USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=16 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 Single : A 81 HIS : no HE2:sc= -1.15 X(o=-1.2,f=-1.2) USER MOD Single : A 85 SER OG : rot -53:sc= -0.672! USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc=-0.00269 USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 117:sc= 0.504 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 GLN : amide:sc= -2.05 K(o=-2.1,f=-3.1!) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc=-0.00508 X(o=-0.0051,f=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 CYS SG : rot 173:sc= -5.28! USER MOD Single : A 121 MET CE :methyl -140:sc= -0.246 (180deg=-1.68!) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 MET CE :methyl -121:sc= -0.149 (180deg=-0.73) USER MOD Single : A 124 MET CE :methyl -175:sc= 0 (180deg=-0.0245) USER MOD Single : A 125 ASN : amide:sc= 0.0101 X(o=0.01,f=0) USER MOD Single : A 126 GLN : amide:sc= -0.201 K(o=-0.2,f=-1) USER MOD Single : A 131 LYS NZ :NH3+ 146:sc= 0.828 (180deg=0.389) 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+ -158:sc= -0.0494 (180deg=-0.518) USER MOD Single : A 142 SER OG : rot 35:sc= 1.14 USER MOD Single : A 144 GLN : amide:sc= -0.557 K(o=-0.56,f=-7.1!) USER MOD ----------------------------------------------------------------- ATOM 130 N HIS A 81 -5.877 7.995 2.700 1.00 1.00 N ATOM 131 CA HIS A 81 -5.946 6.863 3.607 1.00 1.00 C ATOM 132 C HIS A 81 -4.544 6.284 3.815 1.00 1.00 C ATOM 133 O HIS A 81 -3.825 6.030 2.850 1.00 1.00 O ATOM 134 CB HIS A 81 -6.948 5.822 3.101 1.00 1.00 C ATOM 135 CG HIS A 81 -6.579 4.398 3.443 1.00 1.00 C ATOM 136 ND1 HIS A 81 -6.634 3.899 4.732 1.00 1.00 N ATOM 137 CD2 HIS A 81 -6.151 3.373 2.650 1.00 1.00 C ATOM 138 CE1 HIS A 81 -6.252 2.630 4.705 1.00 1.00 C ATOM 139 NE2 HIS A 81 -5.954 2.306 3.414 1.00 1.00 N ATOM 0 HA HIS A 81 -6.312 7.194 4.579 1.00 1.00 H new ATOM 0 HB2 HIS A 81 -7.929 6.043 3.521 1.00 1.00 H new ATOM 0 HB3 HIS A 81 -7.036 5.914 2.018 1.00 1.00 H new ATOM 0 HD1 HIS A 81 -6.920 4.419 5.562 1.00 1.00 H new ATOM 0 HD2 HIS A 81 -5.999 3.422 1.582 1.00 1.00 H new ATOM 0 HE1 HIS A 81 -6.188 1.968 5.556 1.00 1.00 H new ATOM 146 N ILE A 82 -4.199 6.095 5.080 1.00 1.00 N ATOM 147 CA ILE A 82 -2.897 5.553 5.427 1.00 1.00 C ATOM 148 C ILE A 82 -3.020 4.043 5.645 1.00 1.00 C ATOM 149 O ILE A 82 -3.828 3.594 6.455 1.00 1.00 O ATOM 150 CB ILE A 82 -2.307 6.301 6.624 1.00 1.00 C ATOM 151 CG1 ILE A 82 -1.749 7.661 6.200 1.00 1.00 C ATOM 152 CG2 ILE A 82 -1.256 5.448 7.339 1.00 1.00 C ATOM 153 CD1 ILE A 82 -2.739 8.783 6.521 1.00 1.00 C ATOM 0 H ILE A 82 -4.799 6.308 5.877 1.00 1.00 H new ATOM 0 HA ILE A 82 -2.192 5.701 4.609 1.00 1.00 H new