATOM 0 HG3 LYS A1072 -2.597 12.058 -5.838 1.00 1.89 H new ATOM 0 HD2 LYS A1072 -1.800 11.168 -8.644 1.00 2.79 H new ATOM 0 HD3 LYS A1072 -3.458 11.422 -8.136 1.00 2.79 H new ATOM 0 HE2 LYS A1072 -2.914 13.806 -7.580 1.00 2.83 H new ATOM 0 HE3 LYS A1072 -1.265 13.547 -8.112 1.00 2.83 H new ATOM 0 HZ1 LYS A1072 -2.598 14.549 -9.843 1.00 4.11 H new ATOM 0 HZ2 LYS A1072 -2.092 13.000 -10.321 1.00 4.11 H new ATOM 0 HZ3 LYS A1072 -3.691 13.250 -9.805 1.00 4.11 H new ATOM 417 N ILE A1073 0.268 8.867 -4.593 1.00 0.73 N ATOM 418 CA ILE A1073 0.077 7.479 -4.131 1.00 0.75 C ATOM 419 C ILE A1073 0.048 7.407 -2.600 1.00 0.82 C ATOM 420 O ILE A1073 -0.871 6.812 -2.037 1.00 0.87 O ATOM 421 CB ILE A1073 1.160 6.549 -4.727 1.00 0.75 C ATOM 422 CG1 ILE A1073 0.940 6.407 -6.249 1.00 0.72 C ATOM 423 CG2 ILE A1073 1.141 5.151 -4.072 1.00 0.81 C ATOM 424 CD1 ILE A1073 2.157 5.834 -6.976 1.00 0.76 C ATOM 0 H ILE A1073 1.118 9.000 -5.140 1.00 0.73 H new ATOM 0 HA ILE A1073 -0.891 7.129 -4.490 1.00 0.75 H new ATOM 0 HB ILE A1073 2.132 7.000 -4.527 1.00 0.75 H new ATOM 0 HG12 ILE A1073 0.080 5.762 -6.428 1.00 0.72 H new ATOM 0 HG13 ILE A1073 0.699 7.384 -6.669 1.00 0.72 H new ATOM 0 HG21 ILE A1073 1.917 4.529 -4.519 1.00 0.81 H new ATOM 0 HG22 ILE A1073 1.325 5.248 -3.002 1.00 0.81 H new ATOM 0 HG23 ILE A1073 0.167 4.688 -4.232 1.00 0.81 H new ATOM 0 HD11 ILE A1073 1.942 5.758 -8.042 1.00 0.76 H new ATOM 0 HD12 ILE A1073 3.014 6.491 -6.825 1.00 0.76 H new ATOM 0 HD13 ILE A1073 2.384 4.844 -6.580 1.00 0.76 H new ATOM 436 N LEU A1074 1.011 8.040 -1.922 1.00 0.84 N ATOM 437 CA LEU A1074 1.091 8.056 -0.459 1.00 0.90 C ATOM 438 C LEU A1074 -0.139 8.726 0.176 1.00 0.87 C ATOM 439 O LEU A1074 -0.651 8.227 1.179 1.00 0.90 O ATOM 440 CB LEU A1074 2.428 8.702 -0.054 1.00 0.96 C ATOM 441 CG LEU A1074 2.658 8.764 1.470 1.00 1.25 C ATOM 442 CD1 LEU A1074 4.141 8.581 1.790 1.00 1.88 C ATOM 443 CD2 LEU A1074 2.221 10.109 2.057 1.00 2.48 C ATOM 0 H LEU A1074 1.762 8.559 -2.377 1.00 0.84 H new ATOM 0 HA LEU A1074 1.074 7.038 -0.070 1.00 0.90 H new ATOM 0 HB2 LEU A1074 3.244 8.142 -0.512 1.00 0.96 H new ATOM 0 HB3 LEU A1074 2.469 9.713 -0.459 1.00 0.96 H new ATOM 0 HG LEU A1074 2.062 7.965 1.910 1.00 1.25 H new ATOM 0 HD11 LEU A1074 4.289 8.627 2.869 1.00 1.88 H new ATOM 0 HD12 LEU A1074 4.477 7.613 1.419 1.00 1.88 H new ATOM 0 HD13 LEU A1074 4.717 9.373 1.311 1.00 1.88 H new ATOM 0 HD21 LEU A1074 2.399 10.112 3.132 1.00 2.48 H new ATOM 0 HD22 LEU A1074 2.793 10.912 1.592 1.00 2.48 H new ATOM 0 HD23 LEU A1074 1.159 10.262 1.865 1.00 2.48 H new ATOM 455 N ALA A1075 -0.659 9.797 -0.429 1.00 0.85 N ATOM 456 CA ALA A1075 -1.907 10.427 -0.008 1.00 0.86 C ATOM 457 C ALA A1075 -3.114 9.484 -0.165 1.00 0.90 C ATOM 458 O ALA A1075 -3.807 9.227 0.815 1.00 0.99 O ATOM 459 CB ALA A1075 -2.083 11.746 -0.774 1.00 0.85 C ATOM 0 H ALA A1075 -0.221 10.252 -1.230 1.00 0.85 H new ATOM 0 HA ALA A1075 -1.855 10.649 1.058 1.00 0.86 H new ATOM 0 HB1 ALA A1075 -3.013 12.224 -0.466 1.00 0.85 H new ATOM 0 HB2 ALA A1075 -1.245 12.408 -0.556 1.00 0.85 H new ATOM 0 HB3 ALA A1075 -2.116 11.543 -1.844 1.00 0.85 H new ATOM 465 N ILE A1076 -3.364 8.919 -1.352 1.00 0.87 N ATOM 466 CA ILE A1076 -4.578 8.106 -1.568 1.00 0.95 C ATOM 467 C ILE A1076 -4.551 6.765 -0.826 1.00 1.00 C ATOM 468 O ILE A1076 -5.571 6.372 -0.265 1.00 1.04 O ATOM 469 CB ILE A1076 -4.937 7.963 -3.061 1.00 0.99 C ATOM 470 CG1 ILE A1076 -3.879 7.174 -3.867 1.00 0.98 C ATOM 471 CG2 ILE A1076 -5.251 9.369 -3.604 1.00 1.00 C ATOM 472 CD1 ILE A1076 -4.057 7.179 -5.392 1.00 1.04 C ATOM 0 H ILE A1076 -2.757 9.004 -2.168 1.00 0.87 H new ATOM 0 HA ILE A1076 -5.394 8.667 -1.114 1.00 0.95 H new ATOM 0 HB ILE A1076 -5.827 7.344 -3.179 1.00 0.99 H new ATOM 0 HG12 ILE A1076 -2.895 7.581 -3.634 1.00 0.98 H new ATOM 0 HG13 ILE A1076 -3.886 6.140 -3.523 1.00 0.98 H new ATOM 0 HG21 ILE A1076 -5.509 9.302 -4.661 1.00 1.00 H new ATOM 0 HG22 ILE A1076 -6.089 9.793 -3.052 1.00 1.00 H new ATOM 0 HG23 ILE A1076 -4.377 10.009 -3.484 1.00 1.00 H new ATOM 0 HD11 ILE A1076 -3.260 6.596 -5.853 1.00 1.04 H new ATOM 0 HD12 ILE A1076 -5.022 6.740 -5.647 1.00 1.04 H new ATOM 0 HD13 ILE A1076 -4.016 8.204 -5.760 1.00 1.04 H new ATOM 484 N VAL A1077 -3.394 6.099 -0.739 1.00 1.02 N ATOM 485 CA VAL A1077 -3.229 4.899 0.099 1.00 1.09 C ATOM 486 C VAL A1077 -3.362 5.262 1.577 1.00 0.99 C ATOM 487 O VAL A1077 -4.150 4.654 2.297 1.00 1.05 O ATOM 488 CB VAL A1077 -1.883 4.197 -0.174 1.00 1.20 C ATOM 489 CG1 VAL A1077 -1.633 3.022 0.784 1.00 1.37 C ATOM 490 CG2 VAL A1077 -1.834 3.643 -1.602 1.00 1.31 C ATOM 0 H VAL A1077 -2.550 6.371 -1.242 1.00 1.02 H new ATOM 0 HA VAL A1077 -4.021 4.197 -0.161 1.00 1.09 H new ATOM 0 HB VAL A1077 -1.116 4.957 -0.025 1.00 1.20 H new ATOM 0 HG11 VAL A1077 -0.673 2.561 0.551 1.00 1.37 H new ATOM 0 HG12 VAL A1077 -1.621 3.386 1.811 1.00 1.37 H new ATOM 0 HG13 VAL A1077 -2.427 2.284 0.670 1.00 1.37 H new ATOM 0 HG21 VAL A1077 -0.875 3.153 -1.769 1.00 1.31 H new ATOM 0 HG22 VAL A1077 -2.639 2.921 -1.740 1.00 1.31 H new ATOM 0 HG23 VAL A1077 -1.953 4.460 -2.314 1.00 1.31 H new ATOM 500 N GLY A1078 -2.626 6.277 2.039 1.00 0.87 N ATOM 501 CA GLY A1078 -2.581 6.622 3.456 1.00 0.77 C ATOM 502 C GLY A1078 -3.905 7.149 4.004 1.00 0.65 C ATOM 503 O GLY A1078 -4.266 6.863 5.141 1.00 0.73 O ATOM 0 H GLY A1078 -2.051 6.875 1.445 1.00 0.87 H new ATOM 0 HA2 GLY A1078 -2.288 5.740 4.026 1.00 0.77 H new ATOM 0 HA3 GLY A1078 -1.808 7.375 3.613 1.00 0.77 H new ATOM 507 N THR A1079 -4.655 7.903 3.204 1.00 0.64 N ATOM 508 CA THR A1079 -5.995 8.407 3.552 1.00 0.71 C ATOM 509 C THR A1079 -7.119 7.366 3.400 1.00 0.77 C ATOM 510 O THR A1079 -8.132 7.470 4.098 1.00 0.87 O ATOM 511 CB THR A1079 -6.272 9.777 2.902 1.00 0.86 C ATOM 512 OG1 THR A1079 -5.204 10.656 3.217 1.00 1.37 O ATOM 513 CG2 THR A1079 -7.476 10.458 3.502 1.00 1.23 C ATOM 0 H THR A1079 -4.348 8.191 2.275 1.00 0.64 H new ATOM 0 HA THR A1079 -5.995 8.591 4.626 1.00 0.71 H new ATOM 0 HB THR A1079 -6.409 9.590 1.837 1.00 0.86 H new ATOM 0 HG1 THR A1079 -4.459 10.500 2.600 1.00 1.37 H new ATOM 0 HG21 THR A1079 -7.632 11.419 3.013 1.00 1.23 H new ATOM 0 HG22 THR A1079 -8.357 9.832 3.360 1.00 1.23 H new ATOM 0 HG23 THR A1079 -7.311 10.616 4.568 1.00 1.23 H new ATOM 521 N ALA A1080 -6.953 6.315 2.588 1.00 0.77 N ATOM 522 CA ALA A1080 -7.891 5.183 2.565 1.00 0.85 C ATOM 523 C ALA A1080 -7.913 4.371 3.884 1.00 0.90 C ATOM 524 O ALA A1080 -8.930 3.779 4.239 1.00 1.08 O ATOM 525 CB ALA A1080 -7.569 4.289 1.361 1.00 0.92 C ATOM 0 H ALA A1080 -6.175 6.224 1.935 1.00 0.77 H new ATOM 0 HA ALA A1080 -8.897 5.590 2.466 1.00 0.85 H new ATOM 0 HB1 ALA A1080 -8.261 3.447 1.338 1.00 0.92 H new ATOM 0 HB2 ALA A1080 -7.669 4.866 0.442 1.00 0.92 H new ATOM 0 HB3 ALA A1080 -6.548 3.917 1.447 1.00 0.92 H new ATOM 531 N GLU A1081 -6.838 4.400 4.678 1.00 0.90 N ATOM 532 CA GLU A1081 -6.755 3.696 5.969 1.00 1.01 C ATOM 533 C GLU A1081 -7.339 4.539 7.135 1.00 1.12 C ATOM 534 O GLU A1081 -7.158 4.197 8.301 1.00 1.23 O ATOM 535 CB GLU A1081 -5.296 3.253 6.198 1.00 1.15 C ATOM 536 CG GLU A1081 -4.789 2.172 5.214 1.00 1.49 C ATOM 537 CD GLU A1081 -5.122 0.712 5.583 1.00 1.73 C ATOM 538 OE1 GLU A1081 -5.978 0.454 6.459 1.00 2.51 O ATOM 539 OE2 GLU A1081 -4.479 -0.211 5.025 1.00 2.60 O ATOM 0 H GLU A1081 -5.991 4.917 4.443 1.00 0.90 H new ATOM 0 HA GLU A1081 -7.380 2.804 5.941 1.00 1.01 H new ATOM 0 HB2 GLU A1081 -4.649 4.127 6.122 1.00 1.15 H new ATOM 0 HB3 GLU A1081 -5.201 2.873 7.215 1.00 1.15 H new ATOM 0 HG2 GLU A1081 -5.206 2.381 4.229 1.00 1.49 H new ATOM 0 HG3 GLU A1081 -3.706 2.266 5.128 1.00 1.49 H new ATOM 546 N SER A1082 -7.992 5.676 6.839 1.00 1.24 N ATOM 547 CA SER A1082 -8.502 6.679 7.800 1.00 1.28 C ATOM 548 C SER A1082 -9.993 6.559 8.209 1.00 1.49 C ATOM 549 O SER A1082 -10.457 7.362 9.022 1.00 1.73 O ATOM 550 CB SER A1082 -8.150 8.075 7.248 1.00 1.17 C ATOM 551 OG SER A1082 -8.242 9.132 8.191 1.00 1.78 O ATOM 0 H SER A1082 -8.191 5.937 5.873 1.00 1.24 H new ATOM 0 HA SER A1082 -8.005 6.487 8.751 1.00 1.28 H new ATOM 0 HB2 SER A1082 -7.135 8.048 6.853 1.00 1.17 H new ATOM 0 HB3 SER A1082 -8.812 8.296 6.411 1.00 1.17 H new ATOM 0 HG SER A1082 -8.986 8.958 8.805 1.00 1.78 H new ATOM 557 N ASN A1083 -10.776 5.609 7.665 1.00 1.59 N ATOM 558 CA ASN A1083 -12.225 5.487 7.928 1.00 1.99 C ATOM 559 C ASN A1083 -12.575 4.425 8.997 1.00 2.17 C ATOM 560 O ASN A1083 -12.634 4.765 10.181 1.00 2.82 O ATOM 561 CB ASN A1083 -13.014 5.344 6.609 1.00 2.56 C ATOM 562 CG ASN A1083 -14.517 5.477 6.817 1.00 3.55 C ATOM 563 OD1 ASN A1083 -14.983 6.169 7.716 1.00 4.09 O ATOM 564 ND2 ASN A1083 -15.326 4.856 5.992 1.00 4.37 N ATOM 0 H ASN A1083 -10.420 4.899 7.026 1.00 1.59 H new ATOM 0 HA ASN A1083 -12.551 6.421 8.386 1.00 1.99 H new ATOM 0 HB2 ASN A1083 -12.678 6.104 5.903 1.00 2.56 H new ATOM 0 HB3 ASN A1083 -12.796 4.375 6.161 1.00 2.56 H new ATOM 0 HD21 ASN A1083 -16.336 4.950 6.100 1.00 4.37 H new ATOM 0 HD22 ASN A1083 -14.945 4.279 5.242 1.00 4.37 H new ATOM 571 N SER A1084 -12.783 3.159 8.616 1.00 2.16 N ATOM 572 CA SER A1084 -13.022 2.039 9.547 1.00 2.48 C ATOM 573 C SER A1084 -12.380 0.745 9.058 1.00 2.47 C ATOM 574 O SER A1084 -12.798 0.170 8.048 1.00 3.60 O ATOM 575 CB SER A1084 -14.508 1.750 9.726 1.00 3.41 C ATOM 576 OG SER A1084 -15.180 2.856 10.295 1.00 3.95 O ATOM 0 H SER A1084 -12.791 2.875 7.636 1.00 2.16 H new ATOM 0 HA SER A1084 -12.578 2.355 10.491 1.00 2.48 H new ATOM 0 HB2 SER A1084 -14.953 1.508 8.761 1.00 3.41 H new ATOM 0 HB3 SER A1084 -14.637 0.876 10.364 1.00 3.41 H new ATOM 0 HG SER A1084 -16.131 2.644 10.397 1.00 3.95 H new ATOM 582 N GLU A1085 -11.376 0.276 9.792 1.00 1.98 N ATOM 583 CA GLU A1085 -10.497 -0.817 9.377 1.00 2.11 C ATOM 584 C GLU A1085 -9.743 -1.467 10.561 1.00 2.05 C ATOM 585 O GLU A1085 -9.773 -0.973 11.695 1.00 2.71 O ATOM 586 CB GLU A1085 -9.545 -0.278 8.285 1.00 2.54 C ATOM 587 CG GLU A1085 -8.444 0.708 8.712 1.00 2.94 C ATOM 588 CD GLU A1085 -8.917 1.919 9.519 1.00 4.34 C ATOM 589 OE1 GLU A1085 -9.699 2.755 9.011 1.00 4.84 O ATOM 590 OE2 GLU A1085 -8.506 2.036 10.699 1.00 5.53 O ATOM 0 H GLU A1085 -11.144 0.652 10.712 1.00 1.98 H new ATOM 0 HA GLU A1085 -11.099 -1.627 8.966 1.00 2.11 H new ATOM 0 HB2 GLU A1085 -9.063 -1.133 7.810 1.00 2.54 H new ATOM 0 HB3 GLU A1085 -10.153 0.209 7.522 1.00 2.54 H new ATOM 0 HG2 GLU A1085 -7.705 0.166 9.303 1.00 2.94 H new ATOM 0 HG3 GLU A1085 -7.935 1.067 7.817 1.00 2.94 H new ATOM 597 N HIS A1086 -9.065 -2.586 10.300 1.00 2.43 N ATOM 598 CA HIS A1086 -8.201 -3.295 11.267 1.00 2.53 C ATOM 599 C HIS A1086 -6.951 -2.468 11.677 1.00 2.23 C ATOM 600 O HIS A1086 -6.536 -1.585 10.914 1.00 2.30 O ATOM 601 CB HIS A1086 -7.809 -4.681 10.723 1.00 3.32 C ATOM 602 CG HIS A1086 -8.975 -5.616 10.500 1.00 4.01 C ATOM 603 ND1 HIS A1086 -9.981 -5.899 11.397 1.00 5.47 N ATOM 604 CD2 HIS A1086 -9.215 -6.364 9.379 1.00 4.00 C ATOM 605 CE1 HIS A1086 -10.832 -6.762 10.822 1.00 5.93 C ATOM 606 NE2 HIS A1086 -10.405 -7.080 9.585 1.00 4.94 N ATOM 0 H HIS A1086 -9.097 -3.042 9.388 1.00 2.43 H new ATOM 0 HA HIS A1086 -8.783 -3.432 12.179 1.00 2.53 H new ATOM 0 HB2 HIS A1086 -7.278 -4.551 9.780 1.00 3.32 H new ATOM 0 HB3 HIS A1086 -7.113 -5.148 11.420 1.00 3.32 H new ATOM 0 HD2 HIS A1086 -8.598 -6.397 8.493 1.00 4.00 H new ATOM 0 HE1 HIS A1086 -11.729 -7.146 11.284 1.00 5.93 H new ATOM 0 HE2 HIS A1086 -10.857 -7.716 8.928 1.00 4.94 H new ATOM 614 N PRO A1087 -6.323 -2.728 12.851 1.00 2.19 N ATOM 615 CA PRO A1087 -5.304 -1.855 