USER MOD reduce.3.24.130724 H: found=0, std=0, add=731, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 732 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: A1218 GLN :FLIP amide:sc= 0.398 F(o=-0.22,f=0.75) USER MOD Set 1.2: A1226 ASN :FLIP amide:sc= 0.35 F(o=-0.58,f=0.75) USER MOD Set 2.1: A1194 CYS SG : rot 86:sc= 0.335 USER MOD Set 2.2: A1213 MET CE :methyl -172:sc= -0.57 (180deg=-0.743) USER MOD Set 3.1: A1193 TYR OH : rot -23:sc= -0.799! USER MOD Set 3.2: A1205 LYS NZ :NH3+ 139:sc= 0.181 (180deg=-1.77!) USER MOD Set 4.1: A1166 ASN : amide:sc= 0.589 K(o=1.3,f=-3.2) USER MOD Set 4.2: A1169 LYS NZ :NH3+ 168:sc= 0.661 (180deg=0) USER MOD Single : A1170 THR OG1 : rot 74:sc= 0.639 USER MOD Single : A1177 THR OG1 : rot -79:sc= 1.1 USER MOD Single : A1178 THR OG1 : rot -98:sc= 1.15 USER MOD Single : A1180 SER OG : rot 86:sc= 0.407 USER MOD Single : A1183 MET CE :methyl 154:sc= -0.316 (180deg=-1.1) USER MOD Single : A1189 GLN : amide:sc= -0.462 X(o=-0.46,f=0) USER MOD Single : A1192 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1195 THR OG1 : rot 81:sc= 0.792 USER MOD Single : A1201 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1211 LYS NZ :NH3+ -122:sc= 0.636 (180deg=-0.00663) USER MOD Single : A1212 TYR OH : rot 156:sc= -0.108 USER MOD Single : A1214 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1217 MET CE :methyl -175:sc= 0 (180deg=-0.0313) USER MOD Single : A1219 GLN : amide:sc= -0.0282 X(o=-0.028,f=-0.028) USER MOD Single : A1220 SER OG : rot 76:sc= 0.214 USER MOD Single : A1223 SER OG : rot 180:sc= 0 USER MOD Single : A1227 MET CE :methyl -174:sc= -0.44 (180deg=-0.547) USER MOD Single : A1235 ASN : amide:sc= 0.821 K(o=0.82,f=0) USER MOD Single : A1237 GLN :FLIP amide:sc= -0.743 F(o=-1.6!,f=-0.74) USER MOD Single : A1241 GLN : amide:sc= -0.333 X(o=-0.33,f=0) USER MOD Single : A1242 GLN : amide:sc= -0.0544 X(o=-0.054,f=-0.054) USER MOD Single : A1243 THR OG1 : rot 77:sc= 0.773 USER MOD Single : A1244 TYR OH : rot -2:sc= -1.24 USER MOD Single : A1246 SER OG : rot 180:sc= 0.0369 USER MOD Single : A1247 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 24 N LEU A1159 -1.458 4.264 -4.208 1.00 0.00 N ATOM 25 CA LEU A1159 -2.113 5.552 -4.525 1.00 0.00 C ATOM 26 C LEU A1159 -3.128 5.324 -5.651 1.00 0.00 C ATOM 27 O LEU A1159 -2.756 4.831 -6.715 1.00 0.00 O ATOM 28 CB LEU A1159 -1.057 6.643 -4.928 1.00 0.00 C ATOM 29 CG LEU A1159 -1.297 8.059 -4.315 1.00 0.00 C ATOM 30 CD1 LEU A1159 -2.701 8.624 -4.650 1.00 0.00 C ATOM 31 CD2 LEU A1159 -1.083 8.012 -2.804 1.00 0.00 C ATOM 0 HA LEU A1159 -2.629 5.922 -3.639 1.00 0.00 H new ATOM 0 HB2 LEU A1159 -0.068 6.297 -4.627 1.00 0.00 H new ATOM 0 HB3 LEU A1159 -1.047 6.732 -6.014 1.00 0.00 H new ATOM 0 HG LEU A1159 -0.573 8.737 -4.766 1.00 0.00 H new ATOM 0 HD11 LEU A1159 -2.814 9.610 -4.199 1.00 0.00 H new ATOM 0 HD12 LEU A1159 -2.812 8.705 -5.731 1.00 0.00 H new ATOM 0 HD13 LEU A1159 -3.466 7.955 -4.256 1.00 0.00 H new ATOM 0 HD21 LEU A1159 -1.252 9.003 -2.382 1.00 0.00 H new ATOM 0 HD22 LEU A1159 -1.782 7.304 -2.359 1.00 0.00 H new ATOM 0 HD23 LEU A1159 -0.062 7.696 -2.591 1.00 0.00 H new ATOM 43 N ALA A1160 -4.403 5.689 -5.385 1.00 0.00 N ATOM 44 CA ALA A1160 -5.543 5.479 -6.301 1.00 0.00 C ATOM 45 C ALA A1160 -5.707 3.971 -6.632 1.00 0.00 C ATOM 46 O ALA A1160 -6.175 3.596 -7.716 1.00 0.00 O ATOM 47 CB ALA A1160 -5.393 6.366 -7.562 1.00 0.00 C ATOM 0 H ALA A1160 -4.671 6.145 -4.513 1.00 0.00 H new ATOM 0 HA ALA A1160 -6.465 5.789 -5.809 1.00 0.00 H new ATOM 0 HB1 ALA A1160 -6.241 6.200 -8.227 1.00 0.00 H new ATOM 0 HB2 ALA A1160 -5.363 7.415 -7.267 1.00 0.00 H new ATOM 0 HB3 ALA A1160 -4.469 6.108 -8.080 1.00 0.00 H new ATOM 53 N GLY A1161 -5.319 3.119 -5.652 1.00 0.00 N ATOM 54 CA GLY A1161 -5.330 1.658 -5.814 1.00 0.00 C ATOM 55 C GLY A1161 -4.269 1.146 -6.793 1.00 0.00 C ATOM 56 O GLY A1161 -4.410 0.054 -7.354 1.00 0.00 O ATOM 0 H GLY A1161 -4.993 3.429 -4.737 1.00 0.00 H new ATOM 0 HA2 GLY A1161 -5.172 1.191 -4.842 1.00 0.00 H new ATOM 0 HA3 GLY A1161 -6.315 1.346 -6.161 1.00 0.00 H new ATOM 60 N ALA A1162 -3.199 1.938 -6.981 1.00 0.00 N ATOM 61 CA ALA A1162 -2.119 1.645 -7.943 1.00 0.00 C ATOM 62 C ALA A1162 -0.752 1.640 -7.233 1.00 0.00 C ATOM 63 O ALA A1162 -0.434 2.578 -6.489 1.00 0.00 O ATOM 64 CB ALA A1162 -2.147 2.688 -9.075 1.00 0.00 C ATOM 0 H ALA A1162 -3.057 2.807 -6.466 1.00 0.00 H new ATOM 0 HA ALA A1162 -2.275 0.655 -8.371 1.00 0.00 H new ATOM 0 HB1 ALA A1162 -1.350 2.474 -9.787 1.00 0.00 H new ATOM 0 HB2 ALA A1162 -3.110 2.646 -9.585 1.00 0.00 H new ATOM 0 HB3 ALA A1162 -2.001 3.684 -8.656 1.00 0.00 H new ATOM 70 N VAL A1163 0.053 0.582 -7.464 1.00 0.00 N ATOM 71 CA VAL A1163 1.410 0.440 -6.877 1.00 0.00 C ATOM 72 C VAL A1163 2.503 0.484 -7.967 1.00 0.00 C ATOM 73 O VAL A1163 3.524 1.172 -7.806 1.00 0.00 O ATOM 74 CB VAL A1163 1.547 -0.879 -6.013 1.00 0.00 C ATOM 75 CG1 VAL A1163 0.698 -0.791 -4.720 1.00 0.00 C ATOM 76 CG2 VAL A1163 1.176 -2.147 -6.826 1.00 0.00 C ATOM 0 H VAL A1163 -0.215 -0.200 -8.062 1.00 0.00 H new ATOM 0 HA VAL A1163 1.553 1.291 -6.211 1.00 0.00 H new ATOM 0 HB VAL A1163 2.596 -0.966 -5.730 1.00 0.00 H new ATOM 0 HG11 VAL A1163 0.812 -1.711 -4.147 1.00 0.00 H new ATOM 0 HG12 VAL A1163 1.035 0.054 -4.120 1.00 0.00 H new ATOM 0 HG13 VAL A1163 -0.351 -0.654 -4.982 1.00 0.00 H new ATOM 0 HG21 VAL A1163 1.284 -3.029 -6.194 1.00 0.00 H new ATOM 0 HG22 VAL A1163 0.144 -2.070 -7.169 1.00 0.00 H new ATOM 0 HG23 VAL A1163 1.839 -2.234 -7.687 1.00 0.00 H new ATOM 86 N GLU A1164 2.278 -0.251 -9.074 1.00 0.00 N ATOM 87 CA GLU A1164 3.224 -0.319 -10.200 1.00 0.00 C ATOM 88 C GLU A1164 3.279 1.022 -10.943 1.00 0.00 C ATOM 89 O GLU A1164 2.298 1.776 -10.962 1.00 0.00 O ATOM 90 CB GLU A1164 2.865 -1.474 -11.169 1.00 0.00 C ATOM 91 CG GLU A1164 2.895 -2.876 -10.530 1.00 0.00 C ATOM 92 CD GLU A1164 2.683 -4.009 -11.541 1.00 0.00 C ATOM 93 OE1 GLU A1164 3.629 -4.328 -12.287 1.00 0.00 O ATOM 94 OE2 GLU A1164 1.572 -4.575 -11.611 1.00 0.00 O ATOM 0 H GLU A1164 1.437 -0.812 -9.210 1.00 0.00 H new ATOM 0 HA GLU A1164 4.214 -0.526 -9.793 1.00 0.00 H new ATOM 0 HB2 GLU A1164 1.869 -1.295 -11.575 1.00 0.00 H new ATOM 0 HB3 GLU A1164 3.560 -1.456 -12.009 1.00 0.00 H new ATOM 0 HG2 GLU A1164 3.853 -3.019 -10.030 1.00 0.00 H new ATOM 0 HG3 GLU A1164 2.123 -2.934 -9.763 1.00 0.00 H new ATOM 101 N PHE A1165 4.425 1.255 -11.587 1.00 0.00 N ATOM 102 CA PHE A1165 4.870 2.574 -12.068 1.00 0.00 C ATOM 103 C PHE A1165 3.818 3.243 -12.986 1.00 0.00 C ATOM 104 O PHE A1165 3.331 4.345 -12.698 1.00 0.00 O ATOM 105 CB PHE A1165 6.225 2.407 -12.820 1.00 0.00 C ATOM 106 CG PHE A1165 7.244 1.512 -12.095 1.00 0.00 C ATOM 107 CD1 PHE A1165 7.831 1.913 -10.900 1.00 0.00 C ATOM 108 CD2 PHE A1165 7.605 0.262 -12.602 1.00 0.00 C ATOM 109 CE1 PHE A1165 8.728 1.101 -10.230 1.00 0.00 C ATOM 110 CE2 PHE A1165 8.508 -0.551 -11.937 1.00 0.00 C ATOM 111 CZ PHE A1165 9.071 -0.128 -10.752 1.00 0.00 C ATOM 0 H PHE A1165 5.092 0.512 -11.797 1.00 0.00 H new ATOM 0 HA PHE A1165 4.999 3.230 -11.207 1.00 0.00 H new ATOM 0 HB2 PHE A1165 6.030 1.989 -13.808 1.00 0.00 H new ATOM 0 HB3 PHE A1165 6.667 3.392 -12.972 1.00 0.00 H new ATOM 0 HD1 PHE A1165 7.581 2.879 -10.486 1.00 0.00 H new ATOM 0 HD2 PHE A1165 7.172 -0.078 -13.531 1.00 0.00 H new ATOM 0 HE1 PHE A1165 9.160 1.430 -9.297 1.00 0.00 H new ATOM 0 HE2 PHE A1165 8.771 -1.515 -12.346 1.00 0.00 H new ATOM 0 HZ PHE A1165 9.779 -0.758 -10.234 1.00 0.00 H new ATOM 121 N ASN A1166 3.427 2.507 -14.041 1.00 0.00 N ATOM 122 CA ASN A1166 2.578 3.025 -15.138 1.00 0.00 C ATOM 123 C ASN A1166 1.100 3.132 -14.735 1.00 0.00 C ATOM 124 O ASN A1166 0.364 3.964 -15.298 1.00 0.00 O ATOM 125 CB ASN A1166 2.747 2.142 -16.398 1.00 0.00 C ATOM 126 CG ASN A1166 4.197 2.095 -16.880 1.00 0.00 C ATOM 127 OD1 ASN A1166 4.944 3.059 -16.734 1.00 0.00 O ATOM 128 ND2 ASN A1166 4.621 0.973 -17.421 1.00 0.00 N ATOM 0 H ASN A1166 3.691 1.529 -14.161 1.00 0.00 H new ATOM 0 HA ASN A1166 2.911 4.038 -15.363 1.00 0.00 H new ATOM 0 HB2 ASN A1166 2.406 1.130 -16.179 1.00 0.00 H new ATOM 0 HB3 ASN A1166 2.113 2.526 -17.197 1.00 0.00 H new ATOM 0 HD21 ASN A1166 5.590 0.890 -17.730 1.00 0.00 H new ATOM 0 HD22 ASN A1166 3.981 0.186 -17.531 1.00 0.00 H new ATOM 135 N ASP A1167 0.675 2.289 -13.772 1.00 0.00 N ATOM 136 CA ASP A1167 -0.678 2.375 -13.181 1.00 0.00 C ATOM 137 C ASP A1167 -0.817 3.707 -12.440 1.00 0.00 C ATOM 138 O ASP A1167 -1.748 4.462 -12.690 1.00 0.00 O ATOM 139 CB ASP A1167 -0.971 1.191 -12.218 1.00 0.00 C ATOM 140 CG ASP A1167 -0.956 -0.165 -12.930 1.00 0.00 C ATOM 141 OD1 ASP A1167 -1.831 -0.406 -13.784 1.00 0.00 O ATOM 142 OD2 ASP A1167 -0.077 -0.994 -12.651 1.00 0.00 O ATOM 0 H ASP A1167 1.249 1.540 -13.386 1.00 0.00 H new ATOM 0 HA ASP A1167 -1.407 2.317 -13.989 1.00 0.00 H new ATOM 0 HB2 ASP A1167 -0.230 1.186 -11.419 1.00 0.00 H new ATOM 0 HB3 ASP A1167 -1.944 1.341 -11.750 1.00 0.00 H new ATOM 147 N VAL A1168 0.170 4.001 -11.568 1.00 0.00 N ATOM 148 CA VAL A1168 0.223 5.266 -10.794 1.00 0.00 C ATOM 149 C VAL A1168 0.209 6.484 -11.732 1.00 0.00 C ATOM 150 O VAL A1168 -0.467 7.477 -11.455 1.00 0.00 O ATOM 151 CB VAL A1168 1.495 5.319 -9.867 1.00 0.00 C ATOM 152 CG1 VAL A1168 1.568 6.635 -9.041 1.00 0.00 C ATOM 153 CG2 VAL A1168 1.528 4.086 -8.950 1.00 0.00 C ATOM 0 H VAL A1168 0.951 3.373 -11.379 1.00 0.00 H new ATOM 0 HA VAL A1168 -0.665 5.297 -10.162 1.00 0.00 H new ATOM 0 HB VAL A1168 2.376 5.307 -10.509 1.00 0.00 H new ATOM 0 HG11 VAL A1168 2.462 6.624 -8.418 1.00 0.00 H new ATOM 0 HG12 VAL A1168 1.608 7.488 -9.718 1.00 0.00 H new ATOM 0 HG13 VAL A1168 0.685 6.716 -8.407 1.00 0.00 H new ATOM 0 HG21 VAL A1168 2.411 4.130 -8.312 1.00 0.00 H new ATOM 0 HG22 VAL A1168 0.632 4.070 -8.329 1.00 0.00 H new ATOM 0 HG23 VAL A1168 1.564 3.182 -9.557 1.00 0.00 H new ATOM 163 N LYS A1169 0.939 6.369 -12.859 1.00 0.00 N ATOM 164 CA LYS A1169 0.948 7.404 -13.909 1.00 0.00 C ATOM 165 C LYS A1169 -0.482 7.687 -14.421 1.00 0.00 C ATOM 166 O LYS A1169 -0.963 8.817 -14.340 1.00 0.00 O ATOM 167 CB LYS A1169 1.858 6.986 -15.093 1.00 0.00 C ATOM 168 CG LYS A1169 3.353 6.845 -14.743 1.00 0.00 C ATOM 169 CD LYS A1169 4.193 6.374 -15.955 1.00 0.00 C ATOM 170 CE LYS A1169 5.651 6.048 -15.589 1.00 0.00 C ATOM 171 NZ LYS A1169 6.410 5.571 -16.771 1.00 0.00 N ATOM 0 H LYS A1169 1.532 5.565 -13.065 1.00 0.00 H new ATOM 0 HA LYS A1169 1.347 8.316 -13.466 1.00 0.00 H new ATOM 0 HB2 LYS A1169 1.501 6.035 -15.489 1.00 0.00 H new ATOM 0 HB3 LYS A1169 1.754 7.722 -15.890 1.00 0.00 H new ATOM 0 HG2 LYS A1169 3.734 