USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 498 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: A 108 LYS NZ :NH3+ -120:sc= 0.959 (180deg=-0.117) USER MOD Set 1.2: A 110 ASN : amide:sc= 0.838 K(o=1.8,f=-6.5!) USER MOD Single : A 81 HIS : no HD1:sc= -1.11 K(o=-1.1,f=-2.2!) USER MOD Single : A 85 SER OG : rot 94:sc= -0.676 USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.344 USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 115:sc= 0.623 USER MOD Single : A 96 SER OG : rot 180:sc= -0.122 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 CYS SG : rot 168:sc= -4.74! USER MOD Single : A 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 124 MET CE :methyl -133:sc= -0.602 (180deg=-4.44!) USER MOD Single : A 125 ASN : amide:sc= -0.0246 X(o=-0.025,f=-0.026) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 20:sc= 1.19 USER MOD Single : A 144 GLN : amide:sc= -0.0271 X(o=-0.027,f=-0.12) USER MOD ----------------------------------------------------------------- ATOM 130 N HIS A 81 -5.408 7.702 2.985 1.00 1.00 N ATOM 131 CA HIS A 81 -5.517 6.341 3.481 1.00 1.00 C ATOM 132 C HIS A 81 -4.122 5.718 3.581 1.00 1.00 C ATOM 133 O HIS A 81 -3.574 5.257 2.581 1.00 1.00 O ATOM 134 CB HIS A 81 -6.472 5.521 2.613 1.00 1.00 C ATOM 135 CG HIS A 81 -6.096 4.063 2.494 1.00 1.00 C ATOM 136 ND1 HIS A 81 -5.664 3.310 3.572 1.00 1.00 N ATOM 137 CD2 HIS A 81 -6.094 3.228 1.415 1.00 1.00 C ATOM 138 CE1 HIS A 81 -5.414 2.080 3.149 1.00 1.00 C ATOM 139 NE2 HIS A 81 -5.681 2.031 1.812 1.00 1.00 N ATOM 0 HA HIS A 81 -5.946 6.348 4.483 1.00 1.00 H new ATOM 0 HB2 HIS A 81 -7.477 5.594 3.028 1.00 1.00 H new ATOM 0 HB3 HIS A 81 -6.507 5.959 1.616 1.00 1.00 H new ATOM 0 HD2 HIS A 81 -6.380 3.496 0.409 1.00 1.00 H new ATOM 0 HE1 HIS A 81 -5.061 1.260 3.756 1.00 1.00 H new ATOM 0 HE2 HIS A 81 -5.580 1.210 1.216 1.00 1.00 H new ATOM 146 N ILE A 82 -3.591 5.726 4.794 1.00 1.00 N ATOM 147 CA ILE A 82 -2.271 5.168 5.036 1.00 1.00 C ATOM 148 C ILE A 82 -2.395 3.662 5.276 1.00 1.00 C ATOM 149 O ILE A 82 -3.044 3.234 6.229 1.00 1.00 O ATOM 150 CB ILE A 82 -1.573 5.917 6.173 1.00 1.00 C ATOM 151 CG1 ILE A 82 -1.145 7.316 5.726 1.00 1.00 C ATOM 152 CG2 ILE A 82 -0.398 5.106 6.723 1.00 1.00 C ATOM 153 CD1 ILE A 82 -2.038 8.389 6.353 1.00 1.00 C ATOM 0 H ILE A 82 -4.050 6.110 5.620 1.00 1.00 H new ATOM 0 HA ILE A 82 -1.635 5.300 4.161 1.00 1.00 H new ATOM 0 HB ILE A 82 -2.286 6.044 6.988 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -0.107 7.491 6.009 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -1.195 7.386 4.639 1.00 1.00 H new ATOM 0 HG21 ILE A 82 0.081 5.661 7.530 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -0.761 4.152 7.104 1.00 1.00 H new ATOM 0 HG23 ILE A 82 0.325 4.927 5.927 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -1.712 9.374 6.019 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -3.072 8.226 6.048 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -1.967 8.332 7.439 1.00 1.00 H new ATOM 164 N VAL A 83 -1.764 2.901 4.394 1.00 1.00 N ATOM 165 CA VAL A 83 -1.796 1.452 4.499 1.00 1.00 C ATOM 166 C VAL A 83 -1.020 1.018 5.743 1.00 1.00 C ATOM 167 O VAL A 83 0.163 1.327 5.881 1.00 1.00 O ATOM 168 CB VAL A 83 -1.262 0.823 3.211 1.00 1.00 C ATOM 169 CG1 VAL A 83 -0.969 -0.666 3.408 1.00 1.00 C ATOM 170 CG2 VAL A 83 -2.234 1.041 2.049 1.00 1.00 C ATOM 0 H VAL A 83 -1.228 3.260 3.604 1.00 1.00 H new ATOM 0 HA VAL A 83 -2.821 1.100 4.616 1.00 1.00 H new ATOM 0 HB VAL A 83 -0.324 1.319 2.961 1.00 1.00 H new ATOM 0 HG11 VAL A 83 -0.591 -1.089 2.477 1.00 1.00 H new ATOM 0 HG12 VAL A 83 -0.222 -0.789 4.192 1.00 1.00 H new ATOM 0 HG13 VAL A 83 -1.885 -1.182 3.695 1.00 1.00 H new ATOM 0 HG21 VAL A 83 -1.830 0.584 1.146 1.00 1.00 H new ATOM 0 HG22 VAL A 83 -3.195 0.585 2.288 1.00 1.00 H new ATOM 0 HG23 VAL A 83 -2.371 2.110 1.885 1.00 1.00 H new ATOM 180 N ARG A 84 -1.716 0.305 6.617 1.00 1.00 N ATOM 181 CA ARG A 84 -1.107 -0.175 7.845 1.00 1.00 C ATOM 182 C ARG A 84 -1.077 -1.705 7.860 1.00 1.00 C ATOM 183 O ARG A 84 -2.124 -2.350 7.819 1.00 1.00 O ATOM 184 CB ARG A 84 -1.872 0.326 9.072 1.00 1.00 C ATOM 185 CG ARG A 84 -1.678 1.831 9.263 1.00 1.00 C ATOM 186 CD ARG A 84 -1.964 2.242 10.709 1.00 1.00 C ATOM 187 NE ARG A 84 -2.416 3.651 10.754 1.00 1.00 N ATOM 188 CZ ARG A 84 -1.585 4.710 10.858 1.00 1.00 C ATOM 189 NH1 ARG A 84 -0.249 4.528 10.929 1.00 1.00 N ATOM 190 NH2 ARG A 84 -2.098 5.926 10.891 1.00 1.00 N ATOM 0 H ARG A 84 -2.696 0.048 6.498 1.00 1.00 H new ATOM 0 HA ARG A 84 -0.089 0.212 7.883 1.00 1.00 H new ATOM 0 HB2 ARG A 84 -2.933 0.104 8.959 1.00 1.00 H new ATOM 0 HB3 ARG A 84 -1.529 -0.204 9.960 1.00 1.00 H new ATOM 0 HG2 ARG A 84 -0.657 2.106 8.998 1.00 1.00 H new ATOM 0 HG3 ARG A 84 -2.340 2.375 8.589 1.00 1.00 H new ATOM 0 HD2 ARG A 84 -2.728 1.592 11.136 1.00 1.00 H new ATOM 0 HD3 ARG A 84 -1.066 2.120 11.315 1.00 1.00 H new ATOM 0 HE ARG A 84 -3.418 3.833 10.703 1.00 1.00 H new ATOM 0 HH11 ARG A 84 0.139 3.585 10.904 1.00 1.00 H new ATOM 0 HH12 ARG A 84 0.372 5.333 11.007 1.00 1.00 H new ATOM 0 HH21 ARG A 84 -3.108 6.055 10.838 1.00 1.00 H new ATOM 0 HH22 ARG A 84 -1.484 6.737 10.969 1.00 1.00 H new ATOM 199 N SER A 85 0.132 -2.241 7.920 1.00 1.00 N ATOM 200 CA SER A 85 0.311 -3.682 7.941 1.00 1.00 C ATOM 201 C SER A 85 -0.580 -4.306 9.017 1.00 1.00 C ATOM 202 O SER A 85 -0.299 -4.182 10.208 1.00 1.00 O ATOM 203 CB SER A 85 1.776 -4.052 8.186 1.00 1.00 C ATOM 204 OG SER A 85 2.496 -2.994 8.814 1.00 1.00 O ATOM 0 H SER A 85 0.998 -1.703 7.955 1.00 1.00 H new ATOM 0 HA SER A 85 0.022 -4.076 6.966 1.00 1.00 H new ATOM 0 HB2 SER A 85 1.825 -4.944 8.810 1.00 1.00 H new ATOM 0 HB3 SER A 85 2.251 -4.300 7.237 1.00 1.00 H new ATOM 0 HG SER A 85 2.493 -3.128 9.785 1.00 1.00 H new ATOM 209 N PRO A 86 -1.664 -4.978 8.547 1.00 1.00 N ATOM 210 CA PRO A 86 -2.599 -5.621 9.455 1.00 1.00 C ATOM 211 C PRO A 86 -2.007 -6.908 10.031 1.00 1.00 C ATOM 212 O PRO A 86 -2.657 -7.599 10.814 1.00 1.00 O ATOM 213 CB PRO A 86 -3.850 -5.860 8.627 1.00 1.00 C ATOM 214 CG PRO A 86 -3.412 -5.771 7.174 1.00 1.00 C ATOM 215 CD PRO A 86 -2.028 -5.145 7.143 1.00 1.00 C ATOM 0 HA PRO A 86 -2.827 -5.009 10.328 1.00 1.00 H new ATOM 0 HB2 PRO A 86 -4.282 -6.837 8.845 1.00 1.00 H new ATOM 0 HB3 PRO A 86 -4.614 -5.116 8.851 1.00 1.00 H new ATOM 0 HG2 PRO A 86 -3.393 -6.762 6.719 1.00 1.00 H new ATOM 0 HG3 PRO A 86 -4.116 -5.170 6.599 1.00 1.00 H new ATOM 0 HD2 PRO A 86 -1.316 -5.785 6.623 1.00 1.00 H new ATOM 0 HD3 PRO A 86 -2.038 -4.189 6.620 1.00 1.00 H new ATOM 220 N MET A 87 -0.779 -7.192 9.621 1.00 1.00 N ATOM 221 CA MET A 87 -0.091 -8.385 10.086 1.00 1.00 C ATOM 222 C MET A 87 1.416 -8.276 9.849 1.00 1.00 C ATOM 223 O MET A 87 1.861 -8.131 8.711 1.00 1.00 O ATOM 224 CB MET A 87 -0.637 -9.610 9.349 1.00 1.00 C ATOM 225 CG MET A 87 -1.501 -10.467 10.277 1.00 1.00 C ATOM 226 SD MET A 87 -3.052 -10.853 9.483 1.00 1.00 S ATOM 227 CE MET A 87 -4.139 -10.836 10.900 1.00 1.00 C ATOM 0 H MET A 87 -0.243 -6.616 8.972 1.00 1.00 H new ATOM 0 HA MET A 87 -0.265 -8.488 11.157 1.00 1.00 H new ATOM 0 HB2 MET A 87 -1.227 -9.289 8.490 1.00 1.00 H new ATOM 0 HB3 MET A 87 0.190 -10.206 8.963 1.00 1.00 H new ATOM 0 HG2 MET A 87 -0.974 -11.387 10.531 1.00 1.00 H new ATOM 0 HG3 MET A 87 -1.683 -9.936 11.211 1.00 1.00 H new ATOM 0 HE1 MET A 87 -5.157 -11.060 10.581 1.00 1.00 H new ATOM 0 HE2 MET A 87 -3.811 -11.587 11.619 1.00 1.00 H new ATOM 0 HE3 MET A 87 -4.114 -9.851 11.366 1.00 1.00 H new ATOM 235 N VAL A 88 2.161 -8.351 10.942 1.00 1.00 N ATOM 236 CA VAL A 88 3.609 -8.264 10.868 1.00 1.00 C ATOM 237 C VAL A 88 4.114 -9.161 9.736 1.00 1.00 C ATOM 238 O VAL A 88 3.486 -10.168 9.411 1.00 1.00 O ATOM 239 CB VAL A 88 4.226 -8.611 12.225 1.00 1.00 C ATOM 240 CG1 VAL A 88 5.725 -8.305 12.241 1.00 1.00 C ATOM 241 CG2 VAL A 88 3.504 -7.878 13.358 1.00 1.00 C ATOM 0 H VAL A 88 1.789 -8.471 11.884 1.00 1.00 H new ATOM 0 HA VAL A 88 3.917 -7.244 10.637 1.00 1.00 H new ATOM 0 HB VAL A 88 4.102 -9.682 12.386 1.00 1.00 H new ATOM 0 HG11 VAL A 88 6.138 -8.561 13.217 1.00 1.00 H new ATOM 0 HG12 VAL A 88 6.224 -8.892 11.470 1.00 1.00 H new ATOM 0 HG13 VAL A 88 5.882 -7.244 12.048 1.00 1.00 H new ATOM 0 HG21 VAL A 88 3.961 -8.142 14.312 1.00 1.00 H new ATOM 0 HG22 VAL A 88 3.582 -6.802 