13.464 1.00 2.17 C ATOM 616 C PRO A1087 -4.063 -1.467 12.649 1.00 2.09 C ATOM 617 O PRO A1087 -3.460 -0.441 12.975 1.00 2.18 O ATOM 618 CB PRO A1087 -4.871 -2.546 14.757 1.00 2.32 C ATOM 619 CG PRO A1087 -6.105 -3.337 15.160 1.00 2.60 C ATOM 620 CD PRO A1087 -6.710 -3.754 13.820 1.00 2.42 C ATOM 0 HA PRO A1087 -5.794 -0.889 13.587 1.00 2.17 H new ATOM 0 HB2 PRO A1087 -4.011 -3.196 14.597 1.00 2.32 H new ATOM 0 HB3 PRO A1087 -4.587 -1.825 15.523 1.00 2.32 H new ATOM 0 HG2 PRO A1087 -5.846 -4.202 15.771 1.00 2.60 H new ATOM 0 HG3 PRO A1087 -6.798 -2.731 15.743 1.00 2.60 H new ATOM 0 HD2 PRO A1087 -6.341 -4.733 13.516 1.00 2.42 H new ATOM 0 HD3 PRO A1087 -7.795 -3.830 13.891 1.00 2.42 H new ATOM 628 N LEU A1088 -3.668 -2.205 11.604 1.00 2.01 N ATOM 629 CA LEU A1088 -2.547 -1.796 10.736 1.00 1.93 C ATOM 630 C LEU A1088 -2.798 -0.445 10.038 1.00 1.68 C ATOM 631 O LEU A1088 -1.849 0.296 9.779 1.00 1.66 O ATOM 632 CB LEU A1088 -2.237 -2.902 9.699 1.00 2.04 C ATOM 633 CG LEU A1088 -0.971 -3.738 9.970 1.00 1.97 C ATOM 634 CD1 LEU A1088 0.302 -2.890 9.902 1.00 2.13 C ATOM 635 CD2 LEU A1088 -1.006 -4.461 11.317 1.00 2.58 C ATOM 0 H LEU A1088 -4.104 -3.087 11.336 1.00 2.01 H new ATOM 0 HA LEU A1088 -1.678 -1.657 11.379 1.00 1.93 H new ATOM 0 HB2 LEU A1088 -3.092 -3.577 9.649 1.00 2.04 H new ATOM 0 HB3 LEU A1088 -2.140 -2.437 8.718 1.00 2.04 H new ATOM 0 HG LEU A1088 -0.955 -4.486 9.177 1.00 1.97 H new ATOM 0 HD11 LEU A1088 1.170 -3.520 10.099 1.00 2.13 H new ATOM 0 HD12 LEU A1088 0.392 -2.448 8.910 1.00 2.13 H new ATOM 0 HD13 LEU A1088 0.252 -2.098 10.649 1.00 2.13 H new ATOM 0 HD21 LEU A1088 -0.087 -5.032 11.448 1.00 2.58 H new ATOM 0 HD22 LEU A1088 -1.096 -3.730 12.120 1.00 2.58 H new ATOM 0 HD23 LEU A1088 -1.860 -5.138 11.345 1.00 2.58 H new ATOM 647 N GLY A1089 -4.068 -0.087 9.818 1.00 1.52 N ATOM 648 CA GLY A1089 -4.455 1.200 9.236 1.00 1.29 C ATOM 649 C GLY A1089 -3.891 2.392 10.013 1.00 1.20 C ATOM 650 O GLY A1089 -3.227 3.241 9.421 1.00 1.12 O ATOM 0 H GLY A1089 -4.861 -0.688 10.041 1.00 1.52 H new ATOM 0 HA2 GLY A1089 -4.107 1.247 8.204 1.00 1.29 H new ATOM 0 HA3 GLY A1089 -5.542 1.270 9.210 1.00 1.29 H new ATOM 654 N THR A1090 -4.034 2.406 11.347 1.00 1.32 N ATOM 655 CA THR A1090 -3.478 3.482 12.199 1.00 1.39 C ATOM 656 C THR A1090 -1.972 3.696 12.050 1.00 1.41 C ATOM 657 O THR A1090 -1.518 4.822 12.238 1.00 1.44 O ATOM 658 CB THR A1090 -3.735 3.270 13.700 1.00 1.60 C ATOM 659 OG1 THR A1090 -3.223 2.036 14.151 1.00 2.34 O ATOM 660 CG2 THR A1090 -5.210 3.326 14.079 1.00 2.32 C ATOM 0 H THR A1090 -4.532 1.683 11.866 1.00 1.32 H new ATOM 0 HA THR A1090 -4.013 4.358 11.832 1.00 1.39 H new ATOM 0 HB THR A1090 -3.217 4.099 14.182 1.00 1.60 H new ATOM 0 HG1 THR A1090 -3.485 1.326 13.529 1.00 2.34 H new ATOM 0 HG21 THR A1090 -5.316 3.168 15.152 1.00 2.32 H new ATOM 0 HG22 THR A1090 -5.617 4.302 13.814 1.00 2.32 H new ATOM 0 HG23 THR A1090 -5.753 2.548 13.543 1.00 2.32 H new ATOM 668 N ALA A1091 -1.201 2.659 11.701 1.00 1.48 N ATOM 669 CA ALA A1091 0.247 2.759 11.503 1.00 1.53 C ATOM 670 C ALA A1091 0.603 3.403 10.151 1.00 1.36 C ATOM 671 O ALA A1091 1.562 4.178 10.067 1.00 1.40 O ATOM 672 CB ALA A1091 0.865 1.364 11.671 1.00 1.69 C ATOM 0 H ALA A1091 -1.569 1.720 11.547 1.00 1.48 H new ATOM 0 HA ALA A1091 0.669 3.424 12.257 1.00 1.53 H new ATOM 0 HB1 ALA A1091 1.944 1.424 11.526 1.00 1.69 H new ATOM 0 HB2 ALA A1091 0.654 0.991 12.673 1.00 1.69 H new ATOM 0 HB3 ALA A1091 0.437 0.685 10.933 1.00 1.69 H new ATOM 678 N ILE A1092 -0.200 3.135 9.114 1.00 1.22 N ATOM 679 CA ILE A1092 -0.115 3.796 7.805 1.00 1.07 C ATOM 680 C ILE A1092 -0.563 5.254 7.925 1.00 0.99 C ATOM 681 O ILE A1092 0.195 6.138 7.521 1.00 0.95 O ATOM 682 CB ILE A1092 -0.938 3.017 6.750 1.00 1.07 C ATOM 683 CG1 ILE A1092 -0.245 1.671 6.441 1.00 1.24 C ATOM 684 CG2 ILE A1092 -1.136 3.853 5.468 1.00 1.04 C ATOM 685 CD1 ILE A1092 -1.111 0.721 5.607 1.00 1.30 C ATOM 0 H ILE A1092 -0.943 2.438 9.162 1.00 1.22 H new ATOM 0 HA ILE A1092 0.921 3.796 7.467 1.00 1.07 H new ATOM 0 HB ILE A1092 -1.929 2.815 7.156 1.00 1.07 H new ATOM 0 HG12 ILE A1092 0.687 1.864 5.909 1.00 1.24 H new ATOM 0 HG13 ILE A1092 0.019 1.182 7.379 1.00 1.24 H new ATOM 0 HG21 ILE A1092 -1.717 3.280 4.746 1.00 1.04 H new ATOM 0 HG22 ILE A1092 -1.667 4.773 5.712 1.00 1.04 H new ATOM 0 HG23 ILE A1092 -0.164 4.097 5.039 1.00 1.04 H new ATOM 0 HD11 ILE A1092 -0.565 -0.205 5.426 1.00 1.30 H new ATOM 0 HD12 ILE A1092 -2.032 0.500 6.147 1.00 1.30 H new ATOM 0 HD13 ILE A1092 -1.353 1.192 4.654 1.00 1.30 H new ATOM 697 N THR A1093 -1.747 5.540 8.487 1.00 1.02 N ATOM 698 CA THR A1093 -2.256 6.922 8.592 1.00 1.05 C ATOM 699 C THR A1093 -1.290 7.803 9.385 1.00 1.10 C ATOM 700 O THR A1093 -0.919 8.869 8.897 1.00 1.09 O ATOM 701 CB THR A1093 -3.663 7.014 9.207 1.00 1.15 C ATOM 702 OG1 THR A1093 -3.675 6.567 10.540 1.00 2.93 O ATOM 703 CG2 THR A1093 -4.732 6.228 8.467 1.00 2.22 C ATOM 0 H THR A1093 -2.372 4.835 8.877 1.00 1.02 H new ATOM 0 HA THR A1093 -2.331 7.285 7.567 1.00 1.05 H new ATOM 0 HB THR A1093 -3.903 8.075 9.134 1.00 1.15 H new ATOM 0 HG1 THR A1093 -4.583 6.640 10.901 1.00 2.93 H new ATOM 0 HG21 THR A1093 -5.690 6.352 8.972 1.00 2.22 H new ATOM 0 HG22 THR A1093 -4.811 6.596 7.444 1.00 2.22 H new ATOM 0 HG23 THR A1093 -4.463 5.172 8.453 1.00 2.22 H new ATOM 711 N LYS A1094 -0.799 7.318 10.536 1.00 1.20 N ATOM 712 CA LYS A1094 0.231 7.970 11.368 1.00 1.35 C ATOM 713 C LYS A1094 1.471 8.359 10.560 1.00 1.20 C ATOM 714 O LYS A1094 1.864 9.521 10.597 1.00 1.24 O ATOM 715 CB LYS A1094 0.558 7.008 12.528 1.00 1.68 C ATOM 716 CG LYS A1094 1.551 7.445 13.613 1.00 2.65 C ATOM 717 CD LYS A1094 3.024 7.484 13.180 1.00 3.97 C ATOM 718 CE LYS A1094 3.928 7.627 14.406 1.00 4.70 C ATOM 719 NZ LYS A1094 5.266 8.134 14.032 1.00 6.38 N ATOM 0 H LYS A1094 -1.117 6.432 10.928 1.00 1.20 H new ATOM 0 HA LYS A1094 -0.146 8.913 11.763 1.00 1.35 H new ATOM 0 HB2 LYS A1094 -0.381 6.763 13.024 1.00 1.68 H new ATOM 0 HB3 LYS A1094 0.938 6.085 12.090 1.00 1.68 H new ATOM 0 HG2 LYS A1094 1.267 8.437 13.964 1.00 2.65 H new ATOM 0 HG3 LYS A1094 1.457 6.768 14.462 1.00 2.65 H new ATOM 0 HD2 LYS A1094 3.276 6.573 12.637 1.00 3.97 H new ATOM 0 HD3 LYS A1094 3.189 8.318 12.498 1.00 3.97 H new ATOM 0 HE2 LYS A1094 3.467 8.306 15.123 1.00 4.70 H new ATOM 0 HE3 LYS A1094 4.028 6.661 14.901 1.00 4.70 H new ATOM 0 HZ1 LYS A1094 5.871 8.172 14.877 1.00 6.38 H new ATOM 0 HZ2 LYS A1094 5.693 7.499 13.328 1.00 6.38 H new ATOM 0 HZ3 LYS A1094 5.175 9.088 13.628 1.00 6.38 H new ATOM 733 N TYR A1095 2.040 7.440 9.776 1.00 1.09 N ATOM 734 CA TYR A1095 3.238 7.726 8.971 1.00 1.00 C ATOM 735 C TYR A1095 2.939 8.684 7.810 1.00 0.99 C ATOM 736 O TYR A1095 3.705 9.621 7.569 1.00 1.01 O ATOM 737 CB TYR A1095 3.839 6.404 8.454 1.00 0.96 C ATOM 738 CG TYR A1095 4.959 6.593 7.443 1.00 0.95 C ATOM 739 CD1 TYR A1095 6.264 6.881 7.879 1.00 2.05 C ATOM 740 CD2 TYR A1095 4.685 6.545 6.060 1.00 2.23 C ATOM 741 CE1 TYR A1095 7.281 7.164 6.949 1.00 2.18 C ATOM 742 CE2 TYR A1095 5.701 6.821 5.124 1.00 2.31 C ATOM 743 CZ TYR A1095 7.002 7.156 5.568 1.00 1.36 C ATOM 744 OH TYR A1095 7.987 7.501 4.693 1.00 1.72 O ATOM 0 H TYR A1095 1.691 6.486 9.679 1.00 1.09 H new ATOM 0 HA TYR A1095 3.964 8.228 9.610 1.00 1.00 H new ATOM 0 HB2 TYR A1095 4.219 5.833 9.301 1.00 0.96 H new ATOM 0 HB3 TYR A1095 3.047 5.809 7.998 1.00 0.96 H new ATOM 0 HD1 TYR A1095 6.488 6.885 8.936 1.00 2.05 H new ATOM 0 HD2 TYR A1095 3.692 6.295 5.717 1.00 2.23 H new ATOM 0 HE1 TYR A1095 8.279 7.388 7.295 1.00 2.18 H new ATOM 0 HE2 TYR A1095 5.487 6.777 4.066 1.00 2.31 H new ATOM 0 HH TYR A1095 7.644 7.447 3.777 1.00 1.72 H new ATOM 754 N CYS A1096 1.821 8.485 7.105 1.00 0.98 N ATOM 755 CA CYS A1096 1.464 9.274 5.925 1.00 1.00 C ATOM 756 C CYS A1096 1.058 10.709 6.289 1.00 1.11 C ATOM 757 O CYS A1096 1.562 11.655 5.688 1.00 1.18 O ATOM 758 CB CYS A1096 0.367 8.557 5.125 1.00 1.04 C ATOM 759 SG CYS A1096 0.961 6.932 4.571 1.00 2.55 S ATOM 0 H CYS A1096 1.135 7.767 7.340 1.00 0.98 H new ATOM 0 HA CYS A1096 2.350 9.360 5.296 1.00 1.00 H new ATOM 0 HB2 CYS A1096 -0.524 8.437 5.741 1.00 1.04 H new ATOM 0 HB3 CYS A1096 0.080 9.161 4.264 1.00 1.04 H new ATOM 0 HG CYS A1096 0.861 6.078 5.546 1.00 2.55 H new ATOM 765 N LYS A1097 0.213 10.899 7.314 1.00 1.18 N ATOM 766 CA LYS A1097 -0.192 12.230 7.795 1.00 1.29 C ATOM 767 C LYS A1097 1.011 13.043 8.288 1.00 1.29 C ATOM 768 O LYS A1097 1.048 14.255 8.100 1.00 1.38 O ATOM 769 CB LYS A1097 -1.256 12.093 8.903 1.00 1.38 C ATOM 770 CG LYS A1097 -2.089 13.381 9.000 1.00 1.78 C ATOM 771 CD LYS A1097 -2.862 13.571 10.315 1.00 2.90 C ATOM 772 CE LYS A1097 -3.690 12.357 10.746 1.00 4.25 C ATOM 773 NZ LYS A1097 -4.553 12.683 11.906 1.00 5.39 N ATOM 0 H LYS A1097 -0.211 10.131 7.835 1.00 1.18 H new ATOM 0 HA LYS A1097 -0.627 12.774 6.957 1.00 1.29 H new ATOM 0 HB2 LYS A1097 -1.907 11.245 8.689 1.00 1.38 H new ATOM 0 HB3 LYS A1097 -0.773 11.891 9.859 1.00 1.38 H new ATOM 0 HG2 LYS A1097 -1.424 14.234 8.863 1.00 1.78 H new ATOM 0 HG3 LYS A1097 -2.801 13.396 8.175 1.00 1.78 H new ATOM 0 HD2 LYS A1097 -2.153 13.811 11.107 1.00 2.90 H new ATOM 0 HD3 LYS A1097 -3.526 14.429 10.211 1.00 2.90 H new ATOM 0 HE2 LYS A1097 -4.307 12.020 9.913 1.00 4.25 H new ATOM 0 HE3 LYS A1097 -3.025 11.533 11.004 1.00 4.25 H new ATOM 0 HZ1 LYS A1097 -5.103 11.843 12.177 1.00 5.39 H new ATOM 0 HZ2 LYS A1097 -3.960 12.982 12.707 1.00 5.39 H new ATOM 0 HZ3 LYS A1097 -5.203 13.454 11.650 1.00 5.39 H new ATOM 787 N GLN A1098 2.010 12.360 8.851 1.00 1.22 N ATOM 788 CA GLN A1098 3.293 12.934 9.266 1.00 1.24 C ATOM 789 C GLN A1098 4.233 13.195 8.073 1.00 1.25 C ATOM 790 O GLN A1098 4.962 14.185 8.088 1.00 1.28 O ATOM 791 CB GLN A1098 3.894 12.024 10.358 1.00 1.26 C ATOM 792 CG GLN A1098 3.097 12.220 11.650 1.00 2.53 C ATOM 793 CD GLN A1098 3.413 11.284 12.813 1.00 3.84 C ATOM 794 OE1 GLN A1098 4.508 10.758 12.996 1.00 4.16 O ATOM 795 NE2 GLN A1098 2.465 11.104 13.705 1.00 5.23 N ATOM 0 H GLN A1098 1.947 11.359 9.037 1.00 1.22 H new ATOM 0 HA GLN A1098 3.142 13.925 9.693 1.00 1.24 H new ATOM 0 HB2 GLN A1098 3.856 10.981 10.044 1.00 1.26 H new ATOM 0 HB3 GLN A1098 4.944 12.270 10.520 1.00 1.26 H new ATOM 0 HG2 GLN A1098 3.250 13.244 11.989 1.00 2.53 H new ATOM 0 HG3 GLN A1098 2.038 12.118 11.412 1.00 2.53 H new ATOM 0 HE21 GLN A1098 1.550 11.533 13.570 1.00 5.23 H new ATOM 0 HE22 GLN A1098 2.645 10.535 14.532 1.00 5.23 H new ATOM 804 N GLU A1099 4.160 12.411 6.992 1.00 1.25 N ATOM 805 CA GLU A1099 4.926 12.654 5.758 1.00 1.27 C ATOM 806 C GLU A1099 4.473 13.925 5.019 1.00 1.14 C ATOM 807 O GLU A1099 5.323 14.662 4.513 1.00 1.21 O ATOM 808 CB GLU A1099 4.853 11.426 4.828 1.00 1.37 C ATOM 809 CG GLU A1099 5.937 11.409 3.735 1.00 1.55 C ATOM 810 CD GLU A1099 7.312 10.944 4.237 1.00 2.05 C ATOM 811 OE1 GLU A1099 7.611 11.056 5.450 1.00 2.42 O ATOM 812 OE2 GLU A1099 8.130 10.446 3.426 1.00 2.89 O ATOM 0 H GLU A1099 3.565 11.584 6.945 1.00 1.25 H new ATOM 0 HA GLU A1099 5.963 12.817 6.053 1.00 1.27 H new ATOM 0 HB2 GLU A1099 4.942 10.521 5.429 1.00 1.37 H new ATOM 0 HB3 GLU A1099 3.872 11.399 4.354 1.00 1.37 H new ATOM 0 HG2 GLU A1099 5.615 10.753 2.926 1.00 1.55 H new ATOM 0 HG3 GLU A1099 6.033 12.410 3.315 1.00 1.55 H new ATOM 819 N LEU A1100 3.168 14.230 5.001 1.00 1.07 N ATOM 820 CA LEU A1100 2.621 15.514 4.519 1.00 1.03 C ATOM 821 C LEU A1100 2.330 16.543 5.637 1.00 1.39 C ATOM 822 O LEU A1100 1.721 17.581 5.374 1.00 1.77 O ATOM 823 CB LEU A1100 1.454 15.290 3.536 