USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=25 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: A1072 LYS NZ :NH3+ -129:sc= 0.258 (180deg=0) USER MOD Set 1.2: A1178 TYR OH : rot 180:sc= 0.242 USER MOD Set 2.1: A1108 CYS SG : rot 85:sc= 0.338 USER MOD Set 2.2: A1125 ASN : amide:sc= 0.5 K(o=0.84,f=-2!) USER MOD Set 3.1: A1102 THR OG1 : rot -136:sc= 0.848 USER MOD Set 3.2: A1104 THR OG1 : rot 180:sc= 0.651 USER MOD Set 4.1: A1063 THR OG1 : rot -124:sc= 1.12 USER MOD Set 4.2: A1066 ASN : amide:sc= 0.162 K(o=1.3,f=-1.9!) USER MOD Single : A1057 ASN : amide:sc= -0.0472 X(o=-0.047,f=0) USER MOD Single : A1058 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A1060 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1065 SER OG : rot 180:sc= 0 USER MOD Single : A1069 SER OG : rot -59:sc= 0.931 USER MOD Single : A1070 HIS : no HD1:sc= -0.0521 X(o=-0.052,f=0) USER MOD Single : A1071 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1079 THR OG1 : rot 77:sc= 0.353 USER MOD Single : A1082 SER OG : rot -43:sc= 0.0559 USER MOD Single : A1083 ASN : amide:sc= -0.542 X(o=-0.54,f=-0.27) USER MOD Single : A1084 SER OG : rot 12:sc= 1.2 USER MOD Single : A1086 HIS : no HD1:sc= -0.133 X(o=-0.13,f=-0.12) USER MOD Single : A1090 THR OG1 : rot 180:sc= 0.00865 USER MOD Single : A1093 THR OG1 : rot 64:sc= 1.28 USER MOD Single : A1094 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1095 TYR OH : rot 180:sc= 0 USER MOD Single : A1096 CYS SG : rot 10:sc= 0.525 USER MOD Single : A1097 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1098 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A1107 THR OG1 : rot 33:sc= 0.0642 USER MOD Single : A1112 GLN : amide:sc= 0 X(o=0,f=-0.088) USER MOD Single : A1117 CYS SG : rot 180:sc= 0 USER MOD Single : A1120 SER OG : rot 180:sc= -0.107 USER MOD Single : A1121 CYS SG : rot 180:sc= -0.405 USER MOD Single : A1122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1124 THR OG1 : rot 180:sc= 0.15 USER MOD Single : A1177 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1179 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000837) USER MOD Single : A1184 ASN : amide:sc= 0.195 K(o=0.2,f=-2.7!) USER MOD Single : A1188 MET CE :methyl 177:sc= -0.172 (180deg=-0.193) USER MOD Single : A1191 ASN : amide:sc= -1.12 K(o=-1.1,f=-0.14) USER MOD Single : A1196 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1197 ASN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A1200 ASN : amide:sc= 0.0558 K(o=0.056,f=-6.4!) USER MOD Single : A1203 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A1204 THR OG1 : rot 78:sc= 0.214 USER MOD Single : A1206 HIS : no HD1:sc= 0.00113 X(o=0.0011,f=-0.34) 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 -40:sc= 0.126 USER MOD ----------------------------------------------------------------- ATOM 117 N VAL A1055 5.396 -1.351 12.704 1.00 1.56 N ATOM 118 CA VAL A1055 5.574 -0.011 12.107 1.00 1.66 C ATOM 119 C VAL A1055 6.385 -0.116 10.804 1.00 1.69 C ATOM 120 O VAL A1055 6.991 -1.156 10.528 1.00 1.97 O ATOM 121 CB VAL A1055 6.239 0.983 13.086 1.00 2.08 C ATOM 122 CG1 VAL A1055 5.311 1.319 14.258 1.00 2.94 C ATOM 123 CG2 VAL A1055 7.576 0.484 13.647 1.00 2.54 C ATOM 0 HA VAL A1055 4.583 0.382 11.881 1.00 1.66 H new ATOM 0 HB VAL A1055 6.435 1.876 12.493 1.00 2.08 H new ATOM 0 HG11 VAL A1055 5.809 2.020 14.927 1.00 2.94 H new ATOM 0 HG12 VAL A1055 4.394 1.769 13.878 1.00 2.94 H new ATOM 0 HG13 VAL A1055 5.069 0.407 14.803 1.00 2.94 H new ATOM 0 HG21 VAL A1055 7.987 1.231 14.327 1.00 2.54 H new ATOM 0 HG22 VAL A1055 7.418 -0.450 14.186 1.00 2.54 H new ATOM 0 HG23 VAL A1055 8.275 0.316 12.827 1.00 2.54 H new ATOM 133 N VAL A1056 6.390 0.929 9.969 1.00 1.62 N ATOM 134 CA VAL A1056 7.112 0.928 8.679 1.00 1.74 C ATOM 135 C VAL A1056 8.634 0.941 8.860 1.00 1.79 C ATOM 136 O VAL A1056 9.155 1.649 9.723 1.00 2.10 O ATOM 137 CB VAL A1056 6.606 2.054 7.754 1.00 2.01 C ATOM 138 CG1 VAL A1056 7.008 3.465 8.204 1.00 2.49 C ATOM 139 CG2 VAL A1056 7.084 1.847 6.312 1.00 2.73 C ATOM 0 H VAL A1056 5.897 1.801 10.162 1.00 1.62 H new ATOM 0 HA VAL A1056 6.887 -0.015 8.180 1.00 1.74 H new ATOM 0 HB VAL A1056 5.519 1.988 7.811 1.00 2.01 H new ATOM 0 HG11 VAL A1056 6.613 4.198 7.500 1.00 2.49 H new ATOM 0 HG12 VAL A1056 6.602 3.660 9.197 1.00 2.49 H new ATOM 0 HG13 VAL A1056 8.095 3.541 8.235 1.00 2.49 H new ATOM 0 HG21 VAL A1056 6.711 2.657 5.685 1.00 2.73 H new ATOM 0 HG22 VAL A1056 8.174 1.841 6.287 1.00 2.73 H new ATOM 0 HG23 VAL A1056 6.708 0.895 5.937 1.00 2.73 H new ATOM 149 N ASN A1057 9.366 0.170 8.046 1.00 1.66 N ATOM 150 CA ASN A1057 10.815 0.099 8.061 1.00 1.71 C ATOM 151 C ASN A1057 11.410 0.627 6.736 1.00 1.66 C ATOM 152 O ASN A1057 12.321 1.456 6.777 1.00 1.69 O ATOM 153 CB ASN A1057 11.154 -1.364 8.386 1.00 1.66 C ATOM 154 CG ASN A1057 12.603 -1.660 8.092 1.00 2.04 C ATOM 155 OD1 ASN A1057 13.492 -1.402 8.889 1.00 2.95 O ATOM 156 ND2 ASN A1057 12.889 -2.130 6.908 1.00 2.29 N ATOM 0 H ASN A1057 8.945 -0.436 7.342 1.00 1.66 H new ATOM 0 HA ASN A1057 11.267 0.744 8.815 1.00 1.71 H new ATOM 0 HB2 ASN A1057 10.944 -1.565 9.436 1.00 1.66 H new ATOM 0 HB3 ASN A1057 10.517 -2.027 7.801 1.00 1.66 H new ATOM 0 HD21 ASN A1057 13.861 -2.285 6.642 1.00 2.29 H new ATOM 0 HD22 ASN A1057 12.140 -2.343 6.249 1.00 2.29 H new ATOM 163 N GLN A1058 10.883 0.196 5.580 1.00 1.61 N ATOM 164 CA GLN A1058 11.287 0.686 4.251 1.00 1.60 C ATOM 165 C GLN A1058 10.134 0.618 3.236 1.00 1.57 C ATOM 166 O GLN A1058 9.313 -0.299 3.288 1.00 1.44 O ATOM 167 CB GLN A1058 12.524 -0.098 3.754 1.00 1.61 C ATOM 168 CG GLN A1058 13.048 0.398 2.390 1.00 2.16 C ATOM 169 CD GLN A1058 14.474 -0.032 2.055 1.00 2.90 C ATOM 170 OE1 GLN A1058 15.105 -0.819 2.751 1.00 3.52 O ATOM 171 NE2 GLN A1058 15.046 0.503 1.001 1.00 3.67 N ATOM 0 H GLN A1058 10.152 -0.514 5.540 1.00 1.61 H new ATOM 0 HA GLN A1058 11.554 1.739 4.345 1.00 1.60 H new ATOM 0 HB2 GLN A1058 13.320 -0.016 4.494 1.00 1.61 H new ATOM 0 HB3 GLN A1058 12.269 -1.155 3.676 1.00 1.61 H new ATOM 0 HG2 GLN A1058 12.381 0.036 1.607 1.00 2.16 H new ATOM 0 HG3 GLN A1058 12.999 1.487 2.372 1.00 2.16 H new ATOM 0 HE21 GLN A1058 14.527 1.159 0.417 1.00 3.67 H new ATOM 0 HE22 GLN A1058 16.009 0.263 0.766 1.00 3.67 H new ATOM 180 N VAL A1059 10.096 1.557 2.286 1.00 1.68 N ATOM 181 CA VAL A1059 9.147 1.583 1.153 1.00 1.61 C ATOM 182 C VAL A1059 9.864 1.833 -0.176 1.00 1.65 C ATOM 183 O VAL A1059 10.873 2.538 -0.203 1.00 1.92 O ATOM 184 CB VAL A1059 8.042 2.646 1.359 1.00 1.65 C ATOM 185 CG1 VAL A1059 7.170 2.317 2.570 1.00 1.62 C ATOM 186 CG2 VAL A1059 8.572 4.071 1.561 1.00 1.87 C ATOM 0 H VAL A1059 10.741 2.347 2.278 1.00 1.68 H new ATOM 0 HA VAL A1059 8.679 0.599 1.116 1.00 1.61 H new ATOM 0 HB VAL A1059 7.469 2.615 0.432 1.00 1.65 H new ATOM 0 HG11 VAL A1059 6.404 3.084 2.686 1.00 1.62 H new ATOM 0 HG12 VAL A1059 6.694 1.348 2.423 1.00 1.62 H new ATOM 0 HG13 VAL A1059 7.789 2.285 3.466 1.00 1.62 H new ATOM 0 HG21 VAL A1059 7.734 4.755 1.698 1.00 1.87 H new ATOM 0 HG22 VAL A1059 9.212 4.100 2.443 1.00 1.87 H new ATOM 0 HG23 VAL A1059 9.147 4.373 0.686 1.00 1.87 H new ATOM 196 N LYS A1060 9.351 1.286 -1.290 1.00 1.39 N ATOM 197 CA LYS A1060 9.807 1.636 -2.654 1.00 1.24 C ATOM 198 C LYS A1060 8.642 1.923 -3.595 1.00 0.87 C ATOM 199 O LYS A1060 7.621 1.235 -3.568 1.00 0.68 O ATOM 200 CB LYS A1060 10.708 0.574 -3.319 1.00 1.53 C ATOM 201 CG LYS A1060 11.812 -0.046 -2.451 1.00 1.65 C ATOM 202 CD LYS A1060 12.779 -0.916 -3.276 1.00 1.81 C ATOM 203 CE LYS A1060 13.588 -0.092 -4.293 1.00 1.83 C ATOM 204 NZ LYS A1060 14.682 -0.879 -4.910 1.00 2.16 N ATOM 0 H LYS A1060 8.608 0.588 -1.275 1.00 1.39 H new ATOM 0 HA LYS A1060 10.403 2.535 -2.500 1.00 1.24 H new ATOM 0 HB2 LYS A1060 10.070 -0.232 -3.682 1.00 1.53 H new ATOM 0 HB3 LYS A1060 11.178 1.027 -4.192 1.00 1.53 H new ATOM 0 HG2 LYS A1060 12.372 0.748 -1.956 1.00 1.65 H new ATOM 0 HG3 LYS A1060 11.358 -0.653 -1.667 1.00 1.65 H new ATOM 0 HD2 LYS A1060 13.464 -1.431 -2.603 1.00 1.81 H new ATOM 0 HD3 LYS A1060 12.213 -1.684 -3.803 1.00 1.81 H new ATOM 0 HE2 LYS A1060 12.921 0.274 -5.074 1.00 1.83 H new ATOM 0 HE3 LYS A1060 14.008 0.783 -3.797 1.00 1.83 H new ATOM 0 HZ1 LYS A1060 15.199 -0.283 -5.588 1.00 2.16 H new ATOM 0 HZ2 LYS A1060 15.334 -1.207 -4.169 1.00 2.16 H new ATOM 0 HZ3 LYS A1060 14.281 -1.700 -5.407 1.00 2.16 H new ATOM 218 N VAL A1061 8.830 2.895 -4.483 1.00 0.86 N ATOM 219 CA VAL A1061 7.912 3.197 -5.593 1.00 0.69 C ATOM 220 C VAL A1061 8.158 2.218 -6.749 1.00 0.71 C ATOM 221 O VAL A1061 9.310 1.890 -7.033 1.00 1.10 O ATOM 222 CB VAL A1061 8.081 4.656 -6.080 1.00 0.93 C ATOM 223 CG1 VAL A1061 6.786 5.162 -6.725 1.00 0.60 C ATOM 224 CG2 VAL A1061 8.439 5.637 -4.954 1.00 1.70 C ATOM 0 H VAL A1061 9.641 3.513 -4.456 1.00 0.86 H new ATOM 0 HA VAL A1061 6.889 3.083 -5.234 1.00 0.69 H new ATOM 0 HB VAL A1061 8.903 4.626 -6.795 1.00 0.93 H new ATOM 0 HG11 VAL A1061 6.924 6.190 -7.061 1.00 0.60 H new ATOM 0 HG12 VAL A1061 6.534 4.532 -7.578 1.00 0.60 H new ATOM 0 HG13 VAL A1061 5.977 5.125 -5.995 1.00 0.60 H new ATOM 0 HG21 VAL A1061 8.543 6.641 -5.365 1.00 1.70 H new ATOM 0 HG22 VAL A1061 7.649 5.632 -4.203 1.00 1.70 H new ATOM 0 HG23 VAL A1061 9.380 5.335 -4.494 1.00 1.70 H new ATOM 234 N LEU A1062 7.094 1.767 -7.422 1.00 0.61 N ATOM 235 CA LEU A1062 7.144 0.881 -8.604 1.00 0.75 C ATOM 236 C LEU A1062 6.651 1.560 -9.904 1.00 0.73 C ATOM 237 O LEU A1062 6.430 0.906 -10.923 1.00 1.24 O ATOM 238 CB LEU A1062 6.422 -0.453 -8.296 1.00 0.93 C ATOM 239 CG LEU A1062 7.277 -1.638 -7.797 1.00 1.03 C ATOM 240 CD1 LEU A1062 8.611 -1.836 -8.523 1.00 1.28 C ATOM 241 CD2 LEU A1062 7.575 -1.535 -6.305 1.00 2.29 C ATOM 0 H LEU A1062 6.141 2.013 -7.155 1.00 0.61 H new ATOM 0 HA LEU A1062 8.191 0.655 -8.807 1.00 0.75 H new ATOM 0 HB2 LEU A1062 5.656 -0.254 -7.546 1.00 0.93 H new ATOM 0 HB3 LEU A1062 5.906 -0.771 -9.202 1.00 0.93 H new ATOM 0 HG LEU A1062 6.650 -2.501 -8.019 1.00 1.03 H new ATOM 0 HD11 LEU A1062 9.133 -2.693 -8.097 1.00 1.28 H new ATOM 0 HD12 LEU A1062 8.426 -2.014 -9.582 1.00 1.28 H new ATOM 0 HD13 LEU A1062 9.225 -0.943 -8.407 1.00 1.28 H new ATOM 0 HD21 LEU A1062 8.179 -2.388 -5.995 1.00 2.29 H new ATOM 0 HD22 LEU A1062 8.121 -0.613 -6.106 1.00 2.29 H new ATOM 0 HD23 LEU A1062 6.639 -1.531 -5.746 1.00 2.29 H new ATOM 253 N THR A1063 6.492 2.883 -9.863 1.00 0.58 N ATOM 254 CA THR A1063 6.247 3.802 -10.988 1.00 0.77 C ATOM 255 C THR A1063 7.261 4.966 -10.886 1.00 0.93 C ATOM 256 O THR A1063 7.937 5.095 -9.860 1.00 2.13 O ATOM 257 CB THR A1063 4.784 4.292 -10.964 1.00 0.97 C ATOM 258 OG1 THR A1063 4.505 5.240 -11.973 1.00 1.52 O ATOM 259 CG2 THR A1063 4.381 4.948 -9.646 1.00 0.82 C ATOM 0 H THR A1063 6.533 3.384 -8.976 1.00 0.58 H new ATOM 0 HA THR A1063 6.390 3.298 -11.944 1.00 0.77 H new ATOM 0 HB THR A1063 4.215 3.376 -11.120 1.00 0.97 H new ATOM 0 HG1 THR A1063 4.147 6.056 -11.565 1.00 1.52 H new ATOM 0 HG21 THR A1063 3.340 5.268 -9.702 1.00 0.82 H new ATOM 0 HG22 THR A1063 4.498 4.232 -8.833 1.00 0.82 H new ATOM 0 HG23 THR A1063 5.017 5.814 -9.461 1.00 0.82 H new ATOM 267 N GLU A1064 7.400 5.825 -11.901 1.00 1.32 N ATOM 268 CA GLU A1064 8.325 6.978 -11.892 1.00 1.46 C ATOM 269 C GLU A1064 7.581 8.318 -12.093 1.00 1.97 C ATOM 270 O GLU A1064 6.969 8.835 -11.152 1.00 3.07 O ATOM 271 CB GLU A1064 9.485 6.693 -12.873 1.00 1.70 C ATOM 272 CG GLU A1064 10.638 7.702 -12.792 1.00 2.85 C ATOM 273 CD GLU A1064 11.809 7.279 -13.689 1.00 3.18 C ATOM 274 OE1 GLU A1064 11.609 7.009 -14.899 1.00 3.63 O ATOM 275 OE2 GLU A1064 12.961 7.231 -13.203 1.00 3.88 O ATOM 0 H GLU A1064 6.868 5.743 -12.768 1.00 1.32 H new ATOM 0 HA GLU A1064 8.780 7.102 -10.909 1.00 1.46 H new ATOM 0 HB2 GLU A1064 9.876 5.695 -12.676 1.00 1.70 H new ATOM 0 HB3 GLU A1064 9.093 6.687 -13.890 1.00 1.70 H new ATOM 0 HG2 GLU A1064 10.284 8.688 -13.093 1.00 2.85 H new ATOM 0 HG3 GLU A1064 10.979 7.787 -11.760 1.00 2.85 H new ATOM 282 N SER A1065 7.586 8.861 -13.314 1.00 2.22 N ATOM 283 CA SER A1065 6.860 10.079 -13.733 1.00 2.70 C ATOM 284 C SER A1065 5.849 9.727 -14.830 1.00 2.39 C ATOM 285 O SER A1065 5.763 10.382 -15.870 1.00 3.05 O ATOM 286 CB SER A1065 7.833 11.178 -14.177 1.00 3.67 C ATOM 287 OG SER A1065 8.718 11.511 -13.123 1.00 4.24 O ATOM 0 H SER A1065 8.120 8.449 -14.079 1.00 2.22 H new ATOM 0 HA SER A1065 6.310 10.477 -12.880 1.00 2.70 H new ATOM 0 HB2 SER A1065 8.401 10.841 -15.044 1.00 3.67 H new ATOM 0 HB3 SER A1065 7.276 12.063 -14.485 1.00 3.67 H new ATOM 0 HG SER A1065 9.334 12.212 -13.422 1.00 4.24 H new ATOM 293 N ASN A1066 5.151 8.607 -14.622 1.00 1.95 N ATOM 294 CA ASN A1066 4.324 7.938 -15.623 1.00 1.91 C ATOM 295 C ASN A1066 2.826 8.080 -15.288 1.00 1.72 C ATOM 296 O ASN A1066 2.337 9.203 -15.164 1.00 2.12 O ATOM 297 CB ASN A1066 4.834 6.493 -15.811 1.00 2.37 C ATOM 298 CG ASN A1066 6.346 6.371 -15.843 1.00 4.05 C ATOM 299 OD1 ASN A1066 6.949 5.823 -14.931 1.00 5.36 O ATOM 300 ND2 ASN A1066 7.018 6.902 -16.836 1.00 4.95 N ATOM 0 H ASN A1066 5.148 8.127 -13.722 1.00 1.95 H new ATOM 0 HA ASN A1066 4.418 8.419 -16.597 1.00 1.91 H new ATOM 0 HB2 ASN A1066 4.447 5.874 -15.002 1.00 2.37 H new ATOM 0 HB3 ASN A1066 4.428 6.093 -16.740 1.00 2.37 H new ATOM 0 HD21 ASN A1066 8.037 6.856 -16.844 1.00 4.95 H new ATOM 0 HD22 ASN A1066 6.522 7.361 -17.600 1.00 4.95 H new ATOM 307 N ARG A1067 2.110 6.962 -15.087 1.00 1.45 N ATOM 308 CA ARG A1067 0.688 6.928 -14.699 1.00 1.31 C ATOM 309 C ARG A1067 0.385 7.673 -13.387 1.00 1.14 C ATOM 310 O ARG A1067 -0.579 8.435 -13.319 1.00 1.26 O ATOM 311 CB ARG A1067 0.181 5.466 -14.669 1.00 1.31 C ATOM 312 CG ARG A1067 0.937 4.446 -13.785 1.00 2.90 C ATOM 313 CD ARG A1067 2.068 3.684 -14.498 1.00 4.57 C ATOM 314 NE ARG A1067 2.616 2.609 -13.648 1.00 6.17 N ATOM 315 CZ ARG A1067 3.385 1.606 -14.036 1.00 7.50 C ATOM 316 NH1 ARG A1067 3.903 1.488 -15.222 1.00 7.70 