13.203 1.00 1.00 H new ATOM 0 HG23 VAL A 88 2.453 -8.168 13.367 1.00 1.00 H new ATOM 251 N GLY A 89 5.241 -8.763 9.165 1.00 1.00 N ATOM 252 CA GLY A 89 5.836 -9.519 8.076 1.00 1.00 C ATOM 253 C GLY A 89 6.816 -8.656 7.280 1.00 1.00 C ATOM 254 O GLY A 89 7.701 -8.023 7.856 1.00 1.00 O ATOM 0 H GLY A 89 5.758 -7.927 9.436 1.00 1.00 H new ATOM 0 HA2 GLY A 89 6.355 -10.391 8.475 1.00 1.00 H new ATOM 0 HA3 GLY A 89 5.052 -9.889 7.415 1.00 1.00 H new ATOM 258 N THR A 90 6.628 -8.656 5.969 1.00 1.00 N ATOM 259 CA THR A 90 7.484 -7.880 5.089 1.00 1.00 C ATOM 260 C THR A 90 6.670 -7.288 3.937 1.00 1.00 C ATOM 261 O THR A 90 6.049 -8.022 3.169 1.00 1.00 O ATOM 262 CB THR A 90 8.627 -8.786 4.622 1.00 1.00 C ATOM 263 OG1 THR A 90 9.216 -9.252 5.834 1.00 1.00 O ATOM 264 CG2 THR A 90 9.751 -8.005 3.939 1.00 1.00 C ATOM 0 H THR A 90 5.894 -9.182 5.494 1.00 1.00 H new ATOM 0 HA THR A 90 7.917 -7.027 5.611 1.00 1.00 H new ATOM 0 HB THR A 90 8.238 -9.538 3.935 1.00 1.00 H new ATOM 0 HG1 THR A 90 9.965 -9.848 5.625 1.00 1.00 H new ATOM 0 HG21 THR A 90 10.536 -8.694 3.627 1.00 1.00 H new ATOM 0 HG22 THR A 90 9.355 -7.487 3.066 1.00 1.00 H new ATOM 0 HG23 THR A 90 10.164 -7.277 4.637 1.00 1.00 H new ATOM 272 N PHE A 91 6.699 -5.966 3.853 1.00 1.00 N ATOM 273 CA PHE A 91 5.971 -5.267 2.807 1.00 1.00 C ATOM 274 C PHE A 91 6.806 -5.169 1.529 1.00 1.00 C ATOM 275 O PHE A 91 8.005 -4.904 1.586 1.00 1.00 O ATOM 276 CB PHE A 91 5.687 -3.856 3.327 1.00 1.00 C ATOM 277 CG PHE A 91 5.126 -2.904 2.269 1.00 1.00 C ATOM 278 CD1 PHE A 91 5.919 -2.477 1.250 1.00 1.00 C ATOM 279 CD2 PHE A 91 3.834 -2.486 2.347 1.00 1.00 C ATOM 280 CE1 PHE A 91 5.399 -1.594 0.268 1.00 1.00 C ATOM 281 CE2 PHE A 91 3.313 -1.602 1.364 1.00 1.00 C ATOM 282 CZ PHE A 91 4.106 -1.175 0.345 1.00 1.00 C ATOM 0 H PHE A 91 7.215 -5.361 4.492 1.00 1.00 H new ATOM 0 HA PHE A 91 5.054 -5.805 2.568 1.00 1.00 H new ATOM 0 HB2 PHE A 91 4.980 -3.920 4.154 1.00 1.00 H new ATOM 0 HB3 PHE A 91 6.609 -3.435 3.727 1.00 1.00 H new ATOM 0 HD1 PHE A 91 6.945 -2.810 1.188 1.00 1.00 H new ATOM 0 HD2 PHE A 91 3.204 -2.826 3.156 1.00 1.00 H new ATOM 0 HE1 PHE A 91 6.029 -1.254 -0.541 1.00 1.00 H new ATOM 0 HE2 PHE A 91 2.287 -1.269 1.426 1.00 1.00 H new ATOM 0 HZ PHE A 91 3.710 -0.504 -0.403 1.00 1.00 H new ATOM 291 N TYR A 92 6.137 -5.387 0.406 1.00 1.00 N ATOM 292 CA TYR A 92 6.803 -5.327 -0.884 1.00 1.00 C ATOM 293 C TYR A 92 5.973 -4.529 -1.893 1.00 1.00 C ATOM 294 O TYR A 92 4.746 -4.516 -1.819 1.00 1.00 O ATOM 295 CB TYR A 92 6.919 -6.773 -1.367 1.00 1.00 C ATOM 296 CG TYR A 92 8.070 -7.552 -0.728 1.00 1.00 C ATOM 297 CD1 TYR A 92 9.372 -7.129 -0.905 1.00 1.00 C ATOM 298 CD2 TYR A 92 7.807 -8.679 0.024 1.00 1.00 C ATOM 299 CE1 TYR A 92 10.455 -7.862 -0.303 1.00 1.00 C ATOM 300 CE2 TYR A 92 8.891 -9.413 0.624 1.00 1.00 C ATOM 301 CZ TYR A 92 10.162 -8.968 0.432 1.00 1.00 C ATOM 302 OH TYR A 92 11.185 -9.660 0.999 1.00 1.00 O ATOM 0 H TYR A 92 5.142 -5.605 0.363 1.00 1.00 H new ATOM 0 HA TYR A 92 7.773 -4.838 -0.793 1.00 1.00 H new ATOM 0 HB2 TYR A 92 5.983 -7.291 -1.158 1.00 1.00 H new ATOM 0 HB3 TYR A 92 7.050 -6.774 -2.449 1.00 1.00 H new ATOM 0 HD1 TYR A 92 9.578 -6.248 -1.495 1.00 1.00 H new ATOM 0 HD2 TYR A 92 6.788 -9.010 0.162 1.00 1.00 H new ATOM 0 HE1 TYR A 92 11.478 -7.541 -0.432 1.00 1.00 H new ATOM 0 HE2 TYR A 92 8.699 -10.297 1.213 1.00 1.00 H new ATOM 0 HH TYR A 92 10.827 -10.425 1.495 1.00 1.00 H new ATOM 311 N ARG A 93 6.676 -3.884 -2.811 1.00 1.00 N ATOM 312 CA ARG A 93 6.019 -3.086 -3.832 1.00 1.00 C ATOM 313 C ARG A 93 5.842 -3.906 -5.112 1.00 1.00 C ATOM 314 O ARG A 93 5.087 -3.517 -6.003 1.00 1.00 O ATOM 315 CB ARG A 93 6.826 -1.826 -4.151 1.00 1.00 C ATOM 316 CG ARG A 93 7.209 -1.083 -2.870 1.00 1.00 C ATOM 317 CD ARG A 93 6.210 0.034 -2.563 1.00 1.00 C ATOM 318 NE ARG A 93 6.004 0.872 -3.766 1.00 1.00 N ATOM 319 CZ ARG A 93 6.936 1.704 -4.277 1.00 1.00 C ATOM 320 NH1 ARG A 93 8.149 1.815 -3.695 1.00 1.00 N ATOM 321 NH2 ARG A 93 6.644 2.406 -5.356 1.00 1.00 N ATOM 0 H ARG A 93 7.694 -3.897 -2.870 1.00 1.00 H new ATOM 0 HA ARG A 93 5.043 -2.791 -3.446 1.00 1.00 H new ATOM 0 HB2 ARG A 93 7.727 -2.096 -4.702 1.00 1.00 H new ATOM 0 HB3 ARG A 93 6.242 -1.169 -4.796 1.00 1.00 H new ATOM 0 HG2 ARG A 93 7.244 -1.784 -2.036 1.00 1.00 H new ATOM 0 HG3 ARG A 93 8.209 -0.662 -2.975 1.00 1.00 H new ATOM 0 HD2 ARG A 93 5.261 -0.394 -2.241 1.00 1.00 H new ATOM 0 HD3 ARG A 93 6.579 0.647 -1.741 1.00 1.00 H new ATOM 0 HE ARG A 93 5.102 0.817 -4.238 1.00 1.00 H new ATOM 0 HH11 ARG A 93 8.367 1.268 -2.862 1.00 1.00 H new ATOM 0 HH12 ARG A 93 8.847 2.446 -4.088 1.00 1.00 H new ATOM 0 HH21 ARG A 93 5.726 2.315 -5.791 1.00 1.00 H new ATOM 0 HH22 ARG A 93 7.337 3.039 -5.755 1.00 1.00 H new ATOM 330 N THR A 94 6.548 -5.025 -5.163 1.00 1.00 N ATOM 331 CA THR A 94 6.478 -5.902 -6.319 1.00 1.00 C ATOM 332 C THR A 94 6.354 -7.361 -5.874 1.00 1.00 C ATOM 333 O THR A 94 6.762 -7.715 -4.770 1.00 1.00 O ATOM 334 CB THR A 94 7.706 -5.635 -7.191 1.00 1.00 C ATOM 335 OG1 THR A 94 8.806 -5.791 -6.299 1.00 1.00 O ATOM 336 CG2 THR A 94 7.796 -4.177 -7.644 1.00 1.00 C ATOM 0 H THR A 94 7.172 -5.345 -4.422 1.00 1.00 H new ATOM 0 HA THR A 94 5.588 -5.700 -6.916 1.00 1.00 H new ATOM 0 HB THR A 94 7.679 -6.285 -8.065 1.00 1.00 H new ATOM 0 HG1 THR A 94 9.346 -6.560 -6.577 1.00 1.00 H new ATOM 0 HG21 THR A 94 8.685 -4.042 -8.260 1.00 1.00 H new ATOM 0 HG22 THR A 94 6.910 -3.921 -8.225 1.00 1.00 H new ATOM 0 HG23 THR A 94 7.857 -3.528 -6.771 1.00 1.00 H new ATOM 344 N PRO A 95 5.773 -8.191 -6.783 1.00 1.00 N ATOM 345 CA PRO A 95 5.591 -9.604 -6.496 1.00 1.00 C ATOM 346 C PRO A 95 6.917 -10.361 -6.599 1.00 1.00 C ATOM 347 O PRO A 95 7.072 -11.431 -6.013 1.00 1.00 O ATOM 348 CB PRO A 95 4.555 -10.079 -7.501 1.00 1.00 C ATOM 349 CG PRO A 95 4.541 -9.038 -8.608 1.00 1.00 C ATOM 350 CD PRO A 95 5.278 -7.809 -8.102 1.00 1.00 C ATOM 0 HA PRO A 95 5.250 -9.786 -5.477 1.00 1.00 H new ATOM 0 HB2 PRO A 95 4.813 -11.063 -7.893 1.00 1.00 H new ATOM 0 HB3 PRO A 95 3.573 -10.169 -7.037 1.00 1.00 H new ATOM 0 HG2 PRO A 95 5.021 -9.429 -9.505 1.00 1.00 H new ATOM 0 HG3 PRO A 95 3.517 -8.784 -8.880 1.00 1.00 H new ATOM 0 HD2 PRO A 95 6.096 -7.536 -8.768 1.00 1.00 H new ATOM 0 HD3 PRO A 95 4.615 -6.946 -8.041 1.00 1.00 H new ATOM 355 N SER A 96 7.838 -9.776 -7.350 1.00 1.00 N ATOM 356 CA SER A 96 9.145 -10.381 -7.538 1.00 1.00 C ATOM 357 C SER A 96 10.216 -9.293 -7.640 1.00 1.00 C ATOM 358 O SER A 96 9.899 -8.105 -7.656 1.00 1.00 O ATOM 359 CB SER A 96 9.168 -11.267 -8.785 1.00 1.00 C ATOM 360 OG SER A 96 9.385 -12.637 -8.463 1.00 1.00 O ATOM 0 H SER A 96 7.705 -8.889 -7.836 1.00 1.00 H new ATOM 0 HA SER A 96 9.357 -11.011 -6.674 1.00 1.00 H new ATOM 0 HB2 SER A 96 8.223 -11.166 -9.319 1.00 1.00 H new ATOM 0 HB3 SER A 96 9.953 -10.924 -9.459 1.00 1.00 H new ATOM 0 HG SER A 96 9.391 -13.169 -9.286 1.00 1.00 H new ATOM 365 N PRO A 97 11.495 -9.750 -7.708 1.00 1.00 N ATOM 366 CA PRO A 97 12.615 -8.829 -7.808 1.00 1.00 C ATOM 367 C PRO A 97 12.715 -8.238 -9.215 1.00 1.00 C ATOM 368 O PRO A 97 13.128 -7.092 -9.383 1.00 1.00 O ATOM 369 CB PRO A 97 13.834 -9.649 -7.420 1.00 1.00 C ATOM 370 CG PRO A 97 13.423 -11.105 -7.567 1.00 1.00 C ATOM 371 CD PRO A 97 11.908 -11.151 -7.691 1.00 1.00 C ATOM 0 HA PRO A 97 12.508 -7.964 -7.153 1.00 1.00 H new ATOM 0 HB2 PRO A 97 14.682 -9.416 -8.064 1.00 1.00 H new ATOM 0 HB3 PRO A 97 14.141 -9.432 -6.397 1.00 1.00 H new ATOM 0 HG2 PRO A 97 13.892 -11.547 -8.446 1.00 1.00 H new ATOM 0 HG3 PRO A 97 13.753 -11.684 -6.705 1.00 1.00 H new ATOM 0 HD2 PRO A 97 11.601 -11.666 -8.601 1.00 1.00 H new ATOM 0 HD3 PRO A 97 11.458 -11.686 -6.855 1.00 1.00 H new ATOM 376 N ASP A 98 12.329 -9.047 -10.191 1.00 1.00 N ATOM 377 CA ASP A 98 12.369 -8.620 -11.579 1.00 1.00 C ATOM 378 C ASP A 98 10.946 -8.573 -12.136 1.00 1.00 C ATOM 379 O ASP A 98 10.667 -9.149 -13.187 1.00 1.00 O ATOM 380 CB ASP A 98 13.180 -9.596 -12.433 1.00 1.00 C ATOM 381 CG ASP A 98 13.012 -11.072 -12.063 1.00 1.00 C ATOM 382 OD1 ASP A 98 13.741 -11.603 -11.212 1.00 1.00 O ATOM 383 OD2 ASP A 98 12.076 -11.690 -12.698 1.00 1.00 O ATOM 0 H ASP A 98 11.987 -9.997 -10.047 1.00 1.00 H new ATOM 0 HA ASP A 98 12.836 -7.636 -11.615 1.00 1.00 H new ATOM 0 HB2 ASP A 98 12.897 -9.464 -13.477 1.00 1.00 H new