1.00 1.27 C ATOM 824 CG LEU A1100 0.261 14.464 4.055 1.00 1.21 C ATOM 825 CD1 LEU A1100 -1.054 15.195 3.790 1.00 1.48 C ATOM 826 CD2 LEU A1100 0.170 13.122 3.324 1.00 2.28 C ATOM 0 H LEU A1100 2.448 13.584 5.325 1.00 1.07 H new ATOM 0 HA LEU A1100 3.415 15.997 3.950 1.00 1.03 H new ATOM 0 HB2 LEU A1100 1.082 16.265 3.222 1.00 1.27 H new ATOM 0 HB3 LEU A1100 1.848 14.798 2.647 1.00 1.27 H new ATOM 0 HG LEU A1100 0.419 14.315 5.123 1.00 1.21 H new ATOM 0 HD11 LEU A1100 -1.885 14.596 4.163 1.00 1.48 H new ATOM 0 HD12 LEU A1100 -1.044 16.159 4.299 1.00 1.48 H new ATOM 0 HD13 LEU A1100 -1.173 15.352 2.718 1.00 1.48 H new ATOM 0 HD21 LEU A1100 -0.679 12.556 3.707 1.00 2.28 H new ATOM 0 HD22 LEU A1100 0.038 13.297 2.256 1.00 2.28 H new ATOM 0 HD23 LEU A1100 1.087 12.556 3.488 1.00 2.28 H new ATOM 838 N ASP A1101 2.799 16.261 6.859 1.00 1.37 N ATOM 839 CA ASP A1101 2.845 17.143 8.038 1.00 1.55 C ATOM 840 C ASP A1101 1.537 17.899 8.357 1.00 1.58 C ATOM 841 O ASP A1101 1.543 19.095 8.666 1.00 1.57 O ATOM 842 CB ASP A1101 4.085 18.041 7.922 1.00 1.68 C ATOM 843 CG ASP A1101 4.456 18.790 9.204 1.00 1.82 C ATOM 844 OD1 ASP A1101 4.174 18.315 10.333 1.00 3.41 O ATOM 845 OD2 ASP A1101 5.126 19.845 9.080 1.00 1.64 O ATOM 0 H ASP A1101 3.186 15.341 7.068 1.00 1.37 H new ATOM 0 HA ASP A1101 2.939 16.514 8.923 1.00 1.55 H new ATOM 0 HB2 ASP A1101 4.933 17.428 7.617 1.00 1.68 H new ATOM 0 HB3 ASP A1101 3.916 18.769 7.128 1.00 1.68 H new ATOM 850 N THR A1102 0.395 17.218 8.261 1.00 1.69 N ATOM 851 CA THR A1102 -0.950 17.807 8.426 1.00 1.76 C ATOM 852 C THR A1102 -1.663 17.314 9.691 1.00 1.96 C ATOM 853 O THR A1102 -1.255 16.336 10.318 1.00 2.38 O ATOM 854 CB THR A1102 -1.777 17.597 7.150 1.00 1.99 C ATOM 855 OG1 THR A1102 -2.948 18.376 7.208 1.00 2.20 O ATOM 856 CG2 THR A1102 -2.199 16.149 6.929 1.00 2.45 C ATOM 0 H THR A1102 0.370 16.218 8.062 1.00 1.69 H new ATOM 0 HA THR A1102 -0.833 18.881 8.574 1.00 1.76 H new ATOM 0 HB THR A1102 -1.130 17.892 6.324 1.00 1.99 H new ATOM 0 HG1 THR A1102 -3.472 18.240 6.391 1.00 2.20 H new ATOM 0 HG21 THR A1102 -2.780 16.076 6.009 1.00 2.45 H new ATOM 0 HG22 THR A1102 -1.313 15.520 6.850 1.00 2.45 H new ATOM 0 HG23 THR A1102 -2.807 15.815 7.770 1.00 2.45 H new ATOM 864 N GLU A1103 -2.760 17.980 10.053 1.00 1.86 N ATOM 865 CA GLU A1103 -3.716 17.565 11.094 1.00 2.10 C ATOM 866 C GLU A1103 -5.150 17.401 10.544 1.00 2.24 C ATOM 867 O GLU A1103 -6.126 17.364 11.300 1.00 2.53 O ATOM 868 CB GLU A1103 -3.616 18.489 12.318 1.00 2.27 C ATOM 869 CG GLU A1103 -4.055 19.936 12.062 1.00 2.36 C ATOM 870 CD GLU A1103 -3.731 20.792 13.285 1.00 2.72 C ATOM 871 OE1 GLU A1103 -2.558 21.209 13.441 1.00 3.54 O ATOM 872 OE2 GLU A1103 -4.613 21.037 14.143 1.00 3.28 O ATOM 0 H GLU A1103 -3.023 18.862 9.613 1.00 1.86 H new ATOM 0 HA GLU A1103 -3.441 16.567 11.436 1.00 2.10 H new ATOM 0 HB2 GLU A1103 -4.226 18.075 13.121 1.00 2.27 H new ATOM 0 HB3 GLU A1103 -2.585 18.493 12.671 1.00 2.27 H new ATOM 0 HG2 GLU A1103 -3.546 20.331 11.183 1.00 2.36 H new ATOM 0 HG3 GLU A1103 -5.124 19.971 11.854 1.00 2.36 H new ATOM 879 N THR A1104 -5.285 17.287 9.217 1.00 2.18 N ATOM 880 CA THR A1104 -6.549 17.073 8.495 1.00 2.37 C ATOM 881 C THR A1104 -6.337 16.181 7.261 1.00 2.19 C ATOM 882 O THR A1104 -5.363 16.342 6.521 1.00 2.51 O ATOM 883 CB THR A1104 -7.192 18.422 8.125 1.00 2.61 C ATOM 884 OG1 THR A1104 -8.404 18.186 7.439 1.00 3.26 O ATOM 885 CG2 THR A1104 -6.295 19.338 7.285 1.00 2.07 C ATOM 0 H THR A1104 -4.483 17.344 8.589 1.00 2.18 H new ATOM 0 HA THR A1104 -7.240 16.547 9.154 1.00 2.37 H new ATOM 0 HB THR A1104 -7.363 18.949 9.063 1.00 2.61 H new ATOM 0 HG1 THR A1104 -8.818 19.042 7.203 1.00 3.26 H new ATOM 0 HG21 THR A1104 -6.824 20.266 7.069 1.00 2.07 H new ATOM 0 HG22 THR A1104 -5.383 19.561 7.838 1.00 2.07 H new ATOM 0 HG23 THR A1104 -6.040 18.839 6.350 1.00 2.07 H new ATOM 893 N LEU A1105 -7.219 15.201 7.039 1.00 1.97 N ATOM 894 CA LEU A1105 -7.154 14.279 5.896 1.00 1.67 C ATOM 895 C LEU A1105 -8.509 13.642 5.565 1.00 1.42 C ATOM 896 O LEU A1105 -9.311 13.323 6.445 1.00 1.78 O ATOM 897 CB LEU A1105 -6.066 13.197 6.089 1.00 1.88 C ATOM 898 CG LEU A1105 -6.390 12.009 7.012 1.00 2.54 C ATOM 899 CD1 LEU A1105 -5.172 11.093 7.092 1.00 2.77 C ATOM 900 CD2 LEU A1105 -6.768 12.456 8.413 1.00 3.28 C ATOM 0 H LEU A1105 -8.011 15.022 7.657 1.00 1.97 H new ATOM 0 HA LEU A1105 -6.873 14.889 5.037 1.00 1.67 H new ATOM 0 HB2 LEU A1105 -5.812 12.798 5.107 1.00 1.88 H new ATOM 0 HB3 LEU A1105 -5.172 13.687 6.475 1.00 1.88 H new ATOM 0 HG LEU A1105 -7.246 11.484 6.589 1.00 2.54 H new ATOM 0 HD11 LEU A1105 -5.394 10.249 7.745 1.00 2.77 H new ATOM 0 HD12 LEU A1105 -4.926 10.727 6.095 1.00 2.77 H new ATOM 0 HD13 LEU A1105 -4.325 11.649 7.493 1.00 2.77 H new ATOM 0 HD21 LEU A1105 -6.988 11.582 9.027 1.00 3.28 H new ATOM 0 HD22 LEU A1105 -5.940 13.010 8.854 1.00 3.28 H new ATOM 0 HD23 LEU A1105 -7.649 13.097 8.365 1.00 3.28 H new ATOM 912 N GLY A1106 -8.715 13.373 4.285 1.00 1.08 N ATOM 913 CA GLY A1106 -9.866 12.626 3.771 1.00 1.17 C ATOM 914 C GLY A1106 -9.887 12.370 2.263 1.00 1.12 C ATOM 915 O GLY A1106 -9.368 13.156 1.468 1.00 1.77 O ATOM 0 H GLY A1106 -8.073 13.673 3.551 1.00 1.08 H new ATOM 0 HA2 GLY A1106 -9.906 11.664 4.282 1.00 1.17 H new ATOM 0 HA3 GLY A1106 -10.773 13.168 4.039 1.00 1.17 H new ATOM 919 N THR A1107 -10.484 11.240 1.896 1.00 0.91 N ATOM 920 CA THR A1107 -10.768 10.754 0.544 1.00 1.14 C ATOM 921 C THR A1107 -11.990 9.845 0.649 1.00 1.08 C ATOM 922 O THR A1107 -11.994 8.961 1.516 1.00 1.01 O ATOM 923 CB THR A1107 -9.622 9.923 -0.065 1.00 1.25 C ATOM 924 OG1 THR A1107 -9.201 8.906 0.820 1.00 1.11 O ATOM 925 CG2 THR A1107 -8.386 10.745 -0.431 1.00 1.64 C ATOM 0 H THR A1107 -10.812 10.579 2.600 1.00 0.91 H new ATOM 0 HA THR A1107 -10.916 11.621 -0.100 1.00 1.14 H new ATOM 0 HB THR A1107 -10.046 9.506 -0.979 1.00 1.25 H new ATOM 0 HG1 THR A1107 -9.978 8.543 1.295 1.00 1.11 H new ATOM 0 HG21 THR A1107 -7.625 10.089 -0.853 1.00 1.64 H new ATOM 0 HG22 THR A1107 -8.658 11.504 -1.164 1.00 1.64 H new ATOM 0 HG23 THR A1107 -7.993 11.229 0.463 1.00 1.64 H new ATOM 933 N CYS A1108 -12.989 10.003 -0.220 1.00 1.30 N ATOM 934 CA CYS A1108 -14.162 9.125 -0.227 1.00 1.34 C ATOM 935 C CYS A1108 -13.791 7.778 -0.866 1.00 1.09 C ATOM 936 O CYS A1108 -13.141 7.763 -1.918 1.00 1.04 O ATOM 937 CB CYS A1108 -15.328 9.833 -0.927 1.00 1.66 C ATOM 938 SG CYS A1108 -16.884 9.052 -0.424 1.00 2.19 S ATOM 0 H CYS A1108 -13.010 10.734 -0.931 1.00 1.30 H new ATOM 0 HA CYS A1108 -14.492 8.909 0.789 1.00 1.34 H new ATOM 0 HB2 CYS A1108 -15.337 10.891 -0.666 1.00 1.66 H new ATOM 0 HB3 CYS A1108 -15.210 9.773 -2.009 1.00 1.66 H new ATOM 0 HG CYS A1108 -17.879 9.648 -1.012 1.00 2.19 H new ATOM 944 N ILE A1109 -14.168 6.652 -0.247 1.00 1.04 N ATOM 945 CA ILE A1109 -13.701 5.319 -0.586 1.00 0.88 C ATOM 946 C ILE A1109 -14.801 4.268 -0.510 1.00 0.93 C ATOM 947 O ILE A1109 -15.681 4.338 0.349 1.00 1.24 O ATOM 948 CB ILE A1109 -12.508 4.889 0.314 1.00 0.80 C ATOM 949 CG1 ILE A1109 -12.890 4.878 1.819 1.00 1.37 C ATOM 950 CG2 ILE A1109 -11.266 5.753 0.050 1.00 1.36 C ATOM 951 CD1 ILE A1109 -11.746 4.540 2.778 1.00 1.42 C ATOM 0 H ILE A1109 -14.830 6.654 0.529 1.00 1.04 H new ATOM 0 HA ILE A1109 -13.369 5.378 -1.622 1.00 0.88 H new ATOM 0 HB ILE A1109 -12.256 3.863 0.045 1.00 0.80 H new ATOM 0 HG12 ILE A1109 -13.288 5.858 2.084 1.00 1.37 H new ATOM 0 HG13 ILE A1109 -13.693 4.157 1.968 1.00 1.37 H new ATOM 0 HG21 ILE A1109 -10.451 5.426 0.696 1.00 1.36 H new ATOM 0 HG22 ILE A1109 -10.966 5.650 -0.993 1.00 1.36 H new ATOM 0 HG23 ILE A1109 -11.498 6.797 0.260 1.00 1.36 H new ATOM 0 HD11 ILE A1109 -12.114 4.558 3.804 1.00 1.42 H new ATOM 0 HD12 ILE A1109 -11.360 3.547 2.548 1.00 1.42 H new ATOM 0 HD13 ILE A1109 -10.948 5.274 2.666 1.00 1.42 H new ATOM 963 N ASP A1110 -14.719 3.247 -1.363 1.00 0.75 N ATOM 964 CA ASP A1110 -15.542 2.032 -1.267 1.00 0.80 C ATOM 965 C ASP A1110 -14.662 0.851 -0.823 1.00 0.78 C ATOM 966 O ASP A1110 -14.236 0.033 -1.632 1.00 0.74 O ATOM 967 CB ASP A1110 -16.305 1.792 -2.579 1.00 0.85 C ATOM 968 CG ASP A1110 -17.322 0.658 -2.423 1.00 1.02 C ATOM 969 OD1 ASP A1110 -18.161 0.720 -1.488 1.00 2.24 O ATOM 970 OD2 ASP A1110 -17.302 -0.309 -3.217 1.00 1.59 O ATOM 0 H ASP A1110 -14.072 3.236 -2.152 1.00 0.75 H new ATOM 0 HA ASP A1110 -16.311 2.150 -0.504 1.00 0.80 H new ATOM 0 HB2 ASP A1110 -16.818 2.706 -2.878 1.00 0.85 H new ATOM 0 HB3 ASP A1110 -15.601 1.547 -3.374 1.00 0.85 H new ATOM 975 N PHE A1111 -14.316 0.824 0.465 1.00 0.89 N ATOM 976 CA PHE A1111 -13.302 -0.059 1.058 1.00 0.93 C ATOM 977 C PHE A1111 -13.829 -1.481 1.324 1.00 0.99 C ATOM 978 O PHE A1111 -14.814 -1.651 2.051 1.00 1.16 O ATOM 979 CB PHE A1111 -12.819 0.630 2.347 1.00 1.11 C ATOM 980 CG PHE A1111 -11.467 0.230 2.908 1.00 1.12 C ATOM 981 CD1 PHE A1111 -10.304 0.888 2.459 1.00 2.14 C ATOM 982 CD2 PHE A1111 -11.379 -0.668 3.991 1.00 1.42 C ATOM 983 CE1 PHE A1111 -9.085 0.715 3.135 1.00 2.21 C ATOM 984 CE2 PHE A1111 -10.155 -0.847 4.660 1.00 1.49 C ATOM 985 CZ PHE A1111 -9.015 -0.132 4.253 1.00 1.34 C ATOM 0 H PHE A1111 -14.750 1.439 1.153 1.00 0.89 H new ATOM 0 HA PHE A1111 -12.476 -0.203 0.361 1.00 0.93 H new ATOM 0 HB2 PHE A1111 -12.799 1.704 2.163 1.00 1.11 H new ATOM 0 HB3 PHE A1111 -13.567 0.452 3.120 1.00 1.11 H new ATOM 0 HD1 PHE A1111 -10.351 1.528 1.591 1.00 2.14 H new ATOM 0 HD2 PHE A1111 -12.252 -1.219 4.307 1.00 1.42 H new ATOM 0 HE1 PHE A1111 -8.201 1.234 2.795 1.00 2.21 H new ATOM 0 HE2 PHE A1111 -10.091 -1.536 5.489 1.00 1.49 H new ATOM 0 HZ PHE A1111 -8.088 -0.234 4.798 1.00 1.34 H new ATOM 995 N GLN A1112 -13.162 -2.487 0.752 1.00 0.93 N ATOM 996 CA GLN A1112 -13.429 -3.926 0.884 1.00 1.01 C ATOM 997 C GLN A1112 -12.175 -4.648 1.405 1.00 1.07 C ATOM 998 O GLN A1112 -11.062 -4.336 0.980 1.00 1.10 O ATOM 999 CB GLN A1112 -13.824 -4.533 -0.478 1.00 0.98 C ATOM 1000 CG GLN A1112 -14.952 -3.821 -1.242 1.00 1.47 C ATOM 1001 CD GLN A1112 -16.283 -3.807 -0.497 1.00 2.02 C ATOM 1002 OE1 GLN A1112 -16.738 -2.792 0.015 1.00 3.35 O ATOM 1003 NE2 GLN A1112 -16.963 -4.918 -0.359 1.00 2.42 N ATOM 0 H GLN A1112 -12.365 -2.307 0.141 1.00 0.93 H new ATOM 0 HA GLN A1112 -14.251 -4.055 1.588 1.00 1.01 H new ATOM 0 HB2 GLN A1112 -12.939 -4.551 -1.114 1.00 0.98 H new ATOM 0 HB3 GLN A1112 -14.121 -5.569 -0.317 1.00 0.98 H new ATOM 0 HG2 GLN A1112 -14.649 -2.794 -1.446 1.00 1.47 H new ATOM 0 HG3 GLN A1112 -15.091 -4.310 -2.206 1.00 1.47 H new ATOM 0 HE21 GLN A1112 -16.615 -5.783 -0.772 1.00 2.42 H new ATOM 0 HE22 GLN A1112 -17.840 -4.918 0.161 1.00 2.42 H new ATOM 1012 N VAL A1113 -12.338 -5.620 2.309 1.00 1.19 N ATOM 1013 CA VAL A1113 -11.224 -6.261 3.031 1.00 1.31 C ATOM 1014 C VAL A1113 -11.330 -7.790 2.998 1.00 1.49 C ATOM 1015 O VAL A1113 -12.400 -8.359 3.226 1.00 1.65 O ATOM 1016 CB VAL A1113 -11.155 -5.742 4.486 1.00 1.59 C ATOM 1017 CG1 VAL A1113 -9.969 -6.339 5.259 1.00 1.82 C ATOM 1018 CG2 VAL A1113 -11.014 -4.215 4.539 1.00 1.57 C ATOM 0 H VAL A1113 -13.253 -5.990 2.565 1.00 1.19 H new ATOM 0 HA VAL A1113 -10.299 -5.992 2.521 1.00 1.31 H new ATOM 0 HB VAL A1113 -12.093 -6.052 4.948 1.00 1.59 H new ATOM 0 HG11 VAL A1113 -9.962 -5.945 6.275 1.00 1.82 H new ATOM 0 HG12 VAL A1113 -10.065 -7.424 5.291 1.00 1.82 H new ATOM 0 HG13 VAL A1113 -9.038 -6.072 4.760 1.00 1.82 H new ATOM 0 HG21 VAL A1113 -10.969 -3.890 5.578 1.00 1.57 H new ATOM 0 HG22 VAL A1113 -10.100 -3.916 4.025 1.00 1.57 H new ATOM 0 HG23 VAL A1113 -11.872 -3.753 