7.803 -14.389 1.00 0.00 H new ATOM 0 HG3 LYS A1169 3.468 6.134 -13.925 1.00 0.00 H new ATOM 0 HD2 LYS A1169 3.728 5.490 -16.390 1.00 0.00 H new ATOM 0 HD3 LYS A1169 4.182 7.150 -16.721 1.00 0.00 H new ATOM 0 HE2 LYS A1169 6.132 6.936 -15.179 1.00 0.00 H new ATOM 0 HE3 LYS A1169 5.671 5.286 -14.810 1.00 0.00 H new ATOM 0 HZ1 LYS A1169 7.426 5.553 -16.547 1.00 0.00 H new ATOM 0 HZ2 LYS A1169 6.094 4.613 -17.023 1.00 0.00 H new ATOM 0 HZ3 LYS A1169 6.243 6.212 -17.573 1.00 0.00 H new ATOM 185 N THR A1170 -1.161 6.633 -14.886 1.00 0.00 N ATOM 186 CA THR A1170 -2.478 6.755 -15.534 1.00 0.00 C ATOM 187 C THR A1170 -3.547 7.285 -14.544 1.00 0.00 C ATOM 188 O THR A1170 -4.183 8.316 -14.807 1.00 0.00 O ATOM 189 CB THR A1170 -2.911 5.383 -16.145 1.00 0.00 C ATOM 190 OG1 THR A1170 -1.857 4.881 -16.990 1.00 0.00 O ATOM 191 CG2 THR A1170 -4.212 5.487 -16.968 1.00 0.00 C ATOM 0 H THR A1170 -0.818 5.674 -14.826 1.00 0.00 H new ATOM 0 HA THR A1170 -2.393 7.482 -16.342 1.00 0.00 H new ATOM 0 HB THR A1170 -3.099 4.703 -15.314 1.00 0.00 H new ATOM 0 HG1 THR A1170 -1.117 4.559 -16.434 1.00 0.00 H new ATOM 0 HG21 THR A1170 -4.468 4.507 -17.370 1.00 0.00 H new ATOM 0 HG22 THR A1170 -5.021 5.839 -16.327 1.00 0.00 H new ATOM 0 HG23 THR A1170 -4.068 6.189 -17.789 1.00 0.00 H new ATOM 199 N LEU A1171 -3.671 6.601 -13.389 1.00 0.00 N ATOM 200 CA LEU A1171 -4.659 6.936 -12.340 1.00 0.00 C ATOM 201 C LEU A1171 -4.485 8.387 -11.842 1.00 0.00 C ATOM 202 O LEU A1171 -5.434 9.174 -11.894 1.00 0.00 O ATOM 203 CB LEU A1171 -4.572 5.928 -11.142 1.00 0.00 C ATOM 204 CG LEU A1171 -5.338 4.567 -11.288 1.00 0.00 C ATOM 205 CD1 LEU A1171 -6.825 4.797 -11.612 1.00 0.00 C ATOM 206 CD2 LEU A1171 -4.676 3.625 -12.314 1.00 0.00 C ATOM 0 H LEU A1171 -3.087 5.798 -13.155 1.00 0.00 H new ATOM 0 HA LEU A1171 -5.649 6.852 -12.787 1.00 0.00 H new ATOM 0 HB2 LEU A1171 -3.520 5.705 -10.965 1.00 0.00 H new ATOM 0 HB3 LEU A1171 -4.946 6.431 -10.250 1.00 0.00 H new ATOM 0 HG LEU A1171 -5.278 4.066 -10.322 1.00 0.00 H new ATOM 0 HD11 LEU A1171 -7.330 3.836 -11.707 1.00 0.00 H new ATOM 0 HD12 LEU A1171 -7.288 5.372 -10.810 1.00 0.00 H new ATOM 0 HD13 LEU A1171 -6.912 5.347 -12.549 1.00 0.00 H new ATOM 0 HD21 LEU A1171 -5.245 2.698 -12.377 1.00 0.00 H new ATOM 0 HD22 LEU A1171 -4.658 4.107 -13.292 1.00 0.00 H new ATOM 0 HD23 LEU A1171 -3.656 3.404 -12.000 1.00 0.00 H new ATOM 218 N LEU A1172 -3.264 8.736 -11.398 1.00 0.00 N ATOM 219 CA LEU A1172 -2.989 10.065 -10.810 1.00 0.00 C ATOM 220 C LEU A1172 -3.087 11.188 -11.846 1.00 0.00 C ATOM 221 O LEU A1172 -3.449 12.299 -11.491 1.00 0.00 O ATOM 222 CB LEU A1172 -1.614 10.108 -10.074 1.00 0.00 C ATOM 223 CG LEU A1172 -1.616 9.601 -8.598 1.00 0.00 C ATOM 224 CD1 LEU A1172 -2.576 10.448 -7.734 1.00 0.00 C ATOM 225 CD2 LEU A1172 -1.947 8.091 -8.507 1.00 0.00 C ATOM 0 H LEU A1172 -2.452 8.120 -11.434 1.00 0.00 H new ATOM 0 HA LEU A1172 -3.768 10.235 -10.067 1.00 0.00 H new ATOM 0 HB2 LEU A1172 -0.901 9.511 -10.642 1.00 0.00 H new ATOM 0 HB3 LEU A1172 -1.250 11.135 -10.085 1.00 0.00 H new ATOM 0 HG LEU A1172 -0.608 9.724 -8.202 1.00 0.00 H new ATOM 0 HD11 LEU A1172 -2.564 10.079 -6.708 1.00 0.00 H new ATOM 0 HD12 LEU A1172 -2.256 11.490 -7.749 1.00 0.00 H new ATOM 0 HD13 LEU A1172 -3.587 10.374 -8.134 1.00 0.00 H new ATOM 0 HD21 LEU A1172 -1.938 7.779 -7.463 1.00 0.00 H new ATOM 0 HD22 LEU A1172 -2.934 7.909 -8.932 1.00 0.00 H new ATOM 0 HD23 LEU A1172 -1.202 7.521 -9.062 1.00 0.00 H new ATOM 237 N ARG A1173 -2.775 10.905 -13.121 1.00 0.00 N ATOM 238 CA ARG A1173 -2.899 11.919 -14.189 1.00 0.00 C ATOM 239 C ARG A1173 -4.360 12.323 -14.374 1.00 0.00 C ATOM 240 O ARG A1173 -4.711 13.501 -14.193 1.00 0.00 O ATOM 241 CB ARG A1173 -2.284 11.435 -15.519 1.00 0.00 C ATOM 242 CG ARG A1173 -2.445 12.431 -16.695 1.00 0.00 C ATOM 243 CD ARG A1173 -1.513 12.118 -17.872 1.00 0.00 C ATOM 244 NE ARG A1173 -1.624 13.094 -18.963 1.00 0.00 N ATOM 245 CZ ARG A1173 -2.579 13.115 -19.901 1.00 0.00 C ATOM 246 NH1 ARG A1173 -3.622 12.298 -19.852 1.00 0.00 N ATOM 247 NH2 ARG A1173 -2.491 13.976 -20.891 1.00 0.00 N ATOM 0 H ARG A1173 -2.439 9.996 -13.438 1.00 0.00 H new ATOM 0 HA ARG A1173 -2.333 12.797 -13.878 1.00 0.00 H new ATOM 0 HB2 ARG A1173 -1.223 11.240 -15.366 1.00 0.00 H new ATOM 0 HB3 ARG A1173 -2.745 10.487 -15.795 1.00 0.00 H new ATOM 0 HG2 ARG A1173 -3.478 12.413 -17.041 1.00 0.00 H new ATOM 0 HG3 ARG A1173 -2.246 13.442 -16.339 1.00 0.00 H new ATOM 0 HD2 ARG A1173 -0.483 12.093 -17.517 1.00 0.00 H new ATOM 0 HD3 ARG A1173 -1.742 11.124 -18.256 1.00 0.00 H new ATOM 0 HE ARG A1173 -0.910 13.821 -19.011 1.00 0.00 H new ATOM 0 HH11 ARG A1173 -3.712 11.631 -19.085 1.00 0.00 H new ATOM 0 HH12 ARG A1173 -4.335 12.336 -20.581 1.00 0.00 H new ATOM 0 HH21 ARG A1173 -1.701 14.619 -20.939 1.00 0.00 H new ATOM 0 HH22 ARG A1173 -3.213 14.001 -21.611 1.00 0.00 H new ATOM 261 N GLU A1174 -5.208 11.322 -14.660 1.00 0.00 N ATOM 262 CA GLU A1174 -6.633 11.545 -14.941 1.00 0.00 C ATOM 263 C GLU A1174 -7.364 12.102 -13.699 1.00 0.00 C ATOM 264 O GLU A1174 -8.349 12.824 -13.830 1.00 0.00 O ATOM 265 CB GLU A1174 -7.302 10.234 -15.415 1.00 0.00 C ATOM 266 CG GLU A1174 -6.576 9.516 -16.571 1.00 0.00 C ATOM 267 CD GLU A1174 -6.408 10.375 -17.832 1.00 0.00 C ATOM 268 OE1 GLU A1174 -7.320 10.387 -18.680 1.00 0.00 O ATOM 269 OE2 GLU A1174 -5.357 11.035 -17.987 1.00 0.00 O ATOM 0 H GLU A1174 -4.927 10.343 -14.703 1.00 0.00 H new ATOM 0 HA GLU A1174 -6.707 12.285 -15.738 1.00 0.00 H new ATOM 0 HB2 GLU A1174 -7.370 9.551 -14.568 1.00 0.00 H new ATOM 0 HB3 GLU A1174 -8.322 10.456 -15.728 1.00 0.00 H new ATOM 0 HG2 GLU A1174 -5.592 9.198 -16.227 1.00 0.00 H new ATOM 0 HG3 GLU A1174 -7.130 8.614 -16.830 1.00 0.00 H new ATOM 276 N TRP A1175 -6.855 11.757 -12.498 1.00 0.00 N ATOM 277 CA TRP A1175 -7.386 12.267 -11.224 1.00 0.00 C ATOM 278 C TRP A1175 -7.056 13.777 -11.077 1.00 0.00 C ATOM 279 O TRP A1175 -7.961 14.608 -11.089 1.00 0.00 O ATOM 280 CB TRP A1175 -6.834 11.439 -10.022 1.00 0.00 C ATOM 281 CG TRP A1175 -7.411 11.858 -8.689 1.00 0.00 C ATOM 282 CD1 TRP A1175 -8.667 11.593 -8.210 1.00 0.00 C ATOM 283 CD2 TRP A1175 -6.760 12.631 -7.679 1.00 0.00 C ATOM 284 NE1 TRP A1175 -8.835 12.179 -6.985 1.00 0.00 N ATOM 285 CE2 TRP A1175 -7.678 12.817 -6.636 1.00 0.00 C ATOM 286 CE3 TRP A1175 -5.489 13.187 -7.562 1.00 0.00 C ATOM 287 CZ2 TRP A1175 -7.367 13.537 -5.495 1.00 0.00 C ATOM 288 CZ3 TRP A1175 -5.174 13.903 -6.429 1.00 0.00 C ATOM 289 CH2 TRP A1175 -6.110 14.075 -5.408 1.00 0.00 C ATOM 0 H TRP A1175 -6.067 11.119 -12.388 1.00 0.00 H new ATOM 0 HA TRP A1175 -8.470 12.155 -11.223 1.00 0.00 H new ATOM 0 HB2 TRP A1175 -7.050 10.384 -10.188 1.00 0.00 H new ATOM 0 HB3 TRP A1175 -5.749 11.541 -9.988 1.00 0.00 H new ATOM 0 HD1 TRP A1175 -9.415 11.007 -8.724 1.00 0.00 H new ATOM 0 HE1 TRP A1175 -9.686 12.145 -6.423 1.00 0.00 H new ATOM 0 HE3 TRP A1175 -4.760 13.058 -8.349 1.00 0.00 H new ATOM 0 HZ2 TRP A1175 -8.089 13.670 -4.703 1.00 0.00 H new ATOM 0 HZ3 TRP A1175 -4.190 14.337 -6.329 1.00 0.00 H new ATOM 0 HH2 TRP A1175 -5.838 14.644 -4.531 1.00 0.00 H new ATOM 300 N ILE A1176 -5.744 14.106 -11.002 1.00 0.00 N ATOM 301 CA ILE A1176 -5.245 15.485 -10.726 1.00 0.00 C ATOM 302 C ILE A1176 -5.819 16.531 -11.712 1.00 0.00 C ATOM 303 O ILE A1176 -6.243 17.608 -11.295 1.00 0.00 O ATOM 304 CB ILE A1176 -3.658 15.548 -10.739 1.00 0.00 C ATOM 305 CG1 ILE A1176 -3.053 14.685 -9.584 1.00 0.00 C ATOM 306 CG2 ILE A1176 -3.127 17.009 -10.650 1.00 0.00 C ATOM 307 CD1 ILE A1176 -1.534 14.559 -9.587 1.00 0.00 C ATOM 0 H ILE A1176 -4.996 13.425 -11.131 1.00 0.00 H new ATOM 0 HA ILE A1176 -5.599 15.736 -9.726 1.00 0.00 H new ATOM 0 HB ILE A1176 -3.335 15.136 -11.695 1.00 0.00 H new ATOM 0 HG12 ILE A1176 -3.363 15.115 -8.632 1.00 0.00 H new ATOM 0 HG13 ILE A1176 -3.483 13.685 -9.637 1.00 0.00 H new ATOM 0 HG21 ILE A1176 -2.037 17.001 -10.662 1.00 0.00 H new ATOM 0 HG22 ILE A1176 -3.495 17.582 -11.501 1.00 0.00 H new ATOM 0 HG23 ILE A1176 -3.476 17.467 -9.725 1.00 0.00 H new ATOM 0 HD11 ILE A1176 -1.218 13.941 -8.746 1.00 0.00 H new ATOM 0 HD12 ILE A1176 -1.209 14.097 -10.519 1.00 0.00 H new ATOM 0 HD13 ILE A1176 -1.087 15.549 -9.498 1.00 0.00 H new ATOM 319 N THR A1177 -5.862 16.179 -13.007 1.00 0.00 N ATOM 320 CA THR A1177 -6.228 17.125 -14.084 1.00 0.00 C ATOM 321 C THR A1177 -7.761 17.375 -14.191 1.00 0.00 C ATOM 322 O THR A1177 -8.182 18.314 -14.879 1.00 0.00 O ATOM 323 CB THR A1177 -5.664 16.628 -15.458 1.00 0.00 C ATOM 324 OG1 THR A1177 -6.170 15.312 -15.741 1.00 0.00 O ATOM 325 CG2 THR A1177 -4.115 16.605 -15.472 1.00 0.00 C ATOM 0 H THR A1177 -5.647 15.239 -13.340 1.00 0.00 H new ATOM 0 HA THR A1177 -5.775 18.081 -13.822 1.00 0.00 H new ATOM 0 HB THR A1177 -5.993 17.328 -16.226 1.00 0.00 H new ATOM 0 HG1 THR A1177 -5.665 14.649 -15.225 1.00 0.00 H new ATOM 0 HG21 THR A1177 -3.765 16.254 -16.443 1.00 0.00 H new ATOM 0 HG22 THR A1177 -3.735 17.610 -15.291 1.00 0.00 H new ATOM 0 HG23 THR A1177 -3.754 15.934 -14.692 1.00 0.00 H new ATOM 333 N THR A1178 -8.597 16.543 -13.515 1.00 0.00 N ATOM 334 CA THR A1178 -10.077 16.687 -13.555 1.00 0.00 C ATOM 335 C THR A1178 -10.628 17.245 -12.228 1.00 0.00 C ATOM 336 O THR A1178 -11.580 18.034 -12.229 1.00 0.00 O ATOM 337 CB THR A1178 -10.786 15.329 -13.865 1.00 0.00 C ATOM 338 OG1 THR A1178 -10.450 14.366 -12.855 1.00 0.00 O ATOM 339 CG2 THR A1178 -10.407 14.780 -15.260 1.00 0.00 C ATOM 0 H THR A1178 -8.272 15.768 -12.937 1.00 0.00 H new ATOM 0 HA THR A1178 -10.291 17.391 -14.359 1.00 0.00 H new ATOM 0 HB THR A1178 -11.861 15.510 -13.865 1.00 0.00 H new ATOM 0 HG1 THR A1178 -9.722 13.795 -13.177 1.00 0.00 H new ATOM 0 HG21 THR A1178 -10.923 13.835 -15.432 1.00 0.00 H new ATOM 0 HG22 THR A1178 -10.700 15.498 -16.026 1.00 0.00 H new ATOM 0 HG23 THR A1178 -9.330 14.619 -15.307 1.00 0.00 H new ATOM 347 N ILE A1179 -10.040 16.806 -11.099 1.00 0.00 N ATOM 348 CA ILE A1179 -10.472 17.216 -9.748 1.00 0.00 C ATOM 349 C ILE A1179 -10.087 18.690 -9.501 1.00 0.00 C ATOM 350 O ILE A1179 -9.006 19.126 -9.904 1.00 0.00 O ATOM 351 CB ILE A1179 -9.845 16.282 -8.636 1.00 0.00 C ATOM 352 CG1 ILE A1179 -10.203 14.779 -8.888 1.00 0.00 C ATOM 353 CG2 ILE A1179 -10.268 16.710 -7.204 1.00 0.00 C ATOM 354 CD1 ILE A1179 -11.678 14.433 -8.814 1.00 0.00 C ATOM 0 H ILE A1179 -9.253 16.158 -11.097 1.00 0.00 H new ATOM 0 HA ILE A1179 -11.556 17.116 -9.688 1.00 0.00 H new ATOM 0 HB ILE A1179 -8.763 16.395 -8.706 1.00 0.00 H new ATOM 0 HG12 ILE A1179 -9.831 14.496 -9.873 1.00 0.00 H new ATOM 0 HG13 ILE A1179 -9.669 14.170 -8.159 1.00 