ATOM 0 HB ILE A 82 -3.109 6.490 7.338 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -0.805 7.847 6.712 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -1.536 7.654 5.131 1.00 1.00 H new ATOM 0 HG21 ILE A 82 -0.852 6.003 8.186 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -1.716 4.526 7.695 1.00 1.00 H new ATOM 0 HG23 ILE A 82 -0.450 5.207 6.646 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -2.319 9.739 6.210 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -3.674 8.607 5.988 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -2.931 8.803 7.594 1.00 1.00 H new ATOM 164 N VAL A 83 -2.206 3.304 4.905 1.00 1.00 N ATOM 165 CA VAL A 83 -2.213 1.853 5.007 1.00 1.00 C ATOM 166 C VAL A 83 -1.345 1.426 6.191 1.00 1.00 C ATOM 167 O VAL A 83 -0.240 1.936 6.372 1.00 1.00 O ATOM 168 CB VAL A 83 -1.766 1.234 3.682 1.00 1.00 C ATOM 169 CG1 VAL A 83 -1.881 -0.292 3.723 1.00 1.00 C ATOM 170 CG2 VAL A 83 -2.559 1.813 2.510 1.00 1.00 C ATOM 0 H VAL A 83 -1.538 3.682 4.233 1.00 1.00 H new ATOM 0 HA VAL A 83 -3.222 1.487 5.196 1.00 1.00 H new ATOM 0 HB VAL A 83 -0.716 1.487 3.532 1.00 1.00 H new ATOM 0 HG11 VAL A 83 -1.557 -0.707 2.769 1.00 1.00 H new ATOM 0 HG12 VAL A 83 -1.251 -0.683 4.522 1.00 1.00 H new ATOM 0 HG13 VAL A 83 -2.918 -0.574 3.908 1.00 1.00 H new ATOM 0 HG21 VAL A 83 -2.221 1.355 1.580 1.00 1.00 H new ATOM 0 HG22 VAL A 83 -3.620 1.606 2.651 1.00 1.00 H new ATOM 0 HG23 VAL A 83 -2.402 2.891 2.462 1.00 1.00 H new ATOM 180 N ARG A 84 -1.877 0.493 6.968 1.00 1.00 N ATOM 181 CA ARG A 84 -1.164 -0.010 8.130 1.00 1.00 C ATOM 182 C ARG A 84 -0.991 -1.527 8.032 1.00 1.00 C ATOM 183 O ARG A 84 -1.964 -2.255 7.844 1.00 1.00 O ATOM 184 CB ARG A 84 -1.910 0.329 9.423 1.00 1.00 C ATOM 185 CG ARG A 84 -2.141 1.837 9.544 1.00 1.00 C ATOM 186 CD ARG A 84 -3.183 2.147 10.619 1.00 1.00 C ATOM 187 NE ARG A 84 -4.278 2.959 10.044 1.00 1.00 N ATOM 188 CZ ARG A 84 -5.056 3.798 10.761 1.00 1.00 C ATOM 189 NH1 ARG A 84 -4.865 3.942 12.089 1.00 1.00 N ATOM 190 NH2 ARG A 84 -6.006 4.475 10.143 1.00 1.00 N ATOM 0 H ARG A 84 -2.794 0.072 6.815 1.00 1.00 H new ATOM 0 HA ARG A 84 -0.185 0.470 8.152 1.00 1.00 H new ATOM 0 HB2 ARG A 84 -2.867 -0.192 9.442 1.00 1.00 H new ATOM 0 HB3 ARG A 84 -1.338 -0.025 10.281 1.00 1.00 H new ATOM 0 HG2 ARG A 84 -1.202 2.334 9.788 1.00 1.00 H new ATOM 0 HG3 ARG A 84 -2.473 2.236 8.585 1.00 1.00 H new ATOM 0 HD2 ARG A 84 -3.583 1.219 11.027 1.00 1.00 H new ATOM 0 HD3 ARG A 84 -2.717 2.684 11.445 1.00 1.00 H new ATOM 0 HE ARG A 84 -4.456 2.880 9.043 1.00 1.00 H new ATOM 0 HH11 ARG A 84 -4.129 3.415 12.558 1.00 1.00 H new ATOM 0 HH12 ARG A 84 -5.457 4.578 12.623 1.00 1.00 H new ATOM 0 HH21 ARG A 84 -6.143 4.360 9.139 