4.051 1.00 1.57 H new ATOM 1028 N VAL A1114 -10.196 -8.453 2.753 1.00 1.55 N ATOM 1029 CA VAL A1114 -10.013 -9.910 2.869 1.00 1.89 C ATOM 1030 C VAL A1114 -8.709 -10.210 3.643 1.00 1.92 C ATOM 1031 O VAL A1114 -7.623 -10.210 3.056 1.00 1.42 O ATOM 1032 CB VAL A1114 -10.137 -10.590 1.484 1.00 1.86 C ATOM 1033 CG1 VAL A1114 -9.292 -9.962 0.364 1.00 2.35 C ATOM 1034 CG2 VAL A1114 -9.890 -12.101 1.581 1.00 3.29 C ATOM 0 H VAL A1114 -9.345 -7.975 2.457 1.00 1.55 H new ATOM 0 HA VAL A1114 -10.813 -10.355 3.461 1.00 1.89 H new ATOM 0 HB VAL A1114 -11.170 -10.411 1.185 1.00 1.86 H new ATOM 0 HG11 VAL A1114 -9.451 -10.512 -0.564 1.00 2.35 H new ATOM 0 HG12 VAL A1114 -9.588 -8.922 0.225 1.00 2.35 H new ATOM 0 HG13 VAL A1114 -8.237 -10.006 0.636 1.00 2.35 H new ATOM 0 HG21 VAL A1114 -9.984 -12.549 0.592 1.00 3.29 H new ATOM 0 HG22 VAL A1114 -8.887 -12.282 1.967 1.00 3.29 H new ATOM 0 HG23 VAL A1114 -10.623 -12.547 2.253 1.00 3.29 H new ATOM 1044 N PRO A1115 -8.774 -10.415 4.979 1.00 2.65 N ATOM 1045 CA PRO A1115 -7.586 -10.494 5.837 1.00 2.95 C ATOM 1046 C PRO A1115 -6.601 -11.600 5.444 1.00 2.67 C ATOM 1047 O PRO A1115 -6.997 -12.705 5.061 1.00 2.68 O ATOM 1048 CB PRO A1115 -8.102 -10.672 7.268 1.00 3.87 C ATOM 1049 CG PRO A1115 -9.467 -9.995 7.215 1.00 4.10 C ATOM 1050 CD PRO A1115 -9.965 -10.374 5.822 1.00 3.35 C ATOM 0 HA PRO A1115 -7.000 -9.581 5.729 1.00 2.95 H new ATOM 0 HB2 PRO A1115 -8.181 -11.724 7.543 1.00 3.87 H new ATOM 0 HB3 PRO A1115 -7.444 -10.201 7.998 1.00 3.87 H new ATOM 0 HG2 PRO A1115 -10.132 -10.360 7.998 1.00 4.10 H new ATOM 0 HG3 PRO A1115 -9.390 -8.915 7.339 1.00 4.10 H new ATOM 0 HD2 PRO A1115 -10.470 -11.340 5.835 1.00 3.35 H new ATOM 0 HD3 PRO A1115 -10.684 -9.644 5.450 1.00 3.35 H new ATOM 1058 N GLY A1116 -5.306 -11.296 5.530 1.00 2.77 N ATOM 1059 CA GLY A1116 -4.216 -12.157 5.055 1.00 2.57 C ATOM 1060 C GLY A1116 -3.970 -12.098 3.536 1.00 2.11 C ATOM 1061 O GLY A1116 -2.860 -12.392 3.094 1.00 2.35 O ATOM 0 H GLY A1116 -4.975 -10.423 5.942 1.00 2.77 H new ATOM 0 HA2 GLY A1116 -3.297 -11.876 5.570 1.00 2.57 H new ATOM 0 HA3 GLY A1116 -4.436 -13.187 5.335 1.00 2.57 H new ATOM 1065 N CYS A1117 -4.950 -11.665 2.734 1.00 1.64 N ATOM 1066 CA CYS A1117 -4.832 -11.543 1.275 1.00 1.34 C ATOM 1067 C CYS A1117 -4.618 -10.081 0.839 1.00 1.07 C ATOM 1068 O CYS A1117 -3.653 -9.787 0.130 1.00 0.92 O ATOM 1069 CB CYS A1117 -6.075 -12.162 0.617 1.00 1.60 C ATOM 1070 SG CYS A1117 -6.252 -13.907 1.098 1.00 2.25 S ATOM 0 H CYS A1117 -5.865 -11.384 3.087 1.00 1.64 H new ATOM 0 HA CYS A1117 -3.949 -12.088 0.943 1.00 1.34 H new ATOM 0 HB2 CYS A1117 -6.965 -11.606 0.912 1.00 1.60 H new ATOM 0 HB3 CYS A1117 -5.996 -12.084 -0.467 1.00 1.60 H new ATOM 0 HG CYS A1117 -7.310 -14.408 0.532 1.00 2.25 H new ATOM 1076 N GLY A1118 -5.481 -9.161 1.291 1.00 1.11 N ATOM 1077 CA GLY A1118 -5.381 -7.741 0.958 1.00 0.99 C ATOM 1078 C GLY A1118 -6.645 -6.908 1.202 1.00 1.08 C ATOM 1079 O GLY A1118 -7.533 -7.271 1.980 1.00 1.39 O ATOM 0 H GLY A1118 -6.269 -9.385 1.899 1.00 1.11 H new ATOM 0 HA2 GLY A1118 -4.566 -7.308 1.537 1.00 0.99 H new ATOM 0 HA3 GLY A1118 -5.107 -7.652 -0.093 1.00 0.99 H new ATOM 1083 N ILE A1119 -6.674 -5.749 0.545 1.00 0.87 N ATOM 1084 CA ILE A1119 -7.725 -4.722 0.565 1.00 0.85 C ATOM 1085 C ILE A1119 -7.952 -4.244 -0.878 1.00 0.71 C ATOM 1086 O ILE A1119 -6.998 -4.154 -1.655 1.00 0.75 O ATOM 1087 CB ILE A1119 -7.320 -3.558 1.509 1.00 0.91 C ATOM 1088 CG1 ILE A1119 -7.079 -4.095 2.942 1.00 1.16 C ATOM 1089 CG2 ILE A1119 -8.353 -2.417 1.519 1.00 0.96 C ATOM 1090 CD1 ILE A1119 -6.690 -3.041 3.980 1.00 2.00 C ATOM 0 H ILE A1119 -5.903 -5.479 -0.065 1.00 0.87 H new ATOM 0 HA ILE A1119 -8.658 -5.130 0.953 1.00 0.85 H new ATOM 0 HB ILE A1119 -6.393 -3.134 1.123 1.00 0.91 H new ATOM 0 HG12 ILE A1119 -7.985 -4.597 3.281 1.00 1.16 H new ATOM 0 HG13 ILE A1119 -6.293 -4.849 2.902 1.00 1.16 H new ATOM 0 HG21 ILE A1119 -8.019 -1.630 2.195 1.00 0.96 H new ATOM 0 HG22 ILE A1119 -8.456 -2.011 0.513 1.00 0.96 H new ATOM 0 HG23 ILE A1119 -9.316 -2.801 1.856 1.00 0.96 H new ATOM 0 HD11 ILE A1119 -6.544 -3.520 4.948 1.00 2.00 H new ATOM 0 HD12 ILE A1119 -5.765 -2.553 3.674 1.00 2.00 H new ATOM 0 HD13 ILE A1119 -7.483 -2.298 4.059 1.00 2.00 H new ATOM 1102 N SER A1120 -9.197 -3.909 -1.224 1.00 0.88 N ATOM 1103 CA SER A1120 -9.581 -3.304 -2.508 1.00 0.73 C ATOM 1104 C SER A1120 -10.495 -2.109 -2.254 1.00 0.66 C ATOM 1105 O SER A1120 -11.390 -2.186 -1.413 1.00 0.75 O ATOM 1106 CB SER A1120 -10.277 -4.325 -3.413 1.00 0.76 C ATOM 1107 OG SER A1120 -10.462 -3.764 -4.701 1.00 1.25 O ATOM 0 H SER A1120 -9.992 -4.054 -0.602 1.00 0.88 H new ATOM 0 HA SER A1120 -8.679 -2.968 -3.019 1.00 0.73 H new ATOM 0 HB2 SER A1120 -9.678 -5.233 -3.483 1.00 0.76 H new ATOM 0 HB3 SER A1120 -11.239 -4.609 -2.987 1.00 0.76 H new ATOM 0 HG SER A1120 -10.906 -4.417 -5.282 1.00 1.25 H new ATOM 1113 N CYS A1121 -10.247 -0.971 -2.904 1.00 0.57 N ATOM 1114 CA CYS A1121 -11.101 0.205 -2.755 1.00 0.60 C ATOM 1115 C CYS A1121 -11.238 1.069 -4.017 1.00 0.57 C ATOM 1116 O CYS A1121 -10.502 0.915 -5.000 1.00 0.56 O ATOM 1117 CB CYS A1121 -10.631 1.003 -1.524 1.00 0.74 C ATOM 1118 SG CYS A1121 -9.036 1.800 -1.833 1.00 0.87 S ATOM 0 H CYS A1121 -9.460 -0.840 -3.539 1.00 0.57 H new ATOM 0 HA CYS A1121 -12.121 -0.146 -2.596 1.00 0.60 H new ATOM 0 HB2 CYS A1121 -11.375 1.758 -1.271 1.00 0.74 H new ATOM 0 HB3 CYS A1121 -10.548 0.337 -0.665 1.00 0.74 H new ATOM 0 HG CYS A1121 -8.671 2.465 -0.777 1.00 0.87 H new ATOM 1124 N LYS A1122 -12.181 2.018 -3.957 1.00 0.62 N ATOM 1125 CA LYS A1122 -12.288 3.130 -4.905 1.00 0.69 C ATOM 1126 C LYS A1122 -11.812 4.345 -4.118 1.00 0.75 C ATOM 1127 O LYS A1122 -12.002 4.333 -2.904 1.00 1.04 O ATOM 1128 CB LYS A1122 -13.741 3.263 -5.407 1.00 0.83 C ATOM 1129 CG LYS A1122 -13.836 3.790 -6.847 1.00 2.23 C ATOM 1130 CD LYS A1122 -13.498 2.664 -7.835 1.00 1.76 C ATOM 1131 CE LYS A1122 -13.432 3.099 -9.299 1.00 3.23 C ATOM 1132 NZ LYS A1122 -14.733 3.599 -9.805 1.00 4.66 N ATOM 0 H LYS A1122 -12.902 2.033 -3.236 1.00 0.62 H new ATOM 0 HA LYS A1122 -11.690 2.996 -5.806 1.00 0.69 H new ATOM 0 HB2 LYS A1122 -14.229 2.290 -5.350 1.00 0.83 H new ATOM 0 HB3 LYS A1122 -14.288 3.934 -4.744 1.00 0.83 H new ATOM 0 HG2 LYS A1122 -14.840 4.167 -7.041 1.00 2.23 H new ATOM 0 HG3 LYS A1122 -13.150 4.625 -6.985 1.00 2.23 H new ATOM 0 HD2 LYS A1122 -12.538 2.229 -7.555 1.00 1.76 H new ATOM 0 HD3 LYS A1122 -14.245 1.876 -7.737 1.00 1.76 H new ATOM 0 HE2 LYS A1122 -12.680 3.880 -9.408 1.00 3.23 H new ATOM 0 HE3 LYS A1122 -13.108 2.257 -9.910 1.00 3.23 H new ATOM 0 HZ1 LYS A1122 -14.786 3.450 -10.833 1.00 4.66 H new ATOM 0 HZ2 LYS A1122 -15.508 3.084 -9.340 1.00 4.66 H new ATOM 0 HZ3 LYS A1122 -14.819 4.614 -9.597 1.00 4.66 H new ATOM 1146 N VAL A1123 -11.149 5.324 -4.728 1.00 0.71 N ATOM 1147 CA VAL A1123 -10.611 6.487 -3.999 1.00 0.78 C ATOM 1148 C VAL A1123 -10.697 7.775 -4.816 1.00 0.98 C ATOM 1149 O VAL A1123 -10.398 7.785 -6.009 1.00 1.08 O ATOM 1150 CB VAL A1123 -9.192 6.189 -3.465 1.00 0.77 C ATOM 1151 CG1 VAL A1123 -8.129 6.044 -4.556 1.00 1.28 C ATOM 1152 CG2 VAL A1123 -8.734 7.244 -2.455 1.00 1.07 C ATOM 0 H VAL A1123 -10.967 5.342 -5.731 1.00 0.71 H new ATOM 0 HA VAL A1123 -11.244 6.663 -3.129 1.00 0.78 H new ATOM 0 HB VAL A1123 -9.285 5.220 -2.974 1.00 0.77 H new ATOM 0 HG11 VAL A1123 -7.162 5.836 -4.097 1.00 1.28 H new ATOM 0 HG12 VAL A1123 -8.399 5.223 -5.220 1.00 1.28 H new ATOM 0 HG13 VAL A1123 -8.067 6.969 -5.129 1.00 1.28 H new ATOM 0 HG21 VAL A1123 -7.732 7.000 -2.103 1.00 1.07 H new ATOM 0 HG22 VAL A1123 -8.722 8.224 -2.933 1.00 1.07 H new ATOM 0 HG23 VAL A1123 -9.422 7.261 -1.610 1.00 1.07 H new ATOM 1162 N THR A1124 -11.131 8.861 -4.176 1.00 1.07 N ATOM 1163 CA THR A1124 -11.362 10.179 -4.797 1.00 1.24 C ATOM 1164 C THR A1124 -11.304 11.306 -3.749 1.00 1.12 C ATOM 1165 O THR A1124 -10.937 11.062 -2.601 1.00 1.01 O ATOM 1166 CB THR A1124 -12.713 10.155 -5.534 1.00 1.47 C ATOM 1167 OG1 THR A1124 -12.778 11.270 -6.384 1.00 1.69 O ATOM 1168 CG2 THR A1124 -13.923 10.154 -4.597 1.00 1.49 C ATOM 0 H THR A1124 -11.340 8.854 -3.178 1.00 1.07 H new ATOM 0 HA THR A1124 -10.571 10.384 -5.518 1.00 1.24 H new ATOM 0 HB THR A1124 -12.760 9.221 -6.094 1.00 1.47 H new ATOM 0 HG1 THR A1124 -11.871 11.548 -6.628 1.00 1.69 H new ATOM 0 HG21 THR A1124 -14.840 10.137 -5.187 1.00 1.49 H new ATOM 0 HG22 THR A1124 -13.887 9.273 -3.957 1.00 1.49 H new ATOM 0 HG23 THR A1124 -13.906 11.052 -3.980 1.00 1.49 H new ATOM 1176 N ASN A1125 -11.697 12.534 -4.104 1.00 1.23 N ATOM 1177 CA ASN A1125 -11.680 13.737 -3.256 1.00 1.20 C ATOM 1178 C ASN A1125 -10.272 14.296 -2.949 1.00 1.48 C ATOM 1179 O ASN A1125 -10.093 15.002 -1.958 1.00 1.72 O ATOM 1180 CB ASN A1125 -12.548 13.540 -1.978 1.00 1.17 C ATOM 1181 CG ASN A1125 -13.424 14.737 -1.643 1.00 1.88 C ATOM 1182 OD1 ASN A1125 -13.393 15.776 -2.280 1.00 2.89 O ATOM 1183 ND2 ASN A1125 -14.251 14.618 -0.638 1.00 2.19 N ATOM 0 H ASN A1125 -12.055 12.729 -5.039 1.00 1.23 H new ATOM 0 HA ASN A1125 -12.142 14.523 -3.854 1.00 1.20 H new ATOM 0 HB2 ASN A1125 -13.182 12.663 -2.112 1.00 1.17 H new ATOM 0 HB3 ASN A1125 -11.892 13.333 -1.132 1.00 1.17 H new ATOM 0 HD21 ASN A1125 -14.867 15.392 -0.390 1.00 2.19 H new ATOM 0 HD22 ASN A1125 -14.281 13.751 -0.102 1.00 2.19 H new ATOM 1951 N GLN A1177 -10.615 10.173 -9.809 1.00 2.26 N ATOM 1952 CA GLN A1177 -11.002 8.933 -9.137 1.00 1.72 C ATOM 1953 C GLN A1177 -10.126 7.747 -9.587 1.00 1.47 C ATOM 1954 O GLN A1177 -9.853 7.561 -10.778 1.00 1.64 O ATOM 1955 CB GLN A1177 -12.497 8.682 -9.379 1.00 1.85 C ATOM 1956 CG GLN A1177 -13.058 7.477 -8.605 1.00 1.96 C ATOM 1957 CD GLN A1177 -14.559 7.358 -8.759 1.00 2.12 C ATOM 1958 OE1 GLN A1177 -15.090 6.373 -9.265 1.00 2.76 O ATOM 1959 NE2 GLN A1177 -15.303 8.354 -8.357 1.00 2.16 N ATOM 0 HA GLN A1177 -10.836 9.033 -8.064 1.00 1.72 H new ATOM 0 HB2 GLN A1177 -13.056 9.575 -9.098 1.00 1.85 H new ATOM 0 HB3 GLN A1177 -12.662 8.526 -10.445 1.00 1.85 H new ATOM 0 HG2 GLN A1177 -12.583 6.563 -8.961 1.00 1.96 H new ATOM 0 HG3 GLN A1177 -12.808 7.575 -7.549 1.00 1.96 H new ATOM 0 HE21 GLN A1177 -14.870 9.176 -7.936 1.00 2.16 H new ATOM 0 HE22 GLN A1177 -16.316 8.309 -8.465 1.00 2.16 H new ATOM 1968 N TYR A1178 -9.710 6.922 -8.630 1.00 1.14 N ATOM 1969 CA TYR A1178 -8.859 5.743 -8.826 1.00 0.95 C ATOM 1970 C TYR A1178 -9.461 4.453 -8.248 1.00 0.71 C ATOM 1971 O TYR A1178 -10.230 4.496 -7.286 1.00 0.72 O ATOM 1972 CB TYR A1178 -7.464 6.040 -8.257 1.00 1.13 C ATOM 1973 CG TYR A1178 -6.695 7.076 -9.053 1.00 1.03 C ATOM 1974 CD1 TYR A1178 -6.050 6.697 -10.245 1.00 2.50 C ATOM 1975 CD2 TYR A1178 -6.656 8.418 -8.628 1.00 1.78 C ATOM 1976 CE1 TYR A1178 -5.386 7.660 -11.024 1.00 2.63 C ATOM 1977 CE2 TYR A1178 -5.987 9.384 -9.405 1.00 1.83 C ATOM 1978 CZ TYR A1178 -5.373 9.010 -10.620 1.00 1.37 C ATOM 1979 OH TYR A1178 -4.812 9.942 -11.435 1.00 1.77 O ATOM 0 H TYR A1178 -9.966 7.060 -7.652 1.00 1.14 H new ATOM 0 HA TYR A1178 -8.782 5.552 -9.896 1.00 0.95 H new ATOM 0 HB2 TYR A1178 -7.566 6.386 -7.228 1.00 1.13 H new ATOM 0 HB3 TYR A1178 -6.888 5.115 -8.227 1.00 1.13 H new ATOM 0 HD1 TYR A1178 -6.065 5.665 -10.562 1.00 2.50 H new ATOM 0 HD2 TYR A1178 -7.139 8.707 -7.706 1.00 1.78 H new ATOM 0 HE1 TYR A1178 -4.885 7.365 -11.934 1.00 2.63 H new ATOM 0 HE2 TYR A1178 -5.944 10.410 -9.071 1.00 1.83 H new ATOM 0 HH TYR A1178 -4.882 10.826 -11.018 1.00 1.77 H new ATOM 1989 N LYS A1179 -9.082 3.296 -8.807 1.00 0.68 N ATOM 1990 CA