N ATOM 317 NH2 ARG A1067 3.651 0.659 -13.197 1.00 8.97 N ATOM 0 H ARG A1067 2.514 6.031 -15.192 1.00 1.45 H new ATOM 0 HA ARG A1067 0.136 7.477 -15.462 1.00 1.31 H new ATOM 0 HB2 ARG A1067 -0.859 5.481 -14.344 1.00 1.31 H new ATOM 0 HB3 ARG A1067 0.189 5.090 -15.692 1.00 1.31 H new ATOM 0 HG2 ARG A1067 1.357 4.971 -12.927 1.00 2.90 H new ATOM 0 HG3 ARG A1067 0.220 3.723 -13.396 1.00 2.90 H new ATOM 0 HD2 ARG A1067 1.691 3.258 -15.428 1.00 4.57 H new ATOM 0 HD3 ARG A1067 2.864 4.379 -14.766 1.00 4.57 H new ATOM 0 HE ARG A1067 2.376 2.644 -12.657 1.00 6.17 H new ATOM 0 HH11 ARG A1067 3.725 2.201 -15.929 1.00 7.70 H new ATOM 0 HH12 ARG A1067 4.488 0.683 -15.445 1.00 7.70 H new ATOM 0 HH21 ARG A1067 3.269 0.693 -12.252 1.00 8.97 H new ATOM 0 HH22 ARG A1067 4.243 -0.122 -13.480 1.00 8.97 H new ATOM 331 N ILE A1068 1.230 7.499 -12.372 1.00 0.99 N ATOM 332 CA ILE A1068 1.194 8.191 -11.073 1.00 0.91 C ATOM 333 C ILE A1068 2.618 8.377 -10.532 1.00 0.95 C ATOM 334 O ILE A1068 3.524 7.626 -10.909 1.00 1.04 O ATOM 335 CB ILE A1068 0.313 7.469 -10.011 1.00 0.76 C ATOM 336 CG1 ILE A1068 0.241 5.922 -10.098 1.00 1.11 C ATOM 337 CG2 ILE A1068 -1.078 8.110 -9.918 1.00 1.35 C ATOM 338 CD1 ILE A1068 -0.894 5.323 -10.943 1.00 1.26 C ATOM 0 H ILE A1068 2.003 6.836 -12.432 1.00 0.99 H new ATOM 0 HA ILE A1068 0.732 9.161 -11.255 1.00 0.91 H new ATOM 0 HB ILE A1068 0.848 7.629 -9.075 1.00 0.76 H new ATOM 0 HG12 ILE A1068 1.188 5.561 -10.498 1.00 1.11 H new ATOM 0 HG13 ILE A1068 0.153 5.529 -9.085 1.00 1.11 H new ATOM 0 HG21 ILE A1068 -1.671 7.585 -9.169 1.00 1.35 H new ATOM 0 HG22 ILE A1068 -0.978 9.157 -9.633 1.00 1.35 H new ATOM 0 HG23 ILE A1068 -1.575 8.043 -10.886 1.00 1.35 H new ATOM 0 HD11 ILE A1068 -0.830 4.235 -10.920 1.00 1.26 H new ATOM 0 HD12 ILE A1068 -1.855 5.638 -10.537 1.00 1.26 H new ATOM 0 HD13 ILE A1068 -0.803 5.670 -11.972 1.00 1.26 H new ATOM 350 N SER A1069 2.791 9.346 -9.629 1.00 1.01 N ATOM 351 CA SER A1069 4.031 9.612 -8.886 1.00 1.14 C ATOM 352 C SER A1069 3.843 9.511 -7.360 1.00 0.80 C ATOM 353 O SER A1069 2.730 9.547 -6.829 1.00 0.65 O ATOM 354 CB SER A1069 4.636 10.955 -9.319 1.00 1.63 C ATOM 355 OG SER A1069 5.051 10.884 -10.676 1.00 2.30 O ATOM 0 H SER A1069 2.042 9.994 -9.384 1.00 1.01 H new ATOM 0 HA SER A1069 4.744 8.828 -9.139 1.00 1.14 H new ATOM 0 HB2 SER A1069 3.902 11.751 -9.195 1.00 1.63 H new ATOM 0 HB3 SER A1069 5.485 11.203 -8.682 1.00 1.63 H new ATOM 0 HG SER A1069 5.709 10.165 -10.780 1.00 2.30 H new ATOM 361 N HIS A1070 4.954 9.355 -6.639 1.00 0.91 N ATOM 362 CA HIS A1070 5.000 8.958 -5.228 1.00 0.95 C ATOM 363 C HIS A1070 4.202 9.815 -4.231 1.00 0.81 C ATOM 364 O HIS A1070 3.481 9.248 -3.408 1.00 0.90 O ATOM 365 CB HIS A1070 6.474 8.883 -4.811 1.00 1.29 C ATOM 366 CG HIS A1070 6.724 8.295 -3.442 1.00 3.37 C ATOM 367 ND1 HIS A1070 7.842 8.527 -2.678 1.00 4.00 N ATOM 368 CD2 HIS A1070 5.934 7.426 -2.734 1.00 5.52 C ATOM 369 CE1 HIS A1070 7.725 7.838 -1.532 1.00 6.15 C ATOM 370 NE2 HIS A1070 6.573 7.144 -1.522 1.00 7.19 N ATOM 0 H HIS A1070 5.882 9.507 -7.035 1.00 0.91 H new ATOM 0 HA HIS A1070 4.492 7.995 -5.176 1.00 0.95 H new ATOM 0 HB2 HIS A1070 7.014 8.289 -5.548 1.00 1.29 H new ATOM 0 HB3 HIS A1070 6.895 9.888 -4.840 1.00 1.29 H new ATOM 0 HD2 HIS A1070 4.983 7.028 -3.056 1.00 5.52 H new ATOM 0 HE1 HIS A1070 8.451 7.841 -0.733 1.00 6.15 H new ATOM 0 HE2 HIS A1070 6.233 6.534 -0.779 1.00 7.19 H new ATOM 378 N HIS A1071 4.300 11.148 -4.262 1.00 0.75 N ATOM 379 CA HIS A1071 3.700 11.976 -3.206 1.00 0.79 C ATOM 380 C HIS A1071 2.156 11.971 -3.275 1.00 0.78 C ATOM 381 O HIS A1071 1.487 12.027 -2.236 1.00 0.91 O ATOM 382 CB HIS A1071 4.299 13.394 -3.206 1.00 0.93 C ATOM 383 CG HIS A1071 5.804 13.461 -3.385 1.00 2.29 C ATOM 384 ND1 HIS A1071 6.772 12.862 -2.604 1.00 3.53 N ATOM 385 CD2 HIS A1071 6.462 14.161 -4.363 1.00 3.88 C ATOM 386 CE1 HIS A1071 7.974 13.199 -3.100 1.00 4.94 C ATOM 387 NE2 HIS A1071 7.841 13.990 -4.180 1.00 5.26 N ATOM 0 H HIS A1071 4.781 11.672 -4.993 1.00 0.75 H new ATOM 0 HA HIS A1071 3.954 11.529 -2.245 1.00 0.79 H new ATOM 0 HB2 HIS A1071 3.829 13.969 -4.003 1.00 0.93 H new ATOM 0 HB3 HIS A1071 4.039 13.881 -2.266 1.00 0.93 H new ATOM 0 HD2 HIS A1071 5.996 14.745 -5.143 1.00 3.88 H new ATOM 0 HE1 HIS A1071 8.919 12.878 -2.688 1.00 4.94 H new ATOM 0 HE2 HIS A1071 8.590 14.384 -4.749 1.00 5.26 H new ATOM 395 N LYS A1072 1.583 11.807 -4.478 1.00 0.73 N ATOM 396 CA LYS A1072 0.146 11.568 -4.686 1.00 0.74 C ATOM 397 C LYS A1072 -0.266 10.146 -4.281 1.00 0.68 C ATOM 398 O LYS A1072 -1.320 9.986 -3.670 1.00 0.73 O ATOM 399 CB LYS A1072 -0.234 11.910 -6.142 1.00 0.84 C ATOM 400 CG LYS A1072 -1.759 12.032 -6.324 1.00 1.51 C ATOM 401 CD LYS A1072 -2.135 12.594 -7.705 1.00 2.29 C ATOM 402 CE LYS A1072 -3.647 12.864 -7.774 1.00 3.36 C ATOM 403 NZ LYS A1072 -4.025 13.584 -9.011 1.00 4.27 N ATOM 0 H LYS A1072 2.114 11.837 -5.348 1.00 0.73 H new ATOM 0 HA LYS A1072 -0.418 12.230 -4.029 1.00 0.74 H new ATOM 0 HB2 LYS A1072 0.242 12.847 -6.431 1.00 0.84 H new ATOM 0 HB3 LYS A1072 0.151 11.138 -6.809 1.00 0.84 H new ATOM 0 HG2 LYS A1072 -2.218 11.052 -6.195 1.00 1.51 H new ATOM 0 HG3 LYS A1072 -2.165 12.679 -5.547 1.00 1.51 H new ATOM 0 HD2 LYS A1072 -1.585 13.516 -7.893 1.00 2.29 H new ATOM 0 HD3 LYS A1072 -1.848 11.887 -8.484 1.00 2.29 H new ATOM 0 HE2 LYS A1072 -4.187 11.918 -7.725 1.00 3.36 H new ATOM 0 HE3 LYS A1072 -3.951 13.450 -6.906 1.00 3.36 H new ATOM 0 HZ1 LYS A1072 -4.602 14.414 -8.767 1.00 4.27 H new ATOM 0 HZ2 LYS A1072 -3.166 13.893 -9.509 1.00 4.27 H new ATOM 0 HZ3 LYS A1072 -4.573 12.951 -9.627 1.00 4.27 H new ATOM 417 N ILE A1073 0.574 9.134 -4.533 1.00 0.63 N ATOM 418 CA ILE A1073 0.336 7.741 -4.096 1.00 0.65 C ATOM 419 C ILE A1073 0.281 7.633 -2.566 1.00 0.70 C ATOM 420 O ILE A1073 -0.674 7.066 -2.035 1.00 0.79 O ATOM 421 CB ILE A1073 1.384 6.772 -4.695 1.00 0.64 C ATOM 422 CG1 ILE A1073 1.163 6.644 -6.216 1.00 0.61 C ATOM 423 CG2 ILE A1073 1.313 5.369 -4.053 1.00 0.72 C ATOM 424 CD1 ILE A1073 2.370 6.058 -6.952 1.00 0.63 C ATOM 0 H ILE A1073 1.446 9.254 -5.049 1.00 0.63 H new ATOM 0 HA ILE A1073 -0.640 7.442 -4.479 1.00 0.65 H new ATOM 0 HB ILE A1073 2.370 7.188 -4.486 1.00 0.64 H new ATOM 0 HG12 ILE A1073 0.293 6.014 -6.399 1.00 0.61 H new ATOM 0 HG13 ILE A1073 0.936 7.627 -6.628 1.00 0.61 H new ATOM 0 HG21 ILE A1073 2.066 4.724 -4.505 1.00 0.72 H new ATOM 0 HG22 ILE A1073 1.499 5.449 -2.982 1.00 0.72 H new ATOM 0 HG23 ILE A1073 0.324 4.943 -4.219 1.00 0.72 H new ATOM 0 HD11 ILE A1073 2.150 5.994 -8.018 1.00 0.63 H new ATOM 0 HD12 ILE A1073 3.237 6.700 -6.798 1.00 0.63 H new ATOM 0 HD13 ILE A1073 2.583 5.062 -6.565 1.00 0.63 H new ATOM 436 N LEU A1074 1.267 8.189 -1.847 1.00 0.69 N ATOM 437 CA LEU A1074 1.293 8.111 -0.380 1.00 0.76 C ATOM 438 C LEU A1074 0.127 8.888 0.254 1.00 0.72 C ATOM 439 O LEU A1074 -0.389 8.464 1.286 1.00 0.78 O ATOM 440 CB LEU A1074 2.695 8.450 0.169 1.00 0.93 C ATOM 441 CG LEU A1074 3.109 9.935 0.162 1.00 1.60 C ATOM 442 CD1 LEU A1074 2.668 10.685 1.423 1.00 2.54 C ATOM 443 CD2 LEU A1074 4.631 10.053 0.074 1.00 2.36 C ATOM 0 H LEU A1074 2.053 8.695 -2.255 1.00 0.69 H new ATOM 0 HA LEU A1074 1.117 7.080 -0.074 1.00 0.76 H new ATOM 0 HB2 LEU A1074 2.754 8.087 1.195 1.00 0.93 H new ATOM 0 HB3 LEU A1074 3.430 7.891 -0.410 1.00 0.93 H new ATOM 0 HG LEU A1074 2.616 10.380 -0.702 1.00 1.60 H new ATOM 0 HD11 LEU A1074 2.988 11.725 1.359 1.00 2.54 H new ATOM 0 HD12 LEU A1074 1.582 10.645 1.509 1.00 2.54 H new ATOM 0 HD13 LEU A1074 3.119 10.220 2.299 1.00 2.54 H new ATOM 0 HD21 LEU A1074 4.915 11.105 0.070 1.00 2.36 H new ATOM 0 HD22 LEU A1074 5.085 9.559 0.933 1.00 2.36 H new ATOM 0 HD23 LEU A1074 4.980 9.579 -0.843 1.00 2.36 H new ATOM 455 N ALA A1075 -0.352 9.959 -0.397 1.00 0.70 N ATOM 456 CA ALA A1075 -1.603 10.606 -0.007 1.00 0.73 C ATOM 457 C ALA A1075 -2.801 9.651 -0.177 1.00 0.77 C ATOM 458 O ALA A1075 -3.442 9.316 0.815 1.00 0.79 O ATOM 459 CB ALA A1075 -1.764 11.920 -0.782 1.00 0.76 C ATOM 0 H ALA A1075 0.112 10.392 -1.196 1.00 0.70 H new ATOM 0 HA ALA A1075 -1.572 10.853 1.054 1.00 0.73 H new ATOM 0 HB1 ALA A1075 -2.697 12.402 -0.491 1.00 0.76 H new ATOM 0 HB2 ALA A1075 -0.928 12.581 -0.555 1.00 0.76 H new ATOM 0 HB3 ALA A1075 -1.782 11.712 -1.852 1.00 0.76 H new ATOM 465 N ILE A1076 -3.098 9.151 -1.383 1.00 0.81 N ATOM 466 CA ILE A1076 -4.333 8.364 -1.600 1.00 0.91 C ATOM 467 C ILE A1076 -4.355 7.031 -0.839 1.00 0.96 C ATOM 468 O ILE A1076 -5.391 6.681 -0.276 1.00 1.03 O ATOM 469 CB ILE A1076 -4.682 8.201 -3.096 1.00 0.99 C ATOM 470 CG1 ILE A1076 -3.626 7.404 -3.898 1.00 0.96 C ATOM 471 CG2 ILE A1076 -4.955 9.601 -3.669 1.00 1.02 C ATOM 472 CD1 ILE A1076 -3.863 7.316 -5.414 1.00 1.04 C ATOM 0 H ILE A1076 -2.517 9.270 -2.213 1.00 0.81 H new ATOM 0 HA ILE A1076 -5.133 8.960 -1.161 1.00 0.91 H new ATOM 0 HB ILE A1076 -5.578 7.587 -3.191 1.00 0.99 H new ATOM 0 HG12 ILE A1076 -2.650 7.858 -3.728 1.00 0.96 H new ATOM 0 HG13 ILE A1076 -3.581 6.391 -3.497 1.00 0.96 H new ATOM 0 HG21 ILE A1076 -5.205 9.519 -4.727 1.00 1.02 H new ATOM 0 HG22 ILE A1076 -5.788 10.057 -3.134 1.00 1.02 H new ATOM 0 HG23 ILE A1076 -4.066 10.221 -3.553 1.00 1.02 H new ATOM 0 HD11 ILE A1076 -3.063 6.736 -5.874 1.00 1.04 H new ATOM 0 HD12 ILE A1076 -4.820 6.830 -5.605 1.00 1.04 H new ATOM 0 HD13 ILE A1076 -3.874 8.320 -5.839 1.00 1.04 H new ATOM 484 N VAL A1077 -3.223 6.324 -0.735 1.00 0.96 N ATOM 485 CA VAL A1077 -3.120 5.100 0.080 1.00 1.05 C ATOM 486 C VAL A1077 -3.220 5.438 1.571 1.00 0.93 C ATOM 487 O VAL A1077 -4.027 4.846 2.288 1.00 1.02 O ATOM 488 CB VAL A1077 -1.821 4.327 -0.235 1.00 1.19 C ATOM 489 CG1 VAL A1077 -1.672 3.067 0.630 1.00 1.47 C ATOM 490 CG2 VAL A1077 -1.789 3.872 -1.701 1.00 1.35 C ATOM 0 H VAL A1077 -2.356 6.579 -1.209 1.00 0.96 H new ATOM 0 HA VAL A1077 -3.956 4.449 -0.176 1.00 1.05 H new ATOM 0 HB VAL A1077 -1.007 5.020 -0.024 1.00 1.19 H new ATOM 0 HG11 VAL A1077 -0.744 2.557 0.373 1.00 1.47 H new ATOM 0 HG12 VAL A1077 -1.651 3.349 1.683 1.00 1.47 H new ATOM 0 HG13 VAL A1077 -2.515 2.400 0.449 1.00 1.47 H new ATOM 0 HG21 VAL A1077 -0.863 3.330 -1.894 1.00 1.35 H new ATOM 0 HG22 VAL A1077 -2.639 3.219 -1.898 1.00 1.35 H new ATOM 0 HG23 VAL A1077 -1.842 4.743 -2.354 1.00 1.35 H new ATOM 500 N GLY A1078 -2.453 6.418 2.059 1.00 0.79 N ATOM 501 CA GLY A1078 -2.422 6.745 3.485 1.00 0.71 C ATOM 502 C GLY A1078 -3.712 7.359 4.017 1.00 0.63 C ATOM 503 O GLY A1078 -4.079 7.133 5.170 1.00 0.76 O ATOM 0 H GLY A1078 -1.844 7.000 1.484 1.00 0.79 H new ATOM 0 HA2 GLY A1078 -2.206 5.838 4.049 1.00 0.71 H new ATOM 0 HA3 GLY A1078 -1.601 7.438 3.669 1.00 0.71 H new ATOM 507 N THR A1079 -4.429 8.104 3.181 1.00 0.60 N ATOM 508 CA THR A1079 -5.762 8.641 3.504 1.00 0.68 C ATOM 509 C THR A1079 -6.871 7.591 3.406 1.00 0.73 C ATOM 510 O THR A1079 -7.790 7.632 4.226 1.00 0.84 O ATOM 511 CB THR A1079 -6.109 9.906 2.698 1.00 0.81 C ATOM 512 OG1 THR A1079 -5.073 10.860 2.772 1.00 1.28 O ATOM 513 CG2 THR A1079 -7.293 10.618 3.287 1.00 1.10 C ATOM 0 H THR A1079 -4.104 8.359 2.248 1.00 0.60 H new ATOM 0 HA THR A1079 -5.704 8.938 4.551 1.00 0.68 H new ATOM 0 HB THR A1079 -6.289 9.560 1.680 1.00 0.81 H new ATOM 0 HG1 THR A1079 -4.338 10.591 2.183 1.00 1.28 H new ATOM 0 HG21 THR A1079 -7.514 11.507 2.696 1.00 1.10 H new ATOM 0 HG22 THR A1079 -8.157 9.954 3.280 1.00 1.10 H new ATOM 0 HG23 THR A1079 -7.068 10.911 4.313 1.00 1.10 H new ATOM 521 N ALA A1080 -6.780 6.603 2.507 1.00 0.76 N ATOM 522 CA ALA A1080 -7.718 5.473 2.494 1.00 0.84 C ATOM 523 C ALA A1080 -7.685 4.702 3.832 1.00 0.88 C ATOM 524 O ALA A1080 -8.733 4.455 4.430 1.00 1.15 O ATOM 525 CB ALA A1080 -7.415 4.566 1.296 1.00 0.89 C ATOM 0 H ALA A1080 -6.067 6.563 1.779 1.00 0.76 H new ATOM 0 HA ALA A1080 -8.733 5.854 2.383 1.00 0.84 H new ATOM 0 HB1 ALA A1080 -8.112 3.728 1.288 1.00 0.89 H new ATOM 0 HB2 ALA A1080 -7.522 5.135 0.373 1.00 0.89 H new ATOM 0 HB3 ALA A1080 -6.395 4.189 1.374 1.00 0.89 H new ATOM 531 N GLU A1081 -6.488 4.475 4.382 1.00 0.82 N ATOM 532 CA GLU A1081 -6.236 3.793 5.666 1.00 0.91 C ATOM 533 C GLU A1081 -6.635 4.614 6.920 1.00 0.94 C ATOM 534 O GLU A1081 -6.369 4.207 8.052 1.00 1.20 O ATOM 535 CB GLU A1081 -4.745 3.407 5.720 1.00 1.11 C ATOM 536 CG GLU A1081 -4.304 2.371 4.674 1.00 1.80 C ATOM 537 CD GLU A1081 -4.840 0.965 4.966 1.00 1.96 C ATOM 538 OE1 GLU A1081 -5.942 0.616 4.499 1.00 2.96 O ATOM 539 OE2 GLU A1081 -4.144 0.155 5.626 1.00 2.38 O ATOM 0 H GLU A1081 -5.625 4.774 3.927 1.00 0.82 H new ATOM 0 HA GLU A1081 -6.877 2.912 5.698 1.00 0.91 H new ATOM 0 HB2 GLU A1081 -4.147 4.309 5.591 1.00 1.11 H new ATOM 0 HB3 GLU A1081 -4.522 3.016 6.713 1.00 1.11 H new ATOM 0 HG2 GLU A1081 -4.647 2.688 3.689 1.00 1.80 H new ATOM 0 HG3 GLU A1081 -3.215 2.339 4.638 1.00 1.80 H new ATOM 546 N SER A1082 -7.289 5.767 6.746 1.00 0.90 N ATOM 547 CA SER A1082 -7.825 6.636 7.811 1.00 0.99 C ATOM 548 C SER A1082 -9.253 6.249 8.271 1.00 1.11 C ATOM 549 O SER A1082 -9.860 6.943 9.091 1.00 1.37 O ATOM 550 CB SER A1082 -7.732 8.103 7.362 1.00 1.06 C ATOM 551 OG SER A1082 -7.728 8.983 8.475 1.00 1.65 O ATOM 0 H SER A1082 -7.470 6.142 5.815 1.00 0.90 H new ATOM 0 HA SER A1082 -7.209 6.493 8.699 1.00 0.99 H new ATOM 0 HB2 SER A1082 -6.824 8.250 6.776 1.00 1.06 H new ATOM 0 HB3 SER A1082 -8.573 8.340 6.711 1.00 1.06 H new ATOM 0 HG SER A1082 -8.404 8.694 9.123 1.00 1.65 H new ATOM 557 N ASN A1083 -9.848 5.191 7.709 1.00 1.09 N ATOM 558 CA ASN A1083 -11.257 4.816 7.875 1.00 1.35 C ATOM 559 C ASN A1083 -11.595 4.233 9.278 1.00 1.63 C ATOM 560 O ASN A1083 -11.843 5.017 10.202 1.00 2.57 O ATOM 561 CB ASN A1083 -11.681 4.043 6.606 1.00 1.76 C ATOM 562 CG ASN A1083 -12.911 3.168 6.726 1.00 2.67 C ATOM 563 OD1 ASN A1083 -14.045 3.636 6.734 1.00 3.17 O ATOM 564 ND2 ASN A1083 -12.701 1.878 6.816 1.00 3.64 N ATOM 0 H ASN A1083 -9.341 4.547 7.102 1.00 1.09 H new ATOM 0 HA ASN A1083 -11.914 5.684 