ATOM 0 HB3 ASP A 98 14.235 -9.335 -12.354 1.00 1.00 H new ATOM 388 N ALA A 99 10.081 -7.882 -11.408 1.00 1.00 N ATOM 389 CA ALA A 99 8.692 -7.753 -11.815 1.00 1.00 C ATOM 390 C ALA A 99 8.254 -6.295 -11.666 1.00 1.00 C ATOM 391 O ALA A 99 8.736 -5.586 -10.785 1.00 1.00 O ATOM 392 CB ALA A 99 7.827 -8.709 -10.991 1.00 1.00 C ATOM 0 H ALA A 99 10.316 -7.405 -10.538 1.00 1.00 H new ATOM 0 HA ALA A 99 8.573 -8.027 -12.863 1.00 1.00 H new ATOM 0 HB1 ALA A 99 6.785 -8.612 -11.296 1.00 1.00 H new ATOM 0 HB2 ALA A 99 8.159 -9.734 -11.156 1.00 1.00 H new ATOM 0 HB3 ALA A 99 7.919 -8.463 -9.933 1.00 1.00 H new ATOM 398 N LYS A 100 7.346 -5.891 -12.543 1.00 1.00 N ATOM 399 CA LYS A 100 6.838 -4.530 -12.519 1.00 1.00 C ATOM 400 C LYS A 100 6.412 -4.173 -11.093 1.00 1.00 C ATOM 401 O LYS A 100 6.378 -5.036 -10.218 1.00 1.00 O ATOM 402 CB LYS A 100 5.727 -4.355 -13.556 1.00 1.00 C ATOM 403 CG LYS A 100 6.107 -5.012 -14.884 1.00 1.00 C ATOM 404 CD LYS A 100 5.380 -6.345 -15.066 1.00 1.00 C ATOM 405 CE LYS A 100 6.372 -7.474 -15.355 1.00 1.00 C ATOM 406 NZ LYS A 100 6.315 -7.862 -16.782 1.00 1.00 N ATOM 0 H LYS A 100 6.950 -6.482 -13.274 1.00 1.00 H new ATOM 0 HA LYS A 100 7.621 -3.826 -12.803 1.00 1.00 H new ATOM 0 HB2 LYS A 100 4.802 -4.794 -13.181 1.00 1.00 H new ATOM 0 HB3 LYS A 100 5.535 -3.294 -13.713 1.00 1.00 H new ATOM 0 HG2 LYS A 100 5.859 -4.343 -15.708 1.00 1.00 H new ATOM 0 HG3 LYS A 100 7.184 -5.174 -14.918 1.00 1.00 H new ATOM 0 HD2 LYS A 100 4.810 -6.578 -14.167 1.00 1.00 H new ATOM 0 HD3 LYS A 100 4.665 -6.265 -15.885 1.00 1.00 H new ATOM 0 HE2 LYS A 100 7.382 -7.153 -15.100 1.00 1.00 H new ATOM 0 HE3 LYS A 100 6.143 -8.336 -14.728 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 6.994 -8.629 -16.961 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 5.355 -8.188 -17.015 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 6.555 -7.042 -17.375 1.00 1.00 H new ATOM 415 N ALA A 101 6.096 -2.900 -10.905 1.00 1.00 N ATOM 416 CA ALA A 101 5.674 -2.419 -9.601 1.00 1.00 C ATOM 417 C ALA A 101 4.148 -2.301 -9.576 1.00 1.00 C ATOM 418 O ALA A 101 3.542 -1.836 -10.540 1.00 1.00 O ATOM 419 CB ALA A 101 6.366 -1.089 -9.298 1.00 1.00 C ATOM 0 H ALA A 101 6.124 -2.187 -11.634 1.00 1.00 H new ATOM 0 HA ALA A 101 5.964 -3.122 -8.820 1.00 1.00 H new ATOM 0 HB1 ALA A 101 6.049 -0.729 -8.319 1.00 1.00 H new ATOM 0 HB2 ALA A 101 7.447 -1.232 -9.299 1.00 1.00 H new ATOM 0 HB3 ALA A 101 6.096 -0.357 -10.059 1.00 1.00 H new ATOM 425 N PHE A 102 3.572 -2.730 -8.463 1.00 1.00 N ATOM 426 CA PHE A 102 2.129 -2.679 -8.299 1.00 1.00 C ATOM 427 C PHE A 102 1.622 -1.236 -8.362 1.00 1.00 C ATOM 428 O PHE A 102 0.565 -0.971 -8.933 1.00 1.00 O ATOM 429 CB PHE A 102 1.814 -3.257 -6.918 1.00 1.00 C ATOM 430 CG PHE A 102 1.701 -4.783 -6.894 1.00 1.00 C ATOM 431 CD1 PHE A 102 0.641 -5.396 -7.486 1.00 1.00 C ATOM 432 CD2 PHE A 102 2.661 -5.526 -6.282 1.00 1.00 C ATOM 433 CE1 PHE A 102 0.535 -6.812 -7.463 1.00 1.00 C ATOM 434 CE2 PHE A 102 2.555 -6.942 -6.259 1.00 1.00 C ATOM 435 CZ PHE A 102 1.495 -7.555 -6.850 1.00 1.00 C ATOM 0 H PHE A 102 4.078 -3.115 -7.666 1.00 1.00 H new ATOM 0 HA PHE A 102 1.644 -3.243 -9.096 1.00 1.00 H new ATOM 0 HB2 PHE A 102 2.593 -2.949 -6.220 1.00 1.00 H new ATOM 0 HB3 PHE A 102 0.878 -2.828 -6.560 1.00 1.00 H new ATOM 0 HD1 PHE A 102 -0.120 -4.806 -7.974 1.00 1.00 H new ATOM 0 HD2 PHE A 102 3.504 -5.040 -5.814 1.00 1.00 H new ATOM 0 HE1 PHE A 102 -0.307 -7.298 -7.932 1.00 1.00 H new ATOM 0 HE2 PHE A 102 3.317 -7.532 -5.772 1.00 1.00 H new ATOM 0 HZ PHE A 102 1.415 -8.632 -6.833 1.00 1.00 H new ATOM 444 N ILE A 103 2.398 -0.343 -7.767 1.00 1.00 N ATOM 445 CA ILE A 103 2.040 1.066 -7.749 1.00 1.00 C ATOM 446 C ILE A 103 3.299 1.910 -7.954 1.00 1.00 C ATOM 447 O ILE A 103 4.324 1.668 -7.317 1.00 1.00 O ATOM 448 CB ILE A 103 1.272 1.407 -6.470 1.00 1.00 C ATOM 449 CG1 ILE A 103 -0.121 0.775 -6.483 1.00 1.00 C ATOM 450 CG2 ILE A 103 1.214 2.920 -6.253 1.00 1.00 C ATOM 451 CD1 ILE A 103 -0.958 1.269 -5.300 1.00 1.00 C ATOM 0 H ILE A 103 3.273 -0.567 -7.294 1.00 1.00 H new ATOM 0 HA ILE A 103 1.363 1.298 -8.571 1.00 1.00 H new ATOM 0 HB ILE A 103 1.810 0.981 -5.623 1.00 1.00 H new ATOM 0 HG12 ILE A 103 -0.626 1.019 -7.418 1.00 1.00 H new ATOM 0 HG13 ILE A 103 -0.032 -0.311 -6.442 1.00 1.00 H new ATOM 0 HG21 ILE A 103 0.663 3.135 -5.338 1.00 1.00 H new ATOM 0 HG22 ILE A 103 2.227 3.315 -6.168 1.00 1.00 H new ATOM 0 HG23 ILE A 103 0.711 3.390 -7.098 1.00 1.00 H new ATOM 0 HD11 ILE A 103 -1.944 0.805 -5.333 1.00 1.00 H new ATOM 0 HD12 ILE A 103 -0.462 1.002 -4.367 1.00 1.00 H new ATOM 0 HD13 ILE A 103 -1.065 2.352 -5.357 1.00 1.00 H new ATOM 462 N GLU A 104 3.182 2.883 -8.845 1.00 1.00 N ATOM 463 CA GLU A 104 4.298 3.765 -9.142 1.00 1.00 C ATOM 464 C GLU A 104 3.900 5.223 -8.905 1.00 1.00 C ATOM 465 O GLU A 104 2.832 5.656 -9.334 1.00 1.00 O ATOM 466 CB GLU A 104 4.796 3.558 -10.574 1.00 1.00 C ATOM 467 CG GLU A 104 6.251 3.088 -10.586 1.00 1.00 C ATOM 468 CD GLU A 104 7.209 4.272 -10.732 1.00 1.00 C ATOM 469 OE1 GLU A 104 6.790 5.358 -11.160 1.00 1.00 O ATOM 470 OE2 GLU A 104 8.427 4.034 -10.382 1.00 1.00 O ATOM 0 H GLU A 104 2.331 3.080 -9.371 1.00 1.00 H new ATOM 0 HA GLU A 104 5.119 3.519 -8.469 1.00 1.00 H new ATOM 0 HB2 GLU A 104 4.169 2.823 -11.078 1.00 1.00 H new ATOM 0 HB3 GLU A 104 4.707 4.490 -11.132 1.00 1.00 H new ATOM 0 HG2 GLU A 104 6.471 2.550 -9.664 1.00 1.00 H new ATOM 0 HG3 GLU A 104 6.404 2.388 -11.408 1.00 1.00 H new ATOM 476 N VAL A 105 4.782 5.941 -8.224 1.00 1.00 N ATOM 477 CA VAL A 105 4.536 7.341 -7.925 1.00 1.00 C ATOM 478 C VAL A 105 3.897 8.013 -9.143 1.00 1.00 C ATOM 479 O VAL A 105 4.515 8.102 -10.203 1.00 1.00 O ATOM 480 CB VAL A 105 5.835 8.017 -7.482 1.00 1.00 C ATOM 481 CG1 VAL A 105 5.592 9.483 -7.113 1.00 1.00 C ATOM 482 CG2 VAL A 105 6.479 7.260 -6.319 1.00 1.00 C ATOM 0 H VAL A 105 5.668 5.579 -7.871 1.00 1.00 H new ATOM 0 HA VAL A 105 3.836 7.438 -7.095 1.00 1.00 H new ATOM 0 HB VAL A 105 6.528 7.992 -8.323 1.00 1.00 H new ATOM 0 HG11 VAL A 105 6.531 9.940 -6.802 1.00 1.00 H new ATOM 0 HG12 VAL A 105 5.198 10.016 -7.979 1.00 1.00 H new ATOM 0 HG13 VAL A 105 4.873 9.538 -6.296 1.00 1.00 H new ATOM 0 HG21 VAL A 105 7.401 7.762 -6.024 1.00 1.00 H new ATOM 0 HG22 VAL A 105 5.791 7.238 -5.474 1.00 1.00 H new ATOM 0 HG23 VAL A 105 6.705 6.240 -6.629 1.00 1.00 H new ATOM 492 N GLY A 106 2.668 8.470 -8.950 1.00 1.00 N ATOM 493 CA GLY A 106 1.940 9.131 -10.019 1.00 1.00 C ATOM 494 C GLY A 106 0.955 8.170 -10.688 1.00 1.00 C ATOM 495 O GLY A 106 0.914 8.069 -11.912 1.00 1.00 O ATOM 0 H GLY A 106 2.159 8.395 -8.069 1.00 1.00 H new ATOM 0 HA2 GLY A 106 1.401 9.990 -9.620 1.00 1.00 H new ATOM 0 HA3 GLY A 106 2.642 9.512 -10.760 1.00 1.00 H new ATOM 499 N GLN A 107 0.185 7.487 -9.853 1.00 1.00 N ATOM 500 CA GLN A 107 -0.797 6.536 -10.348 1.00 1.00 C ATOM 501 C GLN A 107 -1.988 6.458 -9.391 1.00 1.00 C ATOM 502 O GLN A 107 -1.856 6.752 -8.203 1.00 1.00 O ATOM 503 CB GLN A 107 -0.169 5.157 -10.556 1.00 1.00 C ATOM 504 CG GLN A 107 -0.621 4.544 -11.883 1.00 1.00 C ATOM 505 CD GLN A 107 0.271 3.363 -12.272 1.00 1.00 C ATOM 506 OE1 GLN A 107 1.128 3.459 -13.135 1.00 1.00 O ATOM 507 NE2 GLN A 107 0.020 2.249 -11.592 1.00 1.00 N ATOM 0 H GLN A 107 0.221 7.573 -8.837 1.00 1.00 H new ATOM 0 HA GLN A 107 -1.156 6.884 -11.317 1.00 1.00 H new ATOM 0 HB2 GLN A 107 0.918 5.242 -10.542 1.00 1.00 H new ATOM 0 HB3 GLN A 107 -0.448 4.499 -9.733 1.00 1.00 H new ATOM 0 HG2 GLN A 107 -1.656 4.211 -11.801 1.00 1.00 H new ATOM 0 HG3 GLN A 107 -0.591 5.301 -12.667 1.00 1.00 H new ATOM 0 HE21 GLN A 107 -0.713 2.239 -10.882 1.00 1.00 H new ATOM 0 HE22 GLN A 107 0.560 1.404 -11.780 1.00 1.00 H new ATOM 514 N LYS A 108 -3.125 6.059 -9.943 1.00 1.00 N ATOM 515 CA LYS A 108 -4.338 5.938 -9.153 1.00 1.00 C ATOM 516 C LYS A 108 -4.653 4.456 -8.935 1.00 1.00 C ATOM 517 O LYS A 108 -4.062 3.590 -9.578 1.00 1.00 O ATOM 518 CB LYS A 108 -5.481 6.720 -9.803 1.00 1.00 C ATOM 519 CG LYS A 108 -6.754 6.634 -8.960 1.00 1.00 C ATOM 520 CD LYS A 108 -7.823 7.598 -9.479 1.00 1.00 C ATOM 521 CE LYS A 108 -9.106 6.848 -9.845 1.00 1.00 C ATOM 522 NZ LYS A 108 -8.865 5.937 -10.987 1.00 1.00 N ATOM 0 H LYS A 108 -3.231 5.816 -10.928 1.00 1.00 H new ATOM 0 HA LYS A 108 -4.198 6.383 -8.168 