LYS A1179 -9.367 1.963 -8.237 1.00 0.60 C ATOM 1991 C LYS A1179 -8.049 1.342 -7.779 1.00 0.57 C ATOM 1992 O LYS A1179 -7.192 1.042 -8.614 1.00 0.81 O ATOM 1993 CB LYS A1179 -10.139 1.109 -9.261 1.00 0.76 C ATOM 1994 CG LYS A1179 -10.942 -0.053 -8.652 1.00 1.03 C ATOM 1995 CD LYS A1179 -10.107 -1.250 -8.184 1.00 1.86 C ATOM 1996 CE LYS A1179 -10.956 -2.337 -7.507 1.00 3.28 C ATOM 1997 NZ LYS A1179 -11.994 -2.886 -8.408 1.00 3.51 N ATOM 0 H LYS A1179 -8.560 3.254 -9.682 1.00 0.68 H new ATOM 0 HA LYS A1179 -10.014 2.031 -7.362 1.00 0.60 H new ATOM 0 HB2 LYS A1179 -10.822 1.756 -9.812 1.00 0.76 H new ATOM 0 HB3 LYS A1179 -9.431 0.704 -9.984 1.00 0.76 H new ATOM 0 HG2 LYS A1179 -11.512 0.326 -7.803 1.00 1.03 H new ATOM 0 HG3 LYS A1179 -11.664 -0.401 -9.391 1.00 1.03 H new ATOM 0 HD2 LYS A1179 -9.587 -1.681 -9.039 1.00 1.86 H new ATOM 0 HD3 LYS A1179 -9.343 -0.905 -7.487 1.00 1.86 H new ATOM 0 HE2 LYS A1179 -10.306 -3.145 -7.171 1.00 3.28 H new ATOM 0 HE3 LYS A1179 -11.432 -1.921 -6.619 1.00 3.28 H new ATOM 0 HZ1 LYS A1179 -12.472 -3.683 -7.942 1.00 3.51 H new ATOM 0 HZ2 LYS A1179 -12.690 -2.145 -8.628 1.00 3.51 H new ATOM 0 HZ3 LYS A1179 -11.550 -3.216 -9.289 1.00 3.51 H new ATOM 2011 N VAL A1180 -7.873 1.174 -6.466 1.00 0.51 N ATOM 2012 CA VAL A1180 -6.576 0.808 -5.863 1.00 0.48 C ATOM 2013 C VAL A1180 -6.683 -0.350 -4.872 1.00 0.59 C ATOM 2014 O VAL A1180 -7.676 -0.483 -4.155 1.00 0.81 O ATOM 2015 CB VAL A1180 -5.843 2.020 -5.243 1.00 0.77 C ATOM 2016 CG1 VAL A1180 -5.781 3.206 -6.213 1.00 2.39 C ATOM 2017 CG2 VAL A1180 -6.463 2.540 -3.945 1.00 1.47 C ATOM 0 H VAL A1180 -8.623 1.287 -5.784 1.00 0.51 H new ATOM 0 HA VAL A1180 -5.963 0.454 -6.692 1.00 0.48 H new ATOM 0 HB VAL A1180 -4.849 1.630 -5.024 1.00 0.77 H new ATOM 0 HG11 VAL A1180 -5.258 4.037 -5.739 1.00 2.39 H new ATOM 0 HG12 VAL A1180 -5.248 2.910 -7.116 1.00 2.39 H new ATOM 0 HG13 VAL A1180 -6.793 3.516 -6.474 1.00 2.39 H new ATOM 0 HG21 VAL A1180 -5.885 3.390 -3.581 1.00 1.47 H new ATOM 0 HG22 VAL A1180 -7.490 2.853 -4.132 1.00 1.47 H new ATOM 0 HG23 VAL A1180 -6.456 1.748 -3.196 1.00 1.47 H new ATOM 2027 N LEU A1181 -5.650 -1.195 -4.845 1.00 0.57 N ATOM 2028 CA LEU A1181 -5.533 -2.357 -3.957 1.00 0.78 C ATOM 2029 C LEU A1181 -4.215 -2.295 -3.176 1.00 0.78 C ATOM 2030 O LEU A1181 -3.205 -1.844 -3.721 1.00 0.74 O ATOM 2031 CB LEU A1181 -5.558 -3.678 -4.755 1.00 1.00 C ATOM 2032 CG LEU A1181 -6.894 -4.175 -5.323 1.00 1.16 C ATOM 2033 CD1 LEU A1181 -7.330 -3.372 -6.542 1.00 1.54 C ATOM 2034 CD2 LEU A1181 -6.730 -5.619 -5.796 1.00 1.77 C ATOM 0 H LEU A1181 -4.844 -1.087 -5.461 1.00 0.57 H new ATOM 0 HA LEU A1181 -6.383 -2.331 -3.275 1.00 0.78 H new ATOM 0 HB2 LEU A1181 -4.864 -3.573 -5.589 1.00 1.00 H new ATOM 0 HB3 LEU A1181 -5.163 -4.461 -4.108 1.00 1.00 H new ATOM 0 HG LEU A1181 -7.635 -4.074 -4.530 1.00 1.16 H new ATOM 0 HD11 LEU A1181 -8.280 -3.758 -6.911 1.00 1.54 H new ATOM 0 HD12 LEU A1181 -7.447 -2.324 -6.265 1.00 1.54 H new ATOM 0 HD13 LEU A1181 -6.575 -3.458 -7.324 1.00 1.54 H new ATOM 0 HD21 LEU A1181 -7.676 -5.979 -6.201 1.00 1.77 H new ATOM 0 HD22 LEU A1181 -5.964 -5.664 -6.570 1.00 1.77 H new ATOM 0 HD23 LEU A1181 -6.433 -6.246 -4.955 1.00 1.77 H new ATOM 2046 N ILE A1182 -4.209 -2.835 -1.953 1.00 0.82 N ATOM 2047 CA ILE A1182 -3.000 -3.061 -1.142 1.00 0.77 C ATOM 2048 C ILE A1182 -3.050 -4.474 -0.552 1.00 0.81 C ATOM 2049 O ILE A1182 -3.984 -4.792 0.190 1.00 1.06 O ATOM 2050 CB ILE A1182 -2.828 -2.014 -0.009 1.00 0.89 C ATOM 2051 CG1 ILE A1182 -2.927 -0.542 -0.477 1.00 0.91 C ATOM 2052 CG2 ILE A1182 -1.453 -2.233 0.656 1.00 0.94 C ATOM 2053 CD1 ILE A1182 -4.346 0.039 -0.401 1.00 1.12 C ATOM 0 H ILE A1182 -5.064 -3.136 -1.485 1.00 0.82 H new ATOM 0 HA ILE A1182 -2.137 -2.951 -1.798 1.00 0.77 H new ATOM 0 HB ILE A1182 -3.654 -2.169 0.685 1.00 0.89 H new ATOM 0 HG12 ILE A1182 -2.261 0.069 0.133 1.00 0.91 H new ATOM 0 HG13 ILE A1182 -2.571 -0.473 -1.505 1.00 0.91 H new ATOM 0 HG21 ILE A1182 -1.315 -1.505 1.455 1.00 0.94 H new ATOM 0 HG22 ILE A1182 -1.405 -3.240 1.070 1.00 0.94 H new ATOM 0 HG23 ILE A1182 -0.665 -2.109 -0.087 1.00 0.94 H new ATOM 0 HD11 ILE A1182 -4.335 1.073 -0.745 1.00 1.12 H new ATOM 0 HD12 ILE A1182 -5.013 -0.547 -1.033 1.00 1.12 H new ATOM 0 HD13 ILE A1182 -4.699 0.003 0.630 1.00 1.12 H new ATOM 2065 N GLY A1183 -2.066 -5.327 -0.844 1.00 0.63 N ATOM 2066 CA GLY A1183 -2.105 -6.719 -0.376 1.00 0.65 C ATOM 2067 C GLY A1183 -0.833 -7.523 -0.643 1.00 0.62 C ATOM 2068 O GLY A1183 0.249 -6.954 -0.791 1.00 0.70 O ATOM 0 H GLY A1183 -1.242 -5.086 -1.394 1.00 0.63 H new ATOM 0 HA2 GLY A1183 -2.301 -6.721 0.696 1.00 0.65 H new ATOM 0 HA3 GLY A1183 -2.944 -7.224 -0.854 1.00 0.65 H new ATOM 2072 N ASN A1184 -0.969 -8.851 -0.674 1.00 0.62 N ATOM 2073 CA ASN A1184 0.146 -9.783 -0.872 1.00 0.63 C ATOM 2074 C ASN A1184 0.623 -9.834 -2.344 1.00 0.66 C ATOM 2075 O ASN A1184 -0.143 -9.602 -3.284 1.00 0.68 O ATOM 2076 CB ASN A1184 -0.341 -11.158 -0.361 1.00 0.77 C ATOM 2077 CG ASN A1184 0.634 -12.297 -0.605 1.00 1.71 C ATOM 2078 OD1 ASN A1184 0.568 -12.994 -1.605 1.00 2.97 O ATOM 2079 ND2 ASN A1184 1.600 -12.499 0.250 1.00 2.57 N ATOM 0 H ASN A1184 -1.869 -9.317 -0.561 1.00 0.62 H new ATOM 0 HA ASN A1184 1.024 -9.454 -0.317 1.00 0.63 H new ATOM 0 HB2 ASN A1184 -0.537 -11.086 0.709 1.00 0.77 H new ATOM 0 HB3 ASN A1184 -1.289 -11.397 -0.844 1.00 0.77 H new ATOM 0 HD21 ASN A1184 2.288 -13.232 0.078 1.00 2.57 H new ATOM 0 HD22 ASN A1184 1.667 -11.924 1.090 1.00 2.57 H new ATOM 2086 N ARG A1185 1.866 -10.293 -2.544 1.00 0.70 N ATOM 2087 CA ARG A1185 2.525 -10.427 -3.858 1.00 0.77 C ATOM 2088 C ARG A1185 1.791 -11.364 -4.820 1.00 0.81 C ATOM 2089 O ARG A1185 1.593 -11.015 -5.982 1.00 0.92 O ATOM 2090 CB ARG A1185 4.002 -10.835 -3.659 1.00 0.88 C ATOM 2091 CG ARG A1185 4.258 -12.089 -2.799 1.00 1.46 C ATOM 2092 CD ARG A1185 5.731 -12.124 -2.372 1.00 1.95 C ATOM 2093 NE ARG A1185 6.022 -13.217 -1.426 1.00 2.64 N ATOM 2094 CZ ARG A1185 6.027 -13.136 -0.105 1.00 4.05 C ATOM 2095 NH1 ARG A1185 5.590 -12.092 0.537 1.00 5.37 N ATOM 2096 NH2 ARG A1185 6.477 -14.109 0.631 1.00 4.72 N ATOM 0 H ARG A1185 2.463 -10.592 -1.773 1.00 0.70 H new ATOM 0 HA ARG A1185 2.488 -9.451 -4.343 1.00 0.77 H new ATOM 0 HB2 ARG A1185 4.447 -10.998 -4.641 1.00 0.88 H new ATOM 0 HB3 ARG A1185 4.530 -9.996 -3.205 1.00 0.88 H new ATOM 0 HG2 ARG A1185 3.614 -12.078 -1.920 1.00 1.46 H new ATOM 0 HG3 ARG A1185 4.011 -12.988 -3.364 1.00 1.46 H new ATOM 0 HD2 ARG A1185 6.359 -12.237 -3.256 1.00 1.95 H new ATOM 0 HD3 ARG A1185 5.995 -11.171 -1.913 1.00 1.95 H new ATOM 0 HE ARG A1185 6.242 -14.127 -1.830 1.00 2.64 H new ATOM 0 HH11 ARG A1185 5.224 -11.292 0.021 1.00 5.37 H new ATOM 0 HH12 ARG A1185 5.613 -12.074 1.557 1.00 5.37 H new ATOM 0 HH21 ARG A1185 6.836 -14.957 0.192 1.00 4.72 H new ATOM 0 HH22 ARG A1185 6.471 -14.024 1.647 1.00 4.72 H new ATOM 2110 N GLU A1186 1.319 -12.509 -4.335 1.00 0.82 N ATOM 2111 CA GLU A1186 0.549 -13.460 -5.140 1.00 0.93 C ATOM 2112 C GLU A1186 -0.872 -12.961 -5.441 1.00 0.90 C ATOM 2113 O GLU A1186 -1.436 -13.323 -6.479 1.00 1.01 O ATOM 2114 CB GLU A1186 0.481 -14.835 -4.452 1.00 1.06 C ATOM 2115 CG GLU A1186 1.839 -15.435 -4.054 1.00 1.86 C ATOM 2116 CD GLU A1186 2.766 -15.618 -5.257 1.00 3.37 C ATOM 2117 OE1 GLU A1186 2.504 -16.512 -6.101 1.00 4.34 O ATOM 2118 OE2 GLU A1186 3.756 -14.862 -5.386 1.00 4.52 O ATOM 0 H GLU A1186 1.459 -12.807 -3.370 1.00 0.82 H new ATOM 0 HA GLU A1186 1.075 -13.556 -6.090 1.00 0.93 H new ATOM 0 HB2 GLU A1186 -0.135 -14.746 -3.557 1.00 1.06 H new ATOM 0 HB3 GLU A1186 -0.025 -15.533 -5.119 1.00 1.06 H new ATOM 0 HG2 GLU A1186 2.320 -14.786 -3.322 1.00 1.86 H new ATOM 0 HG3 GLU A1186 1.680 -16.399 -3.570 1.00 1.86 H new ATOM 2125 N TRP A1187 -1.476 -12.110 -4.597 1.00 0.87 N ATOM 2126 CA TRP A1187 -2.868 -11.675 -4.763 1.00 0.90 C ATOM 2127 C TRP A1187 -3.004 -10.617 -5.868 1.00 0.85 C ATOM 2128 O TRP A1187 -4.037 -10.545 -6.538 1.00 0.94 O ATOM 2129 CB TRP A1187 -3.371 -11.154 -3.406 1.00 1.04 C ATOM 2130 CG TRP A1187 -4.840 -10.871 -3.312 1.00 1.19 C ATOM 2131 CD1 TRP A1187 -5.824 -11.788 -3.449 1.00 2.24 C ATOM 2132 CD2 TRP A1187 -5.514 -9.605 -3.028 1.00 1.05 C ATOM 2133 NE1 TRP A1187 -7.054 -11.184 -3.276 1.00 2.48 N ATOM 2134 CE2 TRP A1187 -6.924 -9.839 -3.002 1.00 1.54 C ATOM 2135 CE3 TRP A1187 -5.079 -8.281 -2.805 1.00 1.75 C ATOM 2136 CZ2 TRP A1187 -7.852 -8.814 -2.774 1.00 1.51 C ATOM 2137 CZ3 TRP A1187 -6.003 -7.246 -2.562 1.00 2.09 C ATOM 2138 CH2 TRP A1187 -7.385 -7.507 -2.554 1.00 1.50 C ATOM 0 H TRP A1187 -1.013 -11.706 -3.783 1.00 0.87 H new ATOM 0 HA TRP A1187 -3.482 -12.518 -5.081 1.00 0.90 H new ATOM 0 HB2 TRP A1187 -3.113 -11.886 -2.640 1.00 1.04 H new ATOM 0 HB3 TRP A1187 -2.829 -10.239 -3.168 1.00 1.04 H new ATOM 0 HD1 TRP A1187 -5.671 -12.836 -3.662 1.00 2.24 H new ATOM 0 HE1 TRP A1187 -7.947 -11.672 -3.343 1.00 2.48 H new ATOM 0 HE3 TRP A1187 -4.022 -8.058 -2.821 1.00 1.75 H new ATOM 0 HZ2 TRP A1187 -8.911 -9.026 -2.767 1.00 1.51 H new ATOM 0 HZ3 TRP A1187 -5.647 -6.243 -2.380 1.00 2.09 H new ATOM 0 HH2 TRP A1187 -8.086 -6.704 -2.379 1.00 1.50 H new ATOM 2149 N MET A1188 -1.938 -9.853 -6.134 1.00 0.82 N ATOM 2150 CA MET A1188 -1.837 -8.963 -7.297 1.00 0.88 C ATOM 2151 C MET A1188 -1.686 -9.742 -8.614 1.00 0.90 C ATOM 2152 O MET A1188 -2.271 -9.346 -9.623 1.00 0.91 O ATOM 2153 CB MET A1188 -0.681 -7.967 -7.101 1.00 1.02 C ATOM 2154 CG MET A1188 -1.168 -6.650 -6.485 1.00 1.18 C ATOM 2155 SD MET A1188 -1.941 -6.740 -4.850 1.00 1.66 S ATOM 2156 CE MET A1188 -2.408 -4.997 -4.711 1.00 1.15 C ATOM 0 H MET A1188 -1.110 -9.835 -5.539 1.00 0.82 H new ATOM 0 HA MET A1188 -2.771 -8.406 -7.373 1.00 0.88 H new ATOM 0 HB2 MET A1188 0.078 -8.412 -6.457 1.00 1.02 H new ATOM 0 HB3 MET A1188 -0.206 -7.766 -8.061 1.00 1.02 H new ATOM 0 HG2 MET A1188 -0.317 -5.972 -6.420 1.00 1.18 H new ATOM 0 HG3 MET A1188 -1.883 -6.199 -7.173 1.00 1.18 H new ATOM 0 HE1 MET A1188 -2.971 -4.844 -3.791 1.00 1.15 H new ATOM 0 HE2 MET A1188 -1.510 -4.380 -4.694 1.00 1.15 H new ATOM 0 HE3 MET A1188 -3.025 -4.716 -5.565 1.00 1.15 H new ATOM 2166 N ILE A1189 -0.994 -10.889 -8.611 1.00 0.97 N ATOM 2167 CA ILE A1189 -0.959 -11.793 -9.777 1.00 1.09 C ATOM 2168 C ILE A1189 -2.365 -12.357 -10.049 1.00 1.15 C ATOM 2169 O ILE A1189 -2.784 -12.424 -11.207 1.00 1.31 O ATOM 2170 CB ILE A1189 0.096 -12.914 -9.597 1.00 1.22 C ATOM 2171 CG1 ILE A1189 1.511 -12.315 -9.416 1.00 1.92 C ATOM 2172 CG2 ILE A1189 0.080 -13.879 -10.800 1.00 2.17 C ATOM 2173 CD1 ILE A1189 2.574 -13.348 -9.020 1.00 2.03 C ATOM 0 H ILE A1189 -0.448 -11.217 -7.814 1.00 0.97 H new ATOM 0 HA ILE A1189 -0.651 -11.221 -10.652 1.00 1.09 H new ATOM 0 HB ILE A1189 -0.162 -13.473 -8.698 1.00 1.22 H new ATOM 0 HG12 ILE A1189 1.814 -11.834 -10.346 1.00 1.92 H new ATOM 0 HG13 ILE A1189 1.471 -11.537 -8.653 1.00 1.92 H new ATOM 0 HG21 ILE A1189 0.828 -14.658 -10.652 1.00 2.17 H new ATOM 0 HG22 ILE A1189 -0.906 -14.335 -10.887 1.00 2.17 H new ATOM 0 HG23 ILE A1189 0.306 -13.327 -11.712 1.00 2.17 H new ATOM 0 HD11 ILE A1189 3.539 -12.853 -8.912 1.00 2.03 H new ATOM 0 HD12 ILE A1189 2.296 -13.812 -8.074 1.00 2.03 H new ATOM 0 HD13 ILE A1189 2.643 -14.113 -9.793 1.00 2.03 H new ATOM 2185 N ARG A1190 -3.147 -12.652 -8.998 1.00 1.11 N ATOM 2186 CA ARG A1190 -4.564 -13.054 -9.090 1.00 1.23 C ATOM 2187 C ARG A1190 -5.470 -11.899 -9.549 1.00 1.31 C ATOM 2188 O ARG A1190 -6.466 -12.130 -10.235 1.00 1.59 O ATOM 2189 CB ARG A1190 -4.954 -13.680 -7.736 1.00 1.31 C