7.921 1.00 1.35 H new ATOM 0 HB2 ASN A1083 -11.853 4.766 5.808 1.00 1.76 H new ATOM 0 HB3 ASN A1083 -10.846 3.416 6.294 1.00 1.76 H new ATOM 0 HD21 ASN A1083 -13.491 1.237 6.895 1.00 3.64 H new ATOM 0 HD22 ASN A1083 -11.748 1.515 6.807 1.00 3.64 H new ATOM 571 N SER A1084 -11.665 2.910 9.472 1.00 1.54 N ATOM 572 CA SER A1084 -12.073 2.204 10.714 1.00 2.10 C ATOM 573 C SER A1084 -11.859 0.681 10.584 1.00 2.08 C ATOM 574 O SER A1084 -12.814 -0.091 10.434 1.00 2.94 O ATOM 575 CB SER A1084 -13.559 2.461 11.010 1.00 3.10 C ATOM 576 OG SER A1084 -13.763 3.762 11.521 1.00 3.80 O ATOM 0 H SER A1084 -11.426 2.256 8.727 1.00 1.54 H new ATOM 0 HA SER A1084 -11.455 2.588 11.526 1.00 2.10 H new ATOM 0 HB2 SER A1084 -14.141 2.331 10.098 1.00 3.10 H new ATOM 0 HB3 SER A1084 -13.922 1.725 11.728 1.00 3.10 H new ATOM 0 HG SER A1084 -12.946 4.291 11.405 1.00 3.80 H new ATOM 582 N GLU A1085 -10.605 0.229 10.618 1.00 1.80 N ATOM 583 CA GLU A1085 -10.220 -1.144 10.256 1.00 2.11 C ATOM 584 C GLU A1085 -9.102 -1.774 11.111 1.00 1.91 C ATOM 585 O GLU A1085 -9.347 -2.780 11.786 1.00 2.46 O ATOM 586 CB GLU A1085 -9.900 -1.210 8.738 1.00 2.65 C ATOM 587 CG GLU A1085 -8.749 -0.334 8.190 1.00 2.89 C ATOM 588 CD GLU A1085 -8.967 1.154 8.472 1.00 3.93 C ATOM 589 OE1 GLU A1085 -9.816 1.761 7.785 1.00 4.43 O ATOM 590 OE2 GLU A1085 -8.425 1.656 9.494 1.00 5.03 O ATOM 0 H GLU A1085 -9.815 0.810 10.900 1.00 1.80 H new ATOM 0 HA GLU A1085 -11.085 -1.767 10.485 1.00 2.11 H new ATOM 0 HB2 GLU A1085 -9.674 -2.247 8.491 1.00 2.65 H new ATOM 0 HB3 GLU A1085 -10.807 -0.944 8.196 1.00 2.65 H new ATOM 0 HG2 GLU A1085 -7.808 -0.652 8.638 1.00 2.89 H new ATOM 0 HG3 GLU A1085 -8.658 -0.488 7.115 1.00 2.89 H new ATOM 597 N HIS A1086 -7.883 -1.228 11.082 1.00 1.67 N ATOM 598 CA HIS A1086 -6.684 -1.868 11.637 1.00 1.71 C ATOM 599 C HIS A1086 -5.703 -0.852 12.263 1.00 1.55 C ATOM 600 O HIS A1086 -5.525 0.236 11.702 1.00 1.46 O ATOM 601 CB HIS A1086 -5.946 -2.626 10.509 1.00 2.11 C ATOM 602 CG HIS A1086 -6.795 -3.573 9.692 1.00 2.45 C ATOM 603 ND1 HIS A1086 -6.997 -3.523 8.329 1.00 3.43 N ATOM 604 CD2 HIS A1086 -7.525 -4.630 10.163 1.00 2.74 C ATOM 605 CE1 HIS A1086 -7.835 -4.517 7.994 1.00 3.70 C ATOM 606 NE2 HIS A1086 -8.206 -5.213 9.085 1.00 3.30 N ATOM 0 H HIS A1086 -7.697 -0.315 10.666 1.00 1.67 H new ATOM 0 HA HIS A1086 -7.015 -2.545 12.425 1.00 1.71 H new ATOM 0 HB2 HIS A1086 -5.500 -1.894 9.836 1.00 2.11 H new ATOM 0 HB3 HIS A1086 -5.127 -3.192 10.952 1.00 2.11 H new ATOM 0 HD2 HIS A1086 -7.569 -4.959 11.191 1.00 2.74 H new ATOM 0 HE1 HIS A1086 -8.166 -4.729 6.988 1.00 3.70 H new ATOM 0 HE2 HIS A1086 -8.851 -6.003 9.120 1.00 3.30 H new ATOM 614 N PRO A1087 -4.957 -1.216 13.327 1.00 1.75 N ATOM 615 CA PRO A1087 -3.835 -0.416 13.837 1.00 1.89 C ATOM 616 C PRO A1087 -2.710 -0.242 12.805 1.00 1.69 C ATOM 617 O PRO A1087 -1.954 0.730 12.856 1.00 1.99 O ATOM 618 CB PRO A1087 -3.307 -1.172 15.062 1.00 2.26 C ATOM 619 CG PRO A1087 -4.494 -2.021 15.502 1.00 2.39 C ATOM 620 CD PRO A1087 -5.173 -2.372 14.183 1.00 2.07 C ATOM 0 HA PRO A1087 -4.176 0.591 14.077 1.00 1.89 H new ATOM 0 HB2 PRO A1087 -2.445 -1.789 14.810 1.00 2.26 H new ATOM 0 HB3 PRO A1087 -2.991 -0.488 15.849 1.00 2.26 H new ATOM 0 HG2 PRO A1087 -4.174 -2.913 16.041 1.00 2.39 H new ATOM 0 HG3 PRO A1087 -5.161 -1.470 16.165 1.00 2.39 H new ATOM 0 HD2 PRO A1087 -4.743 -3.273 13.745 1.00 2.07 H new ATOM 0 HD3 PRO A1087 -6.236 -2.564 14.326 1.00 2.07 H new ATOM 628 N LEU A1088 -2.619 -1.172 11.847 1.00 1.42 N ATOM 629 CA LEU A1088 -1.723 -1.106 10.692 1.00 1.47 C ATOM 630 C LEU A1088 -2.150 -0.039 9.670 1.00 1.51 C ATOM 631 O LEU A1088 -1.307 0.538 8.983 1.00 1.84 O ATOM 632 CB LEU A1088 -1.654 -2.506 10.038 1.00 1.55 C ATOM 633 CG LEU A1088 -0.237 -3.080 9.886 1.00 1.88 C ATOM 634 CD1 LEU A1088 0.722 -2.166 9.121 1.00 2.69 C ATOM 635 CD2 LEU A1088 0.360 -3.374 11.258 1.00 1.96 C ATOM 0 H LEU A1088 -3.187 -2.019 11.857 1.00 1.42 H new ATOM 0 HA LEU A1088 -0.735 -0.806 11.040 1.00 1.47 H new ATOM 0 HB2 LEU A1088 -2.249 -3.199 10.633 1.00 1.55 H new ATOM 0 HB3 LEU A1088 -2.117 -2.454 9.052 1.00 1.55 H new ATOM 0 HG LEU A1088 -0.350 -3.993 9.301 1.00 1.88 H new ATOM 0 HD11 LEU A1088 1.701 -2.640 9.055 1.00 2.69 H new ATOM 0 HD12 LEU A1088 0.335 -1.991 8.117 1.00 2.69 H new ATOM 0 HD13 LEU A1088 0.814 -1.215 9.645 1.00 2.69 H new ATOM 0 HD21 LEU A1088 1.364 -3.780 11.138 1.00 1.96 H new ATOM 0 HD22 LEU A1088 0.408 -2.453 11.839 1.00 1.96 H new ATOM 0 HD23 LEU A1088 -0.265 -4.099 11.779 1.00 1.96 H new ATOM 647 N GLY A1089 -3.448 0.258 9.585 1.00 1.29 N ATOM 648 CA GLY A1089 -3.958 1.397 8.819 1.00 1.21 C ATOM 649 C GLY A1089 -3.524 2.708 9.472 1.00 1.17 C ATOM 650 O GLY A1089 -2.901 3.557 8.836 1.00 1.12 O ATOM 0 H GLY A1089 -4.177 -0.286 10.047 1.00 1.29 H new ATOM 0 HA2 GLY A1089 -3.587 1.352 7.795 1.00 1.21 H new ATOM 0 HA3 GLY A1089 -5.046 1.351 8.766 1.00 1.21 H new ATOM 654 N THR A1090 -3.714 2.808 10.791 1.00 1.25 N ATOM 655 CA THR A1090 -3.225 3.925 11.612 1.00 1.30 C ATOM 656 C THR A1090 -1.702 4.105 11.509 1.00 1.31 C ATOM 657 O THR A1090 -1.227 5.235 11.431 1.00 1.33 O ATOM 658 CB THR A1090 -3.647 3.736 13.079 1.00 1.50 C ATOM 659 OG1 THR A1090 -4.999 3.330 13.147 1.00 2.31 O ATOM 660 CG2 THR A1090 -3.528 5.029 13.883 1.00 2.02 C ATOM 0 H THR A1090 -4.220 2.105 11.329 1.00 1.25 H new ATOM 0 HA THR A1090 -3.681 4.835 11.222 1.00 1.30 H new ATOM 0 HB THR A1090 -2.980 2.983 13.498 1.00 1.50 H new ATOM 0 HG1 THR A1090 -5.258 3.211 14.085 1.00 2.31 H new ATOM 0 HG21 THR A1090 -3.837 4.847 14.912 1.00 2.02 H new ATOM 0 HG22 THR A1090 -2.493 5.372 13.869 1.00 2.02 H new ATOM 0 HG23 THR A1090 -4.169 5.792 13.442 1.00 2.02 H new ATOM 668 N ALA A1091 -0.921 3.021 11.442 1.00 1.33 N ATOM 669 CA ALA A1091 0.534 3.075 11.253 1.00 1.39 C ATOM 670 C ALA A1091 0.940 3.714 9.906 1.00 1.23 C ATOM 671 O ALA A1091 1.832 4.571 9.875 1.00 1.19 O ATOM 672 CB ALA A1091 1.109 1.660 11.402 1.00 1.58 C ATOM 0 H ALA A1091 -1.285 2.071 11.518 1.00 1.33 H new ATOM 0 HA ALA A1091 0.955 3.724 12.021 1.00 1.39 H new ATOM 0 HB1 ALA A1091 2.190 1.690 11.263 1.00 1.58 H new ATOM 0 HB2 ALA A1091 0.881 1.278 12.397 1.00 1.58 H new ATOM 0 HB3 ALA A1091 0.665 1.006 10.652 1.00 1.58 H new ATOM 678 N ILE A1092 0.249 3.356 8.812 1.00 1.16 N ATOM 679 CA ILE A1092 0.431 3.998 7.498 1.00 1.01 C ATOM 680 C ILE A1092 -0.002 5.460 7.569 1.00 0.89 C ATOM 681 O ILE A1092 0.768 6.338 7.172 1.00 0.82 O ATOM 682 CB ILE A1092 -0.331 3.247 6.376 1.00 1.04 C ATOM 683 CG1 ILE A1092 0.342 1.879 6.132 1.00 1.26 C ATOM 684 CG2 ILE A1092 -0.392 4.064 5.062 1.00 0.99 C ATOM 685 CD1 ILE A1092 -0.410 1.008 5.123 1.00 1.43 C ATOM 0 H ILE A1092 -0.451 2.614 8.812 1.00 1.16 H new ATOM 0 HA ILE A1092 1.490 3.953 7.245 1.00 1.01 H new ATOM 0 HB ILE A1092 -1.360 3.101 6.704 1.00 1.04 H new ATOM 0 HG12 ILE A1092 1.359 2.040 5.776 1.00 1.26 H new ATOM 0 HG13 ILE A1092 0.417 1.344 7.079 1.00 1.26 H new ATOM 0 HG21 ILE A1092 -0.935 3.497 4.306 1.00 0.99 H new ATOM 0 HG22 ILE A1092 -0.904 5.009 5.244 1.00 0.99 H new ATOM 0 HG23 ILE A1092 0.620 4.262 4.709 1.00 0.99 H new ATOM 0 HD11 ILE A1092 0.115 0.061 4.997 1.00 1.43 H new ATOM 0 HD12 ILE A1092 -1.419 0.817 5.488 1.00 1.43 H new ATOM 0 HD13 ILE A1092 -0.462 1.524 4.164 1.00 1.43 H new ATOM 697 N THR A1093 -1.210 5.745 8.068 1.00 0.91 N ATOM 698 CA THR A1093 -1.745 7.113 8.064 1.00 0.90 C ATOM 699 C THR A1093 -0.873 8.063 8.890 1.00 0.91 C ATOM 700 O THR A1093 -0.562 9.146 8.406 1.00 0.88 O ATOM 701 CB THR A1093 -3.245 7.152 8.430 1.00 1.00 C ATOM 702 OG1 THR A1093 -3.877 8.133 7.646 1.00 2.17 O ATOM 703 CG2 THR A1093 -3.579 7.491 9.883 1.00 1.50 C ATOM 0 H THR A1093 -1.834 5.050 8.478 1.00 0.91 H new ATOM 0 HA THR A1093 -1.696 7.488 7.042 1.00 0.90 H new ATOM 0 HB THR A1093 -3.590 6.133 8.253 1.00 1.00 H new ATOM 0 HG1 THR A1093 -3.828 7.878 6.701 1.00 2.17 H new ATOM 0 HG21 THR A1093 -4.661 7.488 10.018 1.00 1.50 H new ATOM 0 HG22 THR A1093 -3.129 6.749 10.542 1.00 1.50 H new ATOM 0 HG23 THR A1093 -3.186 8.478 10.126 1.00 1.50 H new ATOM 711 N LYS A1094 -0.352 7.644 10.057 1.00 1.00 N ATOM 712 CA LYS A1094 0.606 8.431 10.864 1.00 1.06 C ATOM 713 C LYS A1094 1.894 8.780 10.114 1.00 0.96 C ATOM 714 O LYS A1094 2.315 9.937 10.160 1.00 0.97 O ATOM 715 CB LYS A1094 0.952 7.675 12.158 1.00 1.28 C ATOM 716 CG LYS A1094 -0.178 7.774 13.194 1.00 1.64 C ATOM 717 CD LYS A1094 0.126 7.031 14.504 1.00 2.15 C ATOM 718 CE LYS A1094 0.392 5.533 14.290 1.00 3.70 C ATOM 719 NZ LYS A1094 0.506 4.815 15.578 1.00 4.29 N ATOM 0 H LYS A1094 -0.584 6.742 10.473 1.00 1.00 H new ATOM 0 HA LYS A1094 0.110 9.374 11.094 1.00 1.06 H new ATOM 0 HB2 LYS A1094 1.143 6.627 11.927 1.00 1.28 H new ATOM 0 HB3 LYS A1094 1.871 8.081 12.582 1.00 1.28 H new ATOM 0 HG2 LYS A1094 -0.366 8.824 13.416 1.00 1.64 H new ATOM 0 HG3 LYS A1094 -1.094 7.371 12.761 1.00 1.64 H new ATOM 0 HD2 LYS A1094 0.994 7.485 14.981 1.00 2.15 H new ATOM 0 HD3 LYS A1094 -0.713 7.152 15.189 1.00 2.15 H new ATOM 0 HE2 LYS A1094 -0.416 5.099 13.700 1.00 3.70 H new ATOM 0 HE3 LYS A1094 1.310 5.403 13.717 1.00 3.70 H new ATOM 0 HZ1 LYS A1094 0.685 3.806 15.399 1.00 4.29 H new ATOM 0 HZ2 LYS A1094 1.292 5.214 16.129 1.00 4.29 H new ATOM 0 HZ3 LYS A1094 -0.380 4.919 16.113 1.00 4.29 H new ATOM 733 N TYR A1095 2.479 7.812 9.400 1.00 0.92 N ATOM 734 CA TYR A1095 3.655 8.045 8.546 1.00 0.90 C ATOM 735 C TYR A1095 3.340 9.033 7.404 1.00 0.82 C ATOM 736 O TYR A1095 4.075 10.007 7.197 1.00 0.84 O ATOM 737 CB TYR A1095 4.190 6.696 8.023 1.00 0.97 C ATOM 738 CG TYR A1095 4.967 6.790 6.719 1.00 1.27 C ATOM 739 CD1 TYR A1095 6.226 7.423 6.680 1.00 1.98 C ATOM 740 CD2 TYR A1095 4.386 6.314 5.527 1.00 2.78 C ATOM 741 CE1 TYR A1095 6.883 7.611 5.448 1.00 2.20 C ATOM 742 CE2 TYR A1095 5.039 6.503 4.296 1.00 3.26 C ATOM 743 CZ TYR A1095 6.286 7.163 4.250 1.00 2.33 C ATOM 744 OH TYR A1095 6.899 7.374 3.054 1.00 2.94 O ATOM 0 H TYR A1095 2.153 6.845 9.396 1.00 0.92 H new ATOM 0 HA TYR A1095 4.438 8.513 9.142 1.00 0.90 H new ATOM 0 HB2 TYR A1095 4.834 6.255 8.784 1.00 0.97 H new ATOM 0 HB3 TYR A1095 3.350 6.016 7.883 1.00 0.97 H new ATOM 0 HD1 TYR A1095 6.687 7.764 7.595 1.00 1.98 H new ATOM 0 HD2 TYR A1095 3.436 5.802 5.559 1.00 2.78 H new ATOM 0 HE1 TYR A1095 7.846 8.099 5.420 1.00 2.20 H new ATOM 0 HE2 TYR A1095 4.586 6.143 3.384 1.00 3.26 H new ATOM 0 HH TYR A1095 6.349 7.000 2.334 1.00 2.94 H new ATOM 754 N CYS A1096 2.217 8.826 6.707 1.00 0.77 N ATOM 755 CA CYS A1096 1.812 9.642 5.562 1.00 0.77 C ATOM 756 C CYS A1096 1.447 11.072 5.981 1.00 0.81 C ATOM 757 O CYS A1096 1.943 12.014 5.378 1.00 0.89 O ATOM 758 CB CYS A1096 0.659 8.957 4.815 1.00 0.84 C ATOM 759 SG CYS A1096 1.193 7.336 4.194 1.00 2.29 S ATOM 0 H CYS A1096 1.558 8.079 6.926 1.00 0.77 H new ATOM 0 HA CYS A1096 2.661 9.728 4.884 1.00 0.77 H new ATOM 0 HB2 CYS A1096 -0.195 8.836 5.481 1.00 0.84 H new ATOM 0 HB3 CYS A1096 0.330 9.583 3.985 1.00 0.84 H new ATOM 0 HG CYS A1096 2.356 7.041 4.694 1.00 2.29 H new ATOM 765 N LYS A1097 0.666 11.258 7.055 1.00 0.83 N ATOM 766 CA LYS A1097 0.315 12.561 7.657 1.00 0.91 C ATOM 767 C LYS A1097 1.567 13.391 7.942 1.00 0.91 C ATOM 768 O LYS A1097 1.617 14.564 7.583 1.00 1.00 O ATOM 769 CB LYS A1097 -0.488 12.271 8.944 1.00 1.13 C ATOM 770 CG LYS A1097 -1.114 13.447 9.719 1.00 1.17 C ATOM 771 CD LYS A1097 -0.140 14.503 10.274 1.00 1.52 C ATOM 772 CE LYS A1097 -0.753 15.179 11.504 1.00 2.27 C ATOM 773 NZ LYS A1097 0.230 15.999 12.242 1.00 2.95 N ATOM 0 H LYS A1097 0.242 10.475 7.552 1.00 0.83 H new ATOM 0 HA LYS A1097 -0.288 13.153 6.969 1.00 0.91 H new ATOM 0 HB2 LYS A1097 -1.293 11.585 8.681 1.00 1.13 H new ATOM 0 HB3 LYS A1097 0.172 11.740 9.630 1.00 1.13 H new ATOM 0 HG2 LYS A1097 -1.823 13.950 9.061 1.00 1.17 H new ATOM 0 HG3 LYS A1097 -1.686 13.040 10.553 1.00 1.17 H new ATOM 0 HD2 LYS A1097 0.807 14.033 10.540 1.00 1.52 H new ATOM 0 HD3 LYS A1097 0.078 15.248 9.509 1.00 1.52 H new ATOM 0 HE2 LYS A1097 -1.587 15.808 11.192 1.00 2.27 H new ATOM 0 HE3 LYS A1097 -1.160 14.417 12.169 1.00 2.27 H new ATOM 0 HZ1 LYS A1097 -0.231 16.436 13.065 1.00 2.95 H new ATOM 0 HZ2 LYS A1097 1.014 15.396 12.564 1.00 2.95 H new ATOM 0 HZ3 LYS A1097 0.600 16.743 11.617 1.00 2.95 H new ATOM 787 N GLN A1098 2.597 12.772 8.516 1.00 0.88 N ATOM 788 CA GLN A1098 3.877 13.424 8.802 1.00 0.93 C ATOM 789 C GLN A1098 4.661 13.782 7.513 1.00 0.98 C ATOM 790 O GLN A1098 5.484 14.693 7.526 1.00 1.04 O ATOM 791 CB GLN A1098 4.643 12.509 9.772 1.00 0.97 C ATOM 792 CG GLN A1098 5.828 13.179 10.462 1.00 1.86 C ATOM 793 CD GLN A1098 6.666 12.215 11.300 1.00 2.41 C ATOM 794 OE1 GLN A1098 6.290 11.085 11.588 1.00 3.15 O ATOM 795 NE2 GLN A1098 7.849 12.598 11.714 1.00 3.53 N ATOM 0 H GLN A1098 2.568 11.793 8.799 1.00 0.88 H new ATOM 0 HA GLN A1098 3.722 14.393 9.276 1.00 0.93 H new ATOM 0 HB2 GLN A1098 3.952 12.146 10.533 1.00 0.97 H new ATOM 0 HB3 GLN A1098 5.001 11.637 9.225 1.00 0.97 H new ATOM 0 HG2 GLN A1098 6.465 13.641 9.707 1.00 1.86 H new ATOM 0 HG3 GLN A1098 5.460 13.981 11.103 1.00 1.86 H new ATOM 0 HE21 GLN A1098 8.190 13.533 11.490 1.00 3.53 H new ATOM 0 HE22 GLN A1098 8.429 11.961 12.260 1.00 3.53 H new ATOM 804 N GLU A1099 4.422 13.100 6.386 1.00 1.03 N ATOM 805 CA GLU A1099 4.913 13.483 5.044 1.00 1.21 C ATOM 806 C GLU A1099 4.011 14.513 4.311 1.00 1.36 C ATOM 807 O GLU A1099 4.460 15.166 3.362 1.00 1.74 O ATOM 808 CB GLU A1099 5.164 12.198 4.229 1.00 1.16 C ATOM 809 CG GLU A1099 5.905 12.362 2.887 1.00 1.76 C ATOM 810 CD GLU A1099 7.346 12.893 2.978 1.00 1.96 C ATOM 811 OE1 GLU A1099 7.899 13.073 4.091 1.00 2.04 O ATOM 812 OE2 GLU A1099 7.969 13.118 1.910 1.00 3.39 O ATOM 0 H GLU A1099 3.868 12.244 6.375 1.00 1.03 H new ATOM 0 HA GLU A1099 5.854 14.021 5.161 1.00 1.21 H new ATOM 0 HB2 GLU A1099 5.734 11.507 4.850 1.00 1.16 H new ATOM 0 HB3 GLU A1099 4.201 11.728 4.031 1.00 1.16 H new ATOM 0 HG2 