1.00 1.00 H new ATOM 0 HH22 ARG A 84 -6.603 5.113 10.670 1.00 1.00 H new ATOM 199 N SER A 85 0.255 -1.958 8.162 1.00 1.00 N ATOM 200 CA SER A 85 0.568 -3.374 8.090 1.00 1.00 C ATOM 201 C SER A 85 -0.517 -4.187 8.799 1.00 1.00 C ATOM 202 O SER A 85 -0.514 -4.296 10.025 1.00 1.00 O ATOM 203 CB SER A 85 1.939 -3.667 8.705 1.00 1.00 C ATOM 204 OG SER A 85 1.910 -4.814 9.550 1.00 1.00 O ATOM 0 H SER A 85 1.060 -1.351 8.317 1.00 1.00 H new ATOM 0 HA SER A 85 0.602 -3.664 7.040 1.00 1.00 H new ATOM 0 HB2 SER A 85 2.668 -3.821 7.909 1.00 1.00 H new ATOM 0 HB3 SER A 85 2.271 -2.802 9.279 1.00 1.00 H new ATOM 0 HG SER A 85 1.195 -4.714 10.213 1.00 1.00 H new ATOM 209 N PRO A 86 -1.443 -4.750 7.978 1.00 1.00 N ATOM 210 CA PRO A 86 -2.531 -5.549 8.514 1.00 1.00 C ATOM 211 C PRO A 86 -2.034 -6.928 8.956 1.00 1.00 C ATOM 212 O PRO A 86 -2.814 -7.749 9.434 1.00 1.00 O ATOM 213 CB PRO A 86 -3.556 -5.619 7.394 1.00 1.00 C ATOM 214 CG PRO A 86 -2.809 -5.254 6.122 1.00 1.00 C ATOM 215 CD PRO A 86 -1.477 -4.641 6.522 1.00 1.00 C ATOM 0 HA PRO A 86 -2.970 -5.113 9.412 1.00 1.00 H new ATOM 0 HB2 PRO A 86 -3.987 -6.617 7.321 1.00 1.00 H new ATOM 0 HB3 PRO A 86 -4.380 -4.929 7.575 1.00 1.00 H new ATOM 0 HG2 PRO A 86 -2.652 -6.138 5.505 1.00 1.00 H new ATOM 0 HG3 PRO A 86 -3.390 -4.549 5.527 1.00 1.00 H new ATOM 0 HD2 PRO A 86 -0.643 -5.173 6.065 1.00 1.00 H new ATOM 0 HD3 PRO A 86 -1.406 -3.602 6.201 1.00 1.00 H new ATOM 220 N MET A 87 -0.738 -7.137 8.780 1.00 1.00 N ATOM 221 CA MET A 87 -0.127 -8.402 9.154 1.00 1.00 C ATOM 222 C MET A 87 1.399 -8.288 9.179 1.00 1.00 C ATOM 223 O MET A 87 2.028 -8.105 8.137 1.00 1.00 O ATOM 224 CB MET A 87 -0.543 -9.486 8.157 1.00 1.00 C ATOM 225 CG MET A 87 -1.521 -10.473 8.796 1.00 1.00 C ATOM 226 SD MET A 87 -0.651 -11.937 9.329 1.00 1.00 S ATOM 227 CE MET A 87 -2.033 -12.972 9.782 1.00 1.00 C ATOM 0 H MET A 87 -0.094 -6.453 8.384 1.00 1.00 H new ATOM 0 HA MET A 87 -0.469 -8.667 10.154 1.00 1.00 H new ATOM 0 HB2 MET A 87 -1.005 -9.024 7.284 1.00 1.00 H new ATOM 0 HB3 MET A 87 0.340 -10.020 7.805 1.00 1.00 H new ATOM 0 HG2 MET A 87 -2.018 -10.006 9.646 1.00 1.00 H new ATOM 0 HG3 MET A 87 -2.298 -10.742 8.081 1.00 1.00 H new ATOM 0 HE1 MET A 87 -1.665 -13.934 10.140 1.00 1.00 H new ATOM 0 HE2 MET A 87 -2.608 -12.487 10.571 1.00 1.00 H new ATOM 0 HE3 MET A 87 -2.671 -13.128 8.912 1.00 1.00 H new ATOM 235 N VAL A 88 1.949 -8.401 10.379 1.00 1.00 N ATOM 236 CA VAL A 88 3.389 -8.313 10.552 1.00 1.00 C ATOM 237 C VAL A 88 4.077 -9.251 9.558 1.00 1.00 C ATOM 238 O VAL A 88 3.630 -10.378 9.352 1.00 1.00 O ATOM 239 CB VAL A 88 3.760 -8.608 12.007 1.00 1.00 C ATOM 240 CG1 VAL A 88 5.263 -8.440 12.234 1.00 1.00 C ATOM 241 CG2 VAL A 88 