0.00 H new ATOM 0 HG21 ILE A1179 -9.813 16.040 -6.475 1.00 0.00 H new ATOM 0 HG22 ILE A1179 -9.935 17.731 -7.016 1.00 0.00 H new ATOM 0 HG23 ILE A1179 -11.353 16.660 -7.115 1.00 0.00 H new ATOM 0 HD11 ILE A1179 -11.812 13.368 -9.004 1.00 0.00 H new ATOM 0 HD12 ILE A1179 -12.059 14.675 -7.822 1.00 0.00 H new ATOM 0 HD13 ILE A1179 -12.224 15.007 -9.563 1.00 0.00 H new ATOM 366 N SER A1180 -10.994 19.446 -8.872 1.00 0.00 N ATOM 367 CA SER A1180 -10.801 20.872 -8.578 1.00 0.00 C ATOM 368 C SER A1180 -10.211 21.066 -7.168 1.00 0.00 C ATOM 369 O SER A1180 -9.313 21.887 -6.969 1.00 0.00 O ATOM 370 CB SER A1180 -12.151 21.614 -8.724 1.00 0.00 C ATOM 371 OG SER A1180 -13.162 21.023 -7.916 1.00 0.00 O ATOM 0 H SER A1180 -11.891 19.083 -8.550 1.00 0.00 H new ATOM 0 HA SER A1180 -10.089 21.291 -9.289 1.00 0.00 H new ATOM 0 HB2 SER A1180 -12.025 22.660 -8.443 1.00 0.00 H new ATOM 0 HB3 SER A1180 -12.464 21.600 -9.768 1.00 0.00 H new ATOM 0 HG SER A1180 -13.122 21.402 -7.013 1.00 0.00 H new ATOM 377 N ASP A1181 -10.719 20.288 -6.197 1.00 0.00 N ATOM 378 CA ASP A1181 -10.328 20.401 -4.774 1.00 0.00 C ATOM 379 C ASP A1181 -9.810 19.040 -4.261 1.00 0.00 C ATOM 380 O ASP A1181 -10.613 18.126 -4.037 1.00 0.00 O ATOM 381 CB ASP A1181 -11.532 20.865 -3.907 1.00 0.00 C ATOM 382 CG ASP A1181 -12.130 22.208 -4.360 1.00 0.00 C ATOM 383 OD1 ASP A1181 -11.629 23.272 -3.943 1.00 0.00 O ATOM 384 OD2 ASP A1181 -13.112 22.205 -5.130 1.00 0.00 O ATOM 0 H ASP A1181 -11.413 19.561 -6.373 1.00 0.00 H new ATOM 0 HA ASP A1181 -9.535 21.145 -4.693 1.00 0.00 H new ATOM 0 HB2 ASP A1181 -12.309 20.101 -3.939 1.00 0.00 H new ATOM 0 HB3 ASP A1181 -11.211 20.950 -2.869 1.00 0.00 H new ATOM 389 N PRO A1182 -8.463 18.867 -4.102 1.00 0.00 N ATOM 390 CA PRO A1182 -7.883 17.666 -3.461 1.00 0.00 C ATOM 391 C PRO A1182 -8.075 17.726 -1.925 1.00 0.00 C ATOM 392 O PRO A1182 -7.760 18.749 -1.295 1.00 0.00 O ATOM 393 CB PRO A1182 -6.390 17.750 -3.872 1.00 0.00 C ATOM 394 CG PRO A1182 -6.121 19.220 -3.990 1.00 0.00 C ATOM 395 CD PRO A1182 -7.402 19.818 -4.543 1.00 0.00 C ATOM 0 HA PRO A1182 -8.347 16.728 -3.765 1.00 0.00 H new ATOM 0 HB2 PRO A1182 -5.745 17.286 -3.126 1.00 0.00 H new ATOM 0 HB3 PRO A1182 -6.207 17.235 -4.815 1.00 0.00 H new ATOM 0 HG2 PRO A1182 -5.871 19.653 -3.022 1.00 0.00 H new ATOM 0 HG3 PRO A1182 -5.278 19.414 -4.653 1.00 0.00 H new ATOM 0 HD2 PRO A1182 -7.576 20.820 -4.151 1.00 0.00 H new ATOM 0 HD3 PRO A1182 -7.367 19.902 -5.629 1.00 0.00 H new ATOM 403 N MET A1183 -8.613 16.645 -1.333 1.00 0.00 N ATOM 404 CA MET A1183 -8.892 16.590 0.119 1.00 0.00 C ATOM 405 C MET A1183 -7.600 16.357 0.913 1.00 0.00 C ATOM 406 O MET A1183 -6.567 15.983 0.336 1.00 0.00 O ATOM 407 CB MET A1183 -9.940 15.496 0.444 1.00 0.00 C ATOM 408 CG MET A1183 -11.308 15.701 -0.229 1.00 0.00 C ATOM 409 SD MET A1183 -12.577 14.601 0.436 1.00 0.00 S ATOM 410 CE MET A1183 -12.637 15.150 2.148 1.00 0.00 C ATOM 0 H MET A1183 -8.865 15.794 -1.836 1.00 0.00 H new ATOM 0 HA MET A1183 -9.308 17.553 0.417 1.00 0.00 H new ATOM 0 HB2 MET A1183 -9.542 14.528 0.140 1.00 0.00 H new ATOM 0 HB3 MET A1183 -10.083 15.457 1.524 1.00 0.00 H new ATOM 0 HG2 MET A1183 -11.623 16.736 -0.097 1.00 0.00 H new ATOM 0 HG3 MET A1183 -11.211 15.532 -1.301 1.00 0.00 H new ATOM 0 HE1 MET A1183 -13.621 14.935 2.565 1.00 0.00 H new ATOM 0 HE2 MET A1183 -11.876 14.625 2.725 1.00 0.00 H new ATOM 0 HE3 MET A1183 -12.450 16.223 2.193 1.00 0.00 H new ATOM 420 N GLU A1184 -7.676 16.565 2.247 1.00 0.00 N ATOM 421 CA GLU A1184 -6.520 16.414 3.156 1.00 0.00 C ATOM 422 C GLU A1184 -5.935 14.986 3.047 1.00 0.00 C ATOM 423 O GLU A1184 -4.719 14.819 2.939 1.00 0.00 O ATOM 424 CB GLU A1184 -6.928 16.709 4.624 1.00 0.00 C ATOM 425 CG GLU A1184 -5.752 16.672 5.625 1.00 0.00 C ATOM 426 CD GLU A1184 -6.179 16.821 7.097 1.00 0.00 C ATOM 427 OE1 GLU A1184 -6.530 15.800 7.729 1.00 0.00 O ATOM 428 OE2 GLU A1184 -6.164 17.952 7.630 1.00 0.00 O ATOM 0 H GLU A1184 -8.536 16.841 2.721 1.00 0.00 H new ATOM 0 HA GLU A1184 -5.758 17.135 2.858 1.00 0.00 H new ATOM 0 HB2 GLU A1184 -7.398 17.691 4.669 1.00 0.00 H new ATOM 0 HB3 GLU A1184 -7.678 15.982 4.934 1.00 0.00 H new ATOM 0 HG2 GLU A1184 -5.216 15.730 5.506 1.00 0.00 H new ATOM 0 HG3 GLU A1184 -5.052 17.470 5.378 1.00 0.00 H new ATOM 435 N GLU A1185 -6.841 13.973 3.030 1.00 0.00 N ATOM 436 CA GLU A1185 -6.473 12.543 2.870 1.00 0.00 C ATOM 437 C GLU A1185 -5.591 12.326 1.630 1.00 0.00 C ATOM 438 O GLU A1185 -4.589 11.634 1.706 1.00 0.00 O ATOM 439 CB GLU A1185 -7.734 11.643 2.763 1.00 0.00 C ATOM 440 CG GLU A1185 -8.554 11.546 4.053 1.00 0.00 C ATOM 441 CD GLU A1185 -9.804 10.660 3.910 1.00 0.00 C ATOM 442 OE1 GLU A1185 -9.692 9.420 4.061 1.00 0.00 O ATOM 443 OE2 GLU A1185 -10.904 11.197 3.635 1.00 0.00 O ATOM 0 H GLU A1185 -7.845 14.126 3.127 1.00 0.00 H new ATOM 0 HA GLU A1185 -5.910 12.262 3.760 1.00 0.00 H new ATOM 0 HB2 GLU A1185 -8.374 12.028 1.969 1.00 0.00 H new ATOM 0 HB3 GLU A1185 -7.426 10.640 2.467 1.00 0.00 H new ATOM 0 HG2 GLU A1185 -7.923 11.148 4.848 1.00 0.00 H new ATOM 0 HG3 GLU A1185 -8.859 12.547 4.359 1.00 0.00 H new ATOM 450 N ASP A1186 -5.988 12.946 0.503 1.00 0.00 N ATOM 451 CA ASP A1186 -5.317 12.778 -0.805 1.00 0.00 C ATOM 452 C ASP A1186 -3.910 13.389 -0.795 1.00 0.00 C ATOM 453 O ASP A1186 -2.944 12.739 -1.193 1.00 0.00 O ATOM 454 CB ASP A1186 -6.147 13.424 -1.938 1.00 0.00 C ATOM 455 CG ASP A1186 -7.533 12.791 -2.093 1.00 0.00 C ATOM 456 OD1 ASP A1186 -7.616 11.628 -2.554 1.00 0.00 O ATOM 457 OD2 ASP A1186 -8.545 13.436 -1.756 1.00 0.00 O ATOM 0 H ASP A1186 -6.786 13.581 0.471 1.00 0.00 H new ATOM 0 HA ASP A1186 -5.233 11.707 -0.987 1.00 0.00 H new ATOM 0 HB2 ASP A1186 -6.260 14.490 -1.738 1.00 0.00 H new ATOM 0 HB3 ASP A1186 -5.603 13.332 -2.878 1.00 0.00 H new ATOM 462 N ILE A1187 -3.822 14.643 -0.318 1.00 0.00 N ATOM 463 CA ILE A1187 -2.550 15.398 -0.238 1.00 0.00 C ATOM 464 C ILE A1187 -1.525 14.638 0.638 1.00 0.00 C ATOM 465 O ILE A1187 -0.357 14.492 0.267 1.00 0.00 O ATOM 466 CB ILE A1187 -2.811 16.853 0.326 1.00 0.00 C ATOM 467 CG1 ILE A1187 -3.816 17.627 -0.599 1.00 0.00 C ATOM 468 CG2 ILE A1187 -1.489 17.656 0.504 1.00 0.00 C ATOM 469 CD1 ILE A1187 -4.262 18.989 -0.075 1.00 0.00 C ATOM 0 H ILE A1187 -4.628 15.166 0.024 1.00 0.00 H new ATOM 0 HA ILE A1187 -2.133 15.492 -1.241 1.00 0.00 H new ATOM 0 HB ILE A1187 -3.256 16.747 1.315 1.00 0.00 H new ATOM 0 HG12 ILE A1187 -3.353 17.765 -1.576 1.00 0.00 H new ATOM 0 HG13 ILE A1187 -4.699 17.006 -0.749 1.00 0.00 H new ATOM 0 HG21 ILE A1187 -1.716 18.649 0.893 1.00 0.00 H new ATOM 0 HG22 ILE A1187 -0.837 17.133 1.203 1.00 0.00 H new ATOM 0 HG23 ILE A1187 -0.988 17.750 -0.459 1.00 0.00 H new ATOM 0 HD11 ILE A1187 -4.954 19.443 -0.784 1.00 0.00 H new ATOM 0 HD12 ILE A1187 -4.759 18.864 0.887 1.00 0.00 H new ATOM 0 HD13 ILE A1187 -3.392 19.634 0.047 1.00 0.00 H new ATOM 481 N LEU A1188 -2.015 14.102 1.770 1.00 0.00 N ATOM 482 CA LEU A1188 -1.195 13.333 2.721 1.00 0.00 C ATOM 483 C LEU A1188 -0.810 11.958 2.144 1.00 0.00 C ATOM 484 O LEU A1188 0.316 11.522 2.326 1.00 0.00 O ATOM 485 CB LEU A1188 -1.941 13.164 4.065 1.00 0.00 C ATOM 486 CG LEU A1188 -2.200 14.476 4.871 1.00 0.00 C ATOM 487 CD1 LEU A1188 -3.026 14.189 6.140 1.00 0.00 C ATOM 488 CD2 LEU A1188 -0.878 15.204 5.212 1.00 0.00 C ATOM 0 H LEU A1188 -2.992 14.190 2.051 1.00 0.00 H new ATOM 0 HA LEU A1188 -0.276 13.892 2.897 1.00 0.00 H new ATOM 0 HB2 LEU A1188 -2.901 12.686 3.868 1.00 0.00 H new ATOM 0 HB3 LEU A1188 -1.368 12.482 4.693 1.00 0.00 H new ATOM 0 HG LEU A1188 -2.782 15.144 4.237 1.00 0.00 H new ATOM 0 HD11 LEU A1188 -3.193 15.119 6.684 1.00 0.00 H new ATOM 0 HD12 LEU A1188 -3.986 13.756 5.859 1.00 0.00 H new ATOM 0 HD13 LEU A1188 -2.484 13.489 6.776 1.00 0.00 H new ATOM 0 HD21 LEU A1188 -1.097 16.113 5.773 1.00 0.00 H new ATOM 0 HD22 LEU A1188 -0.247 14.550 5.813 1.00 0.00 H new ATOM 0 HD23 LEU A1188 -0.357 15.463 4.290 1.00 0.00 H new ATOM 500 N GLN A1189 -1.755 11.309 1.429 1.00 0.00 N ATOM 501 CA GLN A1189 -1.538 9.980 0.797 1.00 0.00 C ATOM 502 C GLN A1189 -0.322 10.012 -0.139 1.00 0.00 C ATOM 503 O GLN A1189 0.526 9.118 -0.089 1.00 0.00 O ATOM 504 CB GLN A1189 -2.812 9.507 0.011 1.00 0.00 C ATOM 505 CG GLN A1189 -3.825 8.689 0.837 1.00 0.00 C ATOM 506 CD GLN A1189 -5.101 8.352 0.065 1.00 0.00 C ATOM 507 OE1 GLN A1189 -5.189 7.310 -0.580 1.00 0.00 O ATOM 508 NE2 GLN A1189 -6.088 9.233 0.114 1.00 0.00 N ATOM 0 H GLN A1189 -2.689 11.687 1.271 1.00 0.00 H new ATOM 0 HA GLN A1189 -1.345 9.265 1.597 1.00 0.00 H new ATOM 0 HB2 GLN A1189 -3.319 10.385 -0.390 1.00 0.00 H new ATOM 0 HB3 GLN A1189 -2.492 8.906 -0.841 1.00 0.00 H new ATOM 0 HG2 GLN A1189 -3.352 7.764 1.166 1.00 0.00 H new ATOM 0 HG3 GLN A1189 -4.088 9.249 1.734 1.00 0.00 H new ATOM 0 HE21 GLN A1189 -5.982 10.088 0.659 1.00 0.00 H new ATOM 0 HE22 GLN A1189 -6.955 9.056 -0.394 1.00 0.00 H new ATOM 517 N VAL A1190 -0.256 11.059 -0.977 1.00 0.00 N ATOM 518 CA VAL A1190 0.809 11.227 -1.985 1.00 0.00 C ATOM 519 C VAL A1190 2.188 11.426 -1.304 1.00 0.00 C ATOM 520 O VAL A1190 3.210 10.946 -1.810 1.00 0.00 O ATOM 521 CB VAL A1190 0.472 12.413 -2.964 1.00 0.00 C ATOM 522 CG1 VAL A1190 1.562 12.577 -4.043 1.00 0.00 C ATOM 523 CG2 VAL A1190 -0.918 12.218 -3.632 1.00 0.00 C ATOM 0 H VAL A1190 -0.940 11.816 -0.976 1.00 0.00 H new ATOM 0 HA VAL A1190 0.864 10.315 -2.579 1.00 0.00 H new ATOM 0 HB VAL A1190 0.441 13.324 -2.366 1.00 0.00 H new ATOM 0 HG11 VAL A1190 1.299 13.404 -4.703 1.00 0.00 H new ATOM 0 HG12 VAL A1190 2.519 12.784 -3.565 1.00 0.00 H new ATOM 0 HG13 VAL A1190 1.639 11.659 -4.625 1.00 0.00 H new ATOM 0 HG21 VAL A1190 -1.120 13.054 -4.302 1.00 0.00 H new ATOM 0 HG22 VAL A1190 -0.921 11.288 -4.201 1.00 0.00 H new ATOM 0 HG23 VAL A1190 -1.689 12.175 -2.862 1.00 0.00 H new ATOM 533 N VAL A1191 2.189 12.094 -0.129 1.00 0.00 N ATOM 534 CA VAL A1191 3.395 12.222 0.726 1.00 0.00 C ATOM 535 C VAL A1191 3.857 10.824 1.191 1.00 0.00 C ATOM 536 O VAL A1191 4.997 10.425 0.941 1.00 0.00 O ATOM 537 CB VAL A1191 3.140 13.134 1.993 1.00 0.00 C ATOM 538 CG1 VAL A1191 4.380 13.171 2.931 1.00 0.00 C ATOM 539 CG2 VAL A1191 2.712 14.563 1.583 1.00 0.00 C ATOM 0 H VAL A1191 1.364 12.556 0.252 1.00 0.00 H new ATOM 0 HA VAL A1191 4.168 12.698 0.123 1.00 0.00 H new ATOM 0 HB VAL A1191 2.318 12.687 2.551 1.00 0.00 H new ATOM 0 HG11 VAL A1191 4.167 13.807 3.790 1.00 0.00 H new ATOM 0 HG12 VAL A1191 4.607 12.162 3.274 1.00 0.00 H new ATOM 0 HG13 VAL A1191 5.236 13.570 2.387 1.00 0.00 H new ATOM 0 HG21 VAL A1191 2.545 15.163 2.477 1.00 0.00 H new ATOM 0 HG22 