GLU A1099 5.925 11.395 2.384 1.00 1.76 H new ATOM 0 HG3 GLU A1099 5.328 13.038 2.255 1.00 1.76 H new ATOM 819 N LEU A1100 2.752 14.692 4.739 1.00 1.19 N ATOM 820 CA LEU A1100 1.849 15.762 4.275 1.00 1.38 C ATOM 821 C LEU A1100 2.042 17.084 5.035 1.00 1.37 C ATOM 822 O LEU A1100 1.785 18.155 4.484 1.00 1.49 O ATOM 823 CB LEU A1100 0.366 15.370 4.456 1.00 1.41 C ATOM 824 CG LEU A1100 -0.174 14.110 3.768 1.00 1.45 C ATOM 825 CD1 LEU A1100 -1.696 14.070 3.925 1.00 1.69 C ATOM 826 CD2 LEU A1100 0.162 14.089 2.287 1.00 1.74 C ATOM 0 H LEU A1100 2.321 14.083 5.434 1.00 1.19 H new ATOM 0 HA LEU A1100 2.101 15.897 3.223 1.00 1.38 H new ATOM 0 HB2 LEU A1100 0.186 15.260 5.525 1.00 1.41 H new ATOM 0 HB3 LEU A1100 -0.238 16.211 4.116 1.00 1.41 H new ATOM 0 HG LEU A1100 0.293 13.244 4.238 1.00 1.45 H new ATOM 0 HD11 LEU A1100 -2.089 13.177 3.439 1.00 1.69 H new ATOM 0 HD12 LEU A1100 -1.952 14.049 4.984 1.00 1.69 H new ATOM 0 HD13 LEU A1100 -2.133 14.956 3.464 1.00 1.69 H new ATOM 0 HD21 LEU A1100 -0.238 13.181 1.836 1.00 1.74 H new ATOM 0 HD22 LEU A1100 -0.279 14.960 1.801 1.00 1.74 H new ATOM 0 HD23 LEU A1100 1.244 14.112 2.159 1.00 1.74 H new ATOM 838 N ASP A1101 2.432 17.002 6.309 1.00 1.29 N ATOM 839 CA ASP A1101 2.454 18.102 7.283 1.00 1.31 C ATOM 840 C ASP A1101 1.056 18.733 7.521 1.00 1.35 C ATOM 841 O ASP A1101 0.915 19.937 7.767 1.00 1.47 O ATOM 842 CB ASP A1101 3.601 19.082 6.960 1.00 1.47 C ATOM 843 CG ASP A1101 4.129 19.810 8.198 1.00 1.60 C ATOM 844 OD1 ASP A1101 4.681 19.152 9.114 1.00 1.73 O ATOM 845 OD2 ASP A1101 4.044 21.058 8.262 1.00 2.84 O ATOM 0 H ASP A1101 2.758 16.124 6.712 1.00 1.29 H new ATOM 0 HA ASP A1101 2.690 17.700 8.268 1.00 1.31 H new ATOM 0 HB2 ASP A1101 4.418 18.535 6.491 1.00 1.47 H new ATOM 0 HB3 ASP A1101 3.251 19.816 6.235 1.00 1.47 H new ATOM 850 N THR A1102 -0.011 17.919 7.442 1.00 1.35 N ATOM 851 CA THR A1102 -1.394 18.308 7.792 1.00 1.49 C ATOM 852 C THR A1102 -2.230 17.149 8.334 1.00 1.77 C ATOM 853 O THR A1102 -2.152 16.035 7.819 1.00 2.44 O ATOM 854 CB THR A1102 -2.122 18.954 6.599 1.00 1.85 C ATOM 855 OG1 THR A1102 -3.327 19.562 7.029 1.00 2.24 O ATOM 856 CG2 THR A1102 -2.515 18.013 5.461 1.00 2.27 C ATOM 0 H THR A1102 0.062 16.952 7.127 1.00 1.35 H new ATOM 0 HA THR A1102 -1.291 19.041 8.592 1.00 1.49 H new ATOM 0 HB THR A1102 -1.385 19.658 6.212 1.00 1.85 H new ATOM 0 HG1 THR A1102 -4.045 19.349 6.397 1.00 2.24 H new ATOM 0 HG21 THR A1102 -3.020 18.579 4.679 1.00 2.27 H new ATOM 0 HG22 THR A1102 -1.620 17.545 5.050 1.00 2.27 H new ATOM 0 HG23 THR A1102 -3.185 17.242 5.841 1.00 2.27 H new ATOM 864 N GLU A1103 -3.083 17.410 9.330 1.00 1.88 N ATOM 865 CA GLU A1103 -4.114 16.456 9.788 1.00 2.28 C ATOM 866 C GLU A1103 -5.453 16.577 9.031 1.00 2.11 C ATOM 867 O GLU A1103 -6.393 15.835 9.319 1.00 2.61 O ATOM 868 CB GLU A1103 -4.311 16.518 11.313 1.00 3.06 C ATOM 869 CG GLU A1103 -4.823 17.862 11.843 1.00 3.24 C ATOM 870 CD GLU A1103 -5.253 17.706 13.303 1.00 4.30 C ATOM 871 OE1 GLU A1103 -4.399 17.850 14.216 1.00 4.75 O ATOM 872 OE2 GLU A1103 -6.452 17.398 13.527 1.00 5.15 O ATOM 0 H GLU A1103 -3.083 18.290 9.846 1.00 1.88 H new ATOM 0 HA GLU A1103 -3.728 15.467 9.542 1.00 2.28 H new ATOM 0 HB2 GLU A1103 -5.013 15.737 11.606 1.00 3.06 H new ATOM 0 HB3 GLU A1103 -3.361 16.291 11.797 1.00 3.06 H new ATOM 0 HG2 GLU A1103 -4.042 18.618 11.762 1.00 3.24 H new ATOM 0 HG3 GLU A1103 -5.664 18.206 11.240 1.00 3.24 H new ATOM 879 N THR A1104 -5.553 17.475 8.041 1.00 1.73 N ATOM 880 CA THR A1104 -6.805 17.774 7.306 1.00 1.87 C ATOM 881 C THR A1104 -7.096 16.857 6.116 1.00 1.90 C ATOM 882 O THR A1104 -7.994 17.111 5.310 1.00 3.09 O ATOM 883 CB THR A1104 -6.880 19.250 6.870 1.00 2.01 C ATOM 884 OG1 THR A1104 -5.899 19.520 5.886 1.00 2.78 O ATOM 885 CG2 THR A1104 -6.684 20.237 8.021 1.00 2.46 C ATOM 0 H THR A1104 -4.758 18.026 7.718 1.00 1.73 H new ATOM 0 HA THR A1104 -7.588 17.571 8.036 1.00 1.87 H new ATOM 0 HB THR A1104 -7.886 19.391 6.476 1.00 2.01 H new ATOM 0 HG1 THR A1104 -5.957 20.460 5.615 1.00 2.78 H new ATOM 0 HG21 THR A1104 -6.749 21.257 7.641 1.00 2.46 H new ATOM 0 HG22 THR A1104 -7.459 20.079 8.772 1.00 2.46 H new ATOM 0 HG23 THR A1104 -5.704 20.080 8.472 1.00 2.46 H new ATOM 893 N LEU A1105 -6.346 15.764 6.005 1.00 1.35 N ATOM 894 CA LEU A1105 -6.565 14.696 5.038 1.00 1.11 C ATOM 895 C LEU A1105 -7.892 13.940 5.267 1.00 1.12 C ATOM 896 O LEU A1105 -8.391 13.801 6.386 1.00 1.45 O ATOM 897 CB LEU A1105 -5.335 13.770 5.024 1.00 0.94 C ATOM 898 CG LEU A1105 -5.257 12.749 6.172 1.00 1.45 C ATOM 899 CD1 LEU A1105 -3.998 11.900 6.024 1.00 1.38 C ATOM 900 CD2 LEU A1105 -5.225 13.378 7.552 1.00 2.18 C ATOM 0 H LEU A1105 -5.541 15.593 6.608 1.00 1.35 H new ATOM 0 HA LEU A1105 -6.676 15.138 4.048 1.00 1.11 H new ATOM 0 HB2 LEU A1105 -5.322 13.228 4.078 1.00 0.94 H new ATOM 0 HB3 LEU A1105 -4.437 14.388 5.050 1.00 0.94 H new ATOM 0 HG LEU A1105 -6.166 12.153 6.096 1.00 1.45 H new ATOM 0 HD11 LEU A1105 -3.948 11.179 6.840 1.00 1.38 H new ATOM 0 HD12 LEU A1105 -4.026 11.370 5.072 1.00 1.38 H new ATOM 0 HD13 LEU A1105 -3.119 12.544 6.055 1.00 1.38 H new ATOM 0 HD21 LEU A1105 -5.170 12.595 8.308 1.00 2.18 H new ATOM 0 HD22 LEU A1105 -4.352 14.026 7.637 1.00 2.18 H new ATOM 0 HD23 LEU A1105 -6.130 13.966 7.705 1.00 2.18 H new ATOM 912 N GLY A1106 -8.422 13.388 4.185 1.00 0.96 N ATOM 913 CA GLY A1106 -9.600 12.508 4.146 1.00 1.05 C ATOM 914 C GLY A1106 -10.234 12.382 2.758 1.00 1.08 C ATOM 915 O GLY A1106 -10.180 13.321 1.960 1.00 1.57 O ATOM 0 H GLY A1106 -8.027 13.545 3.258 1.00 0.96 H new ATOM 0 HA2 GLY A1106 -9.312 11.516 4.495 1.00 1.05 H new ATOM 0 HA3 GLY A1106 -10.347 12.887 4.843 1.00 1.05 H new ATOM 919 N THR A1107 -10.798 11.214 2.449 1.00 0.87 N ATOM 920 CA THR A1107 -11.365 10.863 1.143 1.00 0.99 C ATOM 921 C THR A1107 -12.515 9.860 1.290 1.00 0.93 C ATOM 922 O THR A1107 -12.396 8.930 2.092 1.00 0.91 O ATOM 923 CB THR A1107 -10.295 10.218 0.248 1.00 1.13 C ATOM 924 OG1 THR A1107 -9.696 9.121 0.911 1.00 1.09 O ATOM 925 CG2 THR A1107 -9.156 11.153 -0.162 1.00 1.45 C ATOM 0 H THR A1107 -10.876 10.456 3.127 1.00 0.87 H new ATOM 0 HA THR A1107 -11.733 11.786 0.696 1.00 0.99 H new ATOM 0 HB THR A1107 -10.837 9.924 -0.651 1.00 1.13 H new ATOM 0 HG1 THR A1107 -10.357 8.690 1.493 1.00 1.09 H new ATOM 0 HG21 THR A1107 -8.450 10.612 -0.791 1.00 1.45 H new ATOM 0 HG22 THR A1107 -9.562 11.999 -0.716 1.00 1.45 H new ATOM 0 HG23 THR A1107 -8.644 11.515 0.729 1.00 1.45 H new ATOM 933 N CYS A1108 -13.588 9.970 0.502 1.00 1.05 N ATOM 934 CA CYS A1108 -14.624 8.924 0.454 1.00 1.05 C ATOM 935 C CYS A1108 -14.096 7.674 -0.282 1.00 0.88 C ATOM 936 O CYS A1108 -13.404 7.822 -1.295 1.00 0.86 O ATOM 937 CB CYS A1108 -15.902 9.475 -0.191 1.00 1.22 C ATOM 938 SG CYS A1108 -16.500 10.922 0.729 1.00 2.00 S ATOM 0 H CYS A1108 -13.765 10.767 -0.110 1.00 1.05 H new ATOM 0 HA CYS A1108 -14.873 8.619 1.470 1.00 1.05 H new ATOM 0 HB2 CYS A1108 -15.705 9.750 -1.227 1.00 1.22 H new ATOM 0 HB3 CYS A1108 -16.671 8.703 -0.207 1.00 1.22 H new ATOM 0 HG CYS A1108 -15.884 11.987 0.310 1.00 2.00 H new ATOM 944 N ILE A1109 -14.403 6.466 0.222 1.00 0.84 N ATOM 945 CA ILE A1109 -13.889 5.184 -0.251 1.00 0.76 C ATOM 946 C ILE A1109 -14.923 4.054 -0.168 1.00 0.77 C ATOM 947 O ILE A1109 -15.758 4.024 0.736 1.00 0.98 O ATOM 948 CB ILE A1109 -12.584 4.766 0.481 1.00 0.71 C ATOM 949 CG1 ILE A1109 -12.819 4.466 1.983 1.00 1.17 C ATOM 950 CG2 ILE A1109 -11.459 5.795 0.287 1.00 1.30 C ATOM 951 CD1 ILE A1109 -11.552 4.050 2.736 1.00 1.21 C ATOM 0 H ILE A1109 -15.047 6.360 1.006 1.00 0.84 H new ATOM 0 HA ILE A1109 -13.658 5.342 -1.304 1.00 0.76 H new ATOM 0 HB ILE A1109 -12.259 3.835 0.016 1.00 0.71 H new ATOM 0 HG12 ILE A1109 -13.239 5.352 2.459 1.00 1.17 H new ATOM 0 HG13 ILE A1109 -13.561 3.673 2.074 1.00 1.17 H new ATOM 0 HG21 ILE A1109 -10.566 5.462 0.816 1.00 1.30 H new ATOM 0 HG22 ILE A1109 -11.236 5.894 -0.775 1.00 1.30 H new ATOM 0 HG23 ILE A1109 -11.776 6.760 0.683 1.00 1.30 H new ATOM 0 HD11 ILE A1109 -11.796 3.857 3.781 1.00 1.21 H new ATOM 0 HD12 ILE A1109 -11.142 3.146 2.286 1.00 1.21 H new ATOM 0 HD13 ILE A1109 -10.815 4.851 2.678 1.00 1.21 H new ATOM 963 N ASP A1110 -14.841 3.093 -1.090 1.00 0.69 N ATOM 964 CA ASP A1110 -15.721 1.907 -1.160 1.00 0.78 C ATOM 965 C ASP A1110 -14.925 0.619 -0.847 1.00 0.73 C ATOM 966 O ASP A1110 -14.488 -0.090 -1.752 1.00 0.74 O ATOM 967 CB ASP A1110 -16.377 1.904 -2.550 1.00 0.93 C ATOM 968 CG ASP A1110 -17.428 0.813 -2.729 1.00 1.07 C ATOM 969 OD1 ASP A1110 -18.282 0.627 -1.835 1.00 2.12 O ATOM 970 OD2 ASP A1110 -17.458 0.189 -3.818 1.00 1.79 O ATOM 0 H ASP A1110 -14.143 3.111 -1.834 1.00 0.69 H new ATOM 0 HA ASP A1110 -16.508 1.945 -0.406 1.00 0.78 H new ATOM 0 HB2 ASP A1110 -16.840 2.875 -2.726 1.00 0.93 H new ATOM 0 HB3 ASP A1110 -15.603 1.778 -3.307 1.00 0.93 H new ATOM 975 N PHE A1111 -14.679 0.369 0.444 1.00 0.76 N ATOM 976 CA PHE A1111 -13.725 -0.616 0.993 1.00 0.76 C ATOM 977 C PHE A1111 -14.221 -2.083 1.018 1.00 0.77 C ATOM 978 O PHE A1111 -15.126 -2.423 1.781 1.00 0.83 O ATOM 979 CB PHE A1111 -13.375 -0.100 2.406 1.00 0.86 C ATOM 980 CG PHE A1111 -12.059 -0.538 3.024 1.00 0.88 C ATOM 981 CD1 PHE A1111 -10.899 0.221 2.778 1.00 1.94 C ATOM 982 CD2 PHE A1111 -12.010 -1.592 3.959 1.00 2.56 C ATOM 983 CE1 PHE A1111 -9.707 -0.050 3.467 1.00 1.93 C ATOM 984 CE2 PHE A1111 -10.814 -1.865 4.651 1.00 2.62 C ATOM 985 CZ PHE A1111 -9.666 -1.088 4.413 1.00 1.02 C ATOM 0 H PHE A1111 -15.167 0.876 1.182 1.00 0.76 H new ATOM 0 HA PHE A1111 -12.857 -0.679 0.337 1.00 0.76 H new ATOM 0 HB2 PHE A1111 -13.381 0.990 2.374 1.00 0.86 H new ATOM 0 HB3 PHE A1111 -14.177 -0.404 3.079 1.00 0.86 H new ATOM 0 HD1 PHE A1111 -10.927 1.020 2.052 1.00 1.94 H new ATOM 0 HD2 PHE A1111 -12.890 -2.190 4.145 1.00 2.56 H new ATOM 0 HE1 PHE A1111 -8.823 0.538 3.271 1.00 1.93 H new ATOM 0 HE2 PHE A1111 -10.778 -2.673 5.366 1.00 2.62 H new ATOM 0 HZ PHE A1111 -8.755 -1.289 4.956 1.00 1.02 H new ATOM 995 N GLN A1112 -13.583 -2.966 0.236 1.00 0.79 N ATOM 996 CA GLN A1112 -13.859 -4.413 0.149 1.00 0.81 C ATOM 997 C GLN A1112 -12.613 -5.227 0.550 1.00 0.83 C ATOM 998 O GLN A1112 -11.505 -4.919 0.119 1.00 0.84 O ATOM 999 CB GLN A1112 -14.257 -4.806 -1.286 1.00 0.86 C ATOM 1000 CG GLN A1112 -15.325 -3.933 -1.961 1.00 1.51 C ATOM 1001 CD GLN A1112 -16.734 -4.020 -1.367 1.00 1.92 C ATOM 1002 OE1 GLN A1112 -17.193 -5.029 -0.841 1.00 2.38 O ATOM 1003 NE2 GLN A1112 -17.504 -2.963 -1.490 1.00 2.55 N ATOM 0 H GLN A1112 -12.824 -2.680 -0.383 1.00 0.79 H new ATOM 0 HA GLN A1112 -14.680 -4.633 0.831 1.00 0.81 H new ATOM 0 HB2 GLN A1112 -13.361 -4.790 -1.906 1.00 0.86 H new ATOM 0 HB3 GLN A1112 -14.616 -5.835 -1.271 1.00 0.86 H new ATOM 0 HG2 GLN A1112 -14.997 -2.894 -1.919 1.00 1.51 H new ATOM 0 HG3 GLN A1112 -15.378 -4.208 -3.014 1.00 1.51 H new ATOM 0 HE21 GLN A1112 -17.140 -2.115 -1.925 1.00 2.55 H new ATOM 0 HE22 GLN A1112 -18.466 -2.990 -1.151 1.00 2.55 H new ATOM 1012 N VAL A1113 -12.779 -6.287 1.345 1.00 0.96 N ATOM 1013 CA VAL A1113 -11.676 -7.023 1.995 1.00 1.01 C ATOM 1014 C VAL A1113 -11.736 -8.533 1.723 1.00 1.05 C ATOM 1015 O VAL A1113 -12.814 -9.133 1.678 1.00 1.26 O ATOM 1016 CB VAL A1113 -11.687 -6.729 3.518 1.00 1.11 C ATOM 1017 CG1 VAL A1113 -10.602 -7.480 4.306 1.00 1.20 C ATOM 1018 CG2 VAL A1113 -11.573 -5.231 3.834 1.00 1.15 C ATOM 0 H VAL A1113 -13.699 -6.670 1.563 1.00 0.96 H new ATOM 0 HA VAL A1113 -10.738 -6.673 1.564 1.00 1.01 H new ATOM 0 HB VAL A1113 -12.660 -7.097 3.843 1.00 1.11 H new ATOM 0 HG11 VAL A1113 -10.675 -7.222 5.362 1.00 1.20 H new ATOM 0 HG12 VAL A1113 -10.742 -8.554 4.184 1.00 1.20 H new ATOM 0 HG13 VAL A1113 -9.618 -7.197 3.931 1.00 1.20 H new ATOM 0 HG21 VAL A1113 -11.586 -5.085 4.914 1.00 1.15 H new ATOM 0 HG22 VAL A1113 -10.639 -4.843 3.427 1.00 1.15 H new ATOM 0 HG23 VAL A1113 -12.413 -4.700 3.386 1.00 1.15 H new ATOM 1028 N VAL A1114 -10.561 -9.154 1.591 1.00 0.96 N ATOM 1029 CA VAL A1114 -10.344 -10.612 1.569 1.00 1.12 C ATOM 1030 C VAL A1114 -9.239 -10.943 2.588 1.00 1.14 C ATOM 1031 O VAL A1114 -8.081 -10.586 2.338 1.00 0.96 O ATOM 1032 CB VAL A1114 -9.970 -11.125 0.164 1.00 1.17 C ATOM 1033 CG1 VAL A1114 -9.932 -12.661 0.151 1.00 1.99 C ATOM 1034 CG2 VAL A1114 -10.986 -10.678 -0.888 1.00 1.98 C ATOM 0 H VAL A1114 -9.690 -8.633 1.491 1.00 0.96 H new ATOM 0 HA VAL A1114 -11.273 -11.116 1.837 1.00 1.12 H new ATOM 0 HB VAL A1114 -8.991 -10.709 -0.075 1.00 1.17 H new ATOM 0 HG11 VAL A1114 -9.667 -13.010 -0.847 1.00 1.99 H new ATOM 0 HG12 VAL A1114 -9.190 -13.013 0.868 1.00 1.99 H new ATOM 0 HG13 VAL A1114 -10.913 -13.052 0.423 1.00 1.99 H new ATOM 0 HG21 VAL A1114 -10.689 -11.058 -1.865 1.00 1.98 H new ATOM 0 HG22 VAL A1114 -11.971 -11.067 -0.631 1.00 1.98 H new ATOM 0 HG23 VAL A1114 -11.023 -9.589 -0.918 1.00 1.98 H new ATOM 1044 N PRO A1115 -9.553 -11.580 3.740 1.00 1.51 N ATOM 1045 CA PRO A1115 -8.633 -11.748 4.871 1.00 1.73 C ATOM 1046 C PRO A1115 -7.270 -12.363 4.524 1.00 1.72 C ATOM 1047 O PRO A1115 -7.122 -13.576 4.343 1.00 2.01 O ATOM 1048 CB PRO A1115 -9.401 -12.577 5.908 1.00 2.17 C ATOM 1049 CG PRO A1115 -10.839 -12.123 5.683 1.00 2.19 C ATOM 1050 CD PRO A1115 -10.890 -11.987 4.163 1.00 1.85 C ATOM 0 HA PRO A1115 -8.349 -10.767 5.251 1.00 1.73 H new ATOM 0 HB2 PRO A1115 -9.282 -13.648 5.743 1.00 2.17 H new ATOM 0 HB3 PRO A1115 -9.064 -12.372 6.924 1.00 2.17 H new ATOM 0 HG2 PRO A1115 -11.560 -12.852 6.053 1.00 2.19 H new ATOM 0 HG3 PRO A1115 -11.053 -11.180 6.185 1.00 2.19 H new ATOM 0 HD2 PRO A1115 -11.174 -12.931 3.698 1.00 1.85 H new ATOM 0 HD3 PRO A1115 -11.634 -11.248 3.864 1.00 1.85 H new ATOM 1058 N GLY A1116 -6.256 -11.501 4.451 1.00 1.94 N ATOM 1059 CA GLY A1116 -4.857 -11.873 4.224 1.00 2.21 C ATOM 1060 C GLY A1116 -4.478 -12.064 2.750 1.00 1.67 C ATOM 1061 O GLY A1116 -3.329 -12.412 2.468 1.00 1.99 O ATOM 0 H GLY A1116 -6.388 -10.495 4.551 