2.957 -7.727 12.967 1.00 1.00 C ATOM 0 H VAL A 88 1.424 -8.553 11.240 1.00 1.00 H new ATOM 0 HA VAL A 88 3.738 -7.302 10.340 1.00 1.00 H new ATOM 0 HB VAL A 88 3.505 -9.647 12.214 1.00 1.00 H new ATOM 0 HG11 VAL A 88 5.500 -8.655 13.276 1.00 1.00 H new ATOM 0 HG12 VAL A 88 5.808 -9.129 11.588 1.00 1.00 H new ATOM 0 HG13 VAL A 88 5.554 -7.416 12.000 1.00 1.00 H new ATOM 0 HG21 VAL A 88 3.240 -7.957 13.994 1.00 1.00 H new ATOM 0 HG22 VAL A 88 3.166 -6.678 12.759 1.00 1.00 H new ATOM 0 HG23 VAL A 88 1.892 -7.918 12.832 1.00 1.00 H new ATOM 251 N GLY A 89 5.152 -8.751 8.969 1.00 1.00 N ATOM 252 CA GLY A 89 5.906 -9.529 8.001 1.00 1.00 C ATOM 253 C GLY A 89 6.842 -8.636 7.186 1.00 1.00 C ATOM 254 O GLY A 89 7.538 -7.788 7.743 1.00 1.00 O ATOM 0 H GLY A 89 5.520 -7.816 9.143 1.00 1.00 H new ATOM 0 HA2 GLY A 89 6.486 -10.294 8.517 1.00 1.00 H new ATOM 0 HA3 GLY A 89 5.219 -10.047 7.332 1.00 1.00 H new ATOM 258 N THR A 90 6.828 -8.854 5.880 1.00 1.00 N ATOM 259 CA THR A 90 7.667 -8.078 4.982 1.00 1.00 C ATOM 260 C THR A 90 6.819 -7.433 3.884 1.00 1.00 C ATOM 261 O THR A 90 6.127 -8.126 3.140 1.00 1.00 O ATOM 262 CB THR A 90 8.761 -9.001 4.441 1.00 1.00 C ATOM 263 OG1 THR A 90 9.256 -9.666 5.598 1.00 1.00 O ATOM 264 CG2 THR A 90 9.969 -8.227 3.909 1.00 1.00 C ATOM 0 H THR A 90 6.249 -9.557 5.421 1.00 1.00 H new ATOM 0 HA THR A 90 8.148 -7.252 5.506 1.00 1.00 H new ATOM 0 HB THR A 90 8.351 -9.624 3.646 1.00 1.00 H new ATOM 0 HG1 THR A 90 9.969 -10.286 5.339 1.00 1.00 H new ATOM 0 HG21 THR A 90 10.716 -8.929 3.537 1.00 1.00 H new ATOM 0 HG22 THR A 90 9.652 -7.571 3.098 1.00 1.00 H new ATOM 0 HG23 THR A 90 10.401 -7.630 4.712 1.00 1.00 H new ATOM 272 N PHE A 91 6.899 -6.112 3.817 1.00 1.00 N ATOM 273 CA PHE A 91 6.148 -5.365 2.822 1.00 1.00 C ATOM 274 C PHE A 91 6.949 -5.217 1.527 1.00 1.00 C ATOM 275 O PHE A 91 8.115 -4.828 1.555 1.00 1.00 O ATOM 276 CB PHE A 91 5.888 -3.976 3.408 1.00 1.00 C ATOM 277 CG PHE A 91 5.204 -3.010 2.439 1.00 1.00 C ATOM 278 CD1 PHE A 91 5.881 -2.537 1.358 1.00 1.00 C ATOM 279 CD2 PHE A 91 3.918 -2.625 2.658 1.00 1.00 C ATOM 280 CE1 PHE A 91 5.246 -1.640 0.459 1.00 1.00 C ATOM 281 CE2 PHE A 91 3.282 -1.728 1.758 1.00 1.00 C ATOM 282 CZ PHE A 91 3.960 -1.254 0.678 1.00 1.00 C ATOM 0 H PHE A 91 7.473 -5.539 4.436 1.00 1.00 H new ATOM 0 HA PHE A 91 5.221 -5.888 2.586 1.00 1.00 H new ATOM 0 HB2 PHE A 91 5.269 -4.079 4.299 1.00 1.00 H new ATOM 0 HB3 PHE A 91 6.837 -3.544 3.727 1.00 1.00 H new ATOM 0 HD1 PHE A 91 6.902 -2.844 1.184 1.00 1.00 H new ATOM 0 HD2 PHE A 91 3.380 -3.001 3.516 1.00 1.00 H new ATOM 0 HE1 PHE A 91 5.784 -1.264 -0.399 1.00 1.00 H new ATOM 0 HE2 PHE A 91 2.261 -1.423 1.931 1.00 1.00 H new ATOM 0 HZ PHE A 91 