ATOM 2190 CG ARG A1190 -6.415 -14.124 -7.599 1.00 1.57 C ATOM 2191 CD ARG A1190 -7.311 -13.022 -7.021 1.00 2.54 C ATOM 2192 NE ARG A1190 -8.678 -13.513 -6.810 1.00 2.86 N ATOM 2193 CZ ARG A1190 -9.648 -13.586 -7.696 1.00 3.00 C ATOM 2194 NH1 ARG A1190 -9.529 -13.170 -8.921 1.00 3.31 N ATOM 2195 NH2 ARG A1190 -10.787 -14.104 -7.363 1.00 3.43 N ATOM 0 H ARG A1190 -2.806 -12.617 -8.037 1.00 1.11 H new ATOM 0 HA ARG A1190 -4.707 -13.803 -9.869 1.00 1.23 H new ATOM 0 HB2 ARG A1190 -4.314 -14.544 -7.560 1.00 1.31 H new ATOM 0 HB3 ARG A1190 -4.739 -12.958 -6.948 1.00 1.31 H new ATOM 0 HG2 ARG A1190 -6.794 -14.421 -8.577 1.00 1.57 H new ATOM 0 HG3 ARG A1190 -6.466 -15.003 -6.957 1.00 1.57 H new ATOM 0 HD2 ARG A1190 -6.897 -12.670 -6.076 1.00 2.54 H new ATOM 0 HD3 ARG A1190 -7.328 -12.169 -7.699 1.00 2.54 H new ATOM 0 HE ARG A1190 -8.902 -13.835 -5.868 1.00 2.86 H new ATOM 0 HH11 ARG A1190 -8.650 -12.762 -9.238 1.00 3.31 H new ATOM 0 HH12 ARG A1190 -10.315 -13.251 -9.566 1.00 3.31 H new ATOM 0 HH21 ARG A1190 -10.931 -14.454 -6.416 1.00 3.43 H new ATOM 0 HH22 ARG A1190 -11.541 -14.162 -8.048 1.00 3.43 H new ATOM 2209 N ASN A1191 -5.113 -10.650 -9.235 1.00 1.20 N ATOM 2210 CA ASN A1191 -5.746 -9.443 -9.786 1.00 1.30 C ATOM 2211 C ASN A1191 -5.484 -9.202 -11.292 1.00 1.37 C ATOM 2212 O ASN A1191 -6.040 -8.261 -11.867 1.00 1.60 O ATOM 2213 CB ASN A1191 -5.275 -8.237 -8.955 1.00 1.22 C ATOM 2214 CG ASN A1191 -6.267 -7.096 -9.005 1.00 1.49 C ATOM 2215 OD1 ASN A1191 -7.411 -7.246 -8.607 1.00 1.59 O ATOM 2216 ND2 ASN A1191 -5.874 -5.938 -9.478 1.00 2.01 N ATOM 0 H ASN A1191 -4.361 -10.443 -8.578 1.00 1.20 H new ATOM 0 HA ASN A1191 -6.825 -9.584 -9.717 1.00 1.30 H new ATOM 0 HB2 ASN A1191 -5.127 -8.545 -7.920 1.00 1.22 H new ATOM 0 HB3 ASN A1191 -4.309 -7.895 -9.327 1.00 1.22 H new ATOM 0 HD21 ASN A1191 -6.526 -5.154 -9.515 1.00 2.01 H new ATOM 0 HD22 ASN A1191 -4.916 -5.821 -9.809 1.00 2.01 H new ATOM 2223 N GLY A1192 -4.623 -10.008 -11.924 1.00 1.34 N ATOM 2224 CA GLY A1192 -4.281 -9.904 -13.349 1.00 1.50 C ATOM 2225 C GLY A1192 -3.171 -8.889 -13.658 1.00 1.44 C ATOM 2226 O GLY A1192 -3.070 -8.408 -14.789 1.00 1.74 O ATOM 0 H GLY A1192 -4.134 -10.767 -11.450 1.00 1.34 H new ATOM 0 HA2 GLY A1192 -3.971 -10.885 -13.709 1.00 1.50 H new ATOM 0 HA3 GLY A1192 -5.176 -9.628 -13.907 1.00 1.50 H new ATOM 2230 N LEU A1193 -2.352 -8.553 -12.656 1.00 1.13 N ATOM 2231 CA LEU A1193 -1.124 -7.755 -12.781 1.00 1.02 C ATOM 2232 C LEU A1193 0.107 -8.682 -12.931 1.00 1.16 C ATOM 2233 O LEU A1193 -0.028 -9.903 -12.821 1.00 1.59 O ATOM 2234 CB LEU A1193 -0.989 -6.884 -11.520 1.00 0.78 C ATOM 2235 CG LEU A1193 -2.159 -5.908 -11.287 1.00 0.88 C ATOM 2236 CD1 LEU A1193 -2.239 -5.564 -9.805 1.00 1.08 C ATOM 2237 CD2 LEU A1193 -1.978 -4.616 -12.075 1.00 1.09 C ATOM 0 H LEU A1193 -2.533 -8.841 -11.694 1.00 1.13 H new ATOM 0 HA LEU A1193 -1.176 -7.123 -13.668 1.00 1.02 H new ATOM 0 HB2 LEU A1193 -0.899 -7.536 -10.652 1.00 0.78 H new ATOM 0 HB3 LEU A1193 -0.064 -6.312 -11.587 1.00 0.78 H new ATOM 0 HG LEU A1193 -3.073 -6.396 -11.624 1.00 0.88 H new ATOM 0 HD11 LEU A1193 -3.065 -4.874 -9.636 1.00 1.08 H new ATOM 0 HD12 LEU A1193 -2.403 -6.474 -9.228 1.00 1.08 H new ATOM 0 HD13 LEU A1193 -1.306 -5.097 -9.489 1.00 1.08 H new ATOM 0 HD21 LEU A1193 -2.822 -3.953 -11.886 1.00 1.09 H new ATOM 0 HD22 LEU A1193 -1.055 -4.126 -11.764 1.00 1.09 H new ATOM 0 HD23 LEU A1193 -1.927 -4.843 -13.140 1.00 1.09 H new ATOM 2249 N VAL A1194 1.315 -8.137 -13.123 1.00 1.14 N ATOM 2250 CA VAL A1194 2.577 -8.912 -13.108 1.00 1.27 C ATOM 2251 C VAL A1194 3.645 -8.278 -12.203 1.00 1.11 C ATOM 2252 O VAL A1194 3.833 -7.062 -12.208 1.00 1.12 O ATOM 2253 CB VAL A1194 3.080 -9.176 -14.545 1.00 1.60 C ATOM 2254 CG1 VAL A1194 3.620 -7.929 -15.253 1.00 1.63 C ATOM 2255 CG2 VAL A1194 4.152 -10.271 -14.570 1.00 2.13 C ATOM 0 H VAL A1194 1.453 -7.141 -13.295 1.00 1.14 H new ATOM 0 HA VAL A1194 2.363 -9.883 -12.662 1.00 1.27 H new ATOM 0 HB VAL A1194 2.197 -9.504 -15.094 1.00 1.60 H new ATOM 0 HG11 VAL A1194 3.954 -8.196 -16.256 1.00 1.63 H new ATOM 0 HG12 VAL A1194 2.832 -7.179 -15.320 1.00 1.63 H new ATOM 0 HG13 VAL A1194 4.459 -7.524 -14.687 1.00 1.63 H new ATOM 0 HG21 VAL A1194 4.484 -10.432 -15.596 1.00 2.13 H new ATOM 0 HG22 VAL A1194 5.000 -9.964 -13.958 1.00 2.13 H new ATOM 0 HG23 VAL A1194 3.735 -11.197 -14.174 1.00 2.13 H new ATOM 2265 N ILE A1195 4.356 -9.104 -11.423 1.00 1.17 N ATOM 2266 CA ILE A1195 5.436 -8.679 -10.509 1.00 1.10 C ATOM 2267 C ILE A1195 6.818 -9.022 -11.086 1.00 1.19 C ATOM 2268 O ILE A1195 6.980 -9.987 -11.846 1.00 1.38 O ATOM 2269 CB ILE A1195 5.201 -9.250 -9.086 1.00 1.25 C ATOM 2270 CG1 ILE A1195 6.020 -8.578 -7.960 1.00 1.29 C ATOM 2271 CG2 ILE A1195 5.495 -10.754 -9.031 1.00 1.57 C ATOM 2272 CD1 ILE A1195 5.682 -7.100 -7.729 1.00 2.06 C ATOM 0 H ILE A1195 4.196 -10.111 -11.407 1.00 1.17 H new ATOM 0 HA ILE A1195 5.415 -7.593 -10.414 1.00 1.10 H new ATOM 0 HB ILE A1195 4.148 -9.035 -8.901 1.00 1.25 H new ATOM 0 HG12 ILE A1195 5.856 -9.125 -7.032 1.00 1.29 H new ATOM 0 HG13 ILE A1195 7.080 -8.663 -8.198 1.00 1.29 H new ATOM 0 HG21 ILE A1195 5.320 -11.122 -8.020 1.00 1.57 H new ATOM 0 HG22 ILE A1195 4.840 -11.278 -9.726 1.00 1.57 H new ATOM 0 HG23 ILE A1195 6.534 -10.932 -9.307 1.00 1.57 H new ATOM 0 HD11 ILE A1195 6.301 -6.707 -6.923 1.00 2.06 H new ATOM 0 HD12 ILE A1195 5.873 -6.536 -8.642 1.00 2.06 H new ATOM 0 HD13 ILE A1195 4.631 -7.005 -7.458 1.00 2.06 H new ATOM 2284 N ASN A1196 7.830 -8.230 -10.732 1.00 1.13 N ATOM 2285 CA ASN A1196 9.208 -8.415 -11.209 1.00 1.28 C ATOM 2286 C ASN A1196 10.025 -9.236 -10.184 1.00 1.24 C ATOM 2287 O ASN A1196 9.836 -9.077 -8.976 1.00 1.05 O ATOM 2288 CB ASN A1196 9.858 -7.063 -11.602 1.00 1.42 C ATOM 2289 CG ASN A1196 8.897 -5.909 -11.881 1.00 1.45 C ATOM 2290 OD1 ASN A1196 8.939 -4.880 -11.226 1.00 2.71 O ATOM 2291 ND2 ASN A1196 8.005 -6.022 -12.840 1.00 2.05 N ATOM 0 H ASN A1196 7.720 -7.435 -10.102 1.00 1.13 H new ATOM 0 HA ASN A1196 9.196 -9.000 -12.129 1.00 1.28 H new ATOM 0 HB2 ASN A1196 10.532 -6.761 -10.801 1.00 1.42 H new ATOM 0 HB3 ASN A1196 10.469 -7.222 -12.490 1.00 1.42 H new ATOM 0 HD21 ASN A1196 7.359 -5.255 -13.029 1.00 2.05 H new ATOM 0 HD22 ASN A1196 7.959 -6.876 -13.395 1.00 2.05 H new ATOM 2298 N ASN A1197 10.937 -10.104 -10.642 1.00 1.49 N ATOM 2299 CA ASN A1197 11.706 -10.998 -9.757 1.00 1.52 C ATOM 2300 C ASN A1197 12.510 -10.238 -8.684 1.00 1.44 C ATOM 2301 O ASN A1197 12.499 -10.623 -7.520 1.00 1.43 O ATOM 2302 CB ASN A1197 12.640 -11.893 -10.600 1.00 1.76 C ATOM 2303 CG ASN A1197 13.663 -12.605 -9.725 1.00 1.87 C ATOM 2304 OD1 ASN A1197 14.822 -12.213 -9.638 1.00 2.43 O ATOM 2305 ND2 ASN A1197 13.245 -13.607 -8.993 1.00 3.40 N ATOM 0 H ASN A1197 11.164 -10.208 -11.631 1.00 1.49 H new ATOM 0 HA ASN A1197 10.986 -11.617 -9.221 1.00 1.52 H new ATOM 0 HB2 ASN A1197 12.048 -12.629 -11.144 1.00 1.76 H new ATOM 0 HB3 ASN A1197 13.155 -11.286 -11.344 1.00 1.76 H new ATOM 0 HD21 ASN A1197 13.885 -14.067 -8.345 1.00 3.40 H new ATOM 0 HD22 ASN A1197 12.280 -13.928 -9.071 1.00 3.40 H new ATOM 2312 N ASP A1198 13.163 -9.141 -9.064 1.00 1.50 N ATOM 2313 CA ASP A1198 14.039 -8.363 -8.177 1.00 1.53 C ATOM 2314 C ASP A1198 13.311 -7.865 -6.911 1.00 1.29 C ATOM 2315 O ASP A1198 13.814 -7.971 -5.789 1.00 1.22 O ATOM 2316 CB ASP A1198 14.564 -7.179 -8.995 1.00 1.74 C ATOM 2317 CG ASP A1198 15.500 -6.265 -8.204 1.00 1.86 C ATOM 2318 OD1 ASP A1198 16.360 -6.762 -7.442 1.00 2.71 O ATOM 2319 OD2 ASP A1198 15.329 -5.027 -8.302 1.00 2.24 O ATOM 0 H ASP A1198 13.101 -8.759 -10.008 1.00 1.50 H new ATOM 0 HA ASP A1198 14.851 -8.997 -7.822 1.00 1.53 H new ATOM 0 HB2 ASP A1198 15.091 -7.557 -9.871 1.00 1.74 H new ATOM 0 HB3 ASP A1198 13.719 -6.595 -9.359 1.00 1.74 H new ATOM 2324 N VAL A1199 12.127 -7.288 -7.108 1.00 1.18 N ATOM 2325 CA VAL A1199 11.235 -6.805 -6.043 1.00 1.04 C ATOM 2326 C VAL A1199 10.530 -7.939 -5.278 1.00 0.89 C ATOM 2327 O VAL A1199 10.404 -7.846 -4.057 1.00 0.82 O ATOM 2328 CB VAL A1199 10.302 -5.706 -6.584 1.00 1.13 C ATOM 2329 CG1 VAL A1199 9.459 -6.176 -7.765 1.00 1.90 C ATOM 2330 CG2 VAL A1199 9.387 -5.129 -5.506 1.00 1.35 C ATOM 0 H VAL A1199 11.745 -7.137 -8.042 1.00 1.18 H new ATOM 0 HA VAL A1199 11.845 -6.336 -5.271 1.00 1.04 H new ATOM 0 HB VAL A1199 10.970 -4.918 -6.930 1.00 1.13 H new ATOM 0 HG11 VAL A1199 8.821 -5.360 -8.104 1.00 1.90 H new ATOM 0 HG12 VAL A1199 10.114 -6.487 -8.579 1.00 1.90 H new ATOM 0 HG13 VAL A1199 8.839 -7.018 -7.457 1.00 1.90 H new ATOM 0 HG21 VAL A1199 8.751 -4.359 -5.943 1.00 1.35 H new ATOM 0 HG22 VAL A1199 8.764 -5.923 -5.094 1.00 1.35 H new ATOM 0 HG23 VAL A1199 9.992 -4.693 -4.711 1.00 1.35 H new ATOM 2340 N ASN A1200 10.138 -9.043 -5.932 1.00 0.96 N ATOM 2341 CA ASN A1200 9.573 -10.215 -5.234 1.00 0.98 C ATOM 2342 C ASN A1200 10.613 -10.864 -4.296 1.00 0.97 C ATOM 2343 O ASN A1200 10.293 -11.249 -3.168 1.00 0.94 O ATOM 2344 CB ASN A1200 9.022 -11.214 -6.271 1.00 1.21 C ATOM 2345 CG ASN A1200 7.954 -12.131 -5.688 1.00 1.66 C ATOM 2346 OD1 ASN A1200 6.767 -11.886 -5.836 1.00 2.09 O ATOM 2347 ND2 ASN A1200 8.306 -13.195 -5.009 1.00 2.26 N ATOM 0 H ASN A1200 10.201 -9.152 -6.944 1.00 0.96 H new ATOM 0 HA ASN A1200 8.748 -9.891 -4.600 1.00 0.98 H new ATOM 0 HB2 ASN A1200 8.603 -10.664 -7.114 1.00 1.21 H new ATOM 0 HB3 ASN A1200 9.842 -11.818 -6.660 1.00 1.21 H new ATOM 0 HD21 ASN A1200 7.592 -13.806 -4.612 1.00 2.26 H new ATOM 0 HD22 ASN A1200 9.294 -13.412 -4.877 1.00 2.26 H new ATOM 2354 N ASP A1201 11.872 -10.905 -4.739 1.00 1.05 N ATOM 2355 CA ASP A1201 13.011 -11.418 -3.976 1.00 1.10 C ATOM 2356 C ASP A1201 13.369 -10.509 -2.794 1.00 0.98 C ATOM 2357 O ASP A1201 13.501 -10.996 -1.674 1.00 1.07 O ATOM 2358 CB ASP A1201 14.202 -11.611 -4.920 1.00 1.32 C ATOM 2359 CG ASP A1201 15.299 -12.423 -4.245 1.00 1.62 C ATOM 2360 OD1 ASP A1201 15.163 -13.671 -4.209 1.00 2.91 O ATOM 2361 OD2 ASP A1201 16.285 -11.822 -3.758 1.00 1.85 O ATOM 0 H ASP A1201 12.134 -10.572 -5.667 1.00 1.05 H new ATOM 0 HA ASP A1201 12.737 -12.381 -3.544 1.00 1.10 H new ATOM 0 HB2 ASP A1201 13.874 -12.118 -5.828 1.00 1.32 H new ATOM 0 HB3 ASP A1201 14.595 -10.640 -5.221 1.00 1.32 H new ATOM 2366 N PHE A1202 13.417 -9.188 -3.007 1.00 0.94 N ATOM 2367 CA PHE A1202 13.625 -8.196 -1.941 1.00 0.99 C ATOM 2368 C PHE A1202 12.566 -8.309 -0.829 1.00 0.88 C ATOM 2369 O PHE A1202 12.901 -8.227 0.355 1.00 1.03 O ATOM 2370 CB PHE A1202 13.614 -6.788 -2.564 1.00 1.13 C ATOM 2371 CG PHE A1202 13.489 -5.651 -1.562 1.00 1.24 C ATOM 2372 CD1 PHE A1202 14.618 -5.206 -0.850 1.00 2.72 C ATOM 2373 CD2 PHE A1202 12.233 -5.062 -1.314 1.00 2.04 C ATOM 2374 CE1 PHE A1202 14.495 -4.186 0.110 1.00 2.98 C ATOM 2375 CE2 PHE A1202 12.108 -4.049 -0.345 1.00 1.99 C ATOM 2376 CZ PHE A1202 13.239 -3.610 0.368 1.00 1.67 C ATOM 0 H PHE A1202 13.312 -8.772 -3.932 1.00 0.94 H new ATOM 0 HA PHE A1202 14.590 -8.388 -1.471 1.00 0.99 H new ATOM 0 HB2 PHE A1202 14.532 -6.651 -3.136 1.00 1.13 H new ATOM 0 HB3 PHE A1202 12.786 -6.724 -3.270 1.00 1.13 H new ATOM 0 HD1 PHE A1202 15.584 -5.650 -1.042 1.00 2.72 H new ATOM 0 HD2 PHE A1202 11.365 -5.388 -1.868 1.00 2.04 H new ATOM 0 HE1 PHE A1202 15.366 -3.845 0.650 1.00 2.98 H new ATOM 0 HE2 PHE A1202 11.142 -3.608 -0.148 1.00 1.99 H new ATOM 0 HZ PHE A1202 13.142 -2.833 1.111 1.00 1.67 H new ATOM 2386 N MET A1203 11.303 -8.540 -1.204 1.00 0.75 N ATOM 2387 CA MET A1203 10.205 -8.755 -0.254 1.00 0.76 C ATOM 2388 C MET A1203 10.322 -10.095 0.471 