1.00 1.94 H new ATOM 0 HA2 GLY A1116 -4.216 -11.103 4.654 1.00 2.21 H new ATOM 0 HA3 GLY A1116 -4.649 -12.798 4.762 1.00 2.21 H new ATOM 1065 N CYS A1117 -5.414 -11.850 1.820 1.00 1.06 N ATOM 1066 CA CYS A1117 -5.151 -11.799 0.378 1.00 0.84 C ATOM 1067 C CYS A1117 -5.035 -10.342 -0.090 1.00 0.76 C ATOM 1068 O CYS A1117 -4.063 -9.993 -0.760 1.00 0.82 O ATOM 1069 CB CYS A1117 -6.247 -12.557 -0.384 1.00 0.97 C ATOM 1070 SG CYS A1117 -6.383 -14.273 0.194 1.00 1.64 S ATOM 0 H CYS A1117 -6.396 -11.704 2.053 1.00 1.06 H new ATOM 0 HA CYS A1117 -4.200 -12.288 0.167 1.00 0.84 H new ATOM 0 HB2 CYS A1117 -7.203 -12.049 -0.252 1.00 0.97 H new ATOM 0 HB3 CYS A1117 -6.025 -12.547 -1.451 1.00 0.97 H new ATOM 0 HG CYS A1117 -7.320 -14.882 -0.470 1.00 1.64 H new ATOM 1076 N GLY A1118 -5.968 -9.474 0.321 1.00 0.76 N ATOM 1077 CA GLY A1118 -5.886 -8.034 0.074 1.00 0.79 C ATOM 1078 C GLY A1118 -7.201 -7.268 0.233 1.00 0.78 C ATOM 1079 O GLY A1118 -8.175 -7.782 0.788 1.00 0.81 O ATOM 0 H GLY A1118 -6.803 -9.754 0.836 1.00 0.76 H new ATOM 0 HA2 GLY A1118 -5.151 -7.606 0.756 1.00 0.79 H new ATOM 0 HA3 GLY A1118 -5.513 -7.876 -0.938 1.00 0.79 H new ATOM 1083 N ILE A1119 -7.180 -5.995 -0.177 1.00 0.75 N ATOM 1084 CA ILE A1119 -8.231 -4.990 0.012 1.00 0.72 C ATOM 1085 C ILE A1119 -8.354 -4.086 -1.231 1.00 0.77 C ATOM 1086 O ILE A1119 -7.471 -3.271 -1.507 1.00 1.29 O ATOM 1087 CB ILE A1119 -7.954 -4.173 1.306 1.00 0.81 C ATOM 1088 CG1 ILE A1119 -7.917 -5.136 2.521 1.00 1.21 C ATOM 1089 CG2 ILE A1119 -9.003 -3.063 1.489 1.00 0.87 C ATOM 1090 CD1 ILE A1119 -7.800 -4.544 3.926 1.00 1.26 C ATOM 0 H ILE A1119 -6.378 -5.616 -0.681 1.00 0.75 H new ATOM 0 HA ILE A1119 -9.191 -5.492 0.133 1.00 0.72 H new ATOM 0 HB ILE A1119 -6.985 -3.681 1.224 1.00 0.81 H new ATOM 0 HG12 ILE A1119 -8.824 -5.740 2.492 1.00 1.21 H new ATOM 0 HG13 ILE A1119 -7.077 -5.816 2.378 1.00 1.21 H new ATOM 0 HG21 ILE A1119 -8.788 -2.506 2.401 1.00 0.87 H new ATOM 0 HG22 ILE A1119 -8.970 -2.387 0.634 1.00 0.87 H new ATOM 0 HG23 ILE A1119 -9.995 -3.508 1.562 1.00 0.87 H new ATOM 0 HD11 ILE A1119 -7.787 -5.349 4.660 1.00 1.26 H new ATOM 0 HD12 ILE A1119 -6.877 -3.969 4.003 1.00 1.26 H new ATOM 0 HD13 ILE A1119 -8.652 -3.891 4.118 1.00 1.26 H new ATOM 1102 N SER A1120 -9.449 -4.234 -1.984 1.00 0.67 N ATOM 1103 CA SER A1120 -9.851 -3.338 -3.084 1.00 0.66 C ATOM 1104 C SER A1120 -10.728 -2.176 -2.594 1.00 0.64 C ATOM 1105 O SER A1120 -11.630 -2.360 -1.775 1.00 0.67 O ATOM 1106 CB SER A1120 -10.562 -4.139 -4.180 1.00 0.74 C ATOM 1107 OG SER A1120 -10.756 -3.359 -5.346 1.00 1.53 O ATOM 0 H SER A1120 -10.103 -5.004 -1.844 1.00 0.67 H new ATOM 0 HA SER A1120 -8.946 -2.894 -3.499 1.00 0.66 H new ATOM 0 HB2 SER A1120 -9.974 -5.024 -4.426 1.00 0.74 H new ATOM 0 HB3 SER A1120 -11.526 -4.489 -3.810 1.00 0.74 H new ATOM 0 HG SER A1120 -11.210 -3.897 -6.028 1.00 1.53 H new ATOM 1113 N CYS A1121 -10.469 -0.958 -3.075 1.00 0.63 N ATOM 1114 CA CYS A1121 -11.264 0.229 -2.756 1.00 0.65 C ATOM 1115 C CYS A1121 -11.400 1.217 -3.930 1.00 0.67 C ATOM 1116 O CYS A1121 -10.616 1.189 -4.885 1.00 0.69 O ATOM 1117 CB CYS A1121 -10.687 0.883 -1.485 1.00 0.70 C ATOM 1118 SG CYS A1121 -9.068 1.628 -1.816 1.00 0.81 S ATOM 0 H CYS A1121 -9.690 -0.766 -3.706 1.00 0.63 H new ATOM 0 HA CYS A1121 -12.290 -0.086 -2.564 1.00 0.65 H new ATOM 0 HB2 CYS A1121 -11.375 1.646 -1.120 1.00 0.70 H new ATOM 0 HB3 CYS A1121 -10.593 0.135 -0.697 1.00 0.70 H new ATOM 0 HG CYS A1121 -8.610 2.172 -0.728 1.00 0.81 H new ATOM 1124 N LYS A1122 -12.372 2.138 -3.840 1.00 0.71 N ATOM 1125 CA LYS A1122 -12.455 3.307 -4.734 1.00 0.79 C ATOM 1126 C LYS A1122 -12.073 4.516 -3.893 1.00 0.79 C ATOM 1127 O LYS A1122 -12.274 4.446 -2.687 1.00 0.99 O ATOM 1128 CB LYS A1122 -13.855 3.467 -5.355 1.00 0.95 C ATOM 1129 CG LYS A1122 -14.332 2.299 -6.234 1.00 1.22 C ATOM 1130 CD LYS A1122 -13.398 1.984 -7.416 1.00 1.26 C ATOM 1131 CE LYS A1122 -14.058 1.119 -8.506 1.00 1.60 C ATOM 1132 NZ LYS A1122 -14.513 -0.201 -8.007 1.00 2.17 N ATOM 0 H LYS A1122 -13.121 2.095 -3.149 1.00 0.71 H new ATOM 0 HA LYS A1122 -11.780 3.189 -5.582 1.00 0.79 H new ATOM 0 HB2 LYS A1122 -14.575 3.609 -4.550 1.00 0.95 H new ATOM 0 HB3 LYS A1122 -13.864 4.377 -5.955 1.00 0.95 H new ATOM 0 HG2 LYS A1122 -14.430 1.408 -5.614 1.00 1.22 H new ATOM 0 HG3 LYS A1122 -15.325 2.530 -6.620 1.00 1.22 H new ATOM 0 HD2 LYS A1122 -13.060 2.920 -7.861 1.00 1.26 H new ATOM 0 HD3 LYS A1122 -12.512 1.470 -7.042 1.00 1.26 H new ATOM 0 HE2 LYS A1122 -14.910 1.657 -8.921 1.00 1.60 H new ATOM 0 HE3 LYS A1122 -13.349 0.968 -9.320 1.00 1.60 H new ATOM 0 HZ1 LYS A1122 -14.948 -0.736 -8.786 1.00 2.17 H new ATOM 0 HZ2 LYS A1122 -13.699 -0.731 -7.635 1.00 2.17 H new ATOM 0 HZ3 LYS A1122 -15.212 -0.064 -7.249 1.00 2.17 H new ATOM 1146 N VAL A1123 -11.544 5.586 -4.481 1.00 0.81 N ATOM 1147 CA VAL A1123 -11.157 6.809 -3.751 1.00 0.81 C ATOM 1148 C VAL A1123 -11.466 8.085 -4.540 1.00 0.87 C ATOM 1149 O VAL A1123 -11.363 8.113 -5.770 1.00 0.93 O ATOM 1150 CB VAL A1123 -9.692 6.715 -3.265 1.00 0.80 C ATOM 1151 CG1 VAL A1123 -8.663 6.707 -4.396 1.00 1.25 C ATOM 1152 CG2 VAL A1123 -9.324 7.837 -2.292 1.00 1.18 C ATOM 0 H VAL A1123 -11.367 5.638 -5.484 1.00 0.81 H new ATOM 0 HA VAL A1123 -11.778 6.881 -2.858 1.00 0.81 H new ATOM 0 HB VAL A1123 -9.651 5.753 -2.755 1.00 0.80 H new ATOM 0 HG11 VAL A1123 -7.660 6.639 -3.975 1.00 1.25 H new ATOM 0 HG12 VAL A1123 -8.843 5.850 -5.045 1.00 1.25 H new ATOM 0 HG13 VAL A1123 -8.752 7.626 -4.975 1.00 1.25 H new ATOM 0 HG21 VAL A1123 -8.285 7.724 -1.982 1.00 1.18 H new ATOM 0 HG22 VAL A1123 -9.453 8.801 -2.783 1.00 1.18 H new ATOM 0 HG23 VAL A1123 -9.971 7.786 -1.417 1.00 1.18 H new ATOM 1162 N THR A1124 -11.884 9.142 -3.837 1.00 0.90 N ATOM 1163 CA THR A1124 -12.245 10.451 -4.424 1.00 1.00 C ATOM 1164 C THR A1124 -11.931 11.581 -3.428 1.00 1.00 C ATOM 1165 O THR A1124 -11.269 11.321 -2.430 1.00 0.99 O ATOM 1166 CB THR A1124 -13.716 10.406 -4.882 1.00 1.10 C ATOM 1167 OG1 THR A1124 -14.109 11.569 -5.572 1.00 1.26 O ATOM 1168 CG2 THR A1124 -14.730 10.188 -3.763 1.00 1.07 C ATOM 0 H THR A1124 -11.985 9.119 -2.822 1.00 0.90 H new ATOM 0 HA THR A1124 -11.645 10.664 -5.309 1.00 1.00 H new ATOM 0 HB THR A1124 -13.729 9.538 -5.541 1.00 1.10 H new ATOM 0 HG1 THR A1124 -15.048 11.488 -5.841 1.00 1.26 H new ATOM 0 HG21 THR A1124 -15.736 10.171 -4.182 1.00 1.07 H new ATOM 0 HG22 THR A1124 -14.527 9.238 -3.268 1.00 1.07 H new ATOM 0 HG23 THR A1124 -14.652 10.999 -3.039 1.00 1.07 H new ATOM 1176 N ASN A1125 -12.357 12.826 -3.672 1.00 1.13 N ATOM 1177 CA ASN A1125 -12.037 14.031 -2.874 1.00 1.17 C ATOM 1178 C ASN A1125 -10.569 14.509 -2.995 1.00 1.46 C ATOM 1179 O ASN A1125 -10.128 15.351 -2.205 1.00 1.76 O ATOM 1180 CB ASN A1125 -12.465 13.871 -1.391 1.00 1.15 C ATOM 1181 CG ASN A1125 -13.938 13.674 -1.150 1.00 1.84 C ATOM 1182 OD1 ASN A1125 -14.441 12.559 -1.077 1.00 3.08 O ATOM 1183 ND2 ASN A1125 -14.673 14.738 -0.975 1.00 2.42 N ATOM 0 H ASN A1125 -12.962 13.038 -4.465 1.00 1.13 H new ATOM 0 HA ASN A1125 -12.634 14.828 -3.317 1.00 1.17 H new ATOM 0 HB2 ASN A1125 -11.930 13.020 -0.968 1.00 1.15 H new ATOM 0 HB3 ASN A1125 -12.142 14.755 -0.842 1.00 1.15 H new ATOM 0 HD21 ASN A1125 -15.669 14.643 -0.777 1.00 2.42 H new ATOM 0 HD22 ASN A1125 -14.251 15.665 -1.036 1.00 2.42 H new ATOM 1951 N GLN A1177 -12.725 10.086 -10.091 1.00 1.96 N ATOM 1952 CA GLN A1177 -12.616 8.956 -9.165 1.00 1.59 C ATOM 1953 C GLN A1177 -11.493 7.973 -9.565 1.00 1.48 C ATOM 1954 O GLN A1177 -11.229 7.789 -10.754 1.00 1.64 O ATOM 1955 CB GLN A1177 -13.999 8.288 -9.142 1.00 1.63 C ATOM 1956 CG GLN A1177 -14.233 7.256 -8.037 1.00 1.80 C ATOM 1957 CD GLN A1177 -15.668 6.775 -8.084 1.00 2.15 C ATOM 1958 OE1 GLN A1177 -15.995 5.740 -8.649 1.00 2.93 O ATOM 1959 NE2 GLN A1177 -16.595 7.528 -7.559 1.00 2.02 N ATOM 0 HA GLN A1177 -12.334 9.297 -8.169 1.00 1.59 H new ATOM 0 HB2 GLN A1177 -14.755 9.068 -9.048 1.00 1.63 H new ATOM 0 HB3 GLN A1177 -14.161 7.802 -10.104 1.00 1.63 H new ATOM 0 HG2 GLN A1177 -13.553 6.414 -8.163 1.00 1.80 H new ATOM 0 HG3 GLN A1177 -14.019 7.696 -7.063 1.00 1.80 H new ATOM 0 HE21 GLN A1177 -16.340 8.394 -7.084 1.00 2.02 H new ATOM 0 HE22 GLN A1177 -17.574 7.251 -7.623 1.00 2.02 H new ATOM 1968 N TYR A1178 -10.848 7.343 -8.580 1.00 1.27 N ATOM 1969 CA TYR A1178 -9.724 6.399 -8.740 1.00 1.15 C ATOM 1970 C TYR A1178 -10.041 5.023 -8.115 1.00 0.97 C ATOM 1971 O TYR A1178 -10.815 4.945 -7.156 1.00 1.08 O ATOM 1972 CB TYR A1178 -8.468 6.985 -8.072 1.00 1.33 C ATOM 1973 CG TYR A1178 -7.757 8.134 -8.773 1.00 1.46 C ATOM 1974 CD1 TYR A1178 -8.304 9.433 -8.768 1.00 2.93 C ATOM 1975 CD2 TYR A1178 -6.481 7.919 -9.328 1.00 1.70 C ATOM 1976 CE1 TYR A1178 -7.589 10.510 -9.336 1.00 3.19 C ATOM 1977 CE2 TYR A1178 -5.755 8.993 -9.878 1.00 1.83 C ATOM 1978 CZ TYR A1178 -6.316 10.287 -9.904 1.00 2.04 C ATOM 1979 OH TYR A1178 -5.616 11.304 -10.473 1.00 2.37 O ATOM 0 H TYR A1178 -11.102 7.479 -7.602 1.00 1.27 H new ATOM 0 HA TYR A1178 -9.555 6.254 -9.807 1.00 1.15 H new ATOM 0 HB2 TYR A1178 -8.747 7.324 -7.074 1.00 1.33 H new ATOM 0 HB3 TYR A1178 -7.749 6.176 -7.944 1.00 1.33 H new ATOM 0 HD1 TYR A1178 -9.275 9.605 -8.328 1.00 2.93 H new ATOM 0 HD2 TYR A1178 -6.057 6.926 -9.332 1.00 1.70 H new ATOM 0 HE1 TYR A1178 -8.015 11.502 -9.336 1.00 3.19 H new ATOM 0 HE2 TYR A1178 -4.767 8.826 -10.281 1.00 1.83 H new ATOM 0 HH TYR A1178 -4.761 10.964 -10.810 1.00 2.37 H new ATOM 1989 N LYS A1179 -9.407 3.942 -8.596 1.00 0.88 N ATOM 1990 CA LYS A1179 -9.484 2.585 -8.009 1.00 0.87 C ATOM 1991 C LYS A1179 -8.122 2.114 -7.493 1.00 0.83 C ATOM 1992 O LYS A1179 -7.142 2.160 -8.231 1.00 0.85 O ATOM 1993 CB LYS A1179 -10.077 1.626 -9.055 1.00 0.96 C ATOM 1994 CG LYS A1179 -10.391 0.223 -8.506 1.00 1.11 C ATOM 1995 CD LYS A1179 -9.336 -0.844 -8.843 1.00 1.61 C ATOM 1996 CE LYS A1179 -9.847 -2.234 -8.440 1.00 2.49 C ATOM 1997 NZ LYS A1179 -10.824 -2.788 -9.412 1.00 2.58 N ATOM 0 H LYS A1179 -8.811 3.983 -9.423 1.00 0.88 H new ATOM 0 HA LYS A1179 -10.139 2.602 -7.138 1.00 0.87 H new ATOM 0 HB2 LYS A1179 -10.992 2.062 -9.456 1.00 0.96 H new ATOM 0 HB3 LYS A1179 -9.378 1.532 -9.886 1.00 0.96 H new ATOM 0 HG2 LYS A1179 -10.494 0.285 -7.423 1.00 1.11 H new ATOM 0 HG3 LYS A1179 -11.355 -0.100 -8.899 1.00 1.11 H new ATOM 0 HD2 LYS A1179 -9.115 -0.824 -9.910 1.00 1.61 H new ATOM 0 HD3 LYS A1179 -8.405 -0.624 -8.321 1.00 1.61 H new ATOM 0 HE2 LYS A1179 -9.001 -2.916 -8.352 1.00 2.49 H new ATOM 0 HE3 LYS A1179 -10.313 -2.175 -7.456 1.00 2.49 H new ATOM 0 HZ1 LYS A1179 -11.124 -3.734 -9.102 1.00 2.58 H new ATOM 0 HZ2 LYS A1179 -11.653 -2.162 -9.466 1.00 2.58 H new ATOM 0 HZ3 LYS A1179 -10.380 -2.856 -10.350 1.00 2.58 H new ATOM 2011 N VAL A1180 -8.051 1.628 -6.252 1.00 0.77 N ATOM 2012 CA VAL A1180 -6.794 1.220 -5.585 1.00 0.71 C ATOM 2013 C VAL A1180 -6.944 -0.172 -4.971 1.00 0.67 C ATOM 2014 O VAL A1180 -7.966 -0.477 -4.359 1.00 0.76 O ATOM 2015 CB VAL A1180 -6.366 2.234 -4.499 1.00 0.74 C ATOM 2016 CG1 VAL A1180 -4.950 1.947 -3.980 1.00 1.58 C ATOM 2017 CG2 VAL A1180 -6.404 3.685 -4.993 1.00 1.28 C ATOM 0 H VAL A1180 -8.875 1.501 -5.665 1.00 0.77 H new ATOM 0 HA VAL A1180 -6.014 1.196 -6.346 1.00 0.71 H new ATOM 0 HB VAL A1180 -7.093 2.113 -3.696 1.00 0.74 H new ATOM 0 HG11 VAL A1180 -4.686 2.681 -3.219 1.00 1.58 H new ATOM 0 HG12 VAL A1180 -4.917 0.947 -3.547 1.00 1.58 H new ATOM 0 HG13 VAL A1180 -4.241 2.009 -4.805 1.00 1.58 H new ATOM 0 HG21 VAL A1180 -6.094 4.352 -4.188 1.00 1.28 H new ATOM 0 HG22 VAL A1180 -5.727 3.799 -5.840 1.00 1.28 H new ATOM 0 HG23 VAL A1180 -7.418 3.937 -5.303 1.00 1.28 H new ATOM 2027 N LEU A1181 -5.920 -1.014 -5.119 1.00 0.59 N ATOM 2028 CA LEU A1181 -5.911 -2.403 -4.653 1.00 0.63 C ATOM 2029 C LEU A1181 -4.611 -2.681 -3.894 1.00 0.60 C ATOM 2030 O LEU A1181 -3.521 -2.538 -4.450 1.00 0.70 O ATOM 2031 CB LEU A1181 -6.068 -3.305 -5.888 1.00 0.99 C ATOM 2032 CG LEU A1181 -6.553 -4.746 -5.641 1.00 0.94 C ATOM 2033 CD1 LEU A1181 -7.114 -5.318 -6.944 1.00 1.71 C ATOM 2034 CD2 LEU A1181 -5.411 -5.676 -5.237 1.00 2.12 C ATOM 0 H LEU A1181 -5.051 -0.742 -5.578 1.00 0.59 H new ATOM 0 HA LEU A1181 -6.730 -2.602 -3.962 1.00 0.63 H new ATOM 0 HB2 LEU A1181 -6.767 -2.824 -6.573 1.00 0.99 H new ATOM 0 HB3 LEU A1181 -5.106 -3.354 -6.397 1.00 0.99 H new ATOM 0 HG LEU A1181 -7.295 -4.695 -4.844 1.00 0.94 H new ATOM 0 HD11 LEU A1181 -7.459 -6.338 -6.775 1.00 1.71 H new ATOM 0 HD12 LEU A1181 -7.949 -4.704 -7.281 1.00 1.71 H new ATOM 0 HD13 LEU A1181 -6.334 -5.320 -7.706 1.00 1.71 H new ATOM 0 HD21 LEU A1181 -5.801 -6.681 -5.073 1.00 2.12 H new ATOM 0 HD22 LEU A1181 -4.664 -5.701 -6.031 1.00 2.12 H new ATOM 0 HD23 LEU A1181 -4.952 -5.311 -4.318 1.00 2.12 H new ATOM 2046 N ILE A1182 -4.729 -3.096 -2.634 1.00 0.64 N ATOM 2047 CA ILE A1182 -3.601 -3.467 -1.774 1.00 0.66 C ATOM 2048 C ILE A1182 -3.643 -4.978 -1.505 1.00 0.81 C ATOM 2049 O ILE A1182 -4.735 -5.529 -1.388 1.00 1.27 O ATOM 2050 CB ILE A1182 -3.644 -2.664 -0.440 1.00 0.74 C ATOM 2051 CG1 ILE A1182 -3.652 -1.122 -0.601 1.00 0.75 C ATOM 2052 CG2 ILE A1182 -2.449 -3.050 0.455 1.00 0.90 C ATOM 2053 CD1 ILE A1182 -5.034 -0.480 -0.803 1.00 1.75 C ATOM 0 H ILE A1182 -5.632 -3.187 -2.169 1.00 0.64 H new ATOM 0 HA ILE A1182 -2.666 -3.223 -2.279 1.00 0.66 H new ATOM 0 HB ILE A1182 -4.597 -2.937 0.014 1.00 0.74 H new ATOM 0 HG12 ILE A1182 -3.192 -0.680 0.283 1.00 0.75 H new ATOM 0 HG13 ILE A1182 -3.023 -0.861 -1.452 1.00 0.75 H new ATOM 0 HG21 ILE A1182 -2.492 -2.481 1.384 1.00 0.90 H new ATOM 0 HG22 ILE A1182 -2.492 -4.116 0.680 1.00 0.90 H new ATOM 0 HG23 ILE A1182 -1.518 -2.826 -0.065 1.00 0.90 H new ATOM 0 HD11 ILE A1182 -4.922 0.600 -0.904 1.00 1.75 H new ATOM 0 HD12 ILE A1182 -5.494 -0.883 -1.705 1.00 1.75 H new ATOM 0 HD13 ILE A1182 -5.667 -0.700 0.057 1.00 1.75 H new ATOM 2065 N GLY A1183 -2.507 -5.669 -1.363 1.00 0.60 N ATOM 2066 CA GLY A1183 -2.559 -7.059 -0.883 1.00 0.69 C ATOM 2067 C GLY A1183 -1.241 -7.822 -0.767 1.00 0.66 C ATOM 2068 O GLY A1183 -0.175 -7.245 -0.547 1.00 0.91 O ATOM 0 H GLY A1183 -1.574 -5.310 -1.564 1.00 0.60 H new ATOM 0 HA2 GLY A1183 -3.032 -7.057 0.099 1.00 0.69 H new ATOM 0 HA3 GLY A1183 -3.213 -7.620 -1.551 1.00 0.69 H new ATOM 2072 N ASN A1184 -1.348 -9.148 -0.878 1.00 0.70 N ATOM 2073 CA ASN A1184 -0.230 -10.089 -0.921 1.00 0.75 C ATOM 2074 C ASN A1184 0.317 -10.245 -2.356 1.00 0.65 C ATOM 2075 O ASN A1184 -0.418 -10.087 -3.336 1.00 0.60 O ATOM 2076 CB ASN A1184 -0.767 -11.432 -0.371 1.00 0.99 C ATOM 2077 CG ASN A1184 0.214 -12.586 -0.502 1.00 1.70 C ATOM 2078 OD1 ASN A1184 0.118 -13.401 -1.404 1.00 3.04 O ATOM 2079 ND2 ASN A1184 1.214 -12.673 0.336 1.00 2.37 N ATOM 0 H ASN A1184 -2.254 -9.613 -0.943 1.00 0.70 H new ATOM 0 HA ASN A1184 0.606 -9.730 -0.320 1.00 0.75 H new ATOM 0 HB2 ASN A1184 -1.026 -11.306 0.680 1.00 0.99 H new ATOM 0 HB3 ASN A1184 -1.686 -11.688 -0.898 1.00 0.99 H new ATOM 0 HD21 ASN A1184 1.904 -13.417 0.231 1.00 2.37 H new ATOM 0 HD22 ASN A1184 1.304 -11.997 1.094 1.00 2.37 H new ATOM 2086 N ARG A1185 1.567 -10.713 -2.472 1.00 0.72 N ATOM 2087 CA ARG A1185 2.257 -10.962 -3.753 1.00 0.74 C ATOM 2088 C ARG A1185 1.465 -11.889 -4.687 1.00 0.72 C ATOM 2089 O ARG A1185 1.319 -11.590 -5.871 1.00 0.77 O ATOM 2090 CB ARG A1185 3.648 -11.547 -3.442 1.00 1.00 C ATOM 2091 CG ARG A1185 4.544 -11.667 -4.688 1.00 1.56 C ATOM 2092 CD ARG A1185 5.845 -12.435 -4.422 1.00 1.67 C ATOM 2093 NE ARG A1185 5.588 -13.849 -4.100 1.00 2.11 N ATOM 2094 CZ ARG A1185 6.445 -14.751 -3.669 1.00 2.56 C ATOM 2095 NH1 ARG A1185 7.726 -14.561 -3.591 1.00 3.32 N ATOM 2096 NH2 ARG A1185 6.021 -15.917 -3.295 1.00 3.32 N ATOM 0 H ARG A1185 2.144 -10.936 -1.661 1.00 0.72 H new ATOM 0 HA ARG A1185 2.350 -10.017 -4.288 1.00 0.74 H new ATOM 0 HB2 ARG A1185 4.144 -10.917 -2.704 1.00 1.00 H new ATOM 0 HB3 ARG A1185 3.529 -12.532 -2.991 1.00 1.00 H new ATOM 0 HG2 ARG A1185 3.989 -12.169 -5.481 1.00 1.56 H new ATOM 0 HG3 ARG A1185 4.786 -10.668 -5.051 1.00 1.56 H new ATOM 0 HD2 ARG A1185 6.490 -12.373 -5.299 1.00 1.67 H new ATOM 0 HD3 ARG A1185 6.382 -11.966 -3.598 1.00 1.67 H new ATOM 0 HE ARG A1185 4.628 -14.169 -4.226 1.00 2.11 H new ATOM 0 HH11 ARG A1185 8.127 -13.667 -3.874 1.00 3.32 H new ATOM 0 HH12 ARG A1185 8.332 -15.306 -3.247 1.00 3.32 H new ATOM 0 HH21 ARG A1185 5.025 -16.134 -3.335 1.00 3.32 H new ATOM 0 HH22 ARG A1185 6.683 -16.617 -2.961 1.00 3.32 H new ATOM 2110 N GLU A1186 0.931 -12.992 -4.164 1.00 0.76 N ATOM 2111 CA GLU A1186 0.129 -13.952 -4.934 1.00 0.83 C ATOM 2112 C GLU A1186 -1.301 -13.472 -5.272 1.00 0.87 C ATOM 2113 O GLU A1186 -1.903 -13.997 -6.213 1.00 1.11 O ATOM 2114 CB GLU A1186 0.139 -15.335 -4.254 1.00 0.97 C ATOM 2115 CG GLU A1186 1.296 -16.246 -4.701 1.00 1.74 C ATOM 2116 CD GLU A1186 2.702 -15.739 -4.344 1.00 2.95 C ATOM 2117 OE1 GLU A1186 3.203 -16.023 -3.224 1.00 3.80 O ATOM 2118 OE2 GLU A1186 3.373 -15.136 -5.215 1.00 4.15 O ATOM 0 H GLU A1186 1.042 -13.250 -3.184 1.00 0.76 H new ATOM 0 HA GLU A1186 0.614 -14.039 -5.906 1.00 0.83 H new ATOM 0 HB2 GLU A1186 0.196 -15.197 -3.174 1.00 0.97 H new ATOM 0 HB3 GLU A1186 -0.806 -15.837 -4.462 1.00 0.97 H new ATOM 0 HG2 GLU A1186 1.157 -17.230 -4.253 1.00 1.74 H new ATOM 0 HG3 GLU A1186 1.238 -16.377 -5.782 1.00 1.74 H new ATOM 2125 N TRP A1187 -1.862 -12.451 -4.605 1.00 0.77 N ATOM 2126 CA TRP A1187 -3.185 -11.910 -4.975 1.00 0.81 C ATOM 2127 C TRP A1187 -3.100 -10.902 -6.138 1.00 0.73 C ATOM 2128 O TRP A1187 -4.105 -10.603 -6.792 1.00 0.83 O ATOM 2129 CB TRP A1187 -3.894 -11.333 -3.739 1.00 0.94 C ATOM 2130 CG TRP A1187 -5.393 -11.222 -3.841 1.00 1.25 C ATOM 2131 CD1 TRP A1187 -6.233 -12.248 -4.118 1.00 2.45 C ATOM 2132 CD2 TRP A1187 -6.261 -10.063 -3.621 1.00 0.99 C ATOM 2133 NE1 TRP A1187 -7.542 -11.809 -4.095 1.00 2.79 N ATOM 2134 CE2 TRP A1187 -7.621 -10.475 -3.774 1.00 1.80 C ATOM 2135 CE3 TRP A1187 -6.048 -8.702 -3.314 1.00 1.41 C ATOM 2136 CZ2 TRP A1187 -8.703 -9.594 -3.635 1.00 1.80 C ATOM 2137 CZ3 TRP A1187 -7.128 -7.808 -3.161 1.00 1.72 C ATOM 2138 CH2 TRP A1187 -8.454 -8.248 -3.324 1.00 1.39 C ATOM 0 H TRP A1187 -1.425 -11.984 -3.811 1.00 0.77 H new ATOM 0 HA TRP A1187 -3.794 -12.734 -5.348 1.00 0.81 H new ATOM 0 HB2 TRP A1187 -3.652 -11.957 -2.879 1.00 0.94 H new ATOM 0 HB3 TRP A1187 -3.487 -10.342 -3.539 1.00 0.94 H new ATOM 0 HD1 TRP A1187 -5.924 -13.262 -4.326 1.00 2.45 H new ATOM 0 HE1 TRP A1187 -8.349 -12.401 -4.292 1.00 2.79 H new ATOM 0 HE3 TRP A1187 -5.038 -8.338 -3.194 1.00 1.41 H new ATOM 0 HZ2 TRP A1187 -9.715 -9.947 -3.766 1.00 1.80 H new ATOM 0 HZ3 TRP A1187 -6.935 -6.774 -2.916 1.00 1.72 H new ATOM 0 HH2 TRP A1187 -9.275 -7.555 -3.211 1.00 1.39 H new ATOM 2149 N MET A1188 -1.889 -10.435 -6.472 1.00 0.71 N ATOM 2150 CA MET A1188 -1.636 -9.650 -7.685 1.00 0.78 C ATOM 2151 C MET A1188 -1.641 -10.511 -8.951 1.00 0.89 C ATOM 2152 O MET A1188 -2.232 -10.081 -9.939 1.00 0.92 O ATOM 2153 CB MET A1188 -0.331 -8.853 -7.555 1.00 0.92 C ATOM 2154 CG MET A1188 -0.504 -7.652 -6.624 1.00 0.97 C ATOM 2155 SD MET A1188 -1.662 -6.394 -7.234 1.00 1.81 S ATOM 2156 CE MET A1188 -1.956 -5.431 -5.729 1.00 0.68 C ATOM 0 H MET A1188 -1.055 -10.592 -5.906 1.00 0.71 H new ATOM 0 HA MET A1188 -2.460 -8.944 -7.789 1.00 0.78 H new ATOM 0 HB2 MET A1188 0.457 -9.502 -7.173 1.00 0.92 H new ATOM 0 HB3 MET A1188 -0.012 -8.510 -8.539 1.00 0.92 H new ATOM 0 HG2 MET A1188 -0.850 -8.007 -5.653 1.00 0.97 H new ATOM 0 HG3 MET A1188 0.469 -7.187 -6.466 1.00 0.97 H new ATOM 0 HE1 MET A1188 -2.608 -4.588 -5.958 1.00 0.68 H new ATOM 0 HE2 MET A1188 -2.431 -6.064 -4.979 1.00 0.68 H new ATOM 0 HE3 MET A1188 -1.006 -5.061 -5.343 1.00 0.68 H new ATOM 2166 N ILE A1189 -1.114 -11.746 -8.925 1.00 1.03 N ATOM 2167 CA ILE A1189 -1.296 -12.684 -10.054 1.00 1.26 C ATOM 2168 C ILE A1189 -2.759 -13.149 -10.174 1.00 1.33 C ATOM 2169 O ILE A1189 -3.230 -13.396 -11.287 1.00 1.55 O ATOM 2170 CB ILE A1189 -0.278 -13.851 -10.073 1.00 1.43 C ATOM 2171 CG1 ILE A1189 -0.387 -14.777 -8.848 1.00 2.45 C ATOM 2172 CG2 ILE A1189 1.157 -13.310 -10.225 1.00 1.96 C ATOM 2173 CD1 ILE A1189 0.469 -16.046 -8.946 1.00 2.65 C ATOM 0 H ILE A1189 -0.566 -12.118 -8.149 1.00 1.03 H new ATOM 0 HA ILE A1189 -1.068 -12.118 -10.958 1.00 1.26 H new ATOM 0 HB ILE A1189 -0.526 -14.465 -10.939 1.00 1.43 H new ATOM 0 HG12 ILE A1189 -0.093 -14.221 -7.958 1.00 2.45 H new ATOM 0 HG13 ILE A1189 -1.430 -15.064 -8.714 1.00 2.45 H new ATOM 0 HG21 ILE A1189 1.860 -14.143 -10.237 1.00 1.96 H new ATOM 0 HG22 ILE A1189 1.239 -12.753 -11.158 1.00 1.96 H new ATOM 0 HG23 ILE A1189 1.388 -12.651 -9.388 1.00 1.96 H new ATOM 0 HD11 ILE A1189 0.337 -16.645 -8.045 1.00 2.65 H new ATOM 0 HD12 ILE A1189 0.161 -16.626 -9.816 1.00 2.65 H new ATOM 0 HD13 ILE A1189 1.519 -15.770 -9.047 1.00 2.65 H new ATOM 2185 N ARG A1190 -3.538 -13.137 -9.076 1.00 1.23 N ATOM 2186 CA ARG A1190 -5.003 -13.311 -9.135 1.00 1.35 C ATOM 2187 C ARG A1190 -5.642 -12.142 -9.897 1.00 1.21 C ATOM 2188 O ARG A1190 -6.418 -12.379 -10.818 1.00 1.30 O ATOM 2189 CB ARG A1190 -5.590 -13.519 -7.723 1.00 1.43 C ATOM 2190 CG ARG A1190 -7.121 -13.624 -7.657 1.00 1.88 C ATOM 2191 CD ARG A1190 -7.656 -14.847 -8.397 1.00 2.07 C ATOM 2192 NE ARG A1190 -7.386 -16.092 -7.654 1.00 2.86 N ATOM 2193 CZ ARG A1190 -7.636 -17.329 -8.041 1.00 4.20 C ATOM 2194 NH1 ARG A1190 -8.212 -17.629 -9.162 1.00 5.01 N ATOM 2195 NH2 ARG A1190 -7.304 -18.349 -7.311 1.00 5.34 N ATOM 0 H ARG A1190 -3.175 -13.008 -8.132 1.00 1.23 H new ATOM 0 HA ARG A1190 -5.241 -14.217 -9.693 1.00 1.35 H new ATOM 0 HB2 ARG A1190 -5.162 -14.427 -7.300 1.00 1.43 H new ATOM 0 HB3 ARG A1190 -5.272 -12.691 -7.090 1.00 1.43 H new ATOM 0 HG2 ARG A1190 -7.434 -13.669 -6.614 1.00 1.88 H new ATOM 0 HG3 ARG A1190 -7.562 -12.723 -8.084 1.00 1.88 H new ATOM 0 HD2 ARG A1190 -8.730 -14.739 -8.550 1.00 2.07 H new ATOM 0 HD3 ARG A1190 -7.198 -14.905 -9.384 1.00 2.07 H new ATOM 0 HE ARG A1190 -6.957 -15.985 -6.735 1.00 2.86 H new ATOM 0 HH11 ARG A1190 -8.500 -16.888 -9.802 1.00 5.01 H new ATOM 0 HH12 ARG A1190 -8.378 -18.606 -9.405 1.00 5.01 H new ATOM 0 HH21 ARG A1190 -6.838 -18.205 -6.415 1.00 5.34 H new ATOM 0 HH22 ARG A1190 -7.509 -19.295 -7.633 1.00 5.34 H new ATOM 2209 N ASN A1191 -5.230 -10.903 -9.615 1.00 1.04 N ATOM 2210 CA ASN A1191 -5.575 -9.712 -10.416 1.00 0.93 C ATOM 2211 C ASN A1191 -4.898 -9.673 -11.814 1.00 0.96 C ATOM 2212 O ASN A1191 -5.136 -8.741 -12.577 1.00 1.10 O ATOM 2213 CB ASN A1191 -5.261 -8.417 -9.623 1.00 0.84 C ATOM 2214 CG ASN A1191 -5.988 -7.209 -10.212 1.00 1.18 C ATOM 2215 OD1 ASN A1191 -7.198 -7.198 -10.386 1.00 1.62 O ATOM 2216 ND2 ASN A1191 -5.291 -6.159 -10.580 1.00 1.73 N ATOM 0 H ASN A1191 -4.638 -10.690 -8.812 1.00 1.04 H new ATOM 0 HA ASN A1191 -6.646 -9.778 -10.606 1.00 0.93 H new ATOM 0 HB2 ASN A1191 -5.554 -8.547 -8.581 1.00 0.84 H new ATOM 0 HB3 ASN A1191 -4.186 -8.236 -9.631 1.00 0.84 H new ATOM 0 HD21 ASN A1191 -5.760 -5.357 -11.001 1.00 1.73 H new ATOM 0 HD22 ASN A1191 -4.280 -6.145 -10.445 1.00 1.73 H new ATOM 2223 N GLY A1192 -4.044 -10.635 -12.180 1.00 1.09 N ATOM 2224 CA GLY A1192 -3.351 -10.696 -13.478 1.00 1.22 C ATOM 2225 C GLY A1192 -2.153 -9.746 -13.649 1.00 1.12 C ATOM 2226 O GLY A1192 -1.640 -9.614 -14.763 1.00 1.39 O ATOM 0 H GLY A1192 -3.807 -11.415 -11.567 1.00 1.09 H new ATOM 0 HA2 GLY A1192 -3.004 -11.717 -13.635 1.00 1.22 H new ATOM 0 HA3 GLY A1192 -4.075 -10.481 -14.264 1.00 1.22 H new ATOM 2230 N LEU A1193 -1.710 -9.085 -12.576 1.00 0.86 N ATOM 2231 CA LEU A1193 -0.466 -8.303 -12.494 1.00 0.84 C ATOM 2232 C LEU A1193 0.729 -9.221 -12.145 1.00 1.15 C ATOM 2233 O LEU A1193 0.553 -10.410 -11.881 1.00 1.58 O ATOM 2234 CB LEU A1193 -0.657 -7.197 -11.432 1.00 0.63 C ATOM 2235 CG LEU A1193 -1.661 -6.088 -11.811 1.00 0.69 C ATOM 2236 CD1 LEU A1193 -2.108 -5.347 -10.553 1.00 0.97 C ATOM 2237 CD2 LEU A1193 -1.058 -5.034 -12.737 1.00 1.08 C ATOM 0 H LEU A1193 -2.230 -9.078 -11.699 1.00 0.86 H new ATOM 0 HA LEU A1193 -0.245 -7.843 -13.457 1.00 0.84 H new ATOM 0 HB2 LEU A1193 -0.987 -7.661 -10.503 1.00 0.63 H new ATOM 0 HB3 LEU A1193 0.310 -6.736 -11.232 1.00 0.63 H new ATOM 0 HG LEU A1193 -2.486 -6.589 -12.318 1.00 0.69 H new ATOM 0 HD11 LEU A1193 -2.817 -4.565 -10.824 1.00 0.97 H new ATOM 0 HD12 LEU A1193 -2.585 -6.048 -9.868 1.00 0.97 H new ATOM 0 HD13 LEU A1193 -1.241 -4.899 -10.067 1.00 0.97 H new ATOM 0 HD21 LEU A1193 -1.810 -4.280 -12.969 1.00 1.08 H new ATOM 0 HD22 LEU A1193 -0.209 -4.560 -12.244 1.00 1.08 H new ATOM 0 HD23 LEU A1193 -0.723 -5.509 -13.659 1.00 1.08 H new ATOM 2249 N VAL A1194 1.947 -8.678 -12.134 1.00 1.30 N ATOM 2250 CA VAL A1194 3.185 -9.324 -11.637 1.00 1.69 C ATOM 2251 C VAL A1194 4.190 -8.260 -11.162 1.00 1.23 C ATOM 2252 O VAL A1194 4.208 -7.158 -11.719 1.00 1.02 O ATOM 2253 CB VAL A1194 3.785 -10.247 -12.724 1.00 2.30 C ATOM 2254 CG1 VAL A1194 4.319 -9.492 -13.951 1.00 2.07 C ATOM 2255 CG2 VAL A1194 4.900 -11.146 -12.178 1.00 3.21 C ATOM 0 H VAL A1194 2.116 -7.735 -12.484 1.00 1.30 H new ATOM 0 HA VAL A1194 2.943 -9.949 -10.778 1.00 1.69 H new ATOM 0 HB VAL A1194 2.943 -10.861 -13.043 1.00 2.30 H new ATOM 0 HG11 VAL A1194 4.724 -10.205 -14.669 1.00 2.07 H new ATOM 0 HG12 VAL A1194 3.508 -8.931 -14.415 1.00 2.07 H new ATOM 0 HG13 VAL A1194 5.105 -8.804 -13.641 1.00 2.07 H new ATOM 0 HG21 VAL A1194 5.287 -11.774 -12.981 1.00 3.21 H new ATOM 0 HG22 VAL A1194 5.705 -10.527 -11.781 1.00 3.21 H new ATOM 0 HG23 VAL A1194 4.502 -11.777 -11.383 1.00 3.21 H new ATOM 2265 N ILE A1195 5.028 -8.557 -10.157 1.00 1.51 N ATOM 2266 CA ILE A1195 6.037 -7.623 -9.602 1.00 1.44 C ATOM 2267 C ILE A1195 7.488 -8.004 -9.975 1.00 1.46 C ATOM 2268 O ILE A1195 7.769 -9.167 -10.290 1.00 1.80 O ATOM 2269 CB ILE A1195 5.802 -7.428 -8.082 1.00 2.15 C ATOM 2270 CG1 ILE A1195 6.283 -6.031 -7.631 1.00 2.53 C ATOM 2271 CG2 ILE A1195 6.443 -8.546 -7.242 1.00 2.81 C ATOM 2272 CD1 ILE A1195 5.912 -5.665 -6.188 1.00 2.91 C ATOM 0 H ILE A1195 5.029 -9.466 -9.695 1.00 1.51 H new ATOM 0 HA ILE A1195 5.899 -6.651 -10.075 1.00 1.44 H new ATOM 0 HB ILE A1195 4.728 -7.491 -7.908 1.00 2.15 H new ATOM 0 HG12 ILE A1195 7.367 -5.982 -7.738 1.00 2.53 H new ATOM 0 HG13 ILE A1195 5.863 -5.282 -8.302 1.00 2.53 H new ATOM 0 HG21 ILE A1195 6.250 -8.363 -6.185 1.00 2.81 H new ATOM 0 HG22 ILE A1195 6.015 -9.507 -7.528 1.00 2.81 H new ATOM 0 HG23 ILE A1195 7.519 -8.561 -7.417 1.00 2.81 H new ATOM 0 HD11 ILE A1195 6.289 -4.669 -5.957 1.00 2.91 H new ATOM 0 HD12 ILE A1195 4.828 -5.678 -6.077 1.00 2.91 H new ATOM 0 HD13 ILE A1195 6.355 -6.388 -5.504 1.00 2.91 H new ATOM 2284 N ASN A1196 8.418 -7.040 -9.955 1.00 1.26 N ATOM 2285 CA ASN A1196 9.814 -7.237 -10.381 1.00 1.22 C ATOM 2286 C ASN A1196 10.576 -8.251 -9.500 1.00 1.04 C ATOM 2287 O ASN A1196 10.346 -8.353 -8.294 1.00 0.94 O ATOM 2288 CB ASN A1196 10.553 -5.880 -10.447 1.00 1.39 C ATOM 2289 CG ASN A1196 10.563 -5.293 -11.845 1.00 1.77 C ATOM 2290 OD1 ASN A1196 11.540 -5.400 -12.578 1.00 2.92 O ATOM 2291 ND2 ASN A1196 9.486 -4.675 -12.253 1.00 1.59 N ATOM 0 H ASN A1196 8.222 -6.090 -9.639 1.00 1.26 H new ATOM 0 HA ASN A1196 9.785 -7.671 -11.381 1.00 1.22 H new ATOM 0 HB2 ASN A1196 10.076 -5.177 -9.764 1.00 1.39 H new ATOM 0 HB3 ASN A1196 11.579 -6.012 -10.104 1.00 1.39 H new ATOM 0 HD21 ASN A1196 9.452 -4.275 -13.191 1.00 1.59 H new ATOM 0 HD22 ASN A1196 8.680 -4.593 -11.634 1.00 1.59 H new ATOM 2298 N ASN A1197 11.524 -8.981 -10.088 1.00 1.08 N ATOM 2299 CA ASN A1197 12.263 -10.044 -9.393 1.00 1.07 C ATOM 2300 C ASN A1197 13.202 -9.523 -8.288 1.00 1.04 C ATOM 2301 O ASN A1197 13.339 -10.180 -7.255 1.00 1.03 O ATOM 2302 CB ASN A1197 13.059 -10.863 -10.419 1.00 1.28 C ATOM 2303 CG ASN A1197 12.215 -11.681 -11.378 1.00 2.50 C ATOM 2304 OD1 ASN A1197 11.002 -11.801 -11.266 1.00 3.67 O ATOM 2305 ND2 ASN A1197 12.861 -12.282 -12.343 1.00 3.23 N ATOM 