3.477 -0.571 -0.006 1.00 1.00 H new ATOM 291 N TYR A 92 6.291 -5.538 0.422 1.00 1.00 N ATOM 292 CA TYR A 92 6.927 -5.444 -0.881 1.00 1.00 C ATOM 293 C TYR A 92 6.087 -4.601 -1.842 1.00 1.00 C ATOM 294 O TYR A 92 4.859 -4.646 -1.802 1.00 1.00 O ATOM 295 CB TYR A 92 7.006 -6.877 -1.414 1.00 1.00 C ATOM 296 CG TYR A 92 8.086 -7.731 -0.746 1.00 1.00 C ATOM 297 CD1 TYR A 92 9.419 -7.465 -0.981 1.00 1.00 C ATOM 298 CD2 TYR A 92 7.725 -8.767 0.092 1.00 1.00 C ATOM 299 CE1 TYR A 92 10.435 -8.270 -0.352 1.00 1.00 C ATOM 300 CE2 TYR A 92 8.741 -9.570 0.722 1.00 1.00 C ATOM 301 CZ TYR A 92 10.046 -9.282 0.468 1.00 1.00 C ATOM 302 OH TYR A 92 11.006 -10.041 1.062 1.00 1.00 O ATOM 0 H TYR A 92 5.324 -5.863 0.403 1.00 1.00 H new ATOM 0 HA TYR A 92 7.907 -4.973 -0.798 1.00 1.00 H new ATOM 0 HB2 TYR A 92 6.038 -7.359 -1.275 1.00 1.00 H new ATOM 0 HB3 TYR A 92 7.195 -6.845 -2.487 1.00 1.00 H new ATOM 0 HD1 TYR A 92 9.701 -6.654 -1.636 1.00 1.00 H new ATOM 0 HD2 TYR A 92 6.681 -8.975 0.275 1.00 1.00 H new ATOM 0 HE1 TYR A 92 11.482 -8.074 -0.528 1.00 1.00 H new ATOM 0 HE2 TYR A 92 8.473 -10.382 1.381 1.00 1.00 H new ATOM 0 HH TYR A 92 10.582 -10.726 1.621 1.00 1.00 H new ATOM 311 N ARG A 93 6.784 -3.852 -2.684 1.00 1.00 N ATOM 312 CA ARG A 93 6.118 -2.999 -3.655 1.00 1.00 C ATOM 313 C ARG A 93 5.923 -3.748 -4.974 1.00 1.00 C ATOM 314 O ARG A 93 5.111 -3.347 -5.806 1.00 1.00 O ATOM 315 CB ARG A 93 6.924 -1.725 -3.913 1.00 1.00 C ATOM 316 CG ARG A 93 7.103 -0.918 -2.625 1.00 1.00 C ATOM 317 CD ARG A 93 5.928 0.038 -2.410 1.00 1.00 C ATOM 318 NE ARG A 93 5.674 0.813 -3.645 1.00 1.00 N ATOM 319 CZ ARG A 93 6.500 1.769 -4.122 1.00 1.00 C ATOM 320 NH1 ARG A 93 7.642 2.077 -3.469 1.00 1.00 N ATOM 321 NH2 ARG A 93 6.175 2.400 -5.235 1.00 1.00 N ATOM 0 H ARG A 93 7.803 -3.818 -2.714 1.00 1.00 H new ATOM 0 HA ARG A 93 5.147 -2.723 -3.244 1.00 1.00 H new ATOM 0 HB2 ARG A 93 7.900 -1.985 -4.322 1.00 1.00 H new ATOM 0 HB3 ARG A 93 6.417 -1.115 -4.661 1.00 1.00 H new ATOM 0 HG2 ARG A 93 7.185 -1.596 -1.775 1.00 1.00 H new ATOM 0 HG3 ARG A 93 8.033 -0.352 -2.672 1.00 1.00 H new ATOM 0 HD2 ARG A 93 5.036 -0.525 -2.134 1.00 1.00 H new ATOM 0 HD3 ARG A 93 6.146 0.715 -1.584 1.00 1.00 H new ATOM 0 HE ARG A 93 4.822 0.613 -4.169 1.00 1.00 H new ATOM 0 HH11 ARG A 93 7.886 1.586 -2.609 1.00 1.00 H new ATOM 0 HH12 ARG A 93 8.260 2.800 -3.836 1.00 1.00 H new ATOM 0 HH21 ARG A 93 5.311 2.163 -5.722 1.00 1.00 H new ATOM 0 HH22 ARG A 93 6.788 3.125 -5.608 1.00 1.00 H new ATOM 330 N THR A 94 6.682 -4.824 -5.124 1.00 1.00 N ATOM 331 CA THR A 94 6.603 -5.633 -6.329 1.00 1.00 C ATOM 332 C THR A 94 6.504 -7.117 -5.970 1.00 1.00 C ATOM 333 O THR A 94 6.935 -7.529 -4.893 1.00 1.00 O ATOM 334 