1.00 0.80 C ATOM 2389 O MET A1203 10.204 -10.143 1.693 1.00 0.93 O ATOM 2390 CB MET A1203 8.857 -8.687 -0.976 1.00 0.76 C ATOM 2391 CG MET A1203 8.502 -7.237 -1.318 1.00 1.22 C ATOM 2392 SD MET A1203 6.811 -6.984 -1.910 1.00 1.33 S ATOM 2393 CE MET A1203 6.817 -8.033 -3.384 1.00 2.01 C ATOM 0 H MET A1203 11.012 -8.583 -2.181 1.00 0.75 H new ATOM 0 HA MET A1203 10.270 -7.962 0.491 1.00 0.76 H new ATOM 0 HB2 MET A1203 8.896 -9.282 -1.888 1.00 0.76 H new ATOM 0 HB3 MET A1203 8.079 -9.119 -0.347 1.00 0.76 H new ATOM 0 HG2 MET A1203 8.657 -6.622 -0.431 1.00 1.22 H new ATOM 0 HG3 MET A1203 9.195 -6.879 -2.079 1.00 1.22 H new ATOM 0 HE1 MET A1203 5.887 -7.892 -3.935 1.00 2.01 H new ATOM 0 HE2 MET A1203 7.660 -7.762 -4.020 1.00 2.01 H new ATOM 0 HE3 MET A1203 6.908 -9.078 -3.087 1.00 2.01 H new ATOM 2403 N THR A1204 10.588 -11.174 -0.267 1.00 0.79 N ATOM 2404 CA THR A1204 10.766 -12.515 0.304 1.00 0.88 C ATOM 2405 C THR A1204 11.919 -12.543 1.312 1.00 0.93 C ATOM 2406 O THR A1204 11.770 -13.084 2.403 1.00 1.06 O ATOM 2407 CB THR A1204 11.030 -13.531 -0.820 1.00 0.99 C ATOM 2408 OG1 THR A1204 9.908 -13.653 -1.673 1.00 1.52 O ATOM 2409 CG2 THR A1204 11.313 -14.909 -0.244 1.00 1.37 C ATOM 0 H THR A1204 10.687 -11.145 -1.282 1.00 0.79 H new ATOM 0 HA THR A1204 9.850 -12.782 0.831 1.00 0.88 H new ATOM 0 HB THR A1204 11.890 -13.164 -1.380 1.00 0.99 H new ATOM 0 HG1 THR A1204 9.874 -12.885 -2.281 1.00 1.52 H new ATOM 0 HG21 THR A1204 11.497 -15.612 -1.056 1.00 1.37 H new ATOM 0 HG22 THR A1204 12.191 -14.861 0.400 1.00 1.37 H new ATOM 0 HG23 THR A1204 10.454 -15.244 0.338 1.00 1.37 H new ATOM 2417 N GLU A1205 13.051 -11.924 0.984 1.00 0.97 N ATOM 2418 CA GLU A1205 14.218 -11.827 1.866 1.00 1.17 C ATOM 2419 C GLU A1205 13.882 -11.072 3.169 1.00 1.27 C ATOM 2420 O GLU A1205 14.259 -11.505 4.257 1.00 1.42 O ATOM 2421 CB GLU A1205 15.361 -11.169 1.078 1.00 1.34 C ATOM 2422 CG GLU A1205 16.677 -11.120 1.863 1.00 1.60 C ATOM 2423 CD GLU A1205 17.787 -10.401 1.088 1.00 2.48 C ATOM 2424 OE1 GLU A1205 18.107 -10.793 -0.061 1.00 3.61 O ATOM 2425 OE2 GLU A1205 18.385 -9.451 1.653 1.00 2.97 O ATOM 0 H GLU A1205 13.188 -11.467 0.083 1.00 0.97 H new ATOM 0 HA GLU A1205 14.533 -12.822 2.181 1.00 1.17 H new ATOM 0 HB2 GLU A1205 15.518 -11.718 0.149 1.00 1.34 H new ATOM 0 HB3 GLU A1205 15.070 -10.155 0.804 1.00 1.34 H new ATOM 0 HG2 GLU A1205 16.512 -10.612 2.813 1.00 1.60 H new ATOM 0 HG3 GLU A1205 16.998 -12.136 2.095 1.00 1.60 H new ATOM 2432 N HIS A1206 13.102 -9.991 3.076 1.00 1.23 N ATOM 2433 CA HIS A1206 12.633 -9.199 4.226 1.00 1.36 C ATOM 2434 C HIS A1206 11.644 -9.994 5.108 1.00 1.38 C ATOM 2435 O HIS A1206 11.690 -9.941 6.341 1.00 1.54 O ATOM 2436 CB HIS A1206 11.984 -7.918 3.669 1.00 1.35 C ATOM 2437 CG HIS A1206 11.899 -6.776 4.643 1.00 1.39 C ATOM 2438 ND1 HIS A1206 10.846 -6.477 5.476 1.00 2.02 N ATOM 2439 CD2 HIS A1206 12.820 -5.773 4.777 1.00 1.67 C ATOM 2440 CE1 HIS A1206 11.139 -5.330 6.117 1.00 2.32 C ATOM 2441 NE2 HIS A1206 12.342 -4.868 5.733 1.00 1.96 N ATOM 0 H HIS A1206 12.770 -9.631 2.181 1.00 1.23 H new ATOM 0 HA HIS A1206 13.474 -8.949 4.873 1.00 1.36 H new ATOM 0 HB2 HIS A1206 12.550 -7.591 2.797 1.00 1.35 H new ATOM 0 HB3 HIS A1206 10.978 -8.158 3.324 1.00 1.35 H new ATOM 0 HD2 HIS A1206 13.753 -5.693 4.239 1.00 1.67 H new ATOM 0 HE1 HIS A1206 10.497 -4.848 6.839 1.00 2.32 H new ATOM 0 HE2 HIS A1206 12.812 -4.028 6.070 1.00 1.96 H new ATOM 2449 N GLU A1207 10.792 -10.801 4.474 1.00 1.28 N ATOM 2450 CA GLU A1207 9.873 -11.730 5.138 1.00 1.35 C ATOM 2451 C GLU A1207 10.613 -12.923 5.782 1.00 1.42 C ATOM 2452 O GLU A1207 10.191 -13.419 6.827 1.00 1.55 O ATOM 2453 CB GLU A1207 8.799 -12.151 4.122 1.00 1.28 C ATOM 2454 CG GLU A1207 7.576 -12.745 4.819 1.00 1.86 C ATOM 2455 CD GLU A1207 6.531 -13.220 3.815 1.00 1.99 C ATOM 2456 OE1 GLU A1207 5.758 -12.389 3.284 1.00 2.54 O ATOM 2457 OE2 GLU A1207 6.463 -14.441 3.527 1.00 2.92 O ATOM 0 H GLU A1207 10.719 -10.828 3.457 1.00 1.28 H new ATOM 0 HA GLU A1207 9.383 -11.234 5.976 1.00 1.35 H new ATOM 0 HB2 GLU A1207 8.498 -11.287 3.529 1.00 1.28 H new ATOM 0 HB3 GLU A1207 9.217 -12.883 3.430 1.00 1.28 H new ATOM 0 HG2 GLU A1207 7.885 -13.581 5.446 1.00 1.86 H new ATOM 0 HG3 GLU A1207 7.134 -11.998 5.478 1.00 1.86 H new ATOM 2464 N ARG A1208 11.765 -13.330 5.225 1.00 1.40 N ATOM 2465 CA ARG A1208 12.720 -14.291 5.817 1.00 1.57 C ATOM 2466 C ARG A1208 13.451 -13.735 7.046 1.00 1.72 C ATOM 2467 O ARG A1208 13.865 -14.531 7.895 1.00 2.02 O ATOM 2468 CB ARG A1208 13.730 -14.760 4.749 1.00 1.58 C ATOM 2469 CG ARG A1208 13.496 -16.187 4.240 1.00 1.72 C ATOM 2470 CD ARG A1208 12.154 -16.398 3.526 1.00 2.56 C ATOM 2471 NE ARG A1208 12.150 -17.704 2.845 1.00 3.51 N ATOM 2472 CZ ARG A1208 11.258 -18.157 1.986 1.00 4.93 C ATOM 2473 NH1 ARG A1208 10.121 -17.579 1.746 1.00 5.93 N ATOM 2474 NH2 ARG A1208 11.487 -19.235 1.307 1.00 5.86 N ATOM 0 H ARG A1208 12.072 -12.988 4.315 1.00 1.40 H new ATOM 0 HA ARG A1208 12.137 -15.143 6.167 1.00 1.57 H new ATOM 0 HB2 ARG A1208 13.690 -14.074 3.903 1.00 1.58 H new ATOM 0 HB3 ARG A1208 14.736 -14.696 5.164 1.00 1.58 H new ATOM 0 HG2 ARG A1208 14.302 -16.452 3.556 1.00 1.72 H new ATOM 0 HG3 ARG A1208 13.556 -16.874 5.084 1.00 1.72 H new ATOM 0 HD2 ARG A1208 11.337 -16.351 4.246 1.00 2.56 H new ATOM 0 HD3 ARG A1208 11.987 -15.600 2.802 1.00 2.56 H new ATOM 0 HE ARG A1208 12.926 -18.329 3.063 1.00 3.51 H new ATOM 0 HH11 ARG A1208 9.872 -16.720 2.236 1.00 5.93 H new ATOM 0 HH12 ARG A1208 9.476 -17.984 1.067 1.00 5.93 H new ATOM 0 HH21 ARG A1208 12.363 -19.741 1.434 1.00 5.86 H new ATOM 0 HH22 ARG A1208 10.791 -19.578 0.645 1.00 5.86 H new ATOM 2488 N LYS A1209 13.587 -12.405 7.169 1.00 1.61 N ATOM 2489 CA LYS A1209 14.027 -11.756 8.431 1.00 1.73 C ATOM 2490 C LYS A1209 12.940 -11.953 9.491 1.00 1.81 C ATOM 2491 O LYS A1209 13.232 -12.392 10.607 1.00 2.23 O ATOM 2492 CB LYS A1209 14.359 -10.254 8.267 1.00 1.66 C ATOM 2493 CG LYS A1209 15.267 -9.892 7.083 1.00 2.03 C ATOM 2494 CD LYS A1209 16.605 -10.631 7.105 1.00 1.89 C ATOM 2495 CE LYS A1209 17.386 -10.418 5.809 1.00 2.41 C ATOM 2496 NZ LYS A1209 18.638 -11.206 5.831 1.00 2.52 N ATOM 0 H LYS A1209 13.399 -11.749 6.411 1.00 1.61 H new ATOM 0 HA LYS A1209 14.957 -12.233 8.740 1.00 1.73 H new ATOM 0 HB2 LYS A1209 13.423 -9.704 8.163 1.00 1.66 H new ATOM 0 HB3 LYS A1209 14.834 -9.905 9.184 1.00 1.66 H new ATOM 0 HG2 LYS A1209 14.748 -10.120 6.152 1.00 2.03 H new ATOM 0 HG3 LYS A1209 15.452 -8.818 7.090 1.00 2.03 H new ATOM 0 HD2 LYS A1209 17.199 -10.284 7.950 1.00 1.89 H new ATOM 0 HD3 LYS A1209 16.431 -11.697 7.255 1.00 1.89 H new ATOM 0 HE2 LYS A1209 16.776 -10.714 4.956 1.00 2.41 H new ATOM 0 HE3 LYS A1209 17.616 -9.360 5.684 1.00 2.41 H new ATOM 0 HZ1 LYS A1209 19.160 -11.053 4.945 1.00 2.52 H new ATOM 0 HZ2 LYS A1209 19.224 -10.904 6.635 1.00 2.52 H new ATOM 0 HZ3 LYS A1209 18.411 -12.216 5.929 1.00 2.52 H new ATOM 2510 N GLY A1210 11.703 -11.668 9.080 1.00 1.82 N ATOM 2511 CA GLY A1210 10.464 -11.840 9.853 1.00 1.85 C ATOM 2512 C GLY A1210 9.659 -10.541 9.982 1.00 1.69 C ATOM 2513 O GLY A1210 9.058 -10.278 11.026 1.00 1.82 O ATOM 0 H GLY A1210 11.525 -11.290 8.149 1.00 1.82 H new ATOM 0 HA2 GLY A1210 9.845 -12.600 9.375 1.00 1.85 H new ATOM 0 HA3 GLY A1210 10.710 -12.210 10.848 1.00 1.85 H new ATOM 2517 N ARG A1211 9.691 -9.699 8.937 1.00 1.49 N ATOM 2518 CA ARG A1211 9.021 -8.390 8.831 1.00 1.39 C ATOM 2519 C ARG A1211 8.065 -8.400 7.632 1.00 1.42 C ATOM 2520 O ARG A1211 8.369 -9.032 6.623 1.00 1.90 O ATOM 2521 CB ARG A1211 10.087 -7.293 8.688 1.00 1.44 C ATOM 2522 CG ARG A1211 10.877 -7.038 9.977 1.00 1.68 C ATOM 2523 CD ARG A1211 11.933 -5.946 9.755 1.00 2.43 C ATOM 2524 NE ARG A1211 12.548 -5.559 11.032 1.00 2.87 N ATOM 2525 CZ ARG A1211 13.742 -5.041 11.250 1.00 3.95 C ATOM 2526 NH1 ARG A1211 14.623 -4.822 10.314 1.00 5.04 N ATOM 2527 NH2 ARG A1211 14.065 -4.730 12.465 1.00 4.36 N ATOM 0 H ARG A1211 10.216 -9.926 8.092 1.00 1.49 H new ATOM 0 HA ARG A1211 8.435 -8.189 9.728 1.00 1.39 H new ATOM 0 HB2 ARG A1211 10.781 -7.572 7.895 1.00 1.44 H new ATOM 0 HB3 ARG A1211 9.604 -6.366 8.377 1.00 1.44 H new ATOM 0 HG2 ARG A1211 10.197 -6.737 10.774 1.00 1.68 H new ATOM 0 HG3 ARG A1211 11.361 -7.959 10.302 1.00 1.68 H new ATOM 0 HD2 ARG A1211 12.700 -6.307 9.070 1.00 2.43 H new ATOM 0 HD3 ARG A1211 11.472 -5.076 9.288 1.00 2.43 H new ATOM 0 HE ARG A1211 11.975 -5.711 11.862 1.00 2.87 H new ATOM 0 HH11 ARG A1211 14.406 -5.054 9.345 1.00 5.04 H new ATOM 0 HH12 ARG A1211 15.529 -4.418 10.551 1.00 5.04 H new ATOM 0 HH21 ARG A1211 13.403 -4.887 13.225 1.00 4.36 H new ATOM 0 HH22 ARG A1211 14.982 -4.328 12.662 1.00 4.36 H new ATOM 2541 N THR A1212 6.933 -7.709 7.718 1.00 1.14 N ATOM 2542 CA THR A1212 5.828 -7.814 6.744 1.00 1.07 C ATOM 2543 C THR A1212 6.086 -6.986 5.475 1.00 0.95 C ATOM 2544 O THR A1212 6.598 -5.869 5.564 1.00 1.01 O ATOM 2545 CB THR A1212 4.513 -7.393 7.425 1.00 1.12 C ATOM 2546 OG1 THR A1212 4.268 -8.205 8.558 1.00 1.33 O ATOM 2547 CG2 THR A1212 3.280 -7.532 6.532 1.00 1.09 C ATOM 0 H THR A1212 6.745 -7.049 8.472 1.00 1.14 H new ATOM 0 HA THR A1212 5.755 -8.852 6.419 1.00 1.07 H new ATOM 0 HB THR A1212 4.654 -6.342 7.678 1.00 1.12 H new ATOM 0 HG1 THR A1212 3.430 -7.928 8.984 1.00 1.33 H new ATOM 0 HG21 THR A1212 2.394 -7.216 7.083 1.00 1.09 H new ATOM 0 HG22 THR A1212 3.399 -6.907 5.647 1.00 1.09 H new ATOM 0 HG23 THR A1212 3.166 -8.573 6.228 1.00 1.09 H new ATOM 2555 N ALA A1213 5.704 -7.501 4.299 1.00 0.83 N ATOM 2556 CA ALA A1213 5.857 -6.837 2.997 1.00 0.73 C ATOM 2557 C ALA A1213 4.555 -6.876 2.168 1.00 0.66 C ATOM 2558 O ALA A1213 4.087 -7.953 1.789 1.00 0.78 O ATOM 2559 CB ALA A1213 7.018 -7.509 2.246 1.00 0.78 C ATOM 0 H ALA A1213 5.266 -8.419 4.225 1.00 0.83 H new ATOM 0 HA ALA A1213 6.079 -5.782 3.158 1.00 0.73 H new ATOM 0 HB1 ALA A1213 7.149 -7.031 1.275 1.00 0.78 H new ATOM 0 HB2 ALA A1213 7.935 -7.407 2.827 1.00 0.78 H new ATOM 0 HB3 ALA A1213 6.795 -8.566 2.102 1.00 0.78 H new ATOM 2565 N VAL A1214 3.996 -5.706 1.837 1.00 0.61 N ATOM 2566 CA VAL A1214 2.765 -5.553 1.029 1.00 0.64 C ATOM 2567 C VAL A1214 2.949 -4.541 -0.103 1.00 0.66 C ATOM 2568 O VAL A1214 3.787 -3.644 -0.019 1.00 0.64 O ATOM 2569 CB VAL A1214 1.530 -5.191 1.882 1.00 0.73 C ATOM 2570 CG1 VAL A1214 1.175 -6.324 2.853 1.00 1.31 C ATOM 2571 CG2 VAL A1214 1.685 -3.883 2.667 1.00 0.98 C ATOM 0 H VAL A1214 4.392 -4.812 2.128 1.00 0.61 H new ATOM 0 HA VAL A1214 2.577 -6.532 0.587 1.00 0.64 H new ATOM 0 HB VAL A1214 0.721 -5.046 1.166 1.00 0.73 H new ATOM 0 HG11 VAL A1214 0.302 -6.040 3.440 1.00 1.31 H new ATOM 0 HG12 VAL A1214 0.954 -7.230 2.289 1.00 1.31 H new ATOM 0 HG13 VAL A1214 2.017 -6.508 3.521 1.00 1.31 H new ATOM 0 HG21 VAL A1214 0.779 -3.694 3.242 1.00 0.98 H new ATOM 0 HG22 VAL A1214 2.535 -3.964 3.345 1.00 0.98 H new ATOM 0 HG23 VAL A1214 1.852 -3.060 1.973 1.00 0.98 H new ATOM 2581 N LEU A1215 2.181 -4.689 -1.184 1.00 0.72 N ATOM 2582 CA LEU A1215 2.360 -3.919 -2.421 1.00 0.69 C ATOM 2583 C LEU A1215 1.053 -3.361 -2.995 1.00 0.45 C ATOM 2584 O LEU A1215 -0.039 -3.821 -2.658 1.00 0.43 O ATOM 2585 CB LEU A1215 3.260 -4.677 -3.422 1.00 1.00 C ATOM 2586 CG LEU A1215 3.012 -6.153 -3.763 1.00 1.13 C ATOM 2587 CD1 LEU A1215 3.279 -7.104 -2.600 1.00 2.99 C ATOM 2588 CD2 LEU A1215 1.616 -6.385 -4.320 1.00 2.04 C ATOM 0 H LEU A1215 1.408 -5.353 -1.228 1.00 0.72 H new ATOM 0 HA LEU A1215 2.907 -3.010 -2.170 1.00 0.69 H new ATOM 0 HB2 LEU A1215 3.225 -4.124 -4.361 1.00 