VAL A1191 3.498 15.020 0.981 1.00 0.00 H new ATOM 0 HG23 VAL A1191 1.791 14.514 1.001 1.00 0.00 H new ATOM 549 N LYS A1192 2.916 10.086 1.812 1.00 0.00 N ATOM 550 CA LYS A1192 3.157 8.754 2.414 1.00 0.00 C ATOM 551 C LYS A1192 3.643 7.739 1.361 1.00 0.00 C ATOM 552 O LYS A1192 4.462 6.870 1.662 1.00 0.00 O ATOM 553 CB LYS A1192 1.854 8.229 3.089 1.00 0.00 C ATOM 554 CG LYS A1192 1.251 9.161 4.175 1.00 0.00 C ATOM 555 CD LYS A1192 2.141 9.336 5.428 1.00 0.00 C ATOM 556 CE LYS A1192 2.283 8.043 6.247 1.00 0.00 C ATOM 557 NZ LYS A1192 3.198 8.214 7.400 1.00 0.00 N ATOM 0 H LYS A1192 1.951 10.401 1.913 1.00 0.00 H new ATOM 0 HA LYS A1192 3.939 8.864 3.165 1.00 0.00 H new ATOM 0 HB2 LYS A1192 1.104 8.066 2.316 1.00 0.00 H new ATOM 0 HB3 LYS A1192 2.063 7.259 3.540 1.00 0.00 H new ATOM 0 HG2 LYS A1192 1.067 10.141 3.735 1.00 0.00 H new ATOM 0 HG3 LYS A1192 0.284 8.763 4.483 1.00 0.00 H new ATOM 0 HD2 LYS A1192 3.130 9.675 5.120 1.00 0.00 H new ATOM 0 HD3 LYS A1192 1.719 10.116 6.061 1.00 0.00 H new ATOM 0 HE2 LYS A1192 1.302 7.732 6.606 1.00 0.00 H new ATOM 0 HE3 LYS A1192 2.655 7.246 5.604 1.00 0.00 H new ATOM 0 HZ1 LYS A1192 3.266 7.319 7.925 1.00 0.00 H new ATOM 0 HZ2 LYS A1192 4.141 8.486 7.057 1.00 0.00 H new ATOM 0 HZ3 LYS A1192 2.830 8.957 8.028 1.00 0.00 H new ATOM 571 N TYR A1193 3.134 7.886 0.128 1.00 0.00 N ATOM 572 CA TYR A1193 3.450 6.998 -1.002 1.00 0.00 C ATOM 573 C TYR A1193 4.867 7.267 -1.530 1.00 0.00 C ATOM 574 O TYR A1193 5.680 6.343 -1.676 1.00 0.00 O ATOM 575 CB TYR A1193 2.418 7.214 -2.135 1.00 0.00 C ATOM 576 CG TYR A1193 2.601 6.263 -3.321 1.00 0.00 C ATOM 577 CD1 TYR A1193 2.196 4.937 -3.225 1.00 0.00 C ATOM 578 CD2 TYR A1193 3.216 6.671 -4.514 1.00 0.00 C ATOM 579 CE1 TYR A1193 2.390 4.053 -4.257 1.00 0.00 C ATOM 580 CE2 TYR A1193 3.419 5.779 -5.549 1.00 0.00 C ATOM 581 CZ TYR A1193 2.998 4.474 -5.411 1.00 0.00 C ATOM 582 OH TYR A1193 3.208 3.576 -6.418 1.00 0.00 O ATOM 0 H TYR A1193 2.484 8.633 -0.115 1.00 0.00 H new ATOM 0 HA TYR A1193 3.404 5.965 -0.656 1.00 0.00 H new ATOM 0 HB2 TYR A1193 1.414 7.087 -1.730 1.00 0.00 H new ATOM 0 HB3 TYR A1193 2.491 8.242 -2.490 1.00 0.00 H new ATOM 0 HD1 TYR A1193 1.718 4.595 -2.319 1.00 0.00 H new ATOM 0 HD2 TYR A1193 3.535 7.697 -4.625 1.00 0.00 H new ATOM 0 HE1 TYR A1193 2.064 3.028 -4.160 1.00 0.00 H new ATOM 0 HE2 TYR A1193 3.904 6.102 -6.459 1.00 0.00 H new ATOM 0 HH TYR A1193 3.223 2.668 -6.049 1.00 0.00 H new ATOM 592 N CYS A1194 5.144 8.549 -1.813 1.00 0.00 N ATOM 593 CA CYS A1194 6.439 8.986 -2.356 1.00 0.00 C ATOM 594 C CYS A1194 7.568 8.856 -1.310 1.00 0.00 C ATOM 595 O CYS A1194 8.742 8.884 -1.660 1.00 0.00 O ATOM 596 CB CYS A1194 6.320 10.411 -2.910 1.00 0.00 C ATOM 597 SG CYS A1194 5.082 10.584 -4.214 1.00 0.00 S ATOM 0 H CYS A1194 4.479 9.310 -1.672 1.00 0.00 H new ATOM 0 HA CYS A1194 6.712 8.327 -3.180 1.00 0.00 H new ATOM 0 HB2 CYS A1194 6.071 11.089 -2.093 1.00 0.00 H new ATOM 0 HB3 CYS A1194 7.290 10.722 -3.299 1.00 0.00 H new ATOM 0 HG CYS A1194 3.918 10.806 -3.680 1.00 0.00 H new ATOM 603 N THR A1195 7.186 8.733 -0.026 1.00 0.00 N ATOM 604 CA THR A1195 8.111 8.402 1.076 1.00 0.00 C ATOM 605 C THR A1195 8.275 6.864 1.219 1.00 0.00 C ATOM 606 O THR A1195 9.359 6.375 1.560 1.00 0.00 O ATOM 607 CB THR A1195 7.601 9.037 2.411 1.00 0.00 C ATOM 608 OG1 THR A1195 7.514 10.467 2.260 1.00 0.00 O ATOM 609 CG2 THR A1195 8.504 8.709 3.608 1.00 0.00 C ATOM 0 H THR A1195 6.221 8.861 0.279 1.00 0.00 H new ATOM 0 HA THR A1195 9.091 8.819 0.845 1.00 0.00 H new ATOM 0 HB THR A1195 6.620 8.609 2.616 1.00 0.00 H new ATOM 0 HG1 THR A1195 6.679 10.697 1.802 1.00 0.00 H new ATOM 0 HG21 THR A1195 8.101 9.176 4.507 1.00 0.00 H new ATOM 0 HG22 THR A1195 8.545 7.629 3.748 1.00 0.00 H new ATOM 0 HG23 THR A1195 9.508 9.089 3.421 1.00 0.00 H new ATOM 617 N ASP A1196 7.183 6.114 0.952 1.00 0.00 N ATOM 618 CA ASP A1196 7.178 4.630 1.004 1.00 0.00 C ATOM 619 C ASP A1196 8.197 4.040 0.020 1.00 0.00 C ATOM 620 O ASP A1196 8.962 3.149 0.379 1.00 0.00 O ATOM 621 CB ASP A1196 5.762 4.076 0.690 1.00 0.00 C ATOM 622 CG ASP A1196 5.707 2.534 0.600 1.00 0.00 C ATOM 623 OD1 ASP A1196 5.713 1.865 1.657 1.00 0.00 O ATOM 624 OD2 ASP A1196 5.619 1.980 -0.521 1.00 0.00 O ATOM 0 H ASP A1196 6.282 6.516 0.695 1.00 0.00 H new ATOM 0 HA ASP A1196 7.459 4.333 2.014 1.00 0.00 H new ATOM 0 HB2 ASP A1196 5.070 4.411 1.463 1.00 0.00 H new ATOM 0 HB3 ASP A1196 5.416 4.499 -0.253 1.00 0.00 H new ATOM 629 N LEU A1197 8.198 4.561 -1.217 1.00 0.00 N ATOM 630 CA LEU A1197 9.120 4.106 -2.280 1.00 0.00 C ATOM 631 C LEU A1197 10.590 4.537 -2.002 1.00 0.00 C ATOM 632 O LEU A1197 11.525 3.921 -2.524 1.00 0.00 O ATOM 633 CB LEU A1197 8.592 4.550 -3.678 1.00 0.00 C ATOM 634 CG LEU A1197 8.260 6.070 -3.856 1.00 0.00 C ATOM 635 CD1 LEU A1197 9.520 6.909 -4.096 1.00 0.00 C ATOM 636 CD2 LEU A1197 7.213 6.311 -4.966 1.00 0.00 C ATOM 0 H LEU A1197 7.566 5.305 -1.511 1.00 0.00 H new ATOM 0 HA LEU A1197 9.143 3.016 -2.281 1.00 0.00 H new ATOM 0 HB2 LEU A1197 9.336 4.275 -4.425 1.00 0.00 H new ATOM 0 HB3 LEU A1197 7.691 3.977 -3.899 1.00 0.00 H new ATOM 0 HG LEU A1197 7.820 6.400 -2.915 1.00 0.00 H new ATOM 0 HD11 LEU A1197 9.243 7.956 -4.214 1.00 0.00 H new ATOM 0 HD12 LEU A1197 10.194 6.806 -3.245 1.00 0.00 H new ATOM 0 HD13 LEU A1197 10.021 6.562 -5.000 1.00 0.00 H new ATOM 0 HD21 LEU A1197 7.014 7.379 -5.053 1.00 0.00 H new ATOM 0 HD22 LEU A1197 7.595 5.934 -5.915 1.00 0.00 H new ATOM 0 HD23 LEU A1197 6.289 5.790 -4.714 1.00 0.00 H new ATOM 648 N ILE A1198 10.784 5.611 -1.191 1.00 0.00 N ATOM 649 CA ILE A1198 12.120 5.983 -0.641 1.00 0.00 C ATOM 650 C ILE A1198 12.612 4.863 0.302 1.00 0.00 C ATOM 651 O ILE A1198 13.786 4.463 0.255 1.00 0.00 O ATOM 652 CB ILE A1198 12.077 7.380 0.124 1.00 0.00 C ATOM 653 CG1 ILE A1198 11.828 8.547 -0.884 1.00 0.00 C ATOM 654 CG2 ILE A1198 13.353 7.658 0.973 1.00 0.00 C ATOM 655 CD1 ILE A1198 11.674 9.928 -0.253 1.00 0.00 C ATOM 0 H ILE A1198 10.032 6.237 -0.902 1.00 0.00 H new ATOM 0 HA ILE A1198 12.816 6.096 -1.473 1.00 0.00 H new ATOM 0 HB ILE A1198 11.246 7.321 0.827 1.00 0.00 H new ATOM 0 HG12 ILE A1198 12.657 8.578 -1.591 1.00 0.00 H new ATOM 0 HG13 ILE A1198 10.928 8.325 -1.458 1.00 0.00 H new ATOM 0 HG21 ILE A1198 13.258 8.625 1.467 1.00 0.00 H new ATOM 0 HG22 ILE A1198 13.468 6.876 1.724 1.00 0.00 H new ATOM 0 HG23 ILE A1198 14.228 7.667 0.323 1.00 0.00 H new ATOM 0 HD11 ILE A1198 11.505 10.668 -1.035 1.00 0.00 H new ATOM 0 HD12 ILE A1198 10.826 9.923 0.431 1.00 0.00 H new ATOM 0 HD13 ILE A1198 12.581 10.180 0.296 1.00 0.00 H new ATOM 667 N GLU A1199 11.675 4.340 1.120 1.00 0.00 N ATOM 668 CA GLU A1199 11.930 3.205 2.042 1.00 0.00 C ATOM 669 C GLU A1199 11.950 1.847 1.294 1.00 0.00 C ATOM 670 O GLU A1199 12.398 0.836 1.843 1.00 0.00 O ATOM 671 CB GLU A1199 10.864 3.176 3.162 1.00 0.00 C ATOM 672 CG GLU A1199 10.760 4.465 3.982 1.00 0.00 C ATOM 673 CD GLU A1199 9.713 4.347 5.100 1.00 0.00 C ATOM 674 OE1 GLU A1199 8.533 4.648 4.855 1.00 0.00 O ATOM 675 OE2 GLU A1199 10.070 3.925 6.223 1.00 0.00 O ATOM 0 H GLU A1199 10.718 4.691 1.163 1.00 0.00 H new ATOM 0 HA GLU A1199 12.915 3.356 2.483 1.00 0.00 H new ATOM 0 HB2 GLU A1199 9.892 2.967 2.714 1.00 0.00 H new ATOM 0 HB3 GLU A1199 11.088 2.350 3.837 1.00 0.00 H new ATOM 0 HG2 GLU A1199 11.732 4.698 4.417 1.00 0.00 H new ATOM 0 HG3 GLU A1199 10.498 5.294 3.325 1.00 0.00 H new ATOM 682 N GLU A1200 11.434 1.832 0.050 1.00 0.00 N ATOM 683 CA GLU A1200 11.570 0.682 -0.884 1.00 0.00 C ATOM 684 C GLU A1200 12.854 0.801 -1.723 1.00 0.00 C ATOM 685 O GLU A1200 13.149 -0.073 -2.542 1.00 0.00 O ATOM 686 CB GLU A1200 10.338 0.586 -1.815 1.00 0.00 C ATOM 687 CG GLU A1200 9.030 0.206 -1.097 1.00 0.00 C ATOM 688 CD GLU A1200 9.070 -1.197 -0.466 1.00 0.00 C ATOM 689 OE1 GLU A1200 8.877 -2.192 -1.199 1.00 0.00 O ATOM 690 OE2 GLU A1200 9.315 -1.315 0.754 1.00 0.00 O ATOM 0 H GLU A1200 10.910 2.614 -0.342 1.00 0.00 H new ATOM 0 HA GLU A1200 11.631 -0.227 -0.285 1.00 0.00 H new ATOM 0 HB2 GLU A1200 10.199 1.545 -2.315 1.00 0.00 H new ATOM 0 HB3 GLU A1200 10.540 -0.152 -2.591 1.00 0.00 H new ATOM 0 HG2 GLU A1200 8.823 0.941 -0.319 1.00 0.00 H new ATOM 0 HG3 GLU A1200 8.206 0.254 -1.808 1.00 0.00 H new ATOM 697 N LYS A1201 13.594 1.911 -1.503 1.00 0.00 N ATOM 698 CA LYS A1201 14.899 2.204 -2.136 1.00 0.00 C ATOM 699 C LYS A1201 14.776 2.450 -3.661 1.00 0.00 C ATOM 700 O LYS A1201 15.793 2.548 -4.353 1.00 0.00 O ATOM 701 CB LYS A1201 15.987 1.100 -1.809 1.00 0.00 C ATOM 702 CG LYS A1201 16.538 1.099 -0.352 1.00 0.00 C ATOM 703 CD LYS A1201 15.499 0.688 0.719 1.00 0.00 C ATOM 704 CE LYS A1201 15.096 -0.802 0.659 1.00 0.00 C ATOM 705 NZ LYS A1201 16.177 -1.692 1.143 1.00 0.00 N ATOM 0 H LYS A1201 13.292 2.646 -0.864 1.00 0.00 H new ATOM 0 HA LYS A1201 15.247 3.137 -1.693 1.00 0.00 H new ATOM 0 HB2 LYS A1201 15.556 0.120 -2.014 1.00 0.00 H new ATOM 0 HB3 LYS A1201 16.825 1.229 -2.494 1.00 0.00 H new ATOM 0 HG2 LYS A1201 17.388 0.419 -0.297 1.00 0.00 H new ATOM 0 HG3 LYS A1201 16.912 2.095 -0.116 1.00 0.00 H new ATOM 0 HD2 LYS A1201 15.905 0.905 1.707 1.00 0.00 H new ATOM 0 HD3 LYS A1201 14.606 1.301 0.599 1.00 0.00 H new ATOM 0 HE2 LYS A1201 14.201 -0.959 1.261 1.00 0.00 H new ATOM 0 HE3 LYS A1201 14.841 -1.067 -0.367 1.00 0.00 H new ATOM 0 HZ1 LYS A1201 15.864 -2.682 1.085 1.00 0.00 H new ATOM 0 HZ2 LYS A1201 17.024 -1.562 0.553 1.00 0.00 H new ATOM 0 HZ3 LYS A1201 16.403 -1.458 2.131 1.00 0.00 H new ATOM 719 N ASP A1202 13.538 2.624 -4.170 1.00 0.00 N ATOM 720 CA ASP A1202 13.291 2.835 -5.603 1.00 0.00 C ATOM 721 C ASP A1202 13.217 4.348 -5.882 1.00 0.00 C ATOM 722 O ASP A1202 12.137 4.956 -5.901 1.00 0.00 O ATOM 723 CB ASP A1202 12.003 2.085 -6.072 1.00 0.00 C ATOM 724 CG ASP A1202 12.040 1.728 -7.577 1.00 0.00 C ATOM 725 OD1 ASP A1202 12.020 2.640 -8.424 1.00 0.00 O ATOM 726 OD2 ASP A1202 12.152 0.534 -7.913 1.00 0.00 O ATOM 0 H ASP A1202 12.692 2.622 -3.601 1.00 0.00 H new ATOM 0 HA ASP A1202 14.115 2.416 -6.181 1.00 0.00 H new ATOM 0 HB2 ASP A1202 11.885 1.172 -5.488 1.00 0.00 H new ATOM 0 HB3 ASP A1202 11.131 2.707 -5.871 1.00 0.00 H new ATOM 731 N LEU A1203 14.409 4.945 -6.035 1.00 0.00 N ATOM 732 CA LEU A1203 14.579 6.372 -6.351 1.00 0.00 C ATOM 733 C LEU A1203 14.286 6.661 -7.832 1.00 0.00 C ATOM 734 O LEU A1203 14.208 7.826 -8.227 1.00 0.00 O ATOM 735 CB LEU A1203 16.008 6.838 -6.007 1.00 0.00 C ATOM 736 CG LEU A1203 16.416 6.760 -4.510 1.00 0.00 C ATOM 737 CD1 LEU A1203 17.895 7.158 -4.336 1.00 0.00 C ATOM 738 CD2 LEU A1203 15.479 7.626 -3.627 1.00 0.00 C ATOM 0 H LEU A1203 15.293 