CB THR A 94 7.814 -5.299 -7.203 1.00 1.00 C ATOM 335 OG1 THR A 94 8.933 -5.610 -6.377 1.00 1.00 O ATOM 336 CG2 THR A 94 7.950 -3.798 -7.466 1.00 1.00 C ATOM 0 H THR A 94 7.354 -5.154 -4.432 1.00 1.00 H new ATOM 0 HA THR A 94 5.701 -5.408 -6.898 1.00 1.00 H new ATOM 0 HB THR A 94 7.734 -5.828 -8.153 1.00 1.00 H new ATOM 0 HG1 THR A 94 9.454 -6.330 -6.789 1.00 1.00 H new ATOM 0 HG21 THR A 94 8.825 -3.616 -8.091 1.00 1.00 H new ATOM 0 HG22 THR A 94 7.058 -3.436 -7.977 1.00 1.00 H new ATOM 0 HG23 THR A 94 8.065 -3.272 -6.519 1.00 1.00 H new ATOM 344 N PRO A 95 5.918 -7.900 -6.915 1.00 1.00 N ATOM 345 CA PRO A 95 5.756 -9.329 -6.709 1.00 1.00 C ATOM 346 C PRO A 95 7.089 -10.061 -6.879 1.00 1.00 C ATOM 347 O PRO A 95 7.272 -11.155 -6.345 1.00 1.00 O ATOM 348 CB PRO A 95 4.710 -9.757 -7.724 1.00 1.00 C ATOM 349 CG PRO A 95 4.664 -8.652 -8.767 1.00 1.00 C ATOM 350 CD PRO A 95 5.396 -7.446 -8.201 1.00 1.00 C ATOM 0 HA PRO A 95 5.433 -9.574 -5.697 1.00 1.00 H new ATOM 0 HB2 PRO A 95 4.974 -10.712 -8.178 1.00 1.00 H new ATOM 0 HB3 PRO A 95 3.737 -9.888 -7.251 1.00 1.00 H new ATOM 0 HG2 PRO A 95 5.133 -8.982 -9.694 1.00 1.00 H new ATOM 0 HG3 PRO A 95 3.632 -8.395 -9.005 1.00 1.00 H new ATOM 0 HD2 PRO A 95 6.200 -7.124 -8.863 1.00 1.00 H new ATOM 0 HD3 PRO A 95 4.724 -6.597 -8.078 1.00 1.00 H new ATOM 355 N SER A 96 7.984 -9.429 -7.622 1.00 1.00 N ATOM 356 CA SER A 96 9.295 -10.007 -7.868 1.00 1.00 C ATOM 357 C SER A 96 10.332 -8.897 -8.042 1.00 1.00 C ATOM 358 O SER A 96 9.980 -7.722 -8.136 1.00 1.00 O ATOM 359 CB SER A 96 9.274 -10.912 -9.101 1.00 1.00 C ATOM 360 OG SER A 96 9.341 -12.292 -8.751 1.00 1.00 O ATOM 0 H SER A 96 7.828 -8.522 -8.062 1.00 1.00 H new ATOM 0 HA SER A 96 9.567 -10.617 -7.007 1.00 1.00 H new ATOM 0 HB2 SER A 96 8.364 -10.726 -9.672 1.00 1.00 H new ATOM 0 HB3 SER A 96 10.114 -10.661 -9.749 1.00 1.00 H new ATOM 0 HG SER A 96 9.323 -12.837 -9.565 1.00 1.00 H new ATOM 365 N PRO A 97 11.625 -9.318 -8.081 1.00 1.00 N ATOM 366 CA PRO A 97 12.716 -8.373 -8.242 1.00 1.00 C ATOM 367 C PRO A 97 12.799 -7.873 -9.686 1.00 1.00 C ATOM 368 O PRO A 97 13.328 -6.792 -9.943 1.00 1.00 O ATOM 369 CB PRO A 97 13.960 -9.129 -7.803 1.00 1.00 C ATOM 370 CG PRO A 97 13.592 -10.602 -7.855 1.00 1.00 C ATOM 371 CD PRO A 97 12.079 -10.701 -7.974 1.00 1.00 C ATOM 0 HA PRO A 97 12.583 -7.471 -7.645 1.00 1.00 H new ATOM 0 HB2 PRO A 97 14.801 -8.913 -8.462 1.00 1.00 H new ATOM 0 HB3 PRO A 97 14.260 -8.837 -6.797 1.00 1.00 H new ATOM 0 HG2 PRO A 97 14.074 -11.086 -8.704 1.00 1.00 H new ATOM 0 HG3 PRO A 97 13.939 -11.114 -6.957 1.00 1.00 H new ATOM 0 HD2 PRO A 97 11.788 -11.282 -8.849 1.00 1.00 H new ATOM 0 HD3 PRO A 97 11.645 -11.194 -7.104 1.00 1.00 H new