1.00 H new ATOM 0 HB3 LEU A1215 4.281 -4.605 -3.048 1.00 1.00 H new ATOM 0 HG LEU A1215 3.742 -6.386 -4.539 1.00 1.13 H new ATOM 0 HD11 LEU A1215 3.083 -8.129 -2.915 1.00 2.99 H new ATOM 0 HD12 LEU A1215 4.319 -7.014 -2.288 1.00 2.99 H new ATOM 0 HD13 LEU A1215 2.626 -6.850 -1.765 1.00 2.99 H new ATOM 0 HD21 LEU A1215 1.486 -7.443 -4.547 1.00 2.04 H new ATOM 0 HD22 LEU A1215 0.874 -6.078 -3.582 1.00 2.04 H new ATOM 0 HD23 LEU A1215 1.486 -5.800 -5.231 1.00 2.04 H new ATOM 2600 N VAL A1216 1.195 -2.322 -3.826 1.00 0.44 N ATOM 2601 CA VAL A1216 0.111 -1.444 -4.297 1.00 0.44 C ATOM 2602 C VAL A1216 0.006 -1.404 -5.826 1.00 0.36 C ATOM 2603 O VAL A1216 1.017 -1.362 -6.539 1.00 0.37 O ATOM 2604 CB VAL A1216 0.297 -0.012 -3.742 1.00 0.57 C ATOM 2605 CG1 VAL A1216 -0.940 0.868 -3.982 1.00 0.64 C ATOM 2606 CG2 VAL A1216 0.583 0.016 -2.232 1.00 0.70 C ATOM 0 H VAL A1216 2.104 -2.057 -4.206 1.00 0.44 H new ATOM 0 HA VAL A1216 -0.821 -1.864 -3.920 1.00 0.44 H new ATOM 0 HB VAL A1216 1.157 0.378 -4.286 1.00 0.57 H new ATOM 0 HG11 VAL A1216 -0.763 1.864 -3.575 1.00 0.64 H new ATOM 0 HG12 VAL A1216 -1.132 0.942 -5.052 1.00 0.64 H new ATOM 0 HG13 VAL A1216 -1.804 0.423 -3.489 1.00 0.64 H new ATOM 0 HG21 VAL A1216 0.704 1.048 -1.904 1.00 0.70 H new ATOM 0 HG22 VAL A1216 -0.249 -0.441 -1.696 1.00 0.70 H new ATOM 0 HG23 VAL A1216 1.497 -0.540 -2.024 1.00 0.70 H new ATOM 2616 N ALA A1217 -1.235 -1.361 -6.322 1.00 0.36 N ATOM 2617 CA ALA A1217 -1.573 -1.194 -7.737 1.00 0.34 C ATOM 2618 C ALA A1217 -2.760 -0.231 -7.952 1.00 0.39 C ATOM 2619 O ALA A1217 -3.597 -0.064 -7.059 1.00 0.43 O ATOM 2620 CB ALA A1217 -1.851 -2.578 -8.326 1.00 0.34 C ATOM 0 H ALA A1217 -2.060 -1.445 -5.727 1.00 0.36 H new ATOM 0 HA ALA A1217 -0.731 -0.732 -8.254 1.00 0.34 H new ATOM 0 HB1 ALA A1217 -2.106 -2.480 -9.381 1.00 0.34 H new ATOM 0 HB2 ALA A1217 -0.963 -3.202 -8.223 1.00 0.34 H new ATOM 0 HB3 ALA A1217 -2.683 -3.040 -7.794 1.00 0.34 H new ATOM 2626 N VAL A1218 -2.824 0.393 -9.135 1.00 0.48 N ATOM 2627 CA VAL A1218 -3.749 1.484 -9.498 1.00 0.56 C ATOM 2628 C VAL A1218 -4.297 1.282 -10.916 1.00 0.66 C ATOM 2629 O VAL A1218 -3.529 1.313 -11.878 1.00 0.73 O ATOM 2630 CB VAL A1218 -3.019 2.848 -9.429 1.00 0.72 C ATOM 2631 CG1 VAL A1218 -3.957 4.014 -9.760 1.00 0.79 C ATOM 2632 CG2 VAL A1218 -2.395 3.124 -8.053 1.00 0.80 C ATOM 0 H VAL A1218 -2.204 0.142 -9.905 1.00 0.48 H new ATOM 0 HA VAL A1218 -4.577 1.473 -8.789 1.00 0.56 H new ATOM 0 HB VAL A1218 -2.226 2.778 -10.173 1.00 0.72 H new ATOM 0 HG11 VAL A1218 -3.406 4.953 -9.700 1.00 0.79 H new ATOM 0 HG12 VAL A1218 -4.352 3.888 -10.768 1.00 0.79 H new ATOM 0 HG13 VAL A1218 -4.781 4.031 -9.047 1.00 0.79 H new ATOM 0 HG21 VAL A1218 -1.898 4.094 -8.067 1.00 0.80 H new ATOM 0 HG22 VAL A1218 -3.177 3.128 -7.293 1.00 0.80 H new ATOM 0 HG23 VAL A1218 -1.667 2.347 -7.821 1.00 0.80 H new ATOM 2642 N ASP A1219 -5.617 1.123 -11.059 1.00 0.73 N ATOM 2643 CA ASP A1219 -6.331 0.962 -12.343 1.00 0.88 C ATOM 2644 C ASP A1219 -5.635 -0.016 -13.331 1.00 0.82 C ATOM 2645 O ASP A1219 -5.393 0.318 -14.496 1.00 0.87 O ATOM 2646 CB ASP A1219 -6.663 2.346 -12.945 1.00 1.13 C ATOM 2647 CG ASP A1219 -7.874 3.019 -12.288 1.00 2.16 C ATOM 2648 OD1 ASP A1219 -9.018 2.755 -12.729 1.00 3.05 O ATOM 2649 OD2 ASP A1219 -7.714 3.895 -11.410 1.00 3.44 O ATOM 0 H ASP A1219 -6.247 1.101 -10.257 1.00 0.73 H new ATOM 0 HA ASP A1219 -7.279 0.465 -12.136 1.00 0.88 H new ATOM 0 HB2 ASP A1219 -5.795 2.997 -12.843 1.00 1.13 H new ATOM 0 HB3 ASP A1219 -6.853 2.234 -14.012 1.00 1.13 H new ATOM 2654 N ASP A1220 -5.310 -1.226 -12.857 1.00 0.82 N ATOM 2655 CA ASP A1220 -4.597 -2.303 -13.580 1.00 0.90 C ATOM 2656 C ASP A1220 -3.103 -2.023 -13.896 1.00 0.80 C ATOM 2657 O ASP A1220 -2.552 -2.563 -14.861 1.00 0.91 O ATOM 2658 CB ASP A1220 -5.449 -2.805 -14.768 1.00 1.09 C ATOM 2659 CG ASP A1220 -5.010 -4.134 -15.393 1.00 2.65 C ATOM 2660 OD1 ASP A1220 -4.830 -5.137 -14.667 1.00 3.51 O ATOM 2661 OD2 ASP A1220 -4.973 -4.227 -16.647 1.00 4.04 O ATOM 0 H ASP A1220 -5.549 -1.502 -11.904 1.00 0.82 H new ATOM 0 HA ASP A1220 -4.496 -3.138 -12.887 1.00 0.90 H new ATOM 0 HB2 ASP A1220 -6.481 -2.907 -14.432 1.00 1.09 H new ATOM 0 HB3 ASP A1220 -5.441 -2.040 -15.545 1.00 1.09 H new ATOM 2666 N GLU A1221 -2.415 -1.214 -13.078 1.00 0.69 N ATOM 2667 CA GLU A1221 -0.957 -0.982 -13.143 1.00 0.68 C ATOM 2668 C GLU A1221 -0.247 -1.082 -11.774 1.00 0.55 C ATOM 2669 O GLU A1221 -0.740 -0.564 -10.774 1.00 0.55 O ATOM 2670 CB GLU A1221 -0.670 0.424 -13.696 1.00 0.80 C ATOM 2671 CG GLU A1221 -1.125 0.697 -15.137 1.00 1.36 C ATOM 2672 CD GLU A1221 -0.337 0.000 -16.257 1.00 2.11 C ATOM 2673 OE1 GLU A1221 0.622 -0.781 -16.016 1.00 3.12 O ATOM 2674 OE2 GLU A1221 -0.693 0.254 -17.434 1.00 2.85 O ATOM 0 H GLU A1221 -2.866 -0.686 -12.331 1.00 0.69 H new ATOM 0 HA GLU A1221 -0.570 -1.769 -13.791 1.00 0.68 H new ATOM 0 HB2 GLU A1221 -1.150 1.153 -13.042 1.00 0.80 H new ATOM 0 HB3 GLU A1221 0.404 0.602 -13.637 1.00 0.80 H new ATOM 0 HG2 GLU A1221 -2.171 0.403 -15.224 1.00 1.36 H new ATOM 0 HG3 GLU A1221 -1.081 1.772 -15.309 1.00 1.36 H new ATOM 2681 N LEU A1222 0.960 -1.661 -11.727 1.00 0.51 N ATOM 2682 CA LEU A1222 1.876 -1.633 -10.568 1.00 0.47 C ATOM 2683 C LEU A1222 2.231 -0.191 -10.170 1.00 0.51 C ATOM 2684 O LEU A1222 2.493 0.627 -11.058 1.00 0.74 O ATOM 2685 CB LEU A1222 3.189 -2.371 -10.948 1.00 0.54 C ATOM 2686 CG LEU A1222 3.369 -3.799 -10.389 1.00 0.67 C ATOM 2687 CD1 LEU A1222 3.573 -3.823 -8.874 1.00 0.76 C ATOM 2688 CD2 LEU A1222 2.184 -4.704 -10.721 1.00 0.94 C ATOM 0 H LEU A1222 1.343 -2.180 -12.518 1.00 0.51 H new ATOM 0 HA LEU A1222 1.378 -2.117 -9.728 1.00 0.47 H new ATOM 0 HB2 LEU A1222 3.249 -2.421 -12.035 1.00 0.54 H new ATOM 0 HB3 LEU A1222 4.030 -1.765 -10.610 1.00 0.54 H new ATOM 0 HG LEU A1222 4.269 -4.174 -10.877 1.00 0.67 H new ATOM 0 HD11 LEU A1222 3.694 -4.853 -8.539 1.00 0.76 H new ATOM 0 HD12 LEU A1222 4.465 -3.251 -8.618 1.00 0.76 H new ATOM 0 HD13 LEU A1222 2.706 -3.381 -8.383 1.00 0.76 H new ATOM 0 HD21 LEU A1222 2.357 -5.697 -10.307 1.00 0.94 H new ATOM 0 HD22 LEU A1222 1.274 -4.285 -10.291 1.00 0.94 H new ATOM 0 HD23 LEU A1222 2.073 -4.776 -11.803 1.00 0.94 H new ATOM 2700 N CYS A1223 2.367 0.112 -8.869 1.00 0.39 N ATOM 2701 CA CYS A1223 2.853 1.437 -8.456 1.00 0.45 C ATOM 2702 C CYS A1223 3.889 1.498 -7.315 1.00 0.52 C ATOM 2703 O CYS A1223 4.770 2.358 -7.389 1.00 0.71 O ATOM 2704 CB CYS A1223 1.648 2.365 -8.248 1.00 0.52 C ATOM 2705 SG CYS A1223 0.924 2.178 -6.599 1.00 0.51 S ATOM 0 H CYS A1223 2.153 -0.525 -8.102 1.00 0.39 H new ATOM 0 HA CYS A1223 3.469 1.794 -9.281 1.00 0.45 H new ATOM 0 HB2 CYS A1223 1.958 3.400 -8.392 1.00 0.52 H new ATOM 0 HB3 CYS A1223 0.891 2.151 -9.003 1.00 0.52 H new ATOM 0 HG CYS A1223 -0.088 2.985 -6.475 1.00 0.51 H new ATOM 2711 N GLY A1224 3.880 0.612 -6.313 1.00 0.45 N ATOM 2712 CA GLY A1224 4.815 0.711 -5.178 1.00 0.52 C ATOM 2713 C GLY A1224 4.723 -0.442 -4.174 1.00 0.48 C ATOM 2714 O GLY A1224 3.863 -1.315 -4.307 1.00 0.49 O ATOM 0 H GLY A1224 3.240 -0.180 -6.261 1.00 0.45 H new ATOM 0 HA2 GLY A1224 5.833 0.758 -5.566 1.00 0.52 H new ATOM 0 HA3 GLY A1224 4.631 1.648 -4.653 1.00 0.52 H new ATOM 2718 N LEU A1225 5.607 -0.439 -3.171 1.00 0.53 N ATOM 2719 CA LEU A1225 5.592 -1.394 -2.054 1.00 0.53 C ATOM 2720 C LEU A1225 5.962 -0.778 -0.693 1.00 0.62 C ATOM 2721 O LEU A1225 6.658 0.238 -0.620 1.00 0.71 O ATOM 2722 CB LEU A1225 6.425 -2.651 -2.373 1.00 0.50 C ATOM 2723 CG LEU A1225 7.956 -2.478 -2.436 1.00 0.59 C ATOM 2724 CD1 LEU A1225 8.613 -3.834 -2.196 1.00 1.58 C ATOM 2725 CD2 LEU A1225 8.436 -1.977 -3.800 1.00 1.37 C ATOM 0 H LEU A1225 6.367 0.238 -3.110 1.00 0.53 H new ATOM 0 HA LEU A1225 4.552 -1.702 -1.945 1.00 0.53 H new ATOM 0 HB2 LEU A1225 6.200 -3.407 -1.620 1.00 0.50 H new ATOM 0 HB3 LEU A1225 6.089 -3.046 -3.332 1.00 0.50 H new ATOM 0 HG LEU A1225 8.228 -1.742 -1.679 1.00 0.59 H new ATOM 0 HD11 LEU A1225 9.697 -3.726 -2.238 1.00 1.58 H new ATOM 0 HD12 LEU A1225 8.324 -4.210 -1.215 1.00 1.58 H new ATOM 0 HD13 LEU A1225 8.289 -4.536 -2.964 1.00 1.58 H new ATOM 0 HD21 LEU A1225 9.521 -1.873 -3.788 1.00 1.37 H new ATOM 0 HD22 LEU A1225 8.148 -2.691 -4.572 1.00 1.37 H new ATOM 0 HD23 LEU A1225 7.981 -1.010 -4.013 1.00 1.37 H new ATOM 2737 N ILE A1226 5.488 -1.426 0.374 1.00 0.64 N ATOM 2738 CA ILE A1226 5.563 -1.004 1.778 1.00 0.70 C ATOM 2739 C ILE A1226 6.096 -2.167 2.630 1.00 0.67 C ATOM 2740 O ILE A1226 5.528 -3.261 2.632 1.00 0.66 O ATOM 2741 CB ILE A1226 4.165 -0.557 2.287 1.00 0.75 C ATOM 2742 CG1 ILE A1226 3.496 0.487 1.355 1.00 0.79 C ATOM 2743 CG2 ILE A1226 4.256 -0.026 3.734 1.00 0.85 C ATOM 2744 CD1 ILE A1226 2.088 0.923 1.786 1.00 0.89 C ATOM 0 H ILE A1226 5.009 -2.321 0.275 1.00 0.64 H new ATOM 0 HA ILE A1226 6.241 -0.155 1.862 1.00 0.70 H new ATOM 0 HB ILE A1226 3.526 -1.440 2.277 1.00 0.75 H new ATOM 0 HG12 ILE A1226 4.134 1.369 1.302 1.00 0.79 H new ATOM 0 HG13 ILE A1226 3.441 0.073 0.348 1.00 0.79 H new ATOM 0 HG21 ILE A1226 3.266 0.282 4.072 1.00 0.85 H new ATOM 0 HG22 ILE A1226 4.634 -0.813 4.387 1.00 0.85 H new ATOM 0 HG23 ILE A1226 4.932 0.828 3.766 1.00 0.85 H new ATOM 0 HD11 ILE A1226 1.700 1.653 1.076 1.00 0.89 H new ATOM 0 HD12 ILE A1226 1.430 0.055 1.810 1.00 0.89 H new ATOM 0 HD13 ILE A1226 2.134 1.371 2.779 1.00 0.89 H new ATOM 2756 N ALA A1227 7.166 -1.917 3.383 1.00 0.74 N ATOM 2757 CA ALA A1227 7.764 -2.842 4.339 1.00 0.76 C ATOM 2758 C ALA A1227 7.548 -2.350 5.785 1.00 0.81 C ATOM 2759 O ALA A1227 7.753 -1.169 6.094 1.00 0.86 O ATOM 2760 CB ALA A1227 9.242 -3.014 3.973 1.00 0.79 C ATOM 0 H ALA A1227 7.660 -1.025 3.340 1.00 0.74 H new ATOM 0 HA ALA A1227 7.283 -3.819 4.289 1.00 0.76 H new ATOM 0 HB1 ALA A1227 9.713 -3.703 4.675 1.00 0.79 H new ATOM 0 HB2 ALA A1227 9.322 -3.414 2.962 1.00 0.79 H new ATOM 0 HB3 ALA A1227 9.744 -2.048 4.021 1.00 0.79 H new ATOM 2766 N ILE A1228 7.090 -3.253 6.659 1.00 0.86 N ATOM 2767 CA ILE A1228 6.618 -2.956 8.021 1.00 0.91 C ATOM 2768 C ILE A1228 7.327 -3.865 9.037 1.00 0.99 C ATOM 2769 O ILE A1228 7.433 -5.078 8.842 1.00 1.03 O ATOM 2770 CB ILE A1228 5.072 -3.086 8.098 1.00 0.96 C ATOM 2771 CG1 ILE A1228 4.379 -2.298 6.955 1.00 1.26 C ATOM 2772 CG2 ILE A1228 4.544 -2.620 9.467 1.00 1.25 C ATOM 2773 CD1 ILE A1228 2.845 -2.285 6.996 1.00 1.34 C ATOM 0 H ILE A1228 7.035 -4.246 6.432 1.00 0.86 H new ATOM 0 HA ILE A1228 6.868 -1.926 8.273 1.00 0.91 H new ATOM 0 HB ILE A1228 4.829 -4.142 7.976 1.00 0.96 H new ATOM 0 HG12 ILE A1228 4.734 -1.268 6.980 1.00 1.26 H new ATOM 0 HG13 ILE A1228 4.696 -2.721 6.002 1.00 1.26 H new ATOM 0 HG21 ILE A1228 3.459 -2.722 9.492 1.00 1.25 H new ATOM 0 HG22 ILE A1228 4.985 -3.232 10.254 1.00 1.25 H new ATOM 0 HG23 ILE A1228 4.814 -1.576 9.625 1.00 1.25 H new ATOM 0 HD11 ILE A1228 2.463 -1.708 6.154 1.00 1.34 H new ATOM 0 HD12 ILE A1228 2.471 -3.307 6.935 1.00 1.34 H new ATOM 0 HD13 ILE A1228 2.510 -1.831 7.929 1.00 1.34 H new ATOM 2785 N ALA A1229 7.792 -3.276 10.140 1.00 1.05 N ATOM 2786 CA ALA A1229 8.541 -3.926 11.210 1.00 1.15 C ATOM 2787 C ALA A1229 7.711 -4.089 12.496 1.00 1.24 C ATOM 2788 O ALA A1229 6.711 -3.400 12.718 1.00 1.42 O ATOM 2789 CB ALA A1229 9.842 -3.149 11.443 1.00 1.34 C ATOM 0 H ALA A1229 7.647 -2.282 10.317 1.00 1.05 H new ATOM 0 HA ALA A1229 8.786 -4.943 10.905 1.00 1.15 H new ATOM 0 HB1 ALA A1229 10.412 -3.625 12.241 1.00 1.34 H new ATOM 0 HB2 ALA A1229 10.433 -3.146 10.527 1.00 1.34 H new ATOM 0 HB3 ALA A1229 9.607 -2.123 11.727 1.00 1.34 H new