4.444 -5.942 1.00 0.00 H new ATOM 0 HA LEU A1203 13.863 6.926 -5.744 1.00 0.00 H new ATOM 0 HB2 LEU A1203 16.712 6.239 -6.585 1.00 0.00 H new ATOM 0 HB3 LEU A1203 16.120 7.870 -6.339 1.00 0.00 H new ATOM 0 HG LEU A1203 16.305 5.729 -4.175 1.00 0.00 H new ATOM 0 HD11 LEU A1203 18.166 7.099 -3.282 1.00 0.00 H new ATOM 0 HD12 LEU A1203 18.525 6.479 -4.912 1.00 0.00 H new ATOM 0 HD13 LEU A1203 18.042 8.178 -4.691 1.00 0.00 H new ATOM 0 HD21 LEU A1203 15.789 7.551 -2.585 1.00 0.00 H new ATOM 0 HD22 LEU A1203 15.535 8.666 -3.948 1.00 0.00 H new ATOM 0 HD23 LEU A1203 14.454 7.270 -3.727 1.00 0.00 H new ATOM 750 N GLU A1204 14.169 5.596 -8.646 1.00 0.00 N ATOM 751 CA GLU A1204 13.756 5.715 -10.048 1.00 0.00 C ATOM 752 C GLU A1204 12.273 6.119 -10.116 1.00 0.00 C ATOM 753 O GLU A1204 11.916 7.061 -10.819 1.00 0.00 O ATOM 754 CB GLU A1204 14.003 4.385 -10.805 1.00 0.00 C ATOM 755 CG GLU A1204 15.476 3.946 -10.867 1.00 0.00 C ATOM 756 CD GLU A1204 16.385 4.986 -11.537 1.00 0.00 C ATOM 757 OE1 GLU A1204 16.203 5.251 -12.746 1.00 0.00 O ATOM 758 OE2 GLU A1204 17.283 5.546 -10.868 1.00 0.00 O ATOM 0 H GLU A1204 14.357 4.638 -8.350 1.00 0.00 H new ATOM 0 HA GLU A1204 14.353 6.488 -10.532 1.00 0.00 H new ATOM 0 HB2 GLU A1204 13.423 3.597 -10.326 1.00 0.00 H new ATOM 0 HB3 GLU A1204 13.625 4.486 -11.822 1.00 0.00 H new ATOM 0 HG2 GLU A1204 15.835 3.755 -9.856 1.00 0.00 H new ATOM 0 HG3 GLU A1204 15.546 3.005 -11.413 1.00 0.00 H new ATOM 765 N LYS A1205 11.436 5.422 -9.330 1.00 0.00 N ATOM 766 CA LYS A1205 10.009 5.697 -9.203 1.00 0.00 C ATOM 767 C LYS A1205 9.784 7.048 -8.490 1.00 0.00 C ATOM 768 O LYS A1205 8.786 7.722 -8.748 1.00 0.00 O ATOM 769 CB LYS A1205 9.343 4.518 -8.447 1.00 0.00 C ATOM 770 CG LYS A1205 7.850 4.672 -8.135 1.00 0.00 C ATOM 771 CD LYS A1205 6.983 5.019 -9.364 1.00 0.00 C ATOM 772 CE LYS A1205 5.537 5.263 -8.963 1.00 0.00 C ATOM 773 NZ LYS A1205 4.902 4.033 -8.409 1.00 0.00 N ATOM 0 H LYS A1205 11.746 4.637 -8.757 1.00 0.00 H new ATOM 0 HA LYS A1205 9.549 5.781 -10.187 1.00 0.00 H new ATOM 0 HB2 LYS A1205 9.478 3.612 -9.038 1.00 0.00 H new ATOM 0 HB3 LYS A1205 9.876 4.368 -7.508 1.00 0.00 H new ATOM 0 HG2 LYS A1205 7.484 3.744 -7.696 1.00 0.00 H new ATOM 0 HG3 LYS A1205 7.725 5.452 -7.384 1.00 0.00 H new ATOM 0 HD2 LYS A1205 7.382 5.906 -9.855 1.00 0.00 H new ATOM 0 HD3 LYS A1205 7.031 4.205 -10.088 1.00 0.00 H new ATOM 0 HE2 LYS A1205 5.495 6.060 -8.221 1.00 0.00 H new ATOM 0 HE3 LYS A1205 4.972 5.605 -9.830 1.00 0.00 H new ATOM 0 HZ1 LYS A1205 4.314 4.285 -7.589 1.00 0.00 H new ATOM 0 HZ2 LYS A1205 4.307 3.591 -9.138 1.00 0.00 H new ATOM 0 HZ3 LYS A1205 5.641 3.364 -8.113 1.00 0.00 H new ATOM 787 N LEU A1206 10.731 7.431 -7.602 1.00 0.00 N ATOM 788 CA LEU A1206 10.747 8.774 -6.981 1.00 0.00 C ATOM 789 C LEU A1206 10.913 9.833 -8.083 1.00 0.00 C ATOM 790 O LEU A1206 10.085 10.724 -8.215 1.00 0.00 O ATOM 791 CB LEU A1206 11.888 8.867 -5.913 1.00 0.00 C ATOM 792 CG LEU A1206 11.939 10.135 -4.981 1.00 0.00 C ATOM 793 CD1 LEU A1206 12.484 11.386 -5.698 1.00 0.00 C ATOM 794 CD2 LEU A1206 10.566 10.420 -4.338 1.00 0.00 C ATOM 0 H LEU A1206 11.495 6.827 -7.300 1.00 0.00 H new ATOM 0 HA LEU A1206 9.805 8.956 -6.463 1.00 0.00 H new ATOM 0 HB2 LEU A1206 11.817 7.987 -5.273 1.00 0.00 H new ATOM 0 HB3 LEU A1206 12.841 8.803 -6.438 1.00 0.00 H new ATOM 0 HG LEU A1206 12.646 9.898 -4.186 1.00 0.00 H new ATOM 0 HD11 LEU A1206 12.495 12.227 -5.005 1.00 0.00 H new ATOM 0 HD12 LEU A1206 13.498 11.192 -6.049 1.00 0.00 H new ATOM 0 HD13 LEU A1206 11.845 11.625 -6.548 1.00 0.00 H new ATOM 0 HD21 LEU A1206 10.638 11.302 -3.701 1.00 0.00 H new ATOM 0 HD22 LEU A1206 9.828 10.597 -5.120 1.00 0.00 H new ATOM 0 HD23 LEU A1206 10.261 9.563 -3.738 1.00 0.00 H new ATOM 806 N ASP A1207 11.993 9.696 -8.860 1.00 0.00 N ATOM 807 CA ASP A1207 12.335 10.596 -9.984 1.00 0.00 C ATOM 808 C ASP A1207 11.127 10.793 -10.929 1.00 0.00 C ATOM 809 O ASP A1207 10.730 11.938 -11.237 1.00 0.00 O ATOM 810 CB ASP A1207 13.548 9.993 -10.744 1.00 0.00 C ATOM 811 CG ASP A1207 13.877 10.689 -12.081 1.00 0.00 C ATOM 812 OD1 ASP A1207 14.433 11.812 -12.066 1.00 0.00 O ATOM 813 OD2 ASP A1207 13.603 10.098 -13.158 1.00 0.00 O ATOM 0 H ASP A1207 12.671 8.945 -8.729 1.00 0.00 H new ATOM 0 HA ASP A1207 12.597 11.581 -9.598 1.00 0.00 H new ATOM 0 HB2 ASP A1207 14.425 10.041 -10.099 1.00 0.00 H new ATOM 0 HB3 ASP A1207 13.352 8.938 -10.937 1.00 0.00 H new ATOM 818 N LEU A1208 10.513 9.655 -11.305 1.00 0.00 N ATOM 819 CA LEU A1208 9.352 9.613 -12.202 1.00 0.00 C ATOM 820 C LEU A1208 8.135 10.317 -11.579 1.00 0.00 C ATOM 821 O LEU A1208 7.520 11.148 -12.230 1.00 0.00 O ATOM 822 CB LEU A1208 8.987 8.147 -12.569 1.00 0.00 C ATOM 823 CG LEU A1208 10.077 7.336 -13.337 1.00 0.00 C ATOM 824 CD1 LEU A1208 9.592 5.900 -13.635 1.00 0.00 C ATOM 825 CD2 LEU A1208 10.544 8.076 -14.614 1.00 0.00 C ATOM 0 H LEU A1208 10.815 8.733 -10.990 1.00 0.00 H new ATOM 0 HA LEU A1208 9.626 10.146 -13.112 1.00 0.00 H new ATOM 0 HB2 LEU A1208 8.748 7.613 -11.649 1.00 0.00 H new ATOM 0 HB3 LEU A1208 8.081 8.161 -13.174 1.00 0.00 H new ATOM 0 HG LEU A1208 10.951 7.252 -12.691 1.00 0.00 H new ATOM 0 HD11 LEU A1208 10.371 5.357 -14.171 1.00 0.00 H new ATOM 0 HD12 LEU A1208 9.372 5.389 -12.698 1.00 0.00 H new ATOM 0 HD13 LEU A1208 8.691 5.940 -14.247 1.00 0.00 H new ATOM 0 HD21 LEU A1208 11.303 7.481 -15.122 1.00 0.00 H new ATOM 0 HD22 LEU A1208 9.694 8.225 -15.280 1.00 0.00 H new ATOM 0 HD23 LEU A1208 10.965 9.044 -14.340 1.00 0.00 H new ATOM 837 N VAL A1209 7.823 10.011 -10.298 1.00 0.00 N ATOM 838 CA VAL A1209 6.604 10.540 -9.648 1.00 0.00 C ATOM 839 C VAL A1209 6.743 12.061 -9.383 1.00 0.00 C ATOM 840 O VAL A1209 5.771 12.788 -9.491 1.00 0.00 O ATOM 841 CB VAL A1209 6.217 9.756 -8.323 1.00 0.00 C ATOM 842 CG1 VAL A1209 7.137 10.101 -7.122 1.00 0.00 C ATOM 843 CG2 VAL A1209 4.719 9.953 -7.953 1.00 0.00 C ATOM 0 H VAL A1209 8.391 9.409 -9.702 1.00 0.00 H new ATOM 0 HA VAL A1209 5.780 10.381 -10.344 1.00 0.00 H new ATOM 0 HB VAL A1209 6.375 8.701 -8.545 1.00 0.00 H new ATOM 0 HG11 VAL A1209 6.821 9.533 -6.247 1.00 0.00 H new ATOM 0 HG12 VAL A1209 8.168 9.845 -7.368 1.00 0.00 H new ATOM 0 HG13 VAL A1209 7.069 11.167 -6.906 1.00 0.00 H new ATOM 0 HG21 VAL A1209 4.494 9.401 -7.041 1.00 0.00 H new ATOM 0 HG22 VAL A1209 4.520 11.013 -7.794 1.00 0.00 H new ATOM 0 HG23 VAL A1209 4.092 9.584 -8.765 1.00 0.00 H new ATOM 853 N ILE A1210 7.979 12.530 -9.100 1.00 0.00 N ATOM 854 CA ILE A1210 8.271 13.956 -8.840 1.00 0.00 C ATOM 855 C ILE A1210 8.045 14.797 -10.111 1.00 0.00 C ATOM 856 O ILE A1210 7.286 15.775 -10.080 1.00 0.00 O ATOM 857 CB ILE A1210 9.744 14.158 -8.295 1.00 0.00 C ATOM 858 CG1 ILE A1210 9.902 13.540 -6.864 1.00 0.00 C ATOM 859 CG2 ILE A1210 10.189 15.647 -8.313 1.00 0.00 C ATOM 860 CD1 ILE A1210 9.009 14.122 -5.779 1.00 0.00 C ATOM 0 H ILE A1210 8.802 11.930 -9.046 1.00 0.00 H new ATOM 0 HA ILE A1210 7.582 14.298 -8.068 1.00 0.00 H new ATOM 0 HB ILE A1210 10.407 13.625 -8.976 1.00 0.00 H new ATOM 0 HG12 ILE A1210 9.708 12.469 -6.930 1.00 0.00 H new ATOM 0 HG13 ILE A1210 10.940 13.657 -6.553 1.00 0.00 H new ATOM 0 HG21 ILE A1210 11.206 15.727 -7.929 1.00 0.00 H new ATOM 0 HG22 ILE A1210 10.156 16.024 -9.335 1.00 0.00 H new ATOM 0 HG23 ILE A1210 9.517 16.235 -7.687 1.00 0.00 H new ATOM 0 HD11 ILE A1210 9.208 13.616 -4.834 1.00 0.00 H new ATOM 0 HD12 ILE A1210 9.215 15.187 -5.671 1.00 0.00 H new ATOM 0 HD13 ILE A1210 7.964 13.981 -6.053 1.00 0.00 H new ATOM 872 N LYS A1211 8.683 14.388 -11.229 1.00 0.00 N ATOM 873 CA LYS A1211 8.565 15.117 -12.514 1.00 0.00 C ATOM 874 C LYS A1211 7.126 15.046 -13.059 1.00 0.00 C ATOM 875 O LYS A1211 6.608 16.028 -13.596 1.00 0.00 O ATOM 876 CB LYS A1211 9.572 14.581 -13.567 1.00 0.00 C ATOM 877 CG LYS A1211 9.354 13.116 -14.007 1.00 0.00 C ATOM 878 CD LYS A1211 10.432 12.595 -14.984 1.00 0.00 C ATOM 879 CE LYS A1211 11.847 12.640 -14.379 1.00 0.00 C ATOM 880 NZ LYS A1211 12.860 12.002 -15.250 1.00 0.00 N ATOM 0 H LYS A1211 9.281 13.563 -11.270 1.00 0.00 H new ATOM 0 HA LYS A1211 8.808 16.161 -12.319 1.00 0.00 H new ATOM 0 HB2 LYS A1211 9.523 15.219 -14.450 1.00 0.00 H new ATOM 0 HB3 LYS A1211 10.580 14.675 -13.162 1.00 0.00 H new ATOM 0 HG2 LYS A1211 9.339 12.479 -13.123 1.00 0.00 H new ATOM 0 HG3 LYS A1211 8.375 13.029 -14.479 1.00 0.00 H new ATOM 0 HD2 LYS A1211 10.195 11.570 -15.269 1.00 0.00 H new ATOM 0 HD3 LYS A1211 10.411 13.192 -15.896 1.00 0.00 H new ATOM 0 HE2 LYS A1211 12.129 13.678 -14.200 1.00 0.00 H new ATOM 0 HE3 LYS A1211 11.840 12.140 -13.410 1.00 0.00 H new ATOM 0 HZ1 LYS A1211 13.329 11.233 -14.731 1.00 0.00 H new ATOM 0 HZ2 LYS A1211 12.396 11.615 -16.097 1.00 0.00 H new ATOM 0 HZ3 LYS A1211 13.567 12.709 -15.535 1.00 0.00 H new ATOM 894 N TYR A1212 6.479 13.881 -12.862 1.00 0.00 N ATOM 895 CA TYR A1212 5.138 13.596 -13.389 1.00 0.00 C ATOM 896 C TYR A1212 4.099 14.466 -12.664 1.00 0.00 C ATOM 897 O TYR A1212 3.349 15.206 -13.304 1.00 0.00 O ATOM 898 CB TYR A1212 4.817 12.090 -13.223 1.00 0.00 C ATOM 899 CG TYR A1212 3.684 11.578 -14.112 1.00 0.00 C ATOM 900 CD1 TYR A1212 3.890 11.381 -15.478 1.00 0.00 C ATOM 901 CD2 TYR A1212 2.424 11.289 -13.603 1.00 0.00 C ATOM 902 CE1 TYR A1212 2.884 10.917 -16.293 1.00 0.00 C ATOM 903 CE2 TYR A1212 1.419 10.825 -14.419 1.00 0.00 C ATOM 904 CZ TYR A1212 1.652 10.641 -15.762 1.00 0.00 C ATOM 905 OH TYR A1212 0.649 10.166 -16.578 1.00 0.00 O ATOM 0 H TYR A1212 6.878 13.109 -12.329 1.00 0.00 H new ATOM 0 HA TYR A1212 5.104 13.837 -14.452 1.00 0.00 H new ATOM 0 HB2 TYR A1212 5.717 11.514 -13.437 1.00 0.00 H new ATOM 0 HB3 TYR A1212 4.558 11.900 -12.181 1.00 0.00 H new ATOM 0 HD1 TYR A1212 4.859 11.597 -15.904 1.00 0.00 H new ATOM 0 HD2 TYR A1212 2.231 11.431 -12.550 1.00 0.00 H new ATOM 0 HE1 TYR A1212 3.065 10.771 -17.348 1.00 0.00 H new ATOM 0 HE2 TYR A1212 0.446 10.605 -14.005 1.00 0.00 H new ATOM 0 HH TYR A1212 0.001 9.663 -16.041 1.00 0.00 H new ATOM 915 N MET A1213 4.118 14.406 -11.315 1.00 0.00 N ATOM 916 CA MET A1213 3.243 15.229 -10.459 1.00 0.00 C ATOM 917 C MET A1213 3.508 16.711 -10.675 1.00 0.00 C ATOM 918 O MET A1213 2.603 17.499 -10.557 1.00 0.00 O ATOM 919 CB MET A1213 3.410 14.907 -8.952 1.00 0.00 C ATOM 920 CG MET A1213 2.882 13.540 -8.530 1.00 0.00 C ATOM 921 SD MET A1213 3.028 13.266 -6.751 1.00 0.00 S ATOM 922 CE MET A1213 4.776 13.555 -6.422 1.00 0.00 C ATOM 0 H MET A1213 4.738 13.788 -10.793 1.00 0.00 H new ATOM 0 HA MET A1213 2.221 14.985 -10.751 1.00 0.00 H new ATOM 0 HB2 MET A1213 4.468 14.967 -8.697 1.00 0.00 H new ATOM 0 HB3 MET