ATOM 376 N ASP A 98 12.270 -8.682 -10.591 1.00 1.00 N ATOM 377 CA ASP A 98 12.277 -8.336 -12.002 1.00 1.00 C ATOM 378 C ASP A 98 10.839 -8.113 -12.476 1.00 1.00 C ATOM 379 O ASP A 98 10.512 -8.394 -13.628 1.00 1.00 O ATOM 380 CB ASP A 98 12.883 -9.461 -12.842 1.00 1.00 C ATOM 381 CG ASP A 98 14.407 -9.415 -12.982 1.00 1.00 C ATOM 382 OD1 ASP A 98 14.987 -8.370 -13.310 1.00 1.00 O ATOM 383 OD2 ASP A 98 15.010 -10.528 -12.733 1.00 1.00 O ATOM 0 H ASP A 98 11.833 -9.578 -10.374 1.00 1.00 H new ATOM 0 HA ASP A 98 12.875 -7.433 -12.124 1.00 1.00 H new ATOM 0 HB2 ASP A 98 12.603 -10.417 -12.399 1.00 1.00 H new ATOM 0 HB3 ASP A 98 12.441 -9.429 -13.838 1.00 1.00 H new ATOM 388 N ALA A 99 10.020 -7.610 -11.563 1.00 1.00 N ATOM 389 CA ALA A 99 8.626 -7.347 -11.874 1.00 1.00 C ATOM 390 C ALA A 99 8.320 -5.871 -11.613 1.00 1.00 C ATOM 391 O ALA A 99 8.847 -5.281 -10.673 1.00 1.00 O ATOM 392 CB ALA A 99 7.735 -8.281 -11.053 1.00 1.00 C ATOM 0 H ALA A 99 10.296 -7.378 -10.609 1.00 1.00 H new ATOM 0 HA ALA A 99 8.423 -7.545 -12.927 1.00 1.00 H new ATOM 0 HB1 ALA A 99 6.689 -8.084 -11.286 1.00 1.00 H new ATOM 0 HB2 ALA A 99 7.972 -9.317 -11.296 1.00 1.00 H new ATOM 0 HB3 ALA A 99 7.909 -8.109 -9.991 1.00 1.00 H new ATOM 398 N LYS A 100 7.468 -5.317 -12.465 1.00 1.00 N ATOM 399 CA LYS A 100 7.086 -3.921 -12.339 1.00 1.00 C ATOM 400 C LYS A 100 6.630 -3.649 -10.904 1.00 1.00 C ATOM 401 O LYS A 100 6.644 -4.548 -10.064 1.00 1.00 O ATOM 402 CB LYS A 100 6.043 -3.554 -13.396 1.00 1.00 C ATOM 403 CG LYS A 100 6.591 -3.773 -14.807 1.00 1.00 C ATOM 404 CD LYS A 100 7.629 -2.707 -15.164 1.00 1.00 C ATOM 405 CE LYS A 100 8.300 -3.021 -16.502 1.00 1.00 C ATOM 406 NZ LYS A 100 7.391 -2.700 -17.625 1.00 1.00 N ATOM 0 H LYS A 100 7.032 -5.810 -13.244 1.00 1.00 H new ATOM 0 HA LYS A 100 7.941 -3.273 -12.530 1.00 1.00 H new ATOM 0 HB2 LYS A 100 5.147 -4.158 -13.252 1.00 1.00 H new ATOM 0 HB3 LYS A 100 5.748 -2.512 -13.274 1.00 1.00 H new ATOM 0 HG2 LYS A 100 7.042 -4.763 -14.876 1.00 1.00 H new ATOM 0 HG3 LYS A 100 5.773 -3.745 -15.527 1.00 1.00 H new ATOM 0 HD2 LYS A 100 7.149 -1.730 -15.214 1.00 1.00 H new ATOM 0 HD3 LYS A 100 8.383 -2.652 -14.379 1.00 1.00 H new ATOM 0 HE2 LYS A 100 9.222 -2.447 -16.597 1.00 1.00 H new ATOM 0 HE3 LYS A 100 8.575 -4.075 -16.539 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 7.862 -2.919 -18.526 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 6.523 -3.266 -17.541 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 7.149 -1.689 -17.598 1.00 1.00 H new ATOM 415 N ALA A 101 6.237 -2.407 -10.667 1.00 1.00 N ATOM 416 CA ALA A 101 5.777 -2.005 -9.348 1.00 1.00 C ATOM 417 C ALA A 101 4.248 -1.975 -9.333 1.00 1.00 C ATOM 418 O ALA