1.00 1.00 H new ATOM 0 HB2 LYS A 108 -5.190 7.764 -9.923 1.00 1.00 H new ATOM 0 HB3 LYS A 108 -5.674 6.326 -10.801 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -7.139 5.614 -8.979 1.00 1.00 H new ATOM 0 HG3 LYS A 108 -6.522 6.868 -7.921 1.00 1.00 H new ATOM 0 HD2 LYS A 108 -8.040 8.349 -8.719 1.00 1.00 H new ATOM 0 HD3 LYS A 108 -7.446 8.129 -10.353 1.00 1.00 H new ATOM 0 HE2 LYS A 108 -9.459 6.278 -8.986 1.00 1.00 H new ATOM 0 HE3 LYS A 108 -9.891 7.560 -10.099 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 -9.486 6.201 -11.779 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 -7.872 6.011 -11.287 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 -9.068 4.958 -10.699 1.00 1.00 H new ATOM 531 N VAL A 109 -5.586 4.210 -8.027 1.00 1.00 N ATOM 532 CA VAL A 109 -5.987 2.849 -7.716 1.00 1.00 C ATOM 533 C VAL A 109 -7.472 2.831 -7.348 1.00 1.00 C ATOM 534 O VAL A 109 -7.975 3.770 -6.733 1.00 1.00 O ATOM 535 CB VAL A 109 -5.091 2.277 -6.615 1.00 1.00 C ATOM 536 CG1 VAL A 109 -3.663 2.070 -7.123 1.00 1.00 C ATOM 537 CG2 VAL A 109 -5.108 3.173 -5.376 1.00 1.00 C ATOM 0 H VAL A 109 -6.076 4.931 -7.497 1.00 1.00 H new ATOM 0 HA VAL A 109 -5.860 2.205 -8.586 1.00 1.00 H new ATOM 0 HB VAL A 109 -5.489 1.303 -6.330 1.00 1.00 H new ATOM 0 HG11 VAL A 109 -3.047 1.663 -6.321 1.00 1.00 H new ATOM 0 HG12 VAL A 109 -3.673 1.374 -7.962 1.00 1.00 H new ATOM 0 HG13 VAL A 109 -3.250 3.025 -7.448 1.00 1.00 H new ATOM 0 HG21 VAL A 109 -4.464 2.745 -4.608 1.00 1.00 H new ATOM 0 HG22 VAL A 109 -4.746 4.167 -5.641 1.00 1.00 H new ATOM 0 HG23 VAL A 109 -6.126 3.247 -4.995 1.00 1.00 H new ATOM 547 N ASN A 110 -8.133 1.751 -7.740 1.00 1.00 N ATOM 548 CA ASN A 110 -9.550 1.599 -7.459 1.00 1.00 C ATOM 549 C ASN A 110 -9.761 0.373 -6.568 1.00 1.00 C ATOM 550 O ASN A 110 -9.080 -0.639 -6.728 1.00 1.00 O ATOM 551 CB ASN A 110 -10.348 1.389 -8.748 1.00 1.00 C ATOM 552 CG ASN A 110 -10.539 2.709 -9.495 1.00 1.00 C ATOM 553 OD1 ASN A 110 -9.593 3.377 -9.881 1.00 1.00 O ATOM 554 ND2 ASN A 110 -11.812 3.048 -9.680 1.00 1.00 N ATOM 0 H ASN A 110 -7.713 0.974 -8.250 1.00 1.00 H new ATOM 0 HA ASN A 110 -9.895 2.507 -6.965 1.00 1.00 H new ATOM 0 HB2 ASN A 110 -9.829 0.676 -9.389 1.00 1.00 H new ATOM 0 HB3 ASN A 110 -11.320 0.957 -8.512 1.00 1.00 H new ATOM 0 HD21 ASN A 110 -12.044 3.912 -10.170 1.00 1.00 H new ATOM 0 HD22 ASN A 110 -12.556 2.444 -9.332 1.00 1.00 H new ATOM 560 N VAL A 111 -10.705 0.504 -5.648 1.00 1.00 N ATOM 561 CA VAL A 111 -11.013 -0.580 -4.731 1.00 1.00 C ATOM 562 C VAL A 111 -10.977 -1.909 -5.489 1.00 1.00 C ATOM 563 O VAL A 111 -11.858 -2.189 -6.301 1.00 1.00 O ATOM 564 CB VAL A 111 -12.355 -0.320 -4.044 1.00 1.00 C ATOM 565 CG1 VAL A 111 -12.988 -1.628 -3.566 1.00 1.00 C ATOM 566 CG2 VAL A 111 -12.197 0.668 -2.888 1.00 1.00 C ATOM 0 H VAL A 111 -11.267 1.345 -5.518 1.00 1.00 H new ATOM 0 HA VAL A 111 -10.264 -0.636 -3.941 1.00 1.00 H new ATOM 0 HB VAL A 111 -13.026 0.128 -4.777 1.00 1.00 H new ATOM 0 HG11 VAL A 111 -13.941 -1.415 -3.081 1.00 1.00 H new ATOM 0 HG12 VAL A 111 -13.154 -2.285 -4.420 1.00 1.00 H new ATOM 0 HG13 VAL A 111 -12.321 -2.117 -2.856 1.00 1.00 H new ATOM 0 HG21 VAL A 111 -13.166 0.835 -2.417 1.00 1.00 H new ATOM 0 HG22 VAL A 111 -11.502 0.261 -2.154 1.00 1.00 H new ATOM 0 HG23 VAL A 111 -11.810 1.614 -3.268 1.00 1.00 H new ATOM 576 N GLY A 112 -9.948 -2.692 -5.198 1.00 1.00 N ATOM 577 CA GLY A 112 -9.785 -3.984 -5.842 1.00 1.00 C ATOM 578 C GLY A 112 -8.428 -4.082 -6.541 1.00 1.00 C ATOM 579 O GLY A 112 -8.037 -5.153 -7.001 1.00 1.00 O ATOM 0 H GLY A 112 -9.219 -2.456 -4.525 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -9.874 -4.778 -5.100 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -10.584 -4.136 -6.568 1.00 1.00 H new ATOM 583 N ASP A 113 -7.745 -2.947 -6.598 1.00 1.00 N ATOM 584 CA ASP A 113 -6.439 -2.892 -7.232 1.00 1.00 C ATOM 585 C ASP A 113 -5.353 -3.099 -6.174 1.00 1.00 C ATOM 586 O ASP A 113 -5.395 -2.486 -5.109 1.00 1.00 O ATOM 587 CB ASP A 113 -6.203 -1.531 -7.891 1.00 1.00 C ATOM 588 CG ASP A 113 -6.587 -1.452 -9.368 1.00 1.00 C ATOM 589 OD1 ASP A 113 -7.772 -1.336 -9.716 1.00 1.00 O ATOM 590 OD2 ASP A 113 -5.597 -1.515 -10.193 1.00 1.00 O ATOM 0 H ASP A 113 -8.072 -2.060 -6.216 1.00 1.00 H new ATOM 0 HA ASP A 113 -6.401 -3.673 -7.992 1.00 1.00 H new ATOM 0 HB2 ASP A 113 -6.768 -0.777 -7.344 1.00 1.00 H new ATOM 0 HB3 ASP A 113 -5.148 -1.274 -7.791 1.00 1.00 H new ATOM 595 N THR A 114 -4.407 -3.966 -6.505 1.00 1.00 N ATOM 596 CA THR A 114 -3.313 -4.262 -5.597 1.00 1.00 C ATOM 597 C THR A 114 -2.610 -2.971 -5.171 1.00 1.00 C ATOM 598 O THR A 114 -2.438 -2.058 -5.977 1.00 1.00 O ATOM 599 CB THR A 114 -2.382 -5.260 -6.288 1.00 1.00 C ATOM 600 OG1 THR A 114 -3.208 -6.397 -6.528 1.00 1.00 O ATOM 601 CG2 THR A 114 -1.289 -5.785 -5.355 1.00 1.00 C ATOM 0 H THR A 114 -4.376 -4.473 -7.390 1.00 1.00 H new ATOM 0 HA THR A 114 -3.676 -4.718 -4.676 1.00 1.00 H new ATOM 0 HB THR A 114 -1.922 -4.786 -7.155 1.00 1.00 H new ATOM 0 HG1 THR A 114 -2.684 -7.093 -6.976 1.00 1.00 H new ATOM 0 HG21 THR A 114 -0.657 -6.489 -5.896 1.00 1.00 H new ATOM 0 HG22 THR A 114 -0.683 -4.952 -5.000 1.00 1.00 H new ATOM 0 HG23 THR A 114 -1.748 -6.289 -4.504 1.00 1.00 H new ATOM 609 N LEU A 115 -2.221 -2.937 -3.904 1.00 1.00 N ATOM 610 CA LEU A 115 -1.540 -1.775 -3.361 1.00 1.00 C ATOM 611 C LEU A 115 -0.097 -2.147 -3.017 1.00 1.00 C ATOM 612 O LEU A 115 0.804 -1.317 -3.121 1.00 1.00 O ATOM 613 CB LEU A 115 -2.324 -1.198 -2.180 1.00 1.00 C ATOM 614 CG LEU A 115 -2.256 -1.996 -0.877 1.00 1.00 C ATOM 615 CD1 LEU A 115 -1.151 -1.459 0.037 1.00 1.00 C ATOM 616 CD2 LEU A 115 -3.617 -2.021 -0.177 1.00 1.00 C ATOM 0 H LEU A 115 -2.365 -3.696 -3.238 1.00 1.00 H new ATOM 0 HA LEU A 115 -1.495 -0.979 -4.105 1.00 1.00 H new ATOM 0 HB2 LEU A 115 -1.959 -0.190 -1.985 1.00 1.00 H new ATOM 0 HB3 LEU A 115 -3.370 -1.107 -2.473 1.00 1.00 H new ATOM 0 HG LEU A 115 -2.001 -3.027 -1.121 1.00 1.00 H new ATOM 0 HD11 LEU A 115 -1.123 -2.043 0.957 1.00 1.00 H new ATOM 0 HD12 LEU A 115 -0.190 -1.536 -0.471 1.00 1.00 H new ATOM 0 HD13 LEU A 115 -1.352 -0.415 0.277 1.00 1.00 H new ATOM 0 HD21 LEU A 115 -3.541 -2.595 0.747 1.00 1.00 H new ATOM 0 HD22 LEU A 115 -3.926 -1.002 0.054 1.00 1.00 H new ATOM 0 HD23 LEU A 115 -4.355 -2.484 -0.832 1.00 1.00 H new ATOM 627 N CYS A 116 0.077 -3.398 -2.615 1.00 1.00 N ATOM 628 CA CYS A 116 1.396 -3.891 -2.255 1.00 1.00 C ATOM 629 C CYS A 116 1.268 -5.366 -1.868 1.00 1.00 C ATOM 630 O CYS A 116 0.257 -6.003 -2.162 1.00 1.00 O ATOM 631 CB CYS A 116 2.025 -3.060 -1.135 1.00 1.00 C ATOM 632 SG CYS A 116 1.186 -3.413 0.453 1.00 1.00 S ATOM 0 H CYS A 116 -0.673 -4.084 -2.531 1.00 1.00 H new ATOM 0 HA CYS A 116 2.067 -3.797 -3.108 1.00 1.00 H new ATOM 0 HB2 CYS A 116 3.087 -3.290 -1.053 1.00 1.00 H new ATOM 0 HB3 CYS A 116 1.945 -1.999 -1.370 1.00 1.00 H new ATOM 0 HG CYS A 116 1.882 -2.915 1.432 1.00 1.00 H new ATOM 637 N ILE A 117 2.307 -5.865 -1.215 1.00 1.00 N ATOM 638 CA ILE A 117 2.323 -7.253 -0.785 1.00 1.00 C ATOM 639 C ILE A 117 2.851 -7.332 0.650 1.00 1.00 C ATOM 640 O ILE A 117 3.492 -6.399 1.132 1.00 1.00 O ATOM 641 CB ILE A 117 3.109 -8.112 -1.777 1.00 1.00 C ATOM 642 CG1 ILE A 117 2.848 -7.666 -3.217 1.00 1.00 C ATOM 643 CG2 ILE A 117 2.809 -9.599 -1.574 1.00 1.00 C ATOM 644 CD1 ILE A 117 1.450 -8.084 -3.674 1.00 1.00 C ATOM 0 H ILE A 117 3.143 -5.334 -0.973 1.00 1.00 H new ATOM 0 HA ILE A 117 1.312 -7.661 -0.776 1.00 1.00 H new ATOM 0 HB ILE A 117 4.172 -7.969 -1.584 1.00 1.00 H new ATOM 0 HG12 ILE A 117 2.950 -6.583 -3.291 1.00 1.00 H new ATOM 0 HG13 ILE A 117 3.597 -8.102 -3.878 1.00 1.00 H new ATOM 0 HG21 ILE A 117 3.381 -10.187 -2.292 1.00 1.00 H new ATOM 0 HG22 ILE A 117 3.088 -9.892 -0.562 1.00 1.00 H new ATOM 0 HG23 ILE A 117 1.744 -9.779 -1.723 1.00 1.00 H new ATOM 0 HD11 ILE A 117 1.289 -7.755 -4.701 1.00 1.00 H new ATOM 0 HD12 ILE A 117 1.360 -9.169 -3.622 1.00 1.00 H new ATOM 0 HD13 ILE A 117 0.703 -7.626 -3.025 1.00 1.00 H new ATOM 655 N VAL A 118 2.561 -8.454 1.291 1.00 1.00 N ATOM 656 CA VAL A 118 2.998 -8.667 2.661 1.00 1.00 C ATOM 657 C VAL A 118 3.372 -10.138 2.850 1.00 1.00 C ATOM 658 O VAL A 118 2.534 -11.022 2.679 1.00 1.00 O ATOM 659 CB VAL A 118 1.916 -8.195 3.635 1.00 1.00 C ATOM 660 CG1 VAL A 118 2.073 -8.871 4.998 1.00 1.00 C ATOM 661 CG2 VAL A 118 1.929 -6.672 3.773 1.00 1.00 C ATOM 0 H VAL A 118 2.029 -9.225 0.888 1.00 1.00 H new ATOM 0 HA VAL A 118 3.889 -8.076 2.874 1.00 1.00 H new ATOM 0 HB VAL A 118 0.948 -8.485 3.227 1.00 1.00 H new ATOM 0 HG11 VAL A 118 1.292 -8.518 5.671 1.00 1.00 H new ATOM 0 HG12 VAL A 118 1.990 -9.951 4.880 1.00 1.00 H new ATOM 0 HG13 VAL A 118 3.050 -8.626 5.415 1.00 1.00 H new ATOM 0 HG21 VAL A 118 1.151 -6.363 4.471 1.00 1.00 H new ATOM 0 HG22 VAL A 118 2.900 -6.349 4.147 1.00 1.00 H new ATOM 0 HG23 VAL A 118 1.745 -6.217 2.800 1.00 1.00 H new ATOM 671 N GLU A 119 4.632 -10.355 3.200 1.00 1.00 N ATOM 672 CA GLU A 119 5.127 -11.705 3.413 1.00 1.00 C ATOM 673 C GLU A 119 5.208 -12.009 4.911 1.00 1.00 C ATOM 674 O GLU A 119 5.594 -11.151 5.703 1.00 1.00 O ATOM 675 CB GLU A 119 6.486 -11.903 2.739 1.00 1.00 C ATOM 676 CG GLU A 119 6.447 -13.079 1.761 1.00 1.00 C ATOM 677 CD GLU A 119 7.264 -12.775 0.504 1.00 1.00 C ATOM 678 OE1 GLU A 119 8.470 -13.061 0.465 1.00 1.00 O ATOM 679 OE2 GLU A 119 6.603 -12.220 -0.455 1.00 1.00 O ATOM 0 H GLU A 119 5.324 -9.619 3.341 1.00 1.00 H new ATOM 0 HA GLU A 119 4.427 -12.405 2.957 1.00 1.00 H new ATOM 0 HB2 GLU A 119 6.769 -10.994 2.209 1.00 1.00 H new ATOM 0 HB3 GLU A 119 7.249 -12.081 3.497 1.00 1.00 H new ATOM 0 HG2 GLU A 119 6.839 -13.973 2.246 1.00 1.00 H new ATOM 0 HG3 GLU A 119 5.414 -13.293 1.485 1.00 1.00 H new ATOM 685 N ALA A 120 4.837 -13.233 5.254 1.00 1.00 N ATOM 686 CA ALA A 120 4.863 -13.662 6.642 1.00 1.00 C ATOM 687 C ALA A 120 4.765 -15.189 6.702 1.00 1.00 C ATOM 688 O ALA A 120 4.066 -15.801 5.896 1.00 1.00 O ATOM 689 CB ALA A 120 3.733 -12.975 7.409 1.00 1.00 C ATOM 0 H ALA A 120 4.516 -13.942 4.595 1.00 1.00 H new ATOM 0 HA ALA A 120 5.801 -13.373 7.116 1.00 1.00 H new ATOM 0 HB1 ALA A 120 3.752 -13.297 8.450 1.00 1.00 H new ATOM 0 HB2 ALA A 120 3.865 -11.894 7.360 1.00 1.00 H new ATOM 0 HB3 ALA A 120 2.775 -13.244 6.964 1.00 1.00 H new ATOM 695 N MET A 121 5.475 -15.757 7.664 1.00 1.00 N ATOM 696 CA MET A 121 5.477 -17.200 7.840 1.00 1.00 C ATOM 697 C MET A 121 5.873 -17.910 6.544 1.00 1.00 C ATOM 698 O MET A 121 5.521 -19.069 6.334 1.00 1.00 O ATOM 699 CB MET A 121 4.085 -17.663 8.272 1.00 1.00 C ATOM 700 CG MET A 121 3.827 -17.330 9.743 1.00 1.00 C ATOM 701 SD MET A 121 3.198 -18.768 10.594 1.00 1.00 S ATOM 702 CE MET A 121 1.445 -18.496 10.405 1.00 1.00 C ATOM 0 H MET A 121 6.053 -15.245 8.330 1.00 1.00 H new ATOM 0 HA MET A 121 6.208 -17.453 8.608 1.00 1.00 H new ATOM 0 HB2 MET A 121 3.329 -17.184 7.649 1.00 1.00 H new ATOM 0 HB3 MET A 121 3.991 -18.738 8.117 1.00 1.00 H new ATOM 0 HG2 MET A 121 4.750 -16.993 10.215 1.00 1.00 H new ATOM 0 HG3 MET A 121 3.112 -16.511 9.819 1.00 1.00 H new ATOM 0 HE1 MET A 121 0.897 -19.308 10.883 1.00 1.00 H new ATOM 0 HE2 MET A 121 1.171 -17.550 10.872 1.00 1.00 H new ATOM 0 HE3 MET A 121 1.194 -18.464 9.345 1.00 1.00 H new ATOM 710 N LYS A 122 6.599 -17.183 5.706 1.00 1.00 N ATOM 711 CA LYS A 122 7.045 -17.729 4.437 1.00 1.00 C ATOM 712 C LYS A 122 5.848 -17.864 3.495 1.00 1.00 C ATOM 713 O LYS A 122 5.758 -18.825 2.732 1.00 1.00 O ATOM 714 CB LYS A 122 7.809 -19.037 4.654 1.00 1.00 C ATOM 715 CG LYS A 122 8.906 -19.213 3.603 1.00 1.00 C ATOM 716 CD LYS A 122 8.546 -20.324 2.614 1.00 1.00 C ATOM 717 CE LYS A 122 9.296 -21.616 2.943 1.00 1.00 C ATOM 718 NZ LYS A 122 8.772 -22.740 2.136 1.00 1.00 N ATOM 0 H LYS A 122 6.889 -16.221 5.882 1.00 1.00 H new ATOM 0 HA LYS A 122 7.752 -17.051 3.959 1.00 1.00 H new ATOM 0 HB2 LYS A 122 8.251 -19.043 5.650 1.00 1.00 H new ATOM 0 HB3 LYS A 122 7.117 -19.878 4.607 1.00 1.00 H new ATOM 0 HG2 LYS A 122 9.053 -18.276 3.065 1.00 1.00 H new ATOM 0 HG3 LYS A 122 9.850 -19.450 4.094 1.00 1.00 H new ATOM 0 HD2 LYS A 122 7.472 -20.506 2.642 1.00 1.00 H new ATOM 0 HD3 LYS A 122 8.790 -20.006 1.600 1.00 1.00 H new ATOM 0 HE2 LYS A 122 10.360 -21.485 2.747 1.00 1.00 H new ATOM 0 HE3 LYS A 122 9.193 -21.843 4.004 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 9.292 -23.609 2.372 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 7.762 -22.874 2.343 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 8.893 -22.528 1.125 1.00 1.00 H new ATOM 727 N MET A 123 4.955 -16.889 3.579 1.00 1.00 N ATOM 728 CA MET A 123 3.767 -16.888 2.744 1.00 1.00 C ATOM 729 C MET A 123 3.492 -15.491 2.182 1.00 1.00 C ATOM 730 O MET A 123 3.746 -14.489 2.849 1.00 1.00 O ATOM 731 CB MET A 123 2.563 -17.351 3.568 1.00 1.00 C ATOM 732 CG MET A 123 1.693 -18.324 2.770 1.00 1.00 C ATOM 733 SD MET A 123 0.041 -18.358 3.442 1.00 1.00 S ATOM 734 CE MET A 123 0.154 -19.813 4.469 1.00 1.00 C ATOM 0 H MET A 123 5.031 -16.094 4.213 1.00 1.00 H new ATOM 0 HA MET A 123 3.933 -17.570 1.910 1.00 1.00 H new ATOM 0 HB2 MET A 123 2.908 -17.833 4.483 1.00 1.00 H new ATOM 0 HB3 MET A 123 1.969 -16.487 3.867 1.00 1.00 H new ATOM 0 HG2 MET A 123 1.662 -18.022 1.723 1.00 1.00 H new ATOM 0 HG3 MET A 123 2.128 -19.323 2.801 1.00 1.00 H new ATOM 0 HE1 MET A 123 -0.801 -19.982 4.967 1.00 1.00 H new ATOM 0 HE2 MET A 123 0.398 -20.677 3.851 1.00 1.00 H new ATOM 0 HE3 MET A 123 0.934 -19.670 5.217 1.00 1.00 H new ATOM 742 N MET A 124 2.979 -15.470 0.960 1.00 1.00 N ATOM 743 CA MET A 124 2.670 -14.213 0.300 1.00 1.00 C ATOM 744 C MET A 124 1.234 -13.777 0.601 1.00 1.00 C ATOM 745 O MET A 124 0.306 -14.579 0.517 1.00 1.00 O ATOM 746 CB MET A 124 2.849 -14.372 -1.210 1.00 1.00 C ATOM 747 CG MET A 124 4.331 -14.471 -1.579 1.00 1.00 C ATOM 748 SD MET A 124 4.703 -16.111 -2.175 1.00 1.00 S ATOM 749 CE MET A 124 5.186 -16.895 -0.645 1.00 1.00 C ATOM 0 H MET A 124 2.770 -16.303 0.410 1.00 1.00 H new ATOM 0 HA MET A 124 3.350 -13.449 0.676 1.00 1.00 H new ATOM 0 HB2 MET A 124 2.325 -15.266 -1.550 1.00 1.00 H new ATOM 0 HB3 MET A 124 2.398 -13.523 -1.725 1.00 1.00 H new ATOM 0 HG2 MET A 124 4.574 -13.733 -2.344 1.00 1.00 H new ATOM 0 HG3 MET A 124 4.947 -14.243 -0.709 1.00 1.00 H new ATOM 0 HE1 MET A 124 6.112 -17.449 -0.797 1.00 1.00 H new ATOM 0 HE2 MET A 124 5.339 -16.135 0.121 1.00 1.00 H new ATOM 0 HE3 MET A 124 4.402 -17.580 -0.324 1.00 1.00 H new ATOM 757 N ASN A 125 1.097 -12.504 0.945 1.00 1.00 N ATOM 758 CA ASN A 125 -0.210 -11.951 1.258 1.00 1.00 C ATOM 759 C ASN A 125 -0.367 -10.598 0.560 1.00 1.00 C ATOM 760 O ASN A 125 0.121 -9.582 1.051 1.00 1.00 O ATOM 761 CB ASN A 125 -0.367 -11.727 2.763 1.00 1.00 C ATOM 762 CG ASN A 125 -0.210 -13.040 3.532 1.00 1.00 C ATOM 763 OD1 ASN A 125 -1.173 -13.678 3.926 1.00 1.00 O ATOM 764 ND2 ASN A 125 1.054 -13.407 3.724 1.00 1.00 N ATOM 0 H ASN A 125 1.869 -11.841 1.014 1.00 1.00 H new ATOM 0 HA ASN A 125 -0.966 -12.659 0.918 1.00 1.00 H new ATOM 0 HB2 ASN A 125 0.377 -11.009 3.107 1.00 1.00 H new ATOM 0 HB3 ASN A 125 -1.346 -11.295 2.970 1.00 1.00 H new ATOM 0 HD21 ASN A 125 1.264 -14.269 4.227 1.00 1.00 H new ATOM 0 HD22 ASN A 125 1.813 -12.827 3.368 1.00 1.00 H new ATOM 770 N GLN A 126 -1.050 -10.630 -0.575 1.00 1.00 N ATOM 771 CA GLN A 126 -1.277 -9.419 -1.346 1.00 1.00 C ATOM 772 C GLN A 126 -2.274 -8.510 -0.624 1.00 1.00 C ATOM 773 O GLN A 126 -3.134 -8.989 0.114 1.00 1.00 O ATOM 774 CB GLN A 126 -1.761 -9.751 -2.759 1.00 1.00 C ATOM 775 CG GLN A 126 -0.615 -10.286 -3.619 1.00 1.00 C ATOM 776 CD GLN A 126 -0.949 -11.670 -4.180 1.00 1.00 C ATOM 777 OE1 GLN A 126 -0.340 -12.671 -3.839 1.00 1.00 O ATOM 778 NE2 GLN A 126 -1.950 -11.671 -5.056 1.00 1.00 N ATOM 0 H GLN A 126 -1.454 -11.475 -0.979 1.00 1.00 H new ATOM 0 HA GLN A 126 -0.330 -8.887 -1.438 1.00 1.00 H new ATOM 0 HB2 GLN A 126 -2.559 -10.491 -2.709 1.00 1.00 H new ATOM 0 HB3 GLN A 126 -2.182 -8.859 -3.222 1.00 1.00 H new ATOM 0 HG2 GLN A 126 -0.418 -9.595 -4.439 1.00 1.00 H new ATOM 0 HG3 GLN A 126 0.296 -10.342 -3.023 1.00 1.00 H new ATOM 0 HE21 GLN A 126 -2.417 -10.797 -5.297 1.00 1.00 H new ATOM 0 HE22 GLN A 126 -2.250 -12.546 -5.486 1.00 1.00 H new ATOM 785 N ILE A 127 -2.126 -7.215 -0.863 1.00 1.00 N ATOM 786 CA ILE A 127 -3.002 -6.235 -0.244 1.00 1.00 C ATOM 787 C ILE A 127 -3.697 -5.419 -1.336 1.00 1.00 C ATOM 788 O ILE A 127 -3.043 -4.701 -2.090 1.00 1.00 O ATOM 789 CB ILE A 127 -2.227 -5.382 0.761 1.00 1.00 C ATOM 790 CG1 ILE A 127 -1.359 -6.257 1.668 1.00 1.00 C ATOM 791 CG2 ILE A 127 -3.174 -4.487 1.564 1.00 1.00 C ATOM 792 CD1 ILE A 127 -0.968 -5.507 2.942 1.00 1.00 C ATOM 0 H ILE A 127 -1.412 -6.822 -1.477 1.00 1.00 H new ATOM 0 HA ILE A 127 -3.783 -6.732 0.331 1.00 1.00 H new ATOM 0 HB ILE A 127 -1.555 -4.726 0.207 1.00 1.00 H new ATOM 0 HG12 ILE A 127 -1.901 -7.166 1.929 1.00 1.00 H new ATOM 0 HG13 ILE A 127 -0.461 -6.564 1.132 1.00 1.00 H new ATOM 0 HG21 ILE A 127 -2.598 -3.890 2.272 1.00 1.00 H new ATOM 0 HG22 ILE A 127 -3.712 -3.825 0.885 1.00 1.00 H new ATOM 0 HG23 ILE A 127 -3.887 -5.107 2.108 1.00 1.00 H new ATOM 0 HD11 ILE A 127 -0.352 -6.151 3.569 1.00 1.00 H new ATOM 0 HD12 ILE A 127 -0.406 -4.611 2.679 1.00 1.00 H new ATOM 0 HD13 ILE A 127 -1.868 -5.223 3.488 1.00 1.00 H new ATOM 803 N GLU A 128 -5.014 -5.557 -1.386 1.00 1.00 N ATOM 804 CA GLU A 128 -5.805 -4.842 -2.373 1.00 1.00 C ATOM 805 C GLU A 128 -6.380 -3.560 -1.765 1.00 1.00 C ATOM 806 O GLU A 128 -6.994 -3.597 -0.700 1.00 1.00 O ATOM 807 CB GLU A 128 -6.917 -5.730 -2.933 1.00 1.00 C ATOM 808 CG GLU A 128 -6.736 -5.954 -4.436 1.00 1.00 C ATOM 809 CD GLU A 128 -7.794 -6.916 -4.978 1.00 1.00 C ATOM 810 OE1 GLU A 128 -8.980 -6.791 -4.636 1.00 1.00 O ATOM 811 OE2 GLU A 128 -7.349 -7.820 -5.784 1.00 1.00 O ATOM 0 H GLU A 128 -5.553 -6.154 -0.759 1.00 1.00 H new ATOM 0 HA GLU A 128 -5.153 -4.567 -3.202 1.00 1.00 H new ATOM 0 HB2 GLU A 128 -6.916 -6.690 -2.416 1.00 1.00 H new ATOM 0 HB3 GLU A 128 -7.886 -5.268 -2.745 1.00 1.00 H new ATOM 0 HG2 GLU A 128 -6.804 -5.001 -4.960 1.00 1.00 H new ATOM 0 HG3 GLU A 128 -5.741 -6.355 -4.630 1.00 1.00 H new ATOM 817 N ALA A 129 -6.161 -2.459 -2.468 1.00 1.00 N ATOM 818 CA ALA A 129 -6.649 -1.170 -2.011 1.00 1.00 C ATOM 819 C ALA A 129 -8.053 -1.339 -1.427 1.00 1.00 C ATOM 820 O ALA A 129 -8.907 -1.986 -2.031 1.00 1.00 O ATOM 821 CB ALA A 129 -6.617 -0.171 -3.169 1.00 1.00 C ATOM 0 H ALA A 129 -5.652 -2.433 -3.351 1.00 1.00 H new ATOM 0 HA ALA A 129 -6.008 -0.776 -1.222 1.00 1.00 H new ATOM 0 HB1 ALA A 129 -6.983 0.796 -2.825 1.00 1.00 H new ATOM 0 HB2 ALA A 129 -5.594 -0.064 -3.529 1.00 1.00 H new ATOM 0 HB3 ALA A 129 -7.251 -0.532 -3.979 1.00 1.00 H new ATOM 827 N ASP A 130 -8.248 -0.747 -0.257 1.00 1.00 N ATOM 828 CA ASP A 130 -9.533 -0.825 0.416 1.00 1.00 C ATOM 829 C ASP A 130 -10.213 0.546 0.366 1.00 1.00 C ATOM 830 O ASP A 130 -11.170 0.794 1.098 1.00 1.00 O ATOM 831 CB ASP A 130 -9.364 -1.216 1.885 1.00 1.00 C ATOM 832 CG ASP A 130 -10.275 -2.347 2.362 1.00 1.00 C ATOM 833 OD1 ASP A 130 -11.369 -2.559 1.818 1.00 1.00 O ATOM 834 OD2 ASP A 130 -9.815 -3.038 3.350 1.00 1.00 O ATOM 0 H ASP A 130 -7.537 -0.212 0.241 1.00 1.00 H new ATOM 0 HA ASP A 130 -10.134 -1.581 -0.090 1.00 1.00 H new ATOM 0 HB2 ASP A 130 -8.328 -1.511 2.050 1.00 1.00 H new ATOM 0 HB3 ASP A 130 -9.548 -0.337 2.503 1.00 1.00 H new ATOM 839 N LYS A 131 -9.692 1.399 -0.502 1.00 1.00 N ATOM 840 CA LYS A 131 -10.236 2.738 -0.657 1.00 1.00 C ATOM 841 C LYS A 131 -9.536 3.437 -1.824 1.00 1.00 C ATOM 842 O LYS A 131 -8.460 4.007 -1.655 1.00 1.00 O ATOM 843 CB LYS A 131 -10.148 3.507 0.664 1.00 1.00 C ATOM 844 CG LYS A 131 -11.006 4.772 0.618 1.00 1.00 C ATOM 845 CD LYS A 131 -10.146 6.025 0.802 1.00 1.00 C ATOM 846 CE LYS A 131 -10.882 7.078 1.634 1.00 1.00 C ATOM 847 NZ LYS A 131 -10.430 7.034 3.042 1.00 1.00 N ATOM 0 H LYS A 131 -8.898 1.189 -1.107 1.00 1.00 H new ATOM 0 HA LYS A 131 -11.297 2.693 -0.903 1.00 1.00 H new ATOM 0 HB2 LYS A 131 -10.478 2.869 1.484 1.00 1.00 H new ATOM 0 HB3 LYS A 131 -9.111 3.774 0.866 1.00 1.00 H new ATOM 0 HG2 LYS A 131 -11.532 4.824 -0.335 1.00 1.00 H new ATOM 0 HG3 LYS A 131 -11.765 4.730 1.399 1.00 1.00 H new ATOM 0 HD2 LYS A 131 -9.209 5.759 1.292 1.00 1.00 H new ATOM 0 HD3 LYS A 131 -9.889 6.441 -0.172 1.00 1.00 H new ATOM 0 HE2 LYS A 131 -10.702 8.069 1.219 1.00 1.00 H new ATOM 0 HE3 LYS A 131 -11.957 6.903 1.585 1.00 1.00 H new ATOM 0 HZ1 LYS A 131 -10.939 7.755 3.593 1.00 1.00 H new ATOM 0 HZ2 LYS A 131 -10.624 6.093 3.440 1.00 1.00 H new ATOM 0 HZ3 LYS A 131 -9.408 7.224 3.085 1.00 1.00 H new ATOM 856 N SER A 132 -10.177 3.369 -2.981 1.00 1.00 N ATOM 857 CA SER A 132 -9.629 3.989 -4.176 1.00 1.00 C ATOM 858 C SER A 132 -8.992 5.333 -3.823 1.00 1.00 C ATOM 859 O SER A 132 -9.458 6.029 -2.921 1.00 1.00 O ATOM 860 CB SER A 132 -10.710 4.178 -5.243 1.00 1.00 C ATOM 861 OG SER A 132 -11.565 5.279 -4.947 1.00 1.00 O ATOM 0 H SER A 132 -11.070 2.895 -3.117 1.00 1.00 H new ATOM 0 HA SER A 132 -8.864 3.328 -4.584 1.00 1.00 H new ATOM 0 HB2 SER A 132 -10.238 4.336 -6.213 1.00 1.00 H new ATOM 0 HB3 SER A 132 -11.305 3.268 -5.322 1.00 1.00 H new ATOM 0 HG SER A 132 -12.240 5.368 -5.652 1.00 1.00 H new ATOM 866 N GLY A 133 -7.934 5.661 -4.552 1.00 1.00 N ATOM 867 CA GLY A 133 -7.228 6.910 -4.327 1.00 1.00 C ATOM 868 C GLY A 133 -5.957 6.982 -5.175 1.00 1.00 C ATOM 869 O GLY A 133 -5.717 6.117 -6.016 1.00 1.00 O ATOM 0 H GLY A 133 -7.549 5.082 -5.299 1.00 1.00 H new ATOM 0 HA2 GLY A 133 -7.880 7.749 -4.570 1.00 1.00 H new ATOM 0 HA3 GLY A 133 -6.971 7.002 -3.272 1.00 1.00 H new ATOM 873 N THR A 134 -5.173 8.021 -4.924 1.00 1.00 N ATOM 874 CA THR A 134 -3.933 8.217 -5.654 1.00 1.00 C ATOM 875 C THR A 134 -2.733 8.068 -4.716 1.00 1.00 C ATOM 876 O THR A 134 -2.897 7.762 -3.536 1.00 1.00 O ATOM 877 CB THR A 134 -4.000 9.581 -6.344 1.00 1.00 C ATOM 878 OG1 THR A 134 -5.287 9.598 -6.956 1.00 1.00 O ATOM 879 CG2 THR A 134 -3.026 9.691 -7.519 1.00 1.00 C ATOM 0 H THR A 134 -5.373 8.736 -4.225 1.00 1.00 H new ATOM 0 HA THR A 134 -3.802 7.455 -6.422 1.00 1.00 H new ATOM 0 HB THR A 134 -3.784 10.366 -5.619 1.00 1.00 H new ATOM 0 HG1 THR A 134 -5.415 10.449 -7.425 1.00 1.00 H new ATOM 0 HG21 THR A 134 -3.114 10.678 -7.973 1.00 1.00 H new ATOM 0 HG22 THR A 134 -2.007 9.546 -7.161 1.00 1.00 H new ATOM 0 HG23 THR A 134 -3.263 8.928 -8.260 1.00 1.00 H new ATOM 887 N VAL A 135 -1.554 8.291 -5.277 1.00 1.00 N ATOM 888 CA VAL A 135 -0.327 8.186 -4.504 1.00 1.00 C ATOM 889 C VAL A 135 -0.225 9.378 -3.552 1.00 1.00 C ATOM 890 O VAL A 135 -0.598 10.495 -3.907 1.00 1.00 O ATOM 891 CB VAL A 135 0.874 8.069 -5.445 1.00 1.00 C ATOM 892 CG1 VAL A 135 1.064 9.352 -6.256 1.00 1.00 C ATOM 893 CG2 VAL A 135 2.146 7.718 -4.670 1.00 1.00 C ATOM 0 H VAL A 135 -1.422 8.544 -6.256 1.00 1.00 H new ATOM 0 HA VAL A 135 -0.336 7.283 -3.894 1.00 1.00 H new ATOM 0 HB VAL A 135 0.672 7.258 -6.144 1.00 1.00 H new ATOM 0 HG11 VAL A 135 1.924 9.241 -6.916 1.00 1.00 H new ATOM 0 HG12 VAL A 135 0.171 9.541 -6.852 1.00 1.00 H new ATOM 0 HG13 VAL A 135 1.232 10.189 -5.579 1.00 1.00 H new ATOM 0 HG21 VAL A 135 2.984 7.641 -5.362 1.00 1.00 H new ATOM 0 HG22 VAL A 135 2.352 8.497 -3.936 1.00 1.00 H new ATOM 0 HG23 VAL A 135 2.009 6.765 -4.158 1.00 1.00 H new ATOM 903 N LYS A 136 0.281 9.100 -2.359 1.00 1.00 N ATOM 904 CA LYS A 136 0.436 10.135 -1.352 1.00 1.00 C ATOM 905 C LYS A 136 1.895 10.180 -0.893 1.00 1.00 C ATOM 906 O LYS A 136 2.479 11.257 -0.777 1.00 1.00 O ATOM 907 CB LYS A 136 -0.561 9.926 -0.210 1.00 1.00 C ATOM 908 CG LYS A 136 -1.340 11.211 0.081 1.00 1.00 C ATOM 909 CD LYS A 136 -0.628 12.055 1.140 1.00 1.00 C ATOM 910 CE LYS A 136 -1.590 12.456 2.260 1.00 1.00 C ATOM 911 NZ LYS A 136 -1.515 13.913 2.510 1.00 1.00 N ATOM 0 H LYS A 136 0.589 8.172 -2.068 1.00 1.00 H new ATOM 0 HA LYS A 136 0.203 11.113 -1.773 1.00 1.00 H new ATOM 0 HB2 LYS A 136 -1.255 9.127 -0.470 1.00 1.00 H new ATOM 0 HB3 LYS A 136 -0.030 9.607 0.687 1.00 1.00 H new ATOM 0 HG2 LYS A 136 -1.450 11.789 -0.836 1.00 1.00 H new ATOM 0 HG3 LYS A 136 -2.344 10.962 0.424 1.00 1.00 H new ATOM 0 HD2 LYS A 136 0.207 11.492 1.557 1.00 1.00 H new ATOM 0 HD3 LYS A 136 -0.210 12.949 0.677 1.00 1.00 H new ATOM 0 HE2 LYS A 136 -2.609 12.179 1.989 1.00 1.00 H new ATOM 0 HE3 LYS A 136 -1.344 11.911 3.171 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 -2.174 14.169 3.273 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 -0.546 14.168 2.789 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 -1.772 14.428 1.644 1.00 1.00 H new ATOM 920 N ALA A 137 2.441 9.000 -0.645 1.00 1.00 N ATOM 921 CA ALA A 137 3.820 8.891 -0.203 1.00 1.00 C ATOM 922 C ALA A 137 4.051 7.503 0.399 1.00 1.00 C ATOM 923 O ALA A 137 3.254 7.034 1.209 1.00 1.00 O ATOM 924 CB ALA A 137 4.129 10.015 0.789 1.00 1.00 C ATOM 0 H ALA A 137 1.953 8.110 -0.742 1.00 1.00 H new ATOM 0 HA ALA A 137 4.502 9.003 -1.046 