A1213 2.898 15.674 -8.372 1.00 0.00 H new ATOM 0 HG2 MET A1213 1.836 13.451 -8.824 1.00 0.00 H new ATOM 0 HG3 MET A1213 3.430 12.762 -9.061 1.00 0.00 H new ATOM 0 HE1 MET A1213 5.003 13.277 -5.393 1.00 0.00 H new ATOM 0 HE2 MET A1213 5.379 12.953 -7.102 1.00 0.00 H new ATOM 0 HE3 MET A1213 5.005 14.610 -6.572 1.00 0.00 H new ATOM 932 N LYS A1214 4.756 17.084 -10.979 1.00 0.00 N ATOM 933 CA LYS A1214 5.097 18.488 -11.252 1.00 0.00 C ATOM 934 C LYS A1214 4.329 18.988 -12.484 1.00 0.00 C ATOM 935 O LYS A1214 3.684 20.032 -12.433 1.00 0.00 O ATOM 936 CB LYS A1214 6.621 18.651 -11.429 1.00 0.00 C ATOM 937 CG LYS A1214 7.089 20.106 -11.640 1.00 0.00 C ATOM 938 CD LYS A1214 8.622 20.257 -11.554 1.00 0.00 C ATOM 939 CE LYS A1214 9.368 19.353 -12.547 1.00 0.00 C ATOM 940 NZ LYS A1214 10.817 19.629 -12.547 1.00 0.00 N ATOM 0 H LYS A1214 5.544 16.439 -11.042 1.00 0.00 H new ATOM 0 HA LYS A1214 4.799 19.098 -10.399 1.00 0.00 H new ATOM 0 HB2 LYS A1214 7.121 18.246 -10.550 1.00 0.00 H new ATOM 0 HB3 LYS A1214 6.941 18.053 -12.282 1.00 0.00 H new ATOM 0 HG2 LYS A1214 6.748 20.455 -12.614 1.00 0.00 H new ATOM 0 HG3 LYS A1214 6.622 20.746 -10.891 1.00 0.00 H new ATOM 0 HD2 LYS A1214 8.891 21.296 -11.744 1.00 0.00 H new ATOM 0 HD3 LYS A1214 8.949 20.023 -10.541 1.00 0.00 H new ATOM 0 HE2 LYS A1214 9.196 18.308 -12.289 1.00 0.00 H new ATOM 0 HE3 LYS A1214 8.968 19.504 -13.550 1.00 0.00 H new ATOM 0 HZ1 LYS A1214 11.290 19.001 -13.228 1.00 0.00 H new ATOM 0 HZ2 LYS A1214 10.982 20.620 -12.817 1.00 0.00 H new ATOM 0 HZ3 LYS A1214 11.202 19.461 -11.596 1.00 0.00 H new ATOM 954 N ARG A1215 4.341 18.174 -13.554 1.00 0.00 N ATOM 955 CA ARG A1215 3.590 18.456 -14.795 1.00 0.00 C ATOM 956 C ARG A1215 2.084 18.629 -14.502 1.00 0.00 C ATOM 957 O ARG A1215 1.490 19.618 -14.910 1.00 0.00 O ATOM 958 CB ARG A1215 3.819 17.314 -15.823 1.00 0.00 C ATOM 959 CG ARG A1215 5.298 17.142 -16.229 1.00 0.00 C ATOM 960 CD ARG A1215 5.570 15.893 -17.082 1.00 0.00 C ATOM 961 NE ARG A1215 7.013 15.759 -17.380 1.00 0.00 N ATOM 962 CZ ARG A1215 7.594 14.701 -17.960 1.00 0.00 C ATOM 963 NH1 ARG A1215 6.882 13.651 -18.341 1.00 0.00 N ATOM 964 NH2 ARG A1215 8.898 14.714 -18.184 1.00 0.00 N ATOM 0 H ARG A1215 4.870 17.303 -13.585 1.00 0.00 H new ATOM 0 HA ARG A1215 3.957 19.391 -15.218 1.00 0.00 H new ATOM 0 HB2 ARG A1215 3.454 16.377 -15.401 1.00 0.00 H new ATOM 0 HB3 ARG A1215 3.226 17.514 -16.715 1.00 0.00 H new ATOM 0 HG2 ARG A1215 5.617 18.025 -16.783 1.00 0.00 H new ATOM 0 HG3 ARG A1215 5.909 17.094 -15.327 1.00 0.00 H new ATOM 0 HD2 ARG A1215 5.220 15.005 -16.555 1.00 0.00 H new ATOM 0 HD3 ARG A1215 5.007 15.954 -18.013 1.00 0.00 H new ATOM 0 HE ARG A1215 7.617 16.539 -17.122 1.00 0.00 H new ATOM 0 HH11 ARG A1215 5.873 13.639 -18.194 1.00 0.00 H new ATOM 0 HH12 ARG A1215 7.343 12.855 -18.781 1.00 0.00 H new ATOM 0 HH21 ARG A1215 9.454 15.526 -17.915 1.00 0.00 H new ATOM 0 HH22 ARG A1215 9.348 13.912 -18.625 1.00 0.00 H new ATOM 978 N LEU A1216 1.513 17.689 -13.724 1.00 0.00 N ATOM 979 CA LEU A1216 0.049 17.607 -13.487 1.00 0.00 C ATOM 980 C LEU A1216 -0.458 18.687 -12.503 1.00 0.00 C ATOM 981 O LEU A1216 -1.490 19.306 -12.734 1.00 0.00 O ATOM 982 CB LEU A1216 -0.314 16.212 -12.933 1.00 0.00 C ATOM 983 CG LEU A1216 0.238 14.995 -13.714 1.00 0.00 C ATOM 984 CD1 LEU A1216 -0.059 13.696 -12.952 1.00 0.00 C ATOM 985 CD2 LEU A1216 -0.287 14.960 -15.166 1.00 0.00 C ATOM 0 H LEU A1216 2.046 16.966 -13.242 1.00 0.00 H new ATOM 0 HA LEU A1216 -0.437 17.779 -14.447 1.00 0.00 H new ATOM 0 HB2 LEU A1216 0.044 16.149 -11.905 1.00 0.00 H new ATOM 0 HB3 LEU A1216 -1.400 16.131 -12.898 1.00 0.00 H new ATOM 0 HG LEU A1216 1.321 15.096 -13.788 1.00 0.00 H new ATOM 0 HD11 LEU A1216 0.334 12.848 -13.512 1.00 0.00 H new ATOM 0 HD12 LEU A1216 0.414 13.734 -11.971 1.00 0.00 H new ATOM 0 HD13 LEU A1216 -1.136 13.583 -12.832 1.00 0.00 H new ATOM 0 HD21 LEU A1216 0.123 14.091 -15.680 1.00 0.00 H new ATOM 0 HD22 LEU A1216 -1.375 14.896 -15.158 1.00 0.00 H new ATOM 0 HD23 LEU A1216 0.020 15.868 -15.686 1.00 0.00 H new ATOM 997 N MET A1217 0.252 18.838 -11.378 1.00 0.00 N ATOM 998 CA MET A1217 -0.090 19.805 -10.307 1.00 0.00 C ATOM 999 C MET A1217 0.091 21.259 -10.780 1.00 0.00 C ATOM 1000 O MET A1217 -0.599 22.150 -10.300 1.00 0.00 O ATOM 1001 CB MET A1217 0.781 19.566 -9.052 1.00 0.00 C ATOM 1002 CG MET A1217 0.591 18.213 -8.338 1.00 0.00 C ATOM 1003 SD MET A1217 -0.991 18.058 -7.487 1.00 0.00 S ATOM 1004 CE MET A1217 -0.743 16.550 -6.544 1.00 0.00 C ATOM 0 H MET A1217 1.089 18.291 -11.176 1.00 0.00 H new ATOM 0 HA MET A1217 -1.139 19.647 -10.056 1.00 0.00 H new ATOM 0 HB2 MET A1217 1.828 19.657 -9.340 1.00 0.00 H new ATOM 0 HB3 MET A1217 0.576 20.362 -8.337 1.00 0.00 H new ATOM 0 HG2 MET A1217 0.680 17.410 -9.070 1.00 0.00 H new ATOM 0 HG3 MET A1217 1.397 18.077 -7.616 1.00 0.00 H new ATOM 0 HE1 MET A1217 -1.670 16.281 -6.038 1.00 0.00 H new ATOM 0 HE2 MET A1217 -0.450 15.744 -7.217 1.00 0.00 H new ATOM 0 HE3 MET A1217 0.042 16.708 -5.804 1.00 0.00 H new ATOM 1014 N GLN A1218 1.064 21.498 -11.688 1.00 0.00 N ATOM 1015 CA GLN A1218 1.283 22.843 -12.280 1.00 0.00 C ATOM 1016 C GLN A1218 0.429 23.025 -13.556 1.00 0.00 C ATOM 1017 O GLN A1218 0.254 24.153 -14.033 1.00 0.00 O ATOM 1018 CB GLN A1218 2.794 23.092 -12.556 1.00 0.00 C ATOM 1019 CG GLN A1218 3.718 22.896 -11.319 1.00 0.00 C ATOM 1020 CD GLN A1218 3.370 23.773 -10.107 1.00 0.00 C ATOM 1021 OE1 GLN A1218 2.497 23.277 -9.228 1.00 0.00 O flip ATOM 1022 NE2 GLN A1218 3.885 24.883 -9.958 1.00 0.00 N flip ATOM 0 H GLN A1218 1.708 20.783 -12.027 1.00 0.00 H new ATOM 0 HA GLN A1218 0.959 23.593 -11.558 1.00 0.00 H new ATOM 0 HB2 GLN A1218 3.121 22.419 -13.348 1.00 0.00 H new ATOM 0 HB3 GLN A1218 2.919 24.108 -12.930 1.00 0.00 H new ATOM 0 HG2 GLN A1218 3.678 21.850 -11.016 1.00 0.00 H new ATOM 0 HG3 GLN A1218 4.746 23.103 -11.615 1.00 0.00 H new ATOM 0 HE21 GLN A1218 4.549 25.234 -10.648 1.00 0.00 H new ATOM 0 HE22 GLN A1218 3.647 25.451 -9.145 1.00 0.00 H new ATOM 1031 N GLN A1219 -0.082 21.898 -14.112 1.00 0.00 N ATOM 1032 CA GLN A1219 -1.152 21.912 -15.142 1.00 0.00 C ATOM 1033 C GLN A1219 -2.436 22.447 -14.500 1.00 0.00 C ATOM 1034 O GLN A1219 -3.157 23.268 -15.076 1.00 0.00 O ATOM 1035 CB GLN A1219 -1.396 20.481 -15.706 1.00 0.00 C ATOM 1036 CG GLN A1219 -2.400 20.375 -16.871 1.00 0.00 C ATOM 1037 CD GLN A1219 -1.938 21.117 -18.127 1.00 0.00 C ATOM 1038 OE1 GLN A1219 -2.272 22.283 -18.335 1.00 0.00 O ATOM 1039 NE2 GLN A1219 -1.137 20.455 -18.955 1.00 0.00 N ATOM 0 H GLN A1219 0.233 20.961 -13.862 1.00 0.00 H new ATOM 0 HA GLN A1219 -0.849 22.552 -15.971 1.00 0.00 H new ATOM 0 HB2 GLN A1219 -0.440 20.075 -16.038 1.00 0.00 H new ATOM 0 HB3 GLN A1219 -1.746 19.846 -14.892 1.00 0.00 H new ATOM 0 HG2 GLN A1219 -2.557 19.324 -17.114 1.00 0.00 H new ATOM 0 HG3 GLN A1219 -3.362 20.776 -16.552 1.00 0.00 H new ATOM 0 HE21 GLN A1219 -0.880 19.489 -18.752 1.00 0.00 H new ATOM 0 HE22 GLN A1219 -0.779 20.913 -19.793 1.00 0.00 H new ATOM 1048 N SER A1220 -2.696 21.947 -13.289 1.00 0.00 N ATOM 1049 CA SER A1220 -3.765 22.419 -12.423 1.00 0.00 C ATOM 1050 C SER A1220 -3.318 23.732 -11.748 1.00 0.00 C ATOM 1051 O SER A1220 -2.817 23.741 -10.618 1.00 0.00 O ATOM 1052 CB SER A1220 -4.098 21.319 -11.400 1.00 0.00 C ATOM 1053 OG SER A1220 -4.404 20.091 -12.049 1.00 0.00 O ATOM 0 H SER A1220 -2.154 21.186 -12.880 1.00 0.00 H new ATOM 0 HA SER A1220 -4.671 22.630 -12.991 1.00 0.00 H new ATOM 0 HB2 SER A1220 -3.253 21.177 -10.726 1.00 0.00 H new ATOM 0 HB3 SER A1220 -4.944 21.631 -10.788 1.00 0.00 H new ATOM 0 HG SER A1220 -3.576 19.675 -12.370 1.00 0.00 H new ATOM 1059 N VAL A1221 -3.495 24.849 -12.484 1.00 0.00 N ATOM 1060 CA VAL A1221 -2.984 26.187 -12.104 1.00 0.00 C ATOM 1061 C VAL A1221 -3.739 26.806 -10.901 1.00 0.00 C ATOM 1062 O VAL A1221 -3.452 27.946 -10.503 1.00 0.00 O ATOM 1063 CB VAL A1221 -3.034 27.171 -13.335 1.00 0.00 C ATOM 1064 CG1 VAL A1221 -2.196 26.623 -14.520 1.00 0.00 C ATOM 1065 CG2 VAL A1221 -4.495 27.469 -13.774 1.00 0.00 C ATOM 0 H VAL A1221 -4.002 24.849 -13.369 1.00 0.00 H new ATOM 0 HA VAL A1221 -1.950 26.043 -11.792 1.00 0.00 H new ATOM 0 HB VAL A1221 -2.592 28.115 -13.016 1.00 0.00 H new ATOM 0 HG11 VAL A1221 -2.248 27.321 -15.356 1.00 0.00 H new ATOM 0 HG12 VAL A1221 -1.158 26.506 -14.208 1.00 0.00 H new ATOM 0 HG13 VAL A1221 -2.593 25.656 -14.830 1.00 0.00 H new ATOM 0 HG21 VAL A1221 -4.487 28.151 -14.625 1.00 0.00 H new ATOM 0 HG22 VAL A1221 -4.986 26.539 -14.059 1.00 0.00 H new ATOM 0 HG23 VAL A1221 -5.037 27.927 -12.947 1.00 0.00 H new ATOM 1075 N GLU A1222 -4.711 26.054 -10.352 1.00 0.00 N ATOM 1076 CA GLU A1222 -5.421 26.411 -9.122 1.00 0.00 C ATOM 1077 C GLU A1222 -4.447 26.459 -7.933 1.00 0.00 C ATOM 1078 O GLU A1222 -3.552 25.601 -7.822 1.00 0.00 O ATOM 1079 CB GLU A1222 -6.556 25.393 -8.847 1.00 0.00 C ATOM 1080 CG GLU A1222 -7.583 25.270 -9.986 1.00 0.00 C ATOM 1081 CD GLU A1222 -8.733 24.300 -9.675 1.00 0.00 C ATOM 1082 OE1 GLU A1222 -8.592 23.088 -9.940 1.00 0.00 O ATOM 1083 OE2 GLU A1222 -9.786 24.748 -9.180 1.00 0.00 O ATOM 0 H GLU A1222 -5.025 25.173 -10.759 1.00 0.00 H new ATOM 0 HA GLU A1222 -5.860 27.401 -9.248 1.00 0.00 H new ATOM 0 HB2 GLU A1222 -6.114 24.414 -8.664 1.00 0.00 H new ATOM 0 HB3 GLU A1222 -7.076 25.683 -7.934 1.00 0.00 H new ATOM 0 HG2 GLU A1222 -7.997 26.256 -10.198 1.00 0.00 H new ATOM 0 HG3 GLU A1222 -7.073 24.937 -10.890 1.00 0.00 H new ATOM 1090 N SER A1223 -4.649 27.458 -7.056 1.00 0.00 N ATOM 1091 CA SER A1223 -3.791 27.711 -5.892 1.00 0.00 C ATOM 1092 C SER A1223 -3.707 26.480 -4.972 1.00 0.00 C ATOM 1093 O SER A1223 -2.639 26.175 -4.454 1.00 0.00 O ATOM 1094 CB SER A1223 -4.322 28.925 -5.107 1.00 0.00 C ATOM 1095 OG SER A1223 -4.472 30.057 -5.950 1.00 0.00 O ATOM 0 H SER A1223 -5.422 28.118 -7.139 1.00 0.00 H new ATOM 0 HA SER A1223 -2.785 27.923 -6.254 1.00 0.00 H new ATOM 0 HB2 SER A1223 -5.282 28.677 -4.654 1.00 0.00 H new ATOM 0 HB3 SER A1223 -3.637 29.163 -4.293 1.00 0.00 H new ATOM 0 HG SER A1223 -4.812 30.812 -5.426 1.00 0.00 H new ATOM 1101 N VAL A1224 -4.840 25.765 -4.820 1.00 0.00 N ATOM 1102 CA VAL A1224 -4.936 24.579 -3.949 1.00 0.00 C ATOM 1103 C VAL A1224 -3.985 23.448 -4.410 1.00 0.00 C ATOM 1104 O VAL A1224 -3.305 22.842 -3.586 1.00 0.00 O ATOM 1105 CB VAL A1224 -6.417 24.058 -3.844 1.00 0.00 C ATOM 1106 CG1 VAL A1224 -6.994 23.643 -5.225 1.00 0.00 C ATOM 1107 CG2 VAL A1224 -6.533 22.911 -2.810 1.00 0.00 C ATOM 0 H VAL A1224 -5.712 25.994 -5.297 1.00 0.00 H new ATOM 0 HA VAL A1224 -4.619 24.891 -2.954 1.00 