0 H ASN A1197 11.804 -8.855 -11.061 1.00 1.08 H new ATOM 0 HA ASN A1197 11.524 -10.669 -8.891 1.00 1.07 H new ATOM 0 HB2 ASN A1197 13.685 -10.183 -10.998 1.00 1.28 H new ATOM 0 HB3 ASN A1197 13.729 -11.536 -9.884 1.00 1.28 H new ATOM 0 HD21 ASN A1197 12.354 -12.859 -13.014 1.00 3.23 H new ATOM 0 HD22 ASN A1197 13.872 -12.174 -12.425 1.00 3.23 H new ATOM 2312 N ASP A1198 13.808 -8.345 -8.474 1.00 1.12 N ATOM 2313 CA ASP A1198 14.699 -7.714 -7.485 1.00 1.23 C ATOM 2314 C ASP A1198 13.941 -7.371 -6.186 1.00 1.14 C ATOM 2315 O ASP A1198 14.339 -7.786 -5.094 1.00 1.16 O ATOM 2316 CB ASP A1198 15.349 -6.472 -8.119 1.00 1.45 C ATOM 2317 CG ASP A1198 16.375 -5.796 -7.202 1.00 1.82 C ATOM 2318 OD1 ASP A1198 17.252 -6.505 -6.653 1.00 2.94 O ATOM 2319 OD2 ASP A1198 16.303 -4.555 -7.018 1.00 2.28 O ATOM 0 H ASP A1198 13.694 -7.794 -9.325 1.00 1.12 H new ATOM 0 HA ASP A1198 15.485 -8.415 -7.204 1.00 1.23 H new ATOM 0 HB2 ASP A1198 15.837 -6.760 -9.050 1.00 1.45 H new ATOM 0 HB3 ASP A1198 14.571 -5.753 -8.376 1.00 1.45 H new ATOM 2324 N VAL A1199 12.805 -6.672 -6.310 1.00 1.11 N ATOM 2325 CA VAL A1199 11.902 -6.401 -5.174 1.00 1.12 C ATOM 2326 C VAL A1199 11.255 -7.662 -4.596 1.00 0.98 C ATOM 2327 O VAL A1199 10.925 -7.683 -3.412 1.00 0.90 O ATOM 2328 CB VAL A1199 10.816 -5.360 -5.495 1.00 1.21 C ATOM 2329 CG1 VAL A1199 11.444 -4.007 -5.801 1.00 2.97 C ATOM 2330 CG2 VAL A1199 9.888 -5.736 -6.641 1.00 1.91 C ATOM 0 H VAL A1199 12.484 -6.278 -7.194 1.00 1.11 H new ATOM 0 HA VAL A1199 12.558 -5.981 -4.412 1.00 1.12 H new ATOM 0 HB VAL A1199 10.202 -5.317 -4.595 1.00 1.21 H new ATOM 0 HG11 VAL A1199 10.660 -3.284 -6.026 1.00 2.97 H new ATOM 0 HG12 VAL A1199 12.014 -3.667 -4.937 1.00 2.97 H new ATOM 0 HG13 VAL A1199 12.108 -4.100 -6.660 1.00 2.97 H new ATOM 0 HG21 VAL A1199 9.157 -4.942 -6.793 1.00 1.91 H new ATOM 0 HG22 VAL A1199 10.471 -5.871 -7.552 1.00 1.91 H new ATOM 0 HG23 VAL A1199 9.370 -6.665 -6.400 1.00 1.91 H new ATOM 2340 N ASN A1200 11.100 -8.730 -5.382 1.00 1.01 N ATOM 2341 CA ASN A1200 10.562 -9.998 -4.893 1.00 0.96 C ATOM 2342 C ASN A1200 11.561 -10.709 -3.949 1.00 0.93 C ATOM 2343 O ASN A1200 11.159 -11.155 -2.874 1.00 0.91 O ATOM 2344 CB ASN A1200 10.107 -10.823 -6.115 1.00 0.99 C ATOM 2345 CG ASN A1200 9.409 -12.140 -5.813 1.00 1.05 C ATOM 2346 OD1 ASN A1200 9.609 -12.787 -4.799 1.00 2.03 O ATOM 2347 ND2 ASN A1200 8.566 -12.602 -6.702 1.00 1.89 N ATOM 0 H ASN A1200 11.344 -8.739 -6.372 1.00 1.01 H new ATOM 0 HA ASN A1200 9.686 -9.844 -4.263 1.00 0.96 H new ATOM 0 HB2 ASN A1200 9.434 -10.208 -6.713 1.00 0.99 H new ATOM 0 HB3 ASN A1200 10.981 -11.032 -6.732 1.00 0.99 H new ATOM 0 HD21 ASN A1200 8.089 -13.489 -6.540 1.00 1.89 H new ATOM 0 HD22 ASN A1200 8.386 -12.075 -7.556 1.00 1.89 H new ATOM 2354 N ASP A1201 12.861 -10.714 -4.274 1.00 1.01 N ATOM 2355 CA ASP A1201 13.925 -11.247 -3.397 1.00 1.07 C ATOM 2356 C ASP A1201 14.043 -10.453 -2.081 1.00 1.04 C ATOM 2357 O ASP A1201 14.189 -11.041 -1.007 1.00 1.07 O ATOM 2358 CB ASP A1201 15.269 -11.234 -4.149 1.00 1.26 C ATOM 2359 CG ASP A1201 16.407 -11.846 -3.321 1.00 1.45 C ATOM 2360 OD1 ASP A1201 16.331 -13.042 -2.960 1.00 2.24 O ATOM 2361 OD2 ASP A1201 17.415 -11.156 -3.037 1.00 2.08 O ATOM 0 H ASP A1201 13.212 -10.347 -5.159 1.00 1.01 H new ATOM 0 HA ASP A1201 13.659 -12.271 -3.133 1.00 1.07 H new ATOM 0 HB2 ASP A1201 15.165 -11.786 -5.083 1.00 1.26 H new ATOM 0 HB3 ASP A1201 15.526 -10.208 -4.412 1.00 1.26 H new ATOM 2366 N PHE A1202 13.915 -9.126 -2.172 1.00 1.04 N ATOM 2367 CA PHE A1202 13.862 -8.172 -1.055 1.00 1.00 C ATOM 2368 C PHE A1202 12.651 -8.407 -0.131 1.00 0.90 C ATOM 2369 O PHE A1202 12.800 -8.450 1.091 1.00 0.92 O ATOM 2370 CB PHE A1202 13.878 -6.767 -1.683 1.00 1.02 C ATOM 2371 CG PHE A1202 13.276 -5.640 -0.869 1.00 0.90 C ATOM 2372 CD1 PHE A1202 14.016 -5.058 0.174 1.00 1.67 C ATOM 2373 CD2 PHE A1202 11.989 -5.151 -1.176 1.00 1.80 C ATOM 2374 CE1 PHE A1202 13.474 -3.989 0.906 1.00 1.58 C ATOM 2375 CE2 PHE A1202 11.441 -4.094 -0.426 1.00 2.06 C ATOM 2376 CZ PHE A1202 12.185 -3.510 0.614 1.00 1.25 C ATOM 0 H PHE A1202 13.841 -8.660 -3.077 1.00 1.04 H new ATOM 0 HA PHE A1202 14.720 -8.301 -0.395 1.00 1.00 H new ATOM 0 HB2 PHE A1202 14.913 -6.508 -1.906 1.00 1.02 H new ATOM 0 HB3 PHE A1202 13.350 -6.816 -2.635 1.00 1.02 H new ATOM 0 HD1 PHE A1202 15.001 -5.432 0.413 1.00 1.67 H new ATOM 0 HD2 PHE A1202 11.424 -5.588 -1.986 1.00 1.80 H new ATOM 0 HE1 PHE A1202 14.050 -3.533 1.697 1.00 1.58 H new ATOM 0 HE2 PHE A1202 10.449 -3.731 -0.649 1.00 2.06 H new ATOM 0 HZ PHE A1202 11.767 -2.695 1.187 1.00 1.25 H new ATOM 2386 N MET A1203 11.462 -8.647 -0.695 1.00 0.83 N ATOM 2387 CA MET A1203 10.280 -9.038 0.084 1.00 0.79 C ATOM 2388 C MET A1203 10.464 -10.398 0.765 1.00 0.86 C ATOM 2389 O MET A1203 10.174 -10.533 1.953 1.00 0.87 O ATOM 2390 CB MET A1203 9.038 -9.107 -0.810 1.00 0.78 C ATOM 2391 CG MET A1203 8.408 -7.743 -1.082 1.00 1.02 C ATOM 2392 SD MET A1203 6.695 -7.861 -1.671 1.00 1.12 S ATOM 2393 CE MET A1203 6.942 -8.561 -3.322 1.00 2.20 C ATOM 0 H MET A1203 11.292 -8.576 -1.698 1.00 0.83 H new ATOM 0 HA MET A1203 10.149 -8.275 0.851 1.00 0.79 H new ATOM 0 HB2 MET A1203 9.308 -9.569 -1.759 1.00 0.78 H new ATOM 0 HB3 MET A1203 8.297 -9.754 -0.340 1.00 0.78 H new ATOM 0 HG2 MET A1203 8.433 -7.148 -0.169 1.00 1.02 H new ATOM 0 HG3 MET A1203 9.006 -7.213 -1.824 1.00 1.02 H new ATOM 0 HE1 MET A1203 5.976 -8.692 -3.810 1.00 2.20 H new ATOM 0 HE2 MET A1203 7.559 -7.886 -3.915 1.00 2.20 H new ATOM 0 HE3 MET A1203 7.439 -9.527 -3.237 1.00 2.20 H new ATOM 2403 N THR A1204 10.974 -11.391 0.028 1.00 0.94 N ATOM 2404 CA THR A1204 11.238 -12.737 0.550 1.00 1.04 C ATOM 2405 C THR A1204 12.205 -12.692 1.731 1.00 1.08 C ATOM 2406 O THR A1204 11.949 -13.335 2.746 1.00 1.15 O ATOM 2407 CB THR A1204 11.801 -13.643 -0.559 1.00 1.19 C ATOM 2408 OG1 THR A1204 10.824 -13.906 -1.544 1.00 1.41 O ATOM 2409 CG2 THR A1204 12.256 -14.993 -0.026 1.00 1.49 C ATOM 0 H THR A1204 11.217 -11.282 -0.957 1.00 0.94 H new ATOM 0 HA THR A1204 10.292 -13.150 0.900 1.00 1.04 H new ATOM 0 HB THR A1204 12.649 -13.101 -0.977 1.00 1.19 H new ATOM 0 HG1 THR A1204 10.736 -13.128 -2.133 1.00 1.41 H new ATOM 0 HG21 THR A1204 12.645 -15.596 -0.847 1.00 1.49 H new ATOM 0 HG22 THR A1204 13.038 -14.845 0.718 1.00 1.49 H new ATOM 0 HG23 THR A1204 11.411 -15.507 0.433 1.00 1.49 H new ATOM 2417 N GLU A1205 13.280 -11.907 1.630 1.00 1.10 N ATOM 2418 CA GLU A1205 14.297 -11.773 2.679 1.00 1.19 C ATOM 2419 C GLU A1205 13.718 -11.149 3.961 1.00 1.19 C ATOM 2420 O GLU A1205 13.981 -11.635 5.060 1.00 1.27 O ATOM 2421 CB GLU A1205 15.466 -10.950 2.117 1.00 1.29 C ATOM 2422 CG GLU A1205 16.678 -10.912 3.054 1.00 1.41 C ATOM 2423 CD GLU A1205 17.872 -10.232 2.376 1.00 2.19 C ATOM 2424 OE1 GLU A1205 18.344 -10.717 1.315 1.00 3.01 O ATOM 2425 OE2 GLU A1205 18.373 -9.209 2.898 1.00 3.07 O ATOM 0 H GLU A1205 13.473 -11.338 0.806 1.00 1.10 H new ATOM 0 HA GLU A1205 14.656 -12.761 2.967 1.00 1.19 H new ATOM 0 HB2 GLU A1205 15.769 -11.368 1.157 1.00 1.29 H new ATOM 0 HB3 GLU A1205 15.128 -9.931 1.928 1.00 1.29 H new ATOM 0 HG2 GLU A1205 16.420 -10.376 3.968 1.00 1.41 H new ATOM 0 HG3 GLU A1205 16.949 -11.927 3.345 1.00 1.41 H new ATOM 2432 N HIS A1206 12.862 -10.133 3.820 1.00 1.13 N ATOM 2433 CA HIS A1206 12.189 -9.491 4.957 1.00 1.15 C ATOM 2434 C HIS A1206 11.156 -10.425 5.620 1.00 1.12 C ATOM 2435 O HIS A1206 11.132 -10.548 6.846 1.00 1.25 O ATOM 2436 CB HIS A1206 11.554 -8.159 4.512 1.00 1.20 C ATOM 2437 CG HIS A1206 12.484 -6.962 4.544 1.00 1.75 C ATOM 2438 ND1 HIS A1206 13.307 -6.592 5.587 1.00 3.34 N ATOM 2439 CD2 HIS A1206 12.585 -5.973 3.599 1.00 1.90 C ATOM 2440 CE1 HIS A1206 13.884 -5.423 5.278 1.00 3.78 C ATOM 2441 NE2 HIS A1206 13.463 -4.986 4.079 1.00 2.96 N ATOM 0 H HIS A1206 12.615 -9.731 2.916 1.00 1.13 H new ATOM 0 HA HIS A1206 12.939 -9.276 5.718 1.00 1.15 H new ATOM 0 HB2 HIS A1206 11.173 -8.277 3.498 1.00 1.20 H new ATOM 0 HB3 HIS A1206 10.697 -7.951 5.152 1.00 1.20 H new ATOM 0 HD2 HIS A1206 12.076 -5.956 2.647 1.00 1.90 H new ATOM 0 HE1 HIS A1206 14.591 -4.903 5.907 1.00 3.78 H new ATOM 0 HE2 HIS A1206 13.726 -4.117 3.613 1.00 2.96 H new ATOM 2449 N GLU A1207 10.348 -11.144 4.836 1.00 1.03 N ATOM 2450 CA GLU A1207 9.406 -12.154 5.349 1.00 1.09 C ATOM 2451 C GLU A1207 10.141 -13.335 6.022 1.00 1.19 C ATOM 2452 O GLU A1207 9.741 -13.784 7.100 1.00 1.37 O ATOM 2453 CB GLU A1207 8.495 -12.618 4.196 1.00 1.05 C ATOM 2454 CG GLU A1207 7.369 -11.625 3.842 1.00 1.81 C ATOM 2455 CD GLU A1207 6.113 -11.730 4.729 1.00 2.86 C ATOM 2456 OE1 GLU A1207 6.043 -12.587 5.640 1.00 3.93 O ATOM 2457 OE2 GLU A1207 5.144 -10.952 4.519 1.00 3.84 O ATOM 0 H GLU A1207 10.326 -11.044 3.821 1.00 1.03 H new ATOM 0 HA GLU A1207 8.789 -11.706 6.128 1.00 1.09 H new ATOM 0 HB2 GLU A1207 9.107 -12.787 3.310 1.00 1.05 H new ATOM 0 HB3 GLU A1207 8.049 -13.576 4.463 1.00 1.05 H new ATOM 0 HG2 GLU A1207 7.763 -10.611 3.912 1.00 1.81 H new ATOM 0 HG3 GLU A1207 7.078 -11.783 2.804 1.00 1.81 H new ATOM 2464 N ARG A1208 11.279 -13.776 5.466 1.00 1.15 N ATOM 2465 CA ARG A1208 12.185 -14.798 6.038 1.00 1.31 C ATOM 2466 C ARG A1208 12.815 -14.348 7.365 1.00 1.46 C ATOM 2467 O ARG A1208 13.071 -15.173 8.246 1.00 1.75 O ATOM 2468 CB ARG A1208 13.248 -15.127 4.970 1.00 1.31 C ATOM 2469 CG ARG A1208 14.215 -16.269 5.312 1.00 1.91 C ATOM 2470 CD ARG A1208 15.223 -16.434 4.164 1.00 2.28 C ATOM 2471 NE ARG A1208 16.139 -17.571 4.373 1.00 3.24 N ATOM 2472 CZ ARG A1208 17.254 -17.812 3.706 1.00 4.17 C ATOM 2473 NH1 ARG A1208 17.672 -17.056 2.730 1.00 4.52 N ATOM 2474 NH2 ARG A1208 17.966 -18.848 4.028 1.00 5.19 N ATOM 0 H ARG A1208 11.612 -13.420 4.570 1.00 1.15 H new ATOM 0 HA ARG A1208 11.617 -15.694 6.288 1.00 1.31 H new ATOM 0 HB2 ARG A1208 12.736 -15.377 4.041 1.00 1.31 H new ATOM 0 HB3 ARG A1208 13.833 -14.227 4.779 1.00 1.31 H new ATOM 0 HG2 ARG A1208 14.738 -16.053 6.244 1.00 1.91 H new ATOM 0 HG3 ARG A1208 13.663 -17.196 5.464 1.00 1.91 H new ATOM 0 HD2 ARG A1208 14.682 -16.575 3.228 1.00 2.28 H new ATOM 0 HD3 ARG A1208 15.804 -15.518 4.061 1.00 2.28 H new ATOM 0 HE ARG A1208 15.887 -18.236 5.104 1.00 3.24 H new ATOM 0 HH11 ARG A1208 17.131 -16.237 2.452 1.00 4.52 H new ATOM 0 HH12 ARG A1208 18.540 -17.283 2.245 1.00 4.52 H new ATOM 0 HH21 ARG A1208 17.662 -19.460 4.785 1.00 5.19 H new ATOM 0 HH22 ARG A1208 18.830 -19.050 3.524 1.00 5.19 H new ATOM 2488 N LYS A1209 13.005 -13.035 7.548 1.00 1.36 N ATOM 2489 CA LYS A1209 13.460 -12.389 8.799 1.00 1.53 C ATOM 2490 C LYS A1209 12.308 -12.017 9.748 1.00 1.57 C ATOM 2491 O LYS A1209 12.495 -11.259 10.700 1.00 1.98 O ATOM 2492 CB LYS A1209 14.457 -11.246 8.492 1.00 1.78 C ATOM 2493 CG LYS A1209 15.920 -11.731 8.482 1.00 2.44 C ATOM 2494 CD LYS A1209 16.296 -12.588 7.264 1.00 2.16 C ATOM 2495 CE LYS A1209 17.565 -13.433 7.464 1.00 3.16 C ATOM 2496 NZ LYS A1209 18.749 -12.656 7.898 1.00 3.06 N ATOM 0 H LYS A1209 12.841 -12.360 6.801 1.00 1.36 H new ATOM 0 HA LYS A1209 14.018 -13.125 9.377 1.00 1.53 H new ATOM 0 HB2 LYS A1209 14.216 -10.807 7.524 1.00 1.78 H new ATOM 0 HB3 LYS A1209 14.343 -10.458 9.237 1.00 1.78 H new ATOM 0 HG2 LYS A1209 16.578 -10.863 8.517 1.00 2.44 H new ATOM 0 HG3 LYS A1209 16.105 -12.308 9.388 1.00 2.44 H new ATOM 0 HD2 LYS A1209 15.464 -13.251 7.028 1.00 2.16 H new ATOM 0 HD3 LYS A1209 16.438 -11.935 6.403 1.00 2.16 H new ATOM 0 HE2 LYS A1209 17.360 -14.206 8.205 1.00 3.16 H new ATOM 0 HE3 LYS A1209 17.801 -13.941 6.529 1.00 3.16 H new ATOM 0 HZ1 LYS A1209 19.562 -13.295 8.011 1.00 3.06 H new ATOM 0 HZ2 LYS A1209 18.972 -11.935 7.183 1.00 3.06 H new ATOM 0 HZ3 LYS A1209 18.546 -12.192 8.806 1.00 3.06 H new ATOM 2510 N GLY A1210 11.123 -12.595 9.537 1.00 1.58 N ATOM 2511 CA GLY A1210 9.967 -12.487 10.441 1.00 1.68 C ATOM 2512 C GLY A1210 9.241 -11.138 10.393 1.00 1.49 C ATOM 2513 O GLY A1210 8.435 -10.839 11.277 1.00 1.58 O ATOM 0 H GLY A1210 10.932 -13.166 8.714 1.00 1.58 H new ATOM 0 HA2 GLY A1210 9.256 -13.276 10.196 1.00 1.68 H new ATOM 0 HA3 GLY A1210 10.303 -12.667 11.462 1.00 1.68 H new ATOM 2517 N ARG A1211 9.546 -10.310 9.385 1.00 1.35 N ATOM 2518 CA ARG A1211 8.882 -9.034 9.073 1.00 1.21 C ATOM 2519 C ARG A1211 7.713 -9.289 8.110 1.00 1.12 C ATOM 2520 O ARG A1211 7.459 -10.435 7.737 1.00 1.56 O ATOM 2521 CB ARG A1211 9.919 -8.026 8.517 1.00 1.25 C ATOM 2522 CG ARG A1211 11.356 -8.070 9.094 1.00 2.09 C ATOM 2523 CD ARG A1211 11.563 -7.595 10.542 1.00 1.82 C ATOM 2524 NE ARG A1211 10.679 -8.258 11.519 1.00 2.49 N ATOM 2525 CZ ARG A1211 11.004 -8.811 12.672 1.00 3.63 C ATOM 2526 NH1 ARG A1211 12.182 -8.711 13.210 1.00 4.36 N ATOM 2527 NH2 ARG A1211 10.092 -9.475 13.311 1.00 4.86 N ATOM 0 H ARG A1211 10.300 -10.521 8.731 1.00 1.35 H new ATOM 0 HA ARG A1211 8.463 -8.588 9.975 1.00 1.21 H new ATOM 0 HB2 ARG A1211 9.987 -8.176 7.440 1.00 1.25 H new ATOM 0 HB3 ARG A1211 9.526 -7.021 8.674 1.00 1.25 H new ATOM 0 HG2 ARG A1211 11.713 -9.097 9.024 1.00 2.09 H new ATOM 0 HG3 ARG A1211 11.994 -7.466 8.449 1.00 2.09 H new ATOM 0 HD2 ARG A1211 12.600 -7.771 10.827 1.00 1.82 H new ATOM 0 HD3 ARG A1211 11.398 -6.519 10.588 1.00 1.82 H new ATOM 0 HE ARG A1211 9.690 -8.294 11.272 1.00 2.49 H new ATOM 0 HH11 ARG A1211 12.915 -8.182 12.738 1.00 4.36 H new ATOM 0 HH12 ARG A1211 12.374 -9.161 14.105 1.00 4.36 H new ATOM 0 HH21 ARG A1211 9.154 -9.558 12.920 1.00 4.86 H new ATOM 0 HH22 ARG A1211 10.313 -9.914 14.205 1.00 4.86 H new ATOM 2541 N THR A1212 6.983 -8.253 7.708 1.00 1.08 N ATOM 2542 CA THR A1212 5.812 -8.363 6.820 1.00 1.00 C ATOM 2543 C THR A1212 5.991 -7.513 5.555 1.00 0.82 C ATOM 2544 O THR A1212 6.483 -6.386 5.618 1.00 0.87 O ATOM 2545 CB THR A1212 4.540 -8.014 7.618 1.00 1.12 C ATOM 2546 OG1 THR A1212 4.285 -9.050 8.543 1.00 1.39 O ATOM 2547 CG2 THR A1212 3.259 -7.885 6.802 1.00 1.06 C ATOM 0 H THR A1212 7.185 -7.294 7.990 1.00 1.08 H new ATOM 0 