1.00 1.00 H new ATOM 0 HB1 ALA A 137 5.164 9.933 1.121 1.00 1.00 H new ATOM 0 HB2 ALA A 137 3.979 10.980 0.304 1.00 1.00 H new ATOM 0 HB3 ALA A 137 3.465 9.934 1.649 1.00 1.00 H new ATOM 930 N ILE A 138 5.145 6.886 -0.022 1.00 1.00 N ATOM 931 CA ILE A 138 5.491 5.561 0.465 1.00 1.00 C ATOM 932 C ILE A 138 6.597 5.681 1.515 1.00 1.00 C ATOM 933 O ILE A 138 7.593 6.369 1.296 1.00 1.00 O ATOM 934 CB ILE A 138 5.847 4.637 -0.702 1.00 1.00 C ATOM 935 CG1 ILE A 138 5.083 5.032 -1.967 1.00 1.00 C ATOM 936 CG2 ILE A 138 5.621 3.171 -0.329 1.00 1.00 C ATOM 937 CD1 ILE A 138 5.065 3.883 -2.977 1.00 1.00 C ATOM 0 H ILE A 138 5.803 7.279 -0.695 1.00 1.00 H new ATOM 0 HA ILE A 138 4.634 5.100 0.956 1.00 1.00 H new ATOM 0 HB ILE A 138 6.909 4.754 -0.919 1.00 1.00 H new ATOM 0 HG12 ILE A 138 4.061 5.309 -1.708 1.00 1.00 H new ATOM 0 HG13 ILE A 138 5.547 5.910 -2.417 1.00 1.00 H new ATOM 0 HG21 ILE A 138 5.881 2.536 -1.176 1.00 1.00 H new ATOM 0 HG22 ILE A 138 6.247 2.912 0.525 1.00 1.00 H new ATOM 0 HG23 ILE A 138 4.573 3.019 -0.070 1.00 1.00 H new ATOM 0 HD11 ILE A 138 4.516 4.190 -3.867 1.00 1.00 H new ATOM 0 HD12 ILE A 138 6.087 3.625 -3.253 1.00 1.00 H new ATOM 0 HD13 ILE A 138 4.579 3.015 -2.532 1.00 1.00 H new ATOM 948 N LEU A 139 6.385 5.000 2.632 1.00 1.00 N ATOM 949 CA LEU A 139 7.353 5.021 3.716 1.00 1.00 C ATOM 950 C LEU A 139 8.057 3.666 3.793 1.00 1.00 C ATOM 951 O LEU A 139 9.272 3.603 3.979 1.00 1.00 O ATOM 952 CB LEU A 139 6.680 5.440 5.026 1.00 1.00 C ATOM 953 CG LEU A 139 5.299 6.086 4.894 1.00 1.00 C ATOM 954 CD1 LEU A 139 4.556 6.067 6.231 1.00 1.00 C ATOM 955 CD2 LEU A 139 5.408 7.499 4.318 1.00 1.00 C ATOM 0 H LEU A 139 5.558 4.431 2.810 1.00 1.00 H new ATOM 0 HA LEU A 139 8.122 5.769 3.525 1.00 1.00 H new ATOM 0 HB2 LEU A 139 6.588 4.560 5.662 1.00 1.00 H new ATOM 0 HB3 LEU A 139 7.338 6.139 5.542 1.00 1.00 H new ATOM 0 HG LEU A 139 4.711 5.497 4.191 1.00 1.00 H new ATOM 0 HD11 LEU A 139 3.578 6.532 6.110 1.00 1.00 H new ATOM 0 HD12 LEU A 139 4.430 5.036 6.562 1.00 1.00 H new ATOM 0 HD13 LEU A 139 5.131 6.619 6.975 1.00 1.00 H new ATOM 0 HD21 LEU A 139 4.413 7.936 4.234 1.00 1.00 H new ATOM 0 HD22 LEU A 139 6.020 8.114 4.977 1.00 1.00 H new ATOM 0 HD23 LEU A 139 5.869 7.455 3.331 1.00 1.00 H new ATOM 966 N VAL A 140 7.266 2.614 3.644 1.00 1.00 N ATOM 967 CA VAL A 140 7.799 1.263 3.693 1.00 1.00 C ATOM 968 C VAL A 140 8.592 0.985 2.414 1.00 1.00 C ATOM 969 O VAL A 140 8.165 1.355 1.322 1.00 1.00 O ATOM 970 CB VAL A 140 6.665 0.262 3.922 1.00 1.00 C ATOM 971 CG1 VAL A 140 5.655 0.304 2.774 1.00 1.00 C ATOM 972 CG2 VAL A 140 7.215 -1.153 4.118 1.00 1.00 C ATOM 0 H VAL A 140 6.259 2.670 3.489 1.00 1.00 H new ATOM 0 HA VAL A 140 8.486 1.154 4.532 1.00 1.00 H new ATOM 0 HB VAL A 140 6.144 0.549 4.835 1.00 1.00 H new ATOM 0 HG11 VAL A 140 4.860 -0.417 2.962 1.00 1.00 H new ATOM 0 HG12 VAL A 140 5.228 1.304 2.701 1.00 1.00 H new ATOM 0 HG13 VAL A 140 6.157 0.055 1.839 1.00 1.00 H new ATOM 0 HG21 VAL A 140 6.389 -1.845 4.279 1.00 1.00 H new ATOM 0 HG22 VAL A 140 7.772 -1.453 3.231 1.00 1.00 H new ATOM 0 HG23 VAL A 140 7.876 -1.170 4.984 1.00 1.00 H new ATOM 982 N GLU A 141 9.734 0.338 2.594 1.00 1.00 N ATOM 983 CA GLU A 141 10.591 0.007 1.468 1.00 1.00 C ATOM 984 C GLU A 141 10.429 -1.469 1.093 1.00 1.00 C ATOM 985 O GLU A 141 10.484 -2.341 1.957 1.00 1.00 O ATOM 986 CB GLU A 141 12.052 0.336 1.776 1.00 1.00 C ATOM 987 CG GLU A 141 12.772 0.857 0.530 1.00 1.00 C ATOM 988 CD GLU A 141 14.154 0.215 0.386 1.00 1.00 C ATOM 989 OE1 GLU A 141 14.352 -0.639 -0.490 1.00 1.00 O ATOM 990 OE2 GLU A 141 15.040 0.634 1.225 1.00 1.00 O ATOM 0 H GLU A 141 10.086 0.034 3.502 1.00 1.00 H new ATOM 0 HA GLU A 141 10.288 0.614 0.615 1.00 1.00 H new ATOM 0 HB2 GLU A 141 12.101 1.084 2.568 1.00 1.00 H new ATOM 0 HB3 GLU A 141 12.559 -0.555 2.147 1.00 1.00 H new ATOM 0 HG2 GLU A 141 12.174 0.643 -0.356 1.00 1.00 H new ATOM 0 HG3 GLU A 141 12.875 1.940 0.592 1.00 1.00 H new ATOM 996 N SER A 142 10.232 -1.700 -0.196 1.00 1.00 N ATOM 997 CA SER A 142 10.062 -3.053 -0.696 1.00 1.00 C ATOM 998 C SER A 142 11.099 -3.981 -0.059 1.00 1.00 C ATOM 999 O SER A 142 12.229 -4.075 -0.535 1.00 1.00 O ATOM 1000 CB SER A 142 10.177 -3.096 -2.221 1.00 1.00 C ATOM 1001 OG SER A 142 11.520 -2.912 -2.660 1.00 1.00 O ATOM 0 H SER A 142 10.186 -0.973 -0.910 1.00 1.00 H new ATOM 0 HA SER A 142 9.063 -3.394 -0.425 1.00 1.00 H new ATOM 0 HB2 SER A 142 9.804 -4.053 -2.586 1.00 1.00 H new ATOM 0 HB3 SER A 142 9.544 -2.321 -2.654 1.00 1.00 H new ATOM 0 HG SER A 142 12.135 -3.109 -1.923 1.00 1.00 H new ATOM 1006 N GLY A 143 10.677 -4.643 1.009 1.00 1.00 N ATOM 1007 CA GLY A 143 11.555 -5.560 1.715 1.00 1.00 C ATOM 1008 C GLY A 143 11.493 -5.324 3.226 1.00 1.00 C ATOM 1009 O GLY A 143 11.668 -6.254 4.012 1.00 1.00 O ATOM 0 H GLY A 143 9.739 -4.562 1.402 1.00 1.00 H new ATOM 0 HA2 GLY A 143 11.269 -6.588 1.492 1.00 1.00 H new ATOM 0 HA3 GLY A 143 12.579 -5.431 1.365 1.00 1.00 H new ATOM 1013 N GLN A 144 11.245 -4.073 3.587 1.00 1.00 N ATOM 1014 CA GLN A 144 11.158 -3.702 4.989 1.00 1.00 C ATOM 1015 C GLN A 144 10.075 -4.524 5.689 1.00 1.00 C ATOM 1016 O GLN A 144 9.016 -4.778 5.116 1.00 1.00 O ATOM 1017 CB GLN A 144 10.896 -2.203 5.145 1.00 1.00 C ATOM 1018 CG GLN A 144 10.708 -1.828 6.616 1.00 1.00 C ATOM 1019 CD GLN A 144 9.964 -0.499 6.752 1.00 1.00 C ATOM 1020 OE1 GLN A 144 8.872 -0.421 7.291 1.00 1.00 O ATOM 1021 NE2 GLN A 144 10.614 0.541 6.235 1.00 1.00 N ATOM 0 H GLN A 144 11.102 -3.304 2.933 1.00 1.00 H new ATOM 0 HA GLN A 144 12.115 -3.920 5.462 1.00 1.00 H new ATOM 0 HB2 GLN A 144 11.730 -1.639 4.726 1.00 1.00 H new ATOM 0 HB3 GLN A 144 10.007 -1.925 4.579 1.00 1.00 H new ATOM 0 HG2 GLN A 144 10.152 -2.614 7.127 1.00 1.00 H new ATOM 0 HG3 GLN A 144 11.680 -1.756 7.104 1.00 1.00 H new ATOM 0 HE21 GLN A 144 11.526 0.406 5.798 1.00 1.00 H new ATOM 0 HE22 GLN A 144 10.201 1.473 6.276 1.00 1.00 H new ATOM 1028 N PRO A 145 10.384 -4.927 6.951 1.00 1.00 N ATOM 1029 CA PRO A 145 9.448 -5.715 7.735 1.00 1.00 C ATOM 1030 C PRO A 145 8.302 -4.845 8.257 1.00 1.00 C ATOM 1031 O PRO A 145 8.518 -3.704 8.661 1.00 1.00 O ATOM 1032 CB PRO A 145 10.285 -6.326 8.848 1.00 1.00 C ATOM 1033 CG PRO A 145 11.554 -5.492 8.920 1.00 1.00 C ATOM 1034 CD PRO A 145 11.627 -4.645 7.661 1.00 1.00 C ATOM 0 HA PRO A 145 8.959 -6.493 7.149 1.00 1.00 H new ATOM 0 HB2 PRO A 145 9.749 -6.304 9.797 1.00 1.00 H new ATOM 0 HB3 PRO A 145 10.515 -7.370 8.636 1.00 1.00 H new ATOM 0 HG2 PRO A 145 11.544 -4.858 9.807 1.00 1.00 H new ATOM 0 HG3 PRO A 145 12.430 -6.136 8.998 1.00 1.00 H new ATOM 0 HD2 PRO A 145 11.714 -3.585 7.901 1.00 1.00 H new ATOM 0 HD3 PRO A 145 12.496 -4.907 7.057 1.00 1.00 H new ATOM 1039 N VAL A 146 7.108 -5.418 8.231 1.00 1.00 N ATOM 1040 CA VAL A 146 5.928 -4.710 8.696 1.00 1.00 C ATOM 1041 C VAL A 146 5.563 -5.202 10.098 1.00 1.00 C ATOM 1042 O VAL A 146 6.019 -6.260 10.527 1.00 1.00 O ATOM 1043 CB VAL A 146 4.787 -4.876 7.689 1.00 1.00 C ATOM 1044 CG1 VAL A 146 5.328 -4.981 6.262 1.00 1.00 C ATOM 1045 CG2 VAL A 146 3.919 -6.086 8.038 1.00 1.00 C ATOM 0 H VAL A 146 6.932 -6.365 7.895 1.00 1.00 H new ATOM 0 HA VAL A 146 6.128 -3.641 8.768 1.00 1.00 H new ATOM 0 HB VAL A 146 4.158 -3.987 7.744 1.00 1.00 H new ATOM 0 HG11 VAL A 146 4.498 -5.098 5.566 1.00 1.00 H new ATOM 0 HG12 VAL A 146 5.883 -4.076 6.016 1.00 1.00 H new ATOM 0 HG13 VAL A 146 5.990 -5.844 6.186 1.00 1.00 H new ATOM 0 HG21 VAL A 146 3.116 -6.181 7.307 1.00 1.00 H new ATOM 0 HG22 VAL A 146 4.530 -6.988 8.025 1.00 1.00 H new ATOM 0 HG23 VAL A 146 3.491 -5.952 9.032 1.00 1.00 H new ATOM 1055 N GLU A 147 4.745 -4.409 10.775 1.00 1.00 N ATOM 1056 CA GLU A 147 4.313 -4.750 12.119 1.00 1.00 C ATOM 1057 C GLU A 147 2.859 -4.327 12.335 1.00 1.00 C ATOM 1058 O GLU A 147 2.298 -3.588 11.526 1.00 1.00 O ATOM 1059 CB GLU A 147 5.230 -4.115 13.167 1.00 1.00 C ATOM 1060 CG GLU A 147 6.495 -4.951 13.368 1.00 1.00 C ATOM 1061 CD GLU A 147 6.296 -5.986 14.479 1.00 1.00 C ATOM 1062 OE1 GLU A 147 6.926 -7.054 14.450 1.00 1.00 O ATOM 1063 OE2 GLU A 147 5.455 -5.647 15.395 1.00 1.00 O ATOM 0 H GLU A 147 4.370 -3.531 10.417 1.00 1.00 H new ATOM 0 HA GLU A 147 4.376 -5.832 12.235 1.00 1.00 H new ATOM 0 HB2 GLU A 147 5.502 -3.107 12.854 1.00 1.00 H new ATOM 0 HB3 GLU A 147 4.697 -4.022 14.113 1.00 1.00 H new ATOM 0 HG2 GLU A 147 6.754 -5.456 12.437 1.00 1.00 H new ATOM 0 HG3 GLU A 147 7.331 -4.298 13.619 1.00 1.00 H new ATOM 1069 N PHE A 148 2.290 -4.812 13.428 1.00 1.00 N ATOM 1070 CA PHE A 148 0.911 -4.493 13.758 1.00 1.00 C ATOM 1071 C PHE A 148 0.730 -2.987 13.958 1.00 1.00 C ATOM 1072 O PHE A 148 1.569 -2.334 14.577 1.00 1.00 O ATOM 1073 CB PHE A 148 0.589 -5.212 15.070 1.00 1.00 C ATOM 1074 CG PHE A 148 -0.901 -5.499 15.272 1.00 1.00 C ATOM 1075 CD1 PHE A 148 -1.522 -6.439 14.510 1.00 1.00 C ATOM 1076 CD2 PHE A 148 -1.603 -4.814 16.214 1.00 1.00 C ATOM 1077 CE1 PHE A 148 -2.903 -6.705 14.698 1.00 1.00 C ATOM 1078 CE2 PHE A 148 -2.986 -5.080 16.402 1.00 1.00 C ATOM 1079 CZ PHE A 148 -3.607 -6.021 15.639 1.00 1.00 C ATOM 0 H PHE A 148 2.758 -5.423 14.097 1.00 1.00 H new ATOM 0 HA PHE A 148 0.252 -4.807 12.949 1.00 1.00 H new ATOM 0 HB2 PHE A 148 1.137 -6.153 15.101 1.00 1.00 H new ATOM 0 HB3 PHE A 148 0.948 -4.606 15.902 1.00 1.00 H new ATOM 0 HD1 PHE A 148 -0.964 -6.983 13.762 1.00 1.00 H new ATOM 0 HD2 PHE A 148 -1.109 -4.068 16.819 1.00 1.00 H new ATOM 0 HE1 PHE A 148 -3.396 -7.452 14.093 1.00 1.00 H new ATOM 0 HE2 PHE A 148 -3.544 -4.536 17.150 1.00 1.00 H new ATOM 0 HZ PHE A 148 -4.658 -6.224 15.781 1.00 1.00 H new ATOM 1088 N ASP A 149 -0.371 -2.480 13.422 1.00 1.00 N ATOM 1089 CA ASP A 149 -0.673 -1.063 13.533 1.00 1.00 C ATOM 1090 C ASP A 149 0.488 -0.251 12.954 1.00 1.00 C ATOM 1091 O ASP A 149 0.609 0.943 13.221 1.00 1.00 O ATOM 1092 CB ASP A 149 -0.852 -0.652 14.996 1.00 1.00 C ATOM 1093 CG ASP A 149 0.444 -0.336 15.744 1.00 1.00 C ATOM 1094 OD1 ASP A 149 1.054 0.725 15.546 1.00 1.00 O ATOM 1095 OD2 ASP A 149 0.832 -1.248 16.572 1.00 1.00 O ATOM 0 H ASP A 149 -1.064 -3.025 12.910 1.00 1.00 H new ATOM 0 HA ASP A 149 -1.597 -0.871 12.988 1.00 1.00 H new ATOM 0 HB2 ASP A 149 -1.499 0.225 15.034 1.00 1.00 H new ATOM 0 HB3 ASP A 149 -1.371 -1.454 15.522 1.00 1.00 H new ATOM 1100 N GLU A 150 1.310 -0.933 12.170 1.00 1.00 N ATOM 1101 CA GLU A 150 2.457 -0.290 11.550 1.00 1.00 C ATOM 1102 C GLU A 150 2.072 0.275 10.181 1.00 1.00 C ATOM 1103 O GLU A 150 1.375 -0.381 9.408 1.00 1.00 O ATOM 1104 CB GLU A 150 3.633 -1.261 11.433 1.00 1.00 C ATOM 1105 CG GLU A 150 4.967 -0.515 11.488 1.00 1.00 C ATOM 1106 CD GLU A 150 5.423 -0.101 10.087 1.00 1.00 C ATOM 1107 OE1 GLU A 150 5.080 -0.770 9.101 1.00 1.00 O ATOM 1108 OE2 GLU A 150 6.159 0.958 10.043 1.00 1.00 O ATOM 0 H GLU A 150 1.205 -1.923 11.950 1.00 1.00 H new ATOM 0 HA GLU A 150 2.774 0.536 12.186 1.00 1.00 H new ATOM 0 HB2 GLU A 150 3.587 -1.992 12.240 1.00 1.00 H new ATOM 0 HB3 GLU A 150 3.560 -1.815 10.497 1.00 1.00 H new ATOM 0 HG2 GLU A 150 4.867 0.369 12.118 1.00 1.00 H new ATOM 0 HG3 GLU A 150 5.724 -1.150 11.948 1.00 1.00 H new ATOM 1114 N PRO A 151 2.556 1.518 9.915 1.00 1.00 N ATOM 1115 CA PRO A 151 2.271 2.177 8.652 1.00 1.00 C ATOM 1116 C PRO A 151 3.101 1.573 7.518 1.00 1.00 C ATOM 1117 O PRO A 151 4.156 0.989 7.759 1.00 1.00 O ATOM 1118 CB PRO A 151 2.579 3.646 8.897 1.00 1.00 C ATOM 1119 CG PRO A 151 3.462 3.685 10.133 1.00 1.00 C ATOM 1120 CD PRO A 151 3.385 2.324 10.806 1.00 1.00 C ATOM 0 HA PRO A 151 1.236 2.048 8.334 1.00 1.00 H new ATOM 0 HB2 PRO A 151 3.087 4.087 8.040 1.00 1.00 H new ATOM 0 HB3 PRO A 151 1.663 4.217 9.053 1.00 1.00 H new ATOM 0 HG2 PRO A 151 4.491 3.918 9.859 1.00 1.00 H new ATOM 0 HG3 PRO A 151 3.129 4.467 10.815 1.00 1.00 H new ATOM 0 HD2 PRO A 151 4.376 1.886 10.929 1.00 1.00 H new ATOM 0 HD3 PRO A 151 2.943 2.398 11.800 1.00 1.00 H new ATOM 1125 N LEU A 152 2.593 1.735 6.304 1.00 1.00 N ATOM 1126 CA LEU A 152 3.275 1.213 5.133 1.00 1.00 C ATOM 1127 C LEU A 152 3.380 2.315 4.076 1.00 1.00 C ATOM 1128 O LEU A 152 4.415 2.969 3.956 1.00 1.00 O ATOM 1129 CB LEU A 152 2.582 -0.055 4.631 1.00 1.00 C ATOM 1130 CG LEU A 152 2.511 -1.217 5.623 1.00 1.00 C ATOM 1131 CD1 LEU A 152 1.567 -2.310 5.120 1.00 1.00 C ATOM 1132 CD2 LEU A 152 3.907 -1.763 5.930 1.00 1.00 C ATOM 0 H LEU A 152 1.718 2.220 6.107 1.00 1.00 H new ATOM 0 HA LEU A 152 4.292 0.915 5.386 1.00 1.00 H new ATOM 0 HB2 LEU A 152 1.566 0.204 4.332 1.00 1.00 H new ATOM 0 HB3 LEU A 152 3.100 -0.399 3.736 1.00 1.00 H new ATOM 0 HG LEU A 152 2.099 -0.841 6.560 1.00 1.00 H new ATOM 0 HD11 LEU A 152 1.535 -3.124 5.844 1.00 1.00 H new ATOM 0 HD12 LEU A 152 0.566 -1.897 4.994 1.00 1.00 H new ATOM 0 HD13 LEU A 152 1.926 -2.689 4.163 1.00 1.00 H new ATOM 0 HD21 LEU A 152 3.827 -2.588 6.638 1.00 1.00 H new ATOM 0 HD22 LEU A 152 4.369 -2.118 5.009 1.00 1.00 H new ATOM 0 HD23 LEU A 152 4.520 -0.972 6.362 1.00 1.00 H new ATOM 1143 N VAL A 153 2.294 2.488 3.338 1.00 1.00 N ATOM 1144 CA VAL A 153 2.250 3.500 2.295 1.00 1.00 C ATOM 1145 C VAL A 153 1.136 4.501 2.608 1.00 1.00 C ATOM 1146 O VAL A 153 0.169 4.165 3.290 1.00 1.00 O ATOM 1147 CB VAL A 153 2.091 2.835 0.927 1.00 1.00 C ATOM 1148 CG1 VAL A 153 2.252 3.856 -0.201 1.00 1.00 C ATOM 1149 CG2 VAL A 153 3.076 1.676 0.762 1.00 1.00 C ATOM 0 H VAL A 153 1.437 1.945 3.441 1.00 1.00 H new ATOM 0 HA VAL A 153 3.187 4.057 2.263 1.00 1.00 H new ATOM 0 HB VAL A 153 1.082 2.427 0.869 1.00 1.00 H new ATOM 0 HG11 VAL A 153 2.134 3.357 -1.163 1.00 1.00 H new ATOM 0 HG12 VAL A 153 1.494 4.632 -0.100 1.00 1.00 H new ATOM 0 HG13 VAL A 153 3.243 4.307 -0.145 1.00 1.00 H new ATOM 0 HG21 VAL A 153 2.941 1.221 -0.219 1.00 1.00 H new ATOM 0 HG22 VAL A 153 4.096 2.050 0.852 1.00 1.00 H new ATOM 0 HG23 VAL A 153 2.893 0.930 1.536 1.00 1.00 H new ATOM 1159 N VAL A 154 1.309 5.710 2.094 1.00 1.00 N ATOM 1160 CA VAL A 154 0.330 6.761 2.309 1.00 1.00 C ATOM 1161 C VAL A 154 -0.399 7.051 0.996 1.00 1.00 C ATOM 1162 O VAL A 154 0.221 7.456 0.014 1.00 1.00 O ATOM 1163 CB VAL A 154 1.011 7.998 2.900 1.00 1.00 C ATOM 1164 CG1 VAL A 154 -0.021 9.057 3.292 1.00 1.00 C ATOM 1165 CG2 VAL A 154 1.892 7.622 4.093 1.00 1.00 C ATOM 0 H VAL A 154 2.113 5.985 1.529 1.00 1.00 H new ATOM 0 HA VAL A 154 -0.420 6.441 3.033 1.00 1.00 H new ATOM 0 HB VAL A 154 1.654 8.426 2.131 1.00 1.00 H new ATOM 0 HG11 VAL A 154 0.489 9.925 3.709 1.00 1.00 H new ATOM 0 HG12 VAL A 154 -0.587 9.358 2.410 1.00 1.00 H new ATOM 0 HG13 VAL A 154 -0.702 8.644 4.036 1.00 1.00 H new ATOM 0 HG21 VAL A 154 2.364 8.519 4.494 1.00 1.00 H new ATOM 0 HG22 VAL A 154 1.279 7.158 4.866 1.00 1.00 H new ATOM 0 HG23 VAL A 154 2.661 6.921 3.770 1.00 1.00 H new ATOM 1175 N ILE A 155 -1.705 6.830 1.019 1.00 1.00 N ATOM 1176 CA ILE A 155 -2.525 7.062 -0.158 1.00 1.00 C ATOM 1177 C ILE A 155 -3.426 8.276 0.085 1.00 1.00 C ATOM 1178 O ILE A 155 -3.610 8.698 1.225 1.00 1.00 O ATOM 1179 CB ILE A 155 -3.292 5.793 -0.534 1.00 1.00 C ATOM 1180 CG1 ILE A 155 -2.388 4.804 -1.272 1.00 1.00 C ATOM 1181 CG2 ILE A 155 -4.549 6.131 -1.339 1.00 1.00 C ATOM 1182 CD1 ILE A 155 -1.757 3.807 -0.299 1.00 1.00 C ATOM 0 H ILE A 155 -2.216 6.492 1.835 1.00 1.00 H new ATOM 0 HA ILE A 155 -1.899 7.296 -1.019 1.00 1.00 H new ATOM 0 HB ILE A 155 -3.619 5.306 0.385 1.00 1.00 H new ATOM 0 HG12 ILE A 155 -2.967 4.267 -2.023 1.00 1.00 H new ATOM 0 HG13 ILE A 155 -1.605 5.347 -1.801 1.00 1.00 H new ATOM 0 HG21 ILE A 155 -5.076 5.212 -1.594 1.00 1.00 H new ATOM 0 HG22 ILE A 155 -5.201 6.770 -0.744 1.00 1.00 H new ATOM 0 HG23 ILE A 155 -4.266 6.652 -2.254 1.00 1.00 H new ATOM 0 HD11 ILE A 155 -1.119 3.115 -0.849 1.00 1.00 H new ATOM 0 HD12 ILE A 155 -1.159 4.345 0.436 1.00 1.00 H new ATOM 0 HD13 ILE A 155 -2.543 3.249 0.210 1.00 1.00 H new ATOM 1193 N GLU A 156 -3.961 8.802 -1.007 1.00 1.00 N ATOM 1194 CA GLU A 156 -4.836 9.959 -0.928 1.00 1.00 C ATOM 1195 C GLU A 156 -6.246 9.589 -1.392 1.00 1.00 C ATOM 1196 O GLU A 156 -7.190 9.613 -0.602 1.00 1.00 O ATOM 1197 CB GLU A 156 -4.278 11.126 -1.746 1.00 1.00 C ATOM 1198 CG GLU A 156 -4.587 10.950 -3.234 1.00 1.00 C ATOM 1199 CD GLU A 156 -4.117 12.163 -4.039 1.00 1.00 C ATOM 1200 OE1 GLU A 156 -4.931 12.809 -4.716 1.00 1.00 O ATOM 1201 OE2 GLU A 156 -2.859 12.428 -3.942 1.00 1.00 O ATOM 0 H GLU A 156 -3.805 8.448 -1.951 1.00 1.00 H new ATOM 0 HA GLU A 156 -4.889 10.281 0.112 1.00 1.00 H new ATOM 0 HB2 GLU A 156 -4.708 12.062 -1.390 1.00 1.00 H new ATOM 0 HB3 GLU A 156 -3.200 11.194 -1.600 1.00 1.00 H new ATOM 0 HG2 GLU A 156 -4.098 10.050 -3.607 1.00 1.00 H new ATOM 0 HG3 GLU A 156 -5.659 10.811 -3.372 1.00 1.00 H new