0.00 H new ATOM 0 HB VAL A1224 -7.025 24.890 -3.490 1.00 0.00 H new ATOM 0 HG11 VAL A1224 -8.018 23.291 -5.100 1.00 0.00 H new ATOM 0 HG12 VAL A1224 -6.985 24.502 -5.896 1.00 0.00 H new ATOM 0 HG13 VAL A1224 -6.385 22.845 -5.649 1.00 0.00 H new ATOM 0 HG21 VAL A1224 -7.567 22.571 -2.759 1.00 0.00 H new ATOM 0 HG22 VAL A1224 -5.893 22.082 -3.113 1.00 0.00 H new ATOM 0 HG23 VAL A1224 -6.221 23.272 -1.830 1.00 0.00 H new ATOM 1117 N TRP A1225 -3.915 23.214 -5.736 1.00 0.00 N ATOM 1118 CA TRP A1225 -3.059 22.163 -6.331 1.00 0.00 C ATOM 1119 C TRP A1225 -1.584 22.562 -6.301 1.00 0.00 C ATOM 1120 O TRP A1225 -0.715 21.709 -6.134 1.00 0.00 O ATOM 1121 CB TRP A1225 -3.476 21.876 -7.785 1.00 0.00 C ATOM 1122 CG TRP A1225 -4.781 21.131 -7.916 1.00 0.00 C ATOM 1123 CD1 TRP A1225 -6.003 21.636 -8.245 1.00 0.00 C ATOM 1124 CD2 TRP A1225 -4.973 19.727 -7.722 1.00 0.00 C ATOM 1125 NE1 TRP A1225 -6.928 20.637 -8.294 1.00 0.00 N ATOM 1126 CE2 TRP A1225 -6.323 19.457 -7.968 1.00 0.00 C ATOM 1127 CE3 TRP A1225 -4.131 18.672 -7.368 1.00 0.00 C ATOM 1128 CZ2 TRP A1225 -6.846 18.177 -7.883 1.00 0.00 C ATOM 1129 CZ3 TRP A1225 -4.655 17.403 -7.274 1.00 0.00 C ATOM 1130 CH2 TRP A1225 -6.009 17.165 -7.530 1.00 0.00 C ATOM 0 H TRP A1225 -4.448 23.746 -6.424 1.00 0.00 H new ATOM 0 HA TRP A1225 -3.192 21.263 -5.731 1.00 0.00 H new ATOM 0 HB2 TRP A1225 -3.554 22.821 -8.323 1.00 0.00 H new ATOM 0 HB3 TRP A1225 -2.690 21.298 -8.270 1.00 0.00 H new ATOM 0 HD1 TRP A1225 -6.209 22.678 -8.439 1.00 0.00 H new ATOM 0 HE1 TRP A1225 -7.912 20.752 -8.535 1.00 0.00 H new ATOM 0 HE3 TRP A1225 -3.084 18.849 -7.171 1.00 0.00 H new ATOM 0 HZ2 TRP A1225 -7.889 17.988 -8.091 1.00 0.00 H new ATOM 0 HZ3 TRP A1225 -4.012 16.580 -6.999 1.00 0.00 H new ATOM 0 HH2 TRP A1225 -6.397 16.160 -7.446 1.00 0.00 H new ATOM 1141 N ASN A1226 -1.330 23.864 -6.491 1.00 0.00 N ATOM 1142 CA ASN A1226 0.029 24.428 -6.511 1.00 0.00 C ATOM 1143 C ASN A1226 0.670 24.355 -5.110 1.00 0.00 C ATOM 1144 O ASN A1226 1.831 23.965 -4.967 1.00 0.00 O ATOM 1145 CB ASN A1226 -0.017 25.892 -7.011 1.00 0.00 C ATOM 1146 CG ASN A1226 1.374 26.471 -7.261 1.00 0.00 C ATOM 1147 OD1 ASN A1226 1.895 26.260 -8.460 1.00 0.00 O flip ATOM 1148 ND2 ASN A1226 1.981 27.086 -6.382 1.00 0.00 N flip ATOM 0 H ASN A1226 -2.063 24.559 -6.636 1.00 0.00 H new ATOM 0 HA ASN A1226 0.642 23.840 -7.194 1.00 0.00 H new ATOM 0 HB2 ASN A1226 -0.597 25.939 -7.933 1.00 0.00 H new ATOM 0 HB3 ASN A1226 -0.536 26.507 -6.276 1.00 0.00 H new ATOM 0 HD21 ASN A1226 1.549 27.230 -5.469 1.00 0.00 H new ATOM 0 HD22 ASN A1226 2.915 27.451 -6.567 1.00 0.00 H new ATOM 1155 N MET A1227 -0.122 24.724 -4.085 1.00 0.00 N ATOM 1156 CA MET A1227 0.305 24.689 -2.671 1.00 0.00 C ATOM 1157 C MET A1227 0.417 23.243 -2.182 1.00 0.00 C ATOM 1158 O MET A1227 1.330 22.916 -1.420 1.00 0.00 O ATOM 1159 CB MET A1227 -0.680 25.476 -1.772 1.00 0.00 C ATOM 1160 CG MET A1227 -0.732 26.986 -2.035 1.00 0.00 C ATOM 1161 SD MET A1227 -1.856 27.850 -0.911 1.00 0.00 S ATOM 1162 CE MET A1227 -3.436 27.067 -1.256 1.00 0.00 C ATOM 0 H MET A1227 -1.078 25.056 -4.213 1.00 0.00 H new ATOM 0 HA MET A1227 1.284 25.163 -2.606 1.00 0.00 H new ATOM 0 HB2 MET A1227 -1.680 25.064 -1.907 1.00 0.00 H new ATOM 0 HB3 MET A1227 -0.406 25.313 -0.730 1.00 0.00 H new ATOM 0 HG2 MET A1227 0.270 27.403 -1.933 1.00 0.00 H new ATOM 0 HG3 MET A1227 -1.047 27.161 -3.064 1.00 0.00 H new ATOM 0 HE1 MET A1227 -4.225 27.582 -0.707 1.00 0.00 H new ATOM 0 HE2 MET A1227 -3.643 27.121 -2.325 1.00 0.00 H new ATOM 0 HE3 MET A1227 -3.400 26.023 -0.945 1.00 0.00 H new ATOM 1172 N ALA A1228 -0.533 22.392 -2.634 1.00 0.00 N ATOM 1173 CA ALA A1228 -0.536 20.948 -2.330 1.00 0.00 C ATOM 1174 C ALA A1228 0.745 20.309 -2.863 1.00 0.00 C ATOM 1175 O ALA A1228 1.403 19.571 -2.155 1.00 0.00 O ATOM 1176 CB ALA A1228 -1.767 20.240 -2.923 1.00 0.00 C ATOM 0 H ALA A1228 -1.315 22.689 -3.218 1.00 0.00 H new ATOM 0 HA ALA A1228 -0.583 20.833 -1.247 1.00 0.00 H new ATOM 0 HB1 ALA A1228 -1.730 19.179 -2.676 1.00 0.00 H new ATOM 0 HB2 ALA A1228 -2.674 20.678 -2.507 1.00 0.00 H new ATOM 0 HB3 ALA A1228 -1.769 20.361 -4.006 1.00 0.00 H new ATOM 1182 N PHE A1229 1.102 20.657 -4.111 1.00 0.00 N ATOM 1183 CA PHE A1229 2.343 20.198 -4.755 1.00 0.00 C ATOM 1184 C PHE A1229 3.569 20.622 -3.940 1.00 0.00 C ATOM 1185 O PHE A1229 4.403 19.799 -3.611 1.00 0.00 O ATOM 1186 CB PHE A1229 2.468 20.764 -6.188 1.00 0.00 C ATOM 1187 CG PHE A1229 3.806 20.447 -6.863 1.00 0.00 C ATOM 1188 CD1 PHE A1229 4.185 19.127 -7.121 1.00 0.00 C ATOM 1189 CD2 PHE A1229 4.702 21.464 -7.199 1.00 0.00 C ATOM 1190 CE1 PHE A1229 5.406 18.840 -7.693 1.00 0.00 C ATOM 1191 CE2 PHE A1229 5.920 21.174 -7.778 1.00 0.00 C ATOM 1192 CZ PHE A1229 6.274 19.865 -8.018 1.00 0.00 C ATOM 0 H PHE A1229 0.536 21.266 -4.702 1.00 0.00 H new ATOM 0 HA PHE A1229 2.300 19.110 -4.804 1.00 0.00 H new ATOM 0 HB2 PHE A1229 1.659 20.363 -6.799 1.00 0.00 H new ATOM 0 HB3 PHE A1229 2.336 21.845 -6.154 1.00 0.00 H new ATOM 0 HD1 PHE A1229 3.512 18.321 -6.869 1.00 0.00 H new ATOM 0 HD2 PHE A1229 4.438 22.493 -7.003 1.00 0.00 H new ATOM 0 HE1 PHE A1229 5.684 17.815 -7.887 1.00 0.00 H new ATOM 0 HE2 PHE A1229 6.596 21.974 -8.043 1.00 0.00 H new ATOM 0 HZ PHE A1229 7.232 19.639 -8.461 1.00 0.00 H new ATOM 1202 N ASP A1230 3.636 21.921 -3.630 1.00 0.00 N ATOM 1203 CA ASP A1230 4.765 22.537 -2.908 1.00 0.00 C ATOM 1204 C ASP A1230 4.956 21.888 -1.517 1.00 0.00 C ATOM 1205 O ASP A1230 6.087 21.695 -1.061 1.00 0.00 O ATOM 1206 CB ASP A1230 4.517 24.065 -2.792 1.00 0.00 C ATOM 1207 CG ASP A1230 5.687 24.835 -2.153 1.00 0.00 C ATOM 1208 OD1 ASP A1230 6.694 25.080 -2.848 1.00 0.00 O ATOM 1209 OD2 ASP A1230 5.603 25.199 -0.962 1.00 0.00 O ATOM 0 H ASP A1230 2.902 22.586 -3.874 1.00 0.00 H new ATOM 0 HA ASP A1230 5.687 22.368 -3.465 1.00 0.00 H new ATOM 0 HB2 ASP A1230 4.327 24.470 -3.786 1.00 0.00 H new ATOM 0 HB3 ASP A1230 3.617 24.234 -2.201 1.00 0.00 H new ATOM 1214 N PHE A1231 3.830 21.501 -0.897 1.00 0.00 N ATOM 1215 CA PHE A1231 3.800 20.862 0.429 1.00 0.00 C ATOM 1216 C PHE A1231 4.292 19.407 0.338 1.00 0.00 C ATOM 1217 O PHE A1231 5.237 19.032 1.022 1.00 0.00 O ATOM 1218 CB PHE A1231 2.357 20.914 0.997 1.00 0.00 C ATOM 1219 CG PHE A1231 2.214 20.391 2.423 1.00 0.00 C ATOM 1220 CD1 PHE A1231 2.602 21.179 3.508 1.00 0.00 C ATOM 1221 CD2 PHE A1231 1.690 19.119 2.690 1.00 0.00 C ATOM 1222 CE1 PHE A1231 2.472 20.719 4.806 1.00 0.00 C ATOM 1223 CE2 PHE A1231 1.560 18.661 3.991 1.00 0.00 C ATOM 1224 CZ PHE A1231 1.951 19.461 5.048 1.00 0.00 C ATOM 0 H PHE A1231 2.904 21.624 -1.307 1.00 0.00 H new ATOM 0 HA PHE A1231 4.467 21.403 1.100 1.00 0.00 H new ATOM 0 HB2 PHE A1231 2.006 21.945 0.966 1.00 0.00 H new ATOM 0 HB3 PHE A1231 1.703 20.335 0.345 1.00 0.00 H new ATOM 0 HD1 PHE A1231 3.010 22.163 3.331 1.00 0.00 H new ATOM 0 HD2 PHE A1231 1.383 18.487 1.870 1.00 0.00 H new ATOM 0 HE1 PHE A1231 2.778 21.344 5.632 1.00 0.00 H new ATOM 0 HE2 PHE A1231 1.153 17.679 4.179 1.00 0.00 H new ATOM 0 HZ PHE A1231 1.850 19.104 6.062 1.00 0.00 H new ATOM 1234 N ILE A1232 3.634 18.611 -0.529 1.00 0.00 N ATOM 1235 CA ILE A1232 3.969 17.187 -0.767 1.00 0.00 C ATOM 1236 C ILE A1232 5.452 17.038 -1.133 1.00 0.00 C ATOM 1237 O ILE A1232 6.169 16.243 -0.531 1.00 0.00 O ATOM 1238 CB ILE A1232 3.079 16.570 -1.917 1.00 0.00 C ATOM 1239 CG1 ILE A1232 1.567 16.562 -1.518 1.00 0.00 C ATOM 1240 CG2 ILE A1232 3.551 15.143 -2.315 1.00 0.00 C ATOM 1241 CD1 ILE A1232 0.604 16.231 -2.657 1.00 0.00 C ATOM 0 H ILE A1232 2.848 18.939 -1.090 1.00 0.00 H new ATOM 0 HA ILE A1232 3.766 16.645 0.157 1.00 0.00 H new ATOM 0 HB ILE A1232 3.199 17.210 -2.791 1.00 0.00 H new ATOM 0 HG12 ILE A1232 1.421 15.838 -0.716 1.00 0.00 H new ATOM 0 HG13 ILE A1232 1.307 17.541 -1.115 1.00 0.00 H new ATOM 0 HG21 ILE A1232 2.912 14.756 -3.109 1.00 0.00 H new ATOM 0 HG22 ILE A1232 4.581 15.186 -2.668 1.00 0.00 H new ATOM 0 HG23 ILE A1232 3.491 14.485 -1.448 1.00 0.00 H new ATOM 0 HD11 ILE A1232 -0.420 16.249 -2.284 1.00 0.00 H new ATOM 0 HD12 ILE A1232 0.714 16.968 -3.452 1.00 0.00 H new ATOM 0 HD13 ILE A1232 0.830 15.239 -3.048 1.00 0.00 H new ATOM 1253 N LEU A1233 5.876 17.863 -2.100 1.00 0.00 N ATOM 1254 CA LEU A1233 7.248 17.899 -2.606 1.00 0.00 C ATOM 1255 C LEU A1233 8.212 18.177 -1.442 1.00 0.00 C ATOM 1256 O LEU A1233 9.121 17.408 -1.220 1.00 0.00 O ATOM 1257 CB LEU A1233 7.408 18.983 -3.714 1.00 0.00 C ATOM 1258 CG LEU A1233 8.661 18.842 -4.638 1.00 0.00 C ATOM 1259 CD1 LEU A1233 8.500 17.652 -5.599 1.00 0.00 C ATOM 1260 CD2 LEU A1233 8.946 20.150 -5.410 1.00 0.00 C ATOM 0 H LEU A1233 5.261 18.535 -2.559 1.00 0.00 H new ATOM 0 HA LEU A1233 7.484 16.932 -3.051 1.00 0.00 H new ATOM 0 HB2 LEU A1233 6.516 18.967 -4.341 1.00 0.00 H new ATOM 0 HB3 LEU A1233 7.444 19.961 -3.234 1.00 0.00 H new ATOM 0 HG LEU A1233 9.524 18.647 -4.001 1.00 0.00 H new ATOM 0 HD11 LEU A1233 9.384 17.573 -6.232 1.00 0.00 H new ATOM 0 HD12 LEU A1233 8.383 16.733 -5.024 1.00 0.00 H new ATOM 0 HD13 LEU A1233 7.619 17.805 -6.223 1.00 0.00 H new ATOM 0 HD21 LEU A1233 9.824 20.015 -6.042 1.00 0.00 H new ATOM 0 HD22 LEU A1233 8.086 20.400 -6.031 1.00 0.00 H new ATOM 0 HD23 LEU A1233 9.129 20.958 -4.702 1.00 0.00 H new ATOM 1272 N ASP A1234 7.923 19.239 -0.655 1.00 0.00 N ATOM 1273 CA ASP A1234 8.747 19.638 0.515 1.00 0.00 C ATOM 1274 C ASP A1234 8.975 18.459 1.487 1.00 0.00 C ATOM 1275 O ASP A1234 10.114 18.129 1.801 1.00 0.00 O ATOM 1276 CB ASP A1234 8.078 20.812 1.274 1.00 0.00 C ATOM 1277 CG ASP A1234 8.863 21.251 2.529 1.00 0.00 C ATOM 1278 OD1 ASP A1234 9.928 21.890 2.384 1.00 0.00 O ATOM 1279 OD2 ASP A1234 8.420 20.957 3.663 1.00 0.00 O ATOM 0 H ASP A1234 7.116 19.843 -0.810 1.00 0.00 H new ATOM 0 HA ASP A1234 9.717 19.955 0.132 1.00 0.00 H new ATOM 0 HB2 ASP A1234 7.979 21.663 0.600 1.00 0.00 H new ATOM 0 HB3 ASP A1234 7.070 20.519 1.568 1.00 0.00 H new ATOM 1284 N ASN A1235 7.869 17.817 1.911 1.00 0.00 N ATOM 1285 CA ASN A1235 7.897 16.680 2.866 1.00 0.00 C ATOM 1286 C ASN A1235 8.774 15.522 2.349 1.00 0.00 C ATOM 1287 O ASN A1235 9.720 15.098 3.022 1.00 0.00 O ATOM 1288 CB ASN A1235 6.455 16.170 3.167 1.00 0.00 C ATOM 1289 CG ASN A1235 5.686 17.047 4.164 1.00 0.00 C ATOM 1290 OD1 ASN A1235 5.778 16.846 5.373 1.00 0.00 O ATOM 1291 ND2 ASN A1235 4.916 18.006 3.676 1.00 0.00 N ATOM 0 H ASN A1235 6.929 18.068 1.604 1.00 0.00 H new ATOM 0 HA ASN A1235 8.339 17.048 3.792 1.00 0.00 H new ATOM 0 HB2 ASN A1235 5.895 16.120 2.233 1.00 0.00 H new ATOM 0 HB3 ASN A1235 6.513 15.155 3.559 1.00 0.00 H new ATOM 0 HD21 ASN A1235 4.380 18.601 