HA THR A1212 5.709 -9.388 6.465 1.00 1.00 H new ATOM 0 HB THR A1212 4.758 -7.042 8.060 1.00 1.12 H new ATOM 0 HG1 THR A1212 3.479 -8.838 9.058 1.00 1.39 H new ATOM 0 HG21 THR A1212 2.429 -7.638 7.464 1.00 1.06 H new ATOM 0 HG22 THR A1212 3.378 -7.096 6.060 1.00 1.06 H new ATOM 0 HG23 THR A1212 3.052 -8.829 6.298 1.00 1.06 H new ATOM 2555 N ALA A1213 5.589 -8.056 4.402 1.00 0.68 N ATOM 2556 CA ALA A1213 5.707 -7.427 3.082 1.00 0.56 C ATOM 2557 C ALA A1213 4.337 -7.271 2.387 1.00 0.46 C ATOM 2558 O ALA A1213 3.588 -8.247 2.271 1.00 0.58 O ATOM 2559 CB ALA A1213 6.671 -8.284 2.252 1.00 0.69 C ATOM 0 H ALA A1213 5.157 -8.979 4.360 1.00 0.68 H new ATOM 0 HA ALA A1213 6.095 -6.414 3.186 1.00 0.56 H new ATOM 0 HB1 ALA A1213 6.785 -7.847 1.260 1.00 0.69 H new ATOM 0 HB2 ALA A1213 7.642 -8.321 2.746 1.00 0.69 H new ATOM 0 HB3 ALA A1213 6.272 -9.294 2.160 1.00 0.69 H new ATOM 2565 N VAL A1214 3.998 -6.065 1.916 1.00 0.49 N ATOM 2566 CA VAL A1214 2.687 -5.719 1.318 1.00 0.70 C ATOM 2567 C VAL A1214 2.852 -4.773 0.116 1.00 0.66 C ATOM 2568 O VAL A1214 3.735 -3.916 0.120 1.00 0.56 O ATOM 2569 CB VAL A1214 1.739 -5.161 2.407 1.00 1.11 C ATOM 2570 CG1 VAL A1214 2.279 -3.974 3.207 1.00 2.99 C ATOM 2571 CG2 VAL A1214 0.386 -4.705 1.857 1.00 1.30 C ATOM 0 H VAL A1214 4.642 -5.274 1.937 1.00 0.49 H new ATOM 0 HA VAL A1214 2.225 -6.623 0.921 1.00 0.70 H new ATOM 0 HB VAL A1214 1.641 -6.027 3.062 1.00 1.11 H new ATOM 0 HG11 VAL A1214 1.536 -3.662 3.942 1.00 2.99 H new ATOM 0 HG12 VAL A1214 3.195 -4.267 3.719 1.00 2.99 H new ATOM 0 HG13 VAL A1214 2.490 -3.146 2.531 1.00 2.99 H new ATOM 0 HG21 VAL A1214 -0.229 -4.325 2.673 1.00 1.30 H new ATOM 0 HG22 VAL A1214 0.540 -3.916 1.121 1.00 1.30 H new ATOM 0 HG23 VAL A1214 -0.118 -5.548 1.385 1.00 1.30 H new ATOM 2581 N LEU A1215 2.032 -4.935 -0.930 1.00 0.76 N ATOM 2582 CA LEU A1215 2.189 -4.259 -2.229 1.00 0.65 C ATOM 2583 C LEU A1215 0.872 -3.689 -2.794 1.00 0.47 C ATOM 2584 O LEU A1215 -0.216 -4.140 -2.430 1.00 0.48 O ATOM 2585 CB LEU A1215 2.986 -5.146 -3.216 1.00 0.84 C ATOM 2586 CG LEU A1215 2.644 -6.634 -3.414 1.00 1.42 C ATOM 2587 CD1 LEU A1215 3.023 -7.520 -2.226 1.00 3.36 C ATOM 2588 CD2 LEU A1215 1.183 -6.853 -3.781 1.00 2.45 C ATOM 0 H LEU A1215 1.222 -5.553 -0.898 1.00 0.76 H new ATOM 0 HA LEU A1215 2.790 -3.365 -2.064 1.00 0.65 H new ATOM 0 HB2 LEU A1215 2.917 -4.672 -4.195 1.00 0.84 H new ATOM 0 HB3 LEU A1215 4.032 -5.099 -2.912 1.00 0.84 H new ATOM 0 HG LEU A1215 3.265 -6.942 -4.255 1.00 1.42 H new ATOM 0 HD11 LEU A1215 2.751 -8.553 -2.441 1.00 3.36 H new ATOM 0 HD12 LEU A1215 4.097 -7.456 -2.053 1.00 3.36 H new ATOM 0 HD13 LEU A1215 2.491 -7.183 -1.336 1.00 3.36 H new ATOM 0 HD21 LEU A1215 0.996 -7.919 -3.909 1.00 2.45 H new ATOM 0 HD22 LEU A1215 0.546 -6.466 -2.986 1.00 2.45 H new ATOM 0 HD23 LEU A1215 0.959 -6.331 -4.711 1.00 2.45 H new ATOM 2600 N VAL A1216 0.980 -2.664 -3.657 1.00 0.47 N ATOM 2601 CA VAL A1216 -0.154 -1.829 -4.109 1.00 0.53 C ATOM 2602 C VAL A1216 -0.175 -1.582 -5.626 1.00 0.40 C ATOM 2603 O VAL A1216 0.848 -1.256 -6.242 1.00 0.41 O ATOM 2604 CB VAL A1216 -0.164 -0.465 -3.374 1.00 0.77 C ATOM 2605 CG1 VAL A1216 -1.464 0.309 -3.645 1.00 0.90 C ATOM 2606 CG2 VAL A1216 -0.010 -0.607 -1.852 1.00 0.96 C ATOM 0 H VAL A1216 1.871 -2.385 -4.069 1.00 0.47 H new ATOM 0 HA VAL A1216 -1.049 -2.400 -3.861 1.00 0.53 H new ATOM 0 HB VAL A1216 0.694 0.080 -3.769 1.00 0.77 H new ATOM 0 HG11 VAL A1216 -1.438 1.261 -3.115 1.00 0.90 H new ATOM 0 HG12 VAL A1216 -1.562 0.492 -4.715 1.00 0.90 H new ATOM 0 HG13 VAL A1216 -2.315 -0.277 -3.298 1.00 0.90 H new ATOM 0 HG21 VAL A1216 -0.024 0.381 -1.391 1.00 0.96 H new ATOM 0 HG22 VAL A1216 -0.832 -1.203 -1.457 1.00 0.96 H new ATOM 0 HG23 VAL A1216 0.936 -1.099 -1.626 1.00 0.96 H new ATOM 2616 N ALA A1217 -1.379 -1.637 -6.200 1.00 0.39 N ATOM 2617 CA ALA A1217 -1.700 -1.271 -7.580 1.00 0.34 C ATOM 2618 C ALA A1217 -2.850 -0.241 -7.656 1.00 0.37 C ATOM 2619 O ALA A1217 -3.647 -0.108 -6.723 1.00 0.43 O ATOM 2620 CB ALA A1217 -2.020 -2.553 -8.359 1.00 0.41 C ATOM 0 H ALA A1217 -2.200 -1.956 -5.686 1.00 0.39 H new ATOM 0 HA ALA A1217 -0.839 -0.779 -8.033 1.00 0.34 H new ATOM 0 HB1 ALA A1217 -2.262 -2.301 -9.391 1.00 0.41 H new ATOM 0 HB2 ALA A1217 -1.155 -3.215 -8.341 1.00 0.41 H new ATOM 0 HB3 ALA A1217 -2.871 -3.055 -7.899 1.00 0.41 H new ATOM 2626 N VAL A1218 -2.936 0.486 -8.774 1.00 0.43 N ATOM 2627 CA VAL A1218 -3.906 1.577 -9.013 1.00 0.50 C ATOM 2628 C VAL A1218 -4.457 1.459 -10.430 1.00 0.64 C ATOM 2629 O VAL A1218 -3.677 1.483 -11.378 1.00 0.69 O ATOM 2630 CB VAL A1218 -3.255 2.967 -8.829 1.00 0.56 C ATOM 2631 CG1 VAL A1218 -4.238 4.113 -9.119 1.00 0.64 C ATOM 2632 CG2 VAL A1218 -2.744 3.177 -7.397 1.00 0.54 C ATOM 0 H VAL A1218 -2.315 0.332 -9.568 1.00 0.43 H new ATOM 0 HA VAL A1218 -4.711 1.482 -8.284 1.00 0.50 H new ATOM 0 HB VAL A1218 -2.428 2.986 -9.539 1.00 0.56 H new ATOM 0 HG11 VAL A1218 -3.734 5.069 -8.976 1.00 0.64 H new ATOM 0 HG12 VAL A1218 -4.590 4.039 -10.148 1.00 0.64 H new ATOM 0 HG13 VAL A1218 -5.087 4.045 -8.439 1.00 0.64 H new ATOM 0 HG21 VAL A1218 -2.294 4.166 -7.313 1.00 0.54 H new ATOM 0 HG22 VAL A1218 -3.576 3.096 -6.698 1.00 0.54 H new ATOM 0 HG23 VAL A1218 -1.998 2.418 -7.162 1.00 0.54 H new ATOM 2642 N ASP A1219 -5.778 1.333 -10.589 1.00 0.75 N ATOM 2643 CA ASP A1219 -6.466 1.173 -11.885 1.00 0.90 C ATOM 2644 C ASP A1219 -5.772 0.151 -12.828 1.00 0.82 C ATOM 2645 O ASP A1219 -5.652 0.352 -14.042 1.00 0.92 O ATOM 2646 CB ASP A1219 -6.740 2.557 -12.506 1.00 1.15 C ATOM 2647 CG ASP A1219 -8.016 3.212 -11.962 1.00 2.49 C ATOM 2648 OD1 ASP A1219 -9.114 2.920 -12.500 1.00 2.72 O ATOM 2649 OD2 ASP A1219 -7.930 4.089 -11.073 1.00 4.13 O ATOM 0 H ASP A1219 -6.423 1.339 -9.799 1.00 0.75 H new ATOM 0 HA ASP A1219 -7.438 0.712 -11.711 1.00 0.90 H new ATOM 0 HB2 ASP A1219 -5.890 3.212 -12.312 1.00 1.15 H new ATOM 0 HB3 ASP A1219 -6.823 2.454 -13.588 1.00 1.15 H new ATOM 2654 N ASP A1220 -5.336 -0.977 -12.254 1.00 0.75 N ATOM 2655 CA ASP A1220 -4.535 -2.049 -12.872 1.00 0.76 C ATOM 2656 C ASP A1220 -3.118 -1.670 -13.374 1.00 0.69 C ATOM 2657 O ASP A1220 -2.602 -2.263 -14.323 1.00 0.80 O ATOM 2658 CB ASP A1220 -5.357 -2.875 -13.872 1.00 0.96 C ATOM 2659 CG ASP A1220 -6.622 -3.474 -13.267 1.00 1.97 C ATOM 2660 OD1 ASP A1220 -6.552 -4.183 -12.234 1.00 3.01 O ATOM 2661 OD2 ASP A1220 -7.721 -3.246 -13.826 1.00 2.75 O ATOM 0 H ASP A1220 -5.547 -1.182 -11.277 1.00 0.75 H new ATOM 0 HA ASP A1220 -4.287 -2.702 -12.035 1.00 0.76 H new ATOM 0 HB2 ASP A1220 -5.631 -2.242 -14.716 1.00 0.96 H new ATOM 0 HB3 ASP A1220 -4.735 -3.679 -14.265 1.00 0.96 H new ATOM 2666 N GLU A1221 -2.453 -0.719 -12.714 1.00 0.63 N ATOM 2667 CA GLU A1221 -1.021 -0.419 -12.870 1.00 0.63 C ATOM 2668 C GLU A1221 -0.257 -0.576 -11.542 1.00 0.56 C ATOM 2669 O GLU A1221 -0.751 -0.183 -10.482 1.00 0.55 O ATOM 2670 CB GLU A1221 -0.783 1.003 -13.404 1.00 0.74 C ATOM 2671 CG GLU A1221 -0.938 1.157 -14.924 1.00 1.27 C ATOM 2672 CD GLU A1221 -2.388 1.287 -15.393 1.00 2.98 C ATOM 2673 OE1 GLU A1221 -3.020 2.346 -15.165 1.00 4.42 O ATOM 2674 OE2 GLU A1221 -2.905 0.382 -16.089 1.00 3.81 O ATOM 0 H GLU A1221 -2.909 -0.114 -12.032 1.00 0.63 H new ATOM 0 HA GLU A1221 -0.645 -1.141 -13.595 1.00 0.63 H new ATOM 0 HB2 GLU A1221 -1.480 1.682 -12.912 1.00 0.74 H new ATOM 0 HB3 GLU A1221 0.222 1.318 -13.122 1.00 0.74 H new ATOM 0 HG2 GLU A1221 -0.382 2.037 -15.248 1.00 1.27 H new ATOM 0 HG3 GLU A1221 -0.485 0.295 -15.414 1.00 1.27 H new ATOM 2681 N LEU A1222 0.980 -1.083 -11.589 1.00 0.61 N ATOM 2682 CA LEU A1222 1.899 -1.115 -10.440 1.00 0.63 C ATOM 2683 C LEU A1222 2.204 0.295 -9.914 1.00 0.67 C ATOM 2684 O LEU A1222 2.439 1.212 -10.709 1.00 0.92 O ATOM 2685 CB LEU A1222 3.219 -1.822 -10.833 1.00 0.72 C ATOM 2686 CG LEU A1222 3.450 -3.202 -10.184 1.00 0.87 C ATOM 2687 CD1 LEU A1222 3.571 -3.135 -8.659 1.00 1.08 C ATOM 2688 CD2 LEU A1222 2.335 -4.190 -10.529 1.00 1.03 C ATOM 0 H LEU A1222 1.378 -1.488 -12.436 1.00 0.61 H new ATOM 0 HA LEU A1222 1.407 -1.672 -9.643 1.00 0.63 H new ATOM 0 HB2 LEU A1222 3.239 -1.941 -11.916 1.00 0.72 H new ATOM 0 HB3 LEU A1222 4.052 -1.171 -10.569 1.00 0.72 H new ATOM 0 HG LEU A1222 4.397 -3.548 -10.598 1.00 0.87 H new ATOM 0 HD11 LEU A1222 3.732 -4.137 -8.262 1.00 1.08 H new ATOM 0 HD12 LEU A1222 4.413 -2.498 -8.388 1.00 1.08 H new ATOM 0 HD13 LEU A1222 2.654 -2.722 -8.239 1.00 1.08 H new ATOM 0 HD21 LEU A1222 2.538 -5.149 -10.051 1.00 1.03 H new ATOM 0 HD22 LEU A1222 1.381 -3.801 -10.172 1.00 1.03 H new ATOM 0 HD23 LEU A1222 2.290 -4.325 -11.610 1.00 1.03 H new ATOM 2700 N CYS A1223 2.269 0.453 -8.586 1.00 0.50 N ATOM 2701 CA CYS A1223 2.566 1.754 -7.978 1.00 0.56 C ATOM 2702 C CYS A1223 3.582 1.731 -6.813 1.00 0.48 C ATOM 2703 O CYS A1223 4.416 2.635 -6.747 1.00 0.49 O ATOM 2704 CB CYS A1223 1.230 2.449 -7.663 1.00 0.65 C ATOM 2705 SG CYS A1223 0.601 1.991 -6.028 1.00 0.63 S ATOM 0 H CYS A1223 2.120 -0.301 -7.915 1.00 0.50 H new ATOM 0 HA CYS A1223 3.117 2.354 -8.702 1.00 0.56 H new ATOM 0 HB2 CYS A1223 1.363 3.530 -7.711 1.00 0.65 H new ATOM 0 HB3 CYS A1223 0.495 2.184 -8.423 1.00 0.65 H new ATOM 0 HG CYS A1223 0.809 0.724 -5.822 1.00 0.63 H new ATOM 2711 N GLY A1224 3.619 0.706 -5.947 1.00 0.45 N ATOM 2712 CA GLY A1224 4.600 0.656 -4.848 1.00 0.43 C ATOM 2713 C GLY A1224 4.522 -0.576 -3.929 1.00 0.42 C ATOM 2714 O GLY A1224 3.602 -1.388 -4.046 1.00 0.57 O ATOM 0 H GLY A1224 2.987 -0.094 -5.984 1.00 0.45 H new ATOM 0 HA2 GLY A1224 5.600 0.701 -5.278 1.00 0.43 H new ATOM 0 HA3 GLY A1224 4.476 1.549 -4.236 1.00 0.43 H new ATOM 2718 N LEU A1225 5.490 -0.705 -3.009 1.00 0.40 N ATOM 2719 CA LEU A1225 5.501 -1.721 -1.942 1.00 0.39 C ATOM 2720 C LEU A1225 6.047 -1.216 -0.589 1.00 0.54 C ATOM 2721 O LEU A1225 6.760 -0.211 -0.520 1.00 0.68 O ATOM 2722 CB LEU A1225 6.190 -3.017 -2.426 1.00 0.53 C ATOM 2723 CG LEU A1225 7.690 -3.191 -2.134 1.00 0.91 C ATOM 2724 CD1 LEU A1225 8.176 -4.495 -2.754 1.00 1.89 C ATOM 2725 CD2 LEU A1225 8.556 -2.090 -2.715 1.00 1.20 C ATOM 0 H LEU A1225 6.306 -0.093 -2.984 1.00 0.40 H new ATOM 0 HA LEU A1225 4.458 -1.956 -1.730 1.00 0.39 H new ATOM 0 HB2 LEU A1225 5.663 -3.861 -1.981 1.00 0.53 H new ATOM 0 HB3 LEU A1225 6.050 -3.087 -3.505 1.00 0.53 H new ATOM 0 HG LEU A1225 7.784 -3.172 -1.048 1.00 0.91 H new ATOM 0 HD11 LEU A1225 9.239 -4.621 -2.549 1.00 1.89 H new ATOM 0 HD12 LEU A1225 7.622 -5.330 -2.326 1.00 1.89 H new ATOM 0 HD13 LEU A1225 8.015 -4.468 -3.832 1.00 1.89 H new ATOM 0 HD21 LEU A1225 9.601 -2.280 -2.468 1.00 1.20 H new ATOM 0 HD22 LEU A1225 8.437 -2.067 -3.798 1.00 1.20 H new ATOM 0 HD23 LEU A1225 8.254 -1.130 -2.296 1.00 1.20 H new ATOM 2737 N ILE A1226 5.713 -1.939 0.484 1.00 0.59 N ATOM 2738 CA ILE A1226 5.961 -1.573 1.885 1.00 0.78 C ATOM 2739 C ILE A1226 6.507 -2.779 2.673 1.00 0.78 C ATOM 2740 O ILE A1226 5.923 -3.864 2.641 1.00 0.68 O ATOM 2741 CB ILE A1226 4.648 -1.050 2.532 1.00 0.89 C ATOM 2742 CG1 ILE A1226 3.969 0.072 1.702 1.00 0.93 C ATOM 2743 CG2 ILE A1226 4.902 -0.575 3.978 1.00 1.11 C ATOM 2744 CD1 ILE A1226 2.658 0.610 2.293 1.00 1.16 C ATOM 0 H ILE A1226 5.240 -2.838 0.397 1.00 0.59 H new ATOM 0 HA ILE A1226 6.711 -0.782 1.914 1.00 0.78 H new ATOM 0 HB ILE A1226 3.955 -1.891 2.549 1.00 0.89 H new ATOM 0 HG12 ILE A1226 4.670 0.900 1.596 1.00 0.93 H new ATOM 0 HG13 ILE A1226 3.770 -0.307 0.700 1.00 0.93 H new ATOM 0 HG21 ILE A1226 3.970 -0.213 4.411 1.00 1.11 H new ATOM 0 HG22 ILE A1226 5.280 -1.406 4.573 1.00 1.11 H new ATOM 0 HG23 ILE A1226 5.636 0.231 3.973 1.00 1.11 H new ATOM 0 HD11 ILE A1226 2.259 1.389 1.644 1.00 1.16 H new ATOM 0 HD12 ILE A1226 1.935 -0.202 2.373 1.00 1.16 H new ATOM 0 HD13 ILE A1226 2.848 1.025 3.283 1.00 1.16 H new ATOM 2756 N ALA A1227 7.588 -2.567 3.430 1.00 0.93 N ATOM 2757 CA ALA A1227 8.136 -3.506 4.411 1.00 0.92 C ATOM 2758 C ALA A1227 7.943 -2.972 5.848 1.00 0.99 C ATOM 2759 O ALA A1227 8.389 -1.868 6.186 1.00 1.15 O ATOM 2760 CB ALA A1227 9.610 -3.776 4.078 1.00 0.99 C ATOM 0 H ALA A1227 8.126 -1.702 3.373 1.00 0.93 H new ATOM 0 HA ALA A1227 7.598 -4.453 4.361 1.00 0.92 H new ATOM 0 HB1 ALA A1227 10.025 -4.475 4.804 1.00 0.99 H new ATOM 0 HB2 ALA A1227 9.685 -4.205 3.079 1.00 0.99 H new ATOM 0 HB3 ALA A1227 10.168 -2.841 4.114 1.00 0.99 H new ATOM 2766 N ILE A1228 7.283 -3.770 6.690 1.00 0.93 N ATOM 2767 CA ILE A1228 6.794 -3.423 8.039 1.00 0.96 C ATOM 2768 C ILE A1228 7.293 -4.436 9.083 1.00 0.92 C ATOM 2769 O ILE A1228 7.337 -5.636 8.816 1.00 0.96 O ATOM 2770 CB ILE A1228 5.246 -3.276 8.053 1.00 1.02 C ATOM 2771 CG1 ILE A1228 4.524 -4.231 7.072 1.00 1.88 C ATOM 2772 CG2 ILE A1228 4.892 -1.818 7.733 1.00 2.49 C ATOM 2773 CD1 ILE A1228 3.003 -4.321 7.242 1.00 1.90 C ATOM 0 H ILE A1228 7.059 -4.733 6.440 1.00 0.93 H new ATOM 0 HA ILE A1228 7.207 -2.452 8.313 1.00 0.96 H new ATOM 0 HB ILE A1228 4.898 -3.555 9.047 1.00 1.02 H new ATOM 0 HG12 ILE A1228 4.740 -3.910 6.053 1.00 1.88 H new ATOM 0 HG13 ILE A1228 4.945 -5.230 7.187 1.00 1.88 H new ATOM 0 HG21 ILE A1228 3.809 -1.697 7.739 1.00 2.49 H new ATOM 0 HG22 ILE A1228 5.334 -1.163 8.484 1.00 2.49 H new ATOM 0 HG23 ILE A1228 5.281 -1.557 6.749 1.00 2.49 H new ATOM 0 HD11 ILE A1228 2.595 -5.015 6.507 1.00 1.90 H new ATOM 0 HD12 ILE A1228 2.769 -4.676 8.246 1.00 1.90 H new ATOM 0 HD13 ILE A1228 2.561 -3.336 7.094 1.00 1.90 H new ATOM 2785 N ALA A1229 7.689 -3.950 10.263 1.00 0.97 N ATOM 2786 CA ALA A1229 8.407 -4.720 11.286 1.00 1.09 C ATOM 2787 C ALA A1229 7.929 -4.434 12.721 1.00 1.35 C ATOM 2788 O ALA A1229 7.494 -3.321 13.019 1.00 1.59 O ATOM 2789 CB ALA A1229 9.896 -4.377 11.152 1.00 1.33 C ATOM 0 H ALA A1229 7.515 -2.984 10.542 1.00 0.97 H new ATOM 0 HA ALA A1229 8.213 -5.779 11.118 1.00 1.09 H new ATOM 0 HB1 ALA A1229 10.466 -4.931 11.898 1.00 1.33 H new ATOM 0 HB2 ALA A1229 10.243 -4.648 10.155 1.00 1.33 H new ATOM 0 HB3 ALA A1229 10.038 -3.308 11.308 1.00 1.33 H new