4.308 1.00 0.00 H new ATOM 0 HD22 ASN A1235 4.859 18.151 2.668 1.00 0.00 H new ATOM 1298 N VAL A1236 8.470 15.068 1.126 1.00 0.00 N ATOM 1299 CA VAL A1236 9.135 13.912 0.486 1.00 0.00 C ATOM 1300 C VAL A1236 10.638 14.181 0.249 1.00 0.00 C ATOM 1301 O VAL A1236 11.481 13.328 0.535 1.00 0.00 O ATOM 1302 CB VAL A1236 8.419 13.561 -0.872 1.00 0.00 C ATOM 1303 CG1 VAL A1236 9.160 12.448 -1.656 1.00 0.00 C ATOM 1304 CG2 VAL A1236 6.939 13.169 -0.619 1.00 0.00 C ATOM 0 H VAL A1236 7.749 15.493 0.543 1.00 0.00 H new ATOM 0 HA VAL A1236 9.055 13.061 1.163 1.00 0.00 H new ATOM 0 HB VAL A1236 8.444 14.456 -1.494 1.00 0.00 H new ATOM 0 HG11 VAL A1236 8.628 12.241 -2.585 1.00 0.00 H new ATOM 0 HG12 VAL A1236 10.174 12.777 -1.884 1.00 0.00 H new ATOM 0 HG13 VAL A1236 9.200 11.542 -1.051 1.00 0.00 H new ATOM 0 HG21 VAL A1236 6.459 12.929 -1.568 1.00 0.00 H new ATOM 0 HG22 VAL A1236 6.900 12.300 0.037 1.00 0.00 H new ATOM 0 HG23 VAL A1236 6.417 14.002 -0.148 1.00 0.00 H new ATOM 1314 N GLN A1237 10.944 15.393 -0.238 1.00 0.00 N ATOM 1315 CA GLN A1237 12.314 15.812 -0.590 1.00 0.00 C ATOM 1316 C GLN A1237 13.180 15.992 0.673 1.00 0.00 C ATOM 1317 O GLN A1237 14.358 15.663 0.658 1.00 0.00 O ATOM 1318 CB GLN A1237 12.292 17.110 -1.449 1.00 0.00 C ATOM 1319 CG GLN A1237 11.624 16.950 -2.840 1.00 0.00 C ATOM 1320 CD GLN A1237 12.415 16.102 -3.838 1.00 0.00 C ATOM 1321 OE1 GLN A1237 13.245 16.758 -4.635 1.00 0.00 O flip ATOM 1322 NE2 GLN A1237 12.271 14.878 -3.902 1.00 0.00 N flip ATOM 0 H GLN A1237 10.244 16.117 -0.401 1.00 0.00 H new ATOM 0 HA GLN A1237 12.766 15.022 -1.190 1.00 0.00 H new ATOM 0 HB2 GLN A1237 11.767 17.888 -0.895 1.00 0.00 H new ATOM 0 HB3 GLN A1237 13.316 17.455 -1.590 1.00 0.00 H new ATOM 0 HG2 GLN A1237 10.639 16.503 -2.705 1.00 0.00 H new ATOM 0 HG3 GLN A1237 11.469 17.940 -3.269 1.00 0.00 H new ATOM 0 HE21 GLN A1237 11.622 14.407 -3.271 1.00 0.00 H new ATOM 0 HE22 GLN A1237 12.801 14.337 -4.586 1.00 0.00 H new ATOM 1331 N VAL A1238 12.588 16.486 1.777 1.00 0.00 N ATOM 1332 CA VAL A1238 13.318 16.615 3.057 1.00 0.00 C ATOM 1333 C VAL A1238 13.649 15.215 3.630 1.00 0.00 C ATOM 1334 O VAL A1238 14.781 14.981 4.059 1.00 0.00 O ATOM 1335 CB VAL A1238 12.551 17.500 4.113 1.00 0.00 C ATOM 1336 CG1 VAL A1238 13.214 17.418 5.513 1.00 0.00 C ATOM 1337 CG2 VAL A1238 12.470 18.981 3.644 1.00 0.00 C ATOM 0 H VAL A1238 11.618 16.800 1.811 1.00 0.00 H new ATOM 0 HA VAL A1238 14.250 17.138 2.845 1.00 0.00 H new ATOM 0 HB VAL A1238 11.539 17.103 4.194 1.00 0.00 H new ATOM 0 HG11 VAL A1238 12.659 18.040 6.215 1.00 0.00 H new ATOM 0 HG12 VAL A1238 13.206 16.384 5.859 1.00 0.00 H new ATOM 0 HG13 VAL A1238 14.243 17.772 5.450 1.00 0.00 H new ATOM 0 HG21 VAL A1238 11.936 19.570 4.390 1.00 0.00 H new ATOM 0 HG22 VAL A1238 13.477 19.379 3.520 1.00 0.00 H new ATOM 0 HG23 VAL A1238 11.940 19.033 2.693 1.00 0.00 H new ATOM 1347 N VAL A1239 12.668 14.281 3.578 1.00 0.00 N ATOM 1348 CA VAL A1239 12.879 12.865 3.987 1.00 0.00 C ATOM 1349 C VAL A1239 13.992 12.220 3.120 1.00 0.00 C ATOM 1350 O VAL A1239 14.827 11.457 3.620 1.00 0.00 O ATOM 1351 CB VAL A1239 11.549 12.009 3.899 1.00 0.00 C ATOM 1352 CG1 VAL A1239 11.816 10.509 4.206 1.00 0.00 C ATOM 1353 CG2 VAL A1239 10.454 12.571 4.848 1.00 0.00 C ATOM 0 H VAL A1239 11.721 14.481 3.257 1.00 0.00 H new ATOM 0 HA VAL A1239 13.189 12.871 5.032 1.00 0.00 H new ATOM 0 HB VAL A1239 11.185 12.084 2.874 1.00 0.00 H new ATOM 0 HG11 VAL A1239 10.882 9.952 4.137 1.00 0.00 H new ATOM 0 HG12 VAL A1239 12.530 10.112 3.485 1.00 0.00 H new ATOM 0 HG13 VAL A1239 12.223 10.410 5.212 1.00 0.00 H new ATOM 0 HG21 VAL A1239 9.553 11.963 4.765 1.00 0.00 H new ATOM 0 HG22 VAL A1239 10.816 12.546 5.876 1.00 0.00 H new ATOM 0 HG23 VAL A1239 10.224 13.599 4.569 1.00 0.00 H new ATOM 1363 N LEU A1240 14.015 12.594 1.833 1.00 0.00 N ATOM 1364 CA LEU A1240 15.035 12.145 0.864 1.00 0.00 C ATOM 1365 C LEU A1240 16.429 12.702 1.272 1.00 0.00 C ATOM 1366 O LEU A1240 17.436 11.999 1.176 1.00 0.00 O ATOM 1367 CB LEU A1240 14.635 12.621 -0.573 1.00 0.00 C ATOM 1368 CG LEU A1240 14.842 11.618 -1.758 1.00 0.00 C ATOM 1369 CD1 LEU A1240 14.548 12.303 -3.101 1.00 0.00 C ATOM 1370 CD2 LEU A1240 16.241 10.980 -1.761 1.00 0.00 C ATOM 0 H LEU A1240 13.321 13.222 1.428 1.00 0.00 H new ATOM 0 HA LEU A1240 15.091 11.056 0.863 1.00 0.00 H new ATOM 0 HB2 LEU A1240 13.582 12.902 -0.552 1.00 0.00 H new ATOM 0 HB3 LEU A1240 15.202 13.525 -0.796 1.00 0.00 H new ATOM 0 HG LEU A1240 14.131 10.804 -1.613 1.00 0.00 H new ATOM 0 HD11 LEU A1240 14.697 11.591 -3.913 1.00 0.00 H new ATOM 0 HD12 LEU A1240 13.516 12.655 -3.112 1.00 0.00 H new ATOM 0 HD13 LEU A1240 15.222 13.150 -3.233 1.00 0.00 H new ATOM 0 HD21 LEU A1240 16.326 10.294 -2.604 1.00 0.00 H new ATOM 0 HD22 LEU A1240 16.997 11.761 -1.850 1.00 0.00 H new ATOM 0 HD23 LEU A1240 16.393 10.432 -0.831 1.00 0.00 H new ATOM 1382 N GLN A1241 16.460 13.968 1.746 1.00 0.00 N ATOM 1383 CA GLN A1241 17.703 14.633 2.206 1.00 0.00 C ATOM 1384 C GLN A1241 18.173 14.086 3.562 1.00 0.00 C ATOM 1385 O GLN A1241 19.348 14.227 3.907 1.00 0.00 O ATOM 1386 CB GLN A1241 17.525 16.171 2.292 1.00 0.00 C ATOM 1387 CG GLN A1241 17.322 16.859 0.934 1.00 0.00 C ATOM 1388 CD GLN A1241 17.163 18.383 0.991 1.00 0.00 C ATOM 1389 OE1 GLN A1241 17.590 19.094 0.080 1.00 0.00 O ATOM 1390 NE2 GLN A1241 16.502 18.894 2.024 1.00 0.00 N ATOM 0 H GLN A1241 15.630 14.556 1.821 1.00 0.00 H new ATOM 0 HA GLN A1241 18.469 14.411 1.463 1.00 0.00 H new ATOM 0 HB2 GLN A1241 16.669 16.391 2.930 1.00 0.00 H new ATOM 0 HB3 GLN A1241 18.402 16.600 2.777 1.00 0.00 H new ATOM 0 HG2 GLN A1241 18.172 16.622 0.294 1.00 0.00 H new ATOM 0 HG3 GLN A1241 16.437 16.435 0.459 1.00 0.00 H new ATOM 0 HE21 GLN A1241 16.160 18.281 2.764 1.00 0.00 H new ATOM 0 HE22 GLN A1241 16.337 19.899 2.077 1.00 0.00 H new ATOM 1399 N GLN A1242 17.251 13.492 4.336 1.00 0.00 N ATOM 1400 CA GLN A1242 17.586 12.818 5.607 1.00 0.00 C ATOM 1401 C GLN A1242 18.220 11.449 5.319 1.00 0.00 C ATOM 1402 O GLN A1242 19.243 11.090 5.910 1.00 0.00 O ATOM 1403 CB GLN A1242 16.321 12.636 6.492 1.00 0.00 C ATOM 1404 CG GLN A1242 15.626 13.939 6.938 1.00 0.00 C ATOM 1405 CD GLN A1242 16.532 14.882 7.737 1.00 0.00 C ATOM 1406 OE1 GLN A1242 16.636 14.772 8.959 1.00 0.00 O ATOM 1407 NE2 GLN A1242 17.176 15.827 7.062 1.00 0.00 N ATOM 0 H GLN A1242 16.258 13.463 4.103 1.00 0.00 H new ATOM 0 HA GLN A1242 18.296 13.443 6.149 1.00 0.00 H new ATOM 0 HB2 GLN A1242 15.600 12.030 5.943 1.00 0.00 H new ATOM 0 HB3 GLN A1242 16.600 12.071 7.382 1.00 0.00 H new ATOM 0 HG2 GLN A1242 15.259 14.464 6.056 1.00 0.00 H new ATOM 0 HG3 GLN A1242 14.756 13.686 7.544 1.00 0.00 H new ATOM 0 HE21 GLN A1242 17.070 15.893 6.050 1.00 0.00 H new ATOM 0 HE22 GLN A1242 17.777 16.487 7.556 1.00 0.00 H new ATOM 1416 N THR A1243 17.606 10.707 4.380 1.00 0.00 N ATOM 1417 CA THR A1243 17.962 9.309 4.097 1.00 0.00 C ATOM 1418 C THR A1243 19.192 9.226 3.153 1.00 0.00 C ATOM 1419 O THR A1243 20.244 8.705 3.538 1.00 0.00 O ATOM 1420 CB THR A1243 16.732 8.545 3.499 1.00 0.00 C ATOM 1421 OG1 THR A1243 15.579 8.767 4.332 1.00 0.00 O ATOM 1422 CG2 THR A1243 16.971 7.027 3.390 1.00 0.00 C ATOM 0 H THR A1243 16.848 11.062 3.797 1.00 0.00 H new ATOM 0 HA THR A1243 18.239 8.827 5.035 1.00 0.00 H new ATOM 0 HB THR A1243 16.574 8.933 2.493 1.00 0.00 H new ATOM 0 HG1 THR A1243 15.221 9.663 4.163 1.00 0.00 H new ATOM 0 HG21 THR A1243 16.086 6.549 2.970 1.00 0.00 H new ATOM 0 HG22 THR A1243 17.827 6.839 2.743 1.00 0.00 H new ATOM 0 HG23 THR A1243 17.168 6.618 4.381 1.00 0.00 H new ATOM 1430 N TYR A1244 19.052 9.771 1.932 1.00 0.00 N ATOM 1431 CA TYR A1244 20.079 9.671 0.861 1.00 0.00 C ATOM 1432 C TYR A1244 20.963 10.929 0.766 1.00 0.00 C ATOM 1433 O TYR A1244 22.009 10.897 0.105 1.00 0.00 O ATOM 1434 CB TYR A1244 19.388 9.394 -0.499 1.00 0.00 C ATOM 1435 CG TYR A1244 18.651 8.048 -0.551 1.00 0.00 C ATOM 1436 CD1 TYR A1244 17.323 7.929 -0.141 1.00 0.00 C ATOM 1437 CD2 TYR A1244 19.298 6.889 -0.987 1.00 0.00 C ATOM 1438 CE1 TYR A1244 16.676 6.712 -0.164 1.00 0.00 C ATOM 1439 CE2 TYR A1244 18.644 5.673 -1.015 1.00 0.00 C ATOM 1440 CZ TYR A1244 17.337 5.594 -0.599 1.00 0.00 C ATOM 1441 OH TYR A1244 16.683 4.390 -0.603 1.00 0.00 O ATOM 0 H TYR A1244 18.224 10.296 1.652 1.00 0.00 H new ATOM 0 HA TYR A1244 20.739 8.843 1.118 1.00 0.00 H new ATOM 0 HB2 TYR A1244 18.679 10.195 -0.707 1.00 0.00 H new ATOM 0 HB3 TYR A1244 20.138 9.419 -1.290 1.00 0.00 H new ATOM 0 HD1 TYR A1244 16.792 8.806 0.200 1.00 0.00 H new ATOM 0 HD2 TYR A1244 20.328 6.945 -1.308 1.00 0.00 H new ATOM 0 HE1 TYR A1244 15.649 6.640 0.161 1.00 0.00 H new ATOM 0 HE2 TYR A1244 19.157 4.789 -1.362 1.00 0.00 H new ATOM 0 HH TYR A1244 15.782 4.506 -0.235 1.00 0.00 H new ATOM 1451 N GLY A1245 20.537 12.037 1.389 1.00 0.00 N ATOM 1452 CA GLY A1245 21.338 13.271 1.417 1.00 0.00 C ATOM 1453 C GLY A1245 20.910 14.274 0.349 1.00 0.00 C ATOM 1454 O GLY A1245 20.634 15.437 0.666 1.00 0.00 O ATOM 0 H GLY A1245 19.645 12.105 1.879 1.00 0.00 H new ATOM 0 HA2 GLY A1245 21.251 13.734 2.400 1.00 0.00 H new ATOM 0 HA3 GLY A1245 22.389 13.021 1.274 1.00 0.00 H new ATOM 1458 N SER A1246 20.845 13.828 -0.920 1.00 0.00 N ATOM 1459 CA SER A1246 20.452 14.689 -2.062 1.00 0.00 C ATOM 1460 C SER A1246 19.002 14.377 -2.495 1.00 0.00 C ATOM 1461 O SER A1246 18.333 13.524 -1.897 1.00 0.00 O ATOM 1462 CB SER A1246 21.443 14.470 -3.228 1.00 0.00 C ATOM 1463 OG SER A1246 21.202 15.354 -4.315 1.00 0.00 O ATOM 0 H SER A1246 21.061 12.867 -1.186 1.00 0.00 H new ATOM 0 HA SER A1246 20.489 15.736 -1.762 1.00 0.00 H new ATOM 0 HB2 SER A1246 22.462 14.611 -2.867 1.00 0.00 H new ATOM 0 HB3 SER A1246 21.368 13.440 -3.577 1.00 0.00 H new ATOM 0 HG SER A1246 21.852 15.181 -5.028 1.00 0.00 H new ATOM 1469 N THR A1247 18.529 15.077 -3.550 1.00 0.00 N ATOM 1470 CA THR A1247 17.134 15.010 -4.034 1.00 0.00 C ATOM 1471 C THR A1247 17.053 15.024 -5.565 1.00 0.00 C ATOM 1472 O THR A1247 17.921 15.596 -6.233 1.00 0.00 O ATOM 1473 CB THR A1247 16.302 16.213 -3.474 1.00 0.00 C ATOM 1474 OG1 THR A1247 17.086 17.417 -3.498 1.00 0.00 O ATOM 1475 CG2 THR A1247 15.804 15.953 -2.063 1.00 0.00 C ATOM 0 H THR A1247 19.113 15.711 -4.095 1.00 0.00 H new ATOM 0 HA THR A1247 16.722 14.067 -3.675 1.00 0.00 H new ATOM 0 HB THR A1247 15.431 16.331 -4.119 1.00 0.00 H new ATOM 0 HG1 THR A1247 16.554 18.161 -3.147 1.00 0.00 H new ATOM 0 HG21 THR A1247 15.232 16.813 -1.715 1.00 0.00 H new ATOM 0 HG22 THR A1247 15.167 15.068 -2.059 1.00 0.00 H new ATOM 0 HG23 THR A1247 16.655 15.791 -1.401 1.00 0.00 H new