A 101 3.626 -1.428 -10.242 1.00 1.00 O ATOM 419 CB ALA A 101 6.392 -0.652 -8.983 1.00 1.00 C ATOM 0 H ALA A 101 6.227 -1.665 -11.366 1.00 1.00 H new ATOM 0 HA ALA A 101 6.099 -2.723 -8.594 1.00 1.00 H new ATOM 0 HB1 ALA A 101 6.047 -0.350 -7.994 1.00 1.00 H new ATOM 0 HB2 ALA A 101 7.479 -0.736 -8.978 1.00 1.00 H new ATOM 0 HB3 ALA A 101 6.089 0.095 -9.716 1.00 1.00 H new ATOM 425 N PHE A 102 3.687 -2.569 -8.290 1.00 1.00 N ATOM 426 CA PHE A 102 2.241 -2.617 -8.146 1.00 1.00 C ATOM 427 C PHE A 102 1.638 -1.212 -8.202 1.00 1.00 C ATOM 428 O PHE A 102 0.583 -1.009 -8.801 1.00 1.00 O ATOM 429 CB PHE A 102 1.950 -3.230 -6.774 1.00 1.00 C ATOM 430 CG PHE A 102 1.861 -4.757 -6.781 1.00 1.00 C ATOM 431 CD1 PHE A 102 0.814 -5.374 -7.391 1.00 1.00 C ATOM 432 CD2 PHE A 102 2.830 -5.497 -6.178 1.00 1.00 C ATOM 433 CE1 PHE A 102 0.732 -6.792 -7.397 1.00 1.00 C ATOM 434 CE2 PHE A 102 2.748 -6.914 -6.185 1.00 1.00 C ATOM 435 CZ PHE A 102 1.701 -7.532 -6.794 1.00 1.00 C ATOM 0 H PHE A 102 4.206 -3.021 -7.537 1.00 1.00 H new ATOM 0 HA PHE A 102 1.805 -3.203 -8.955 1.00 1.00 H new ATOM 0 HB2 PHE A 102 2.732 -2.925 -6.078 1.00 1.00 H new ATOM 0 HB3 PHE A 102 1.011 -2.823 -6.397 1.00 1.00 H new ATOM 0 HD1 PHE A 102 0.045 -4.786 -7.871 1.00 1.00 H new ATOM 0 HD2 PHE A 102 3.662 -5.006 -5.694 1.00 1.00 H new ATOM 0 HE1 PHE A 102 -0.100 -7.283 -7.880 1.00 1.00 H new ATOM 0 HE2 PHE A 102 3.517 -7.502 -5.706 1.00 1.00 H new ATOM 0 HZ PHE A 102 1.639 -8.610 -6.799 1.00 1.00 H new ATOM 444 N ILE A 103 2.334 -0.278 -7.570 1.00 1.00 N ATOM 445 CA ILE A 103 1.879 1.101 -7.540 1.00 1.00 C ATOM 446 C ILE A 103 3.074 2.032 -7.759 1.00 1.00 C ATOM 447 O ILE A 103 3.908 2.197 -6.871 1.00 1.00 O ATOM 448 CB ILE A 103 1.108 1.385 -6.250 1.00 1.00 C ATOM 449 CG1 ILE A 103 0.800 2.877 -6.111 1.00 1.00 C ATOM 450 CG2 ILE A 103 1.858 0.841 -5.032 1.00 1.00 C ATOM 451 CD1 ILE A 103 -0.450 3.254 -6.909 1.00 1.00 C ATOM 0 H ILE A 103 3.209 -0.450 -7.075 1.00 1.00 H new ATOM 0 HA ILE A 103 1.175 1.287 -8.351 1.00 1.00 H new ATOM 0 HB ILE A 103 0.153 0.862 -6.302 1.00 1.00 H new ATOM 0 HG12 ILE A 103 0.654 3.126 -5.060 1.00 1.00 H new ATOM 0 HG13 ILE A 103 1.650 3.462 -6.462 1.00 1.00 H new ATOM 0 HG21 ILE A 103 1.288 1.056 -4.128 1.00 1.00 H new ATOM 0 HG22 ILE A 103 1.984 -0.237 -5.134 1.00 1.00 H new ATOM 0 HG23 ILE A 103 2.837 1.316 -4.966 1.00 1.00 H new ATOM 0 HD11 ILE A 103 -0.648 4.320 -6.794 1.00 1.00 H new ATOM 0 HD12 ILE A 103 -0.291 3.026 -7.963 1.00 1.00 H new ATOM 0 HD13 ILE A 103 -1.303 2.685 -6.539 1.00 1.00 H new ATOM 462 N GLU A 104 3.119 2.615 -8.948 1.00 1.00 N ATOM 463 CA GLU A 104 4.198 3.525 -9.296 1.00 1.00 C ATOM 464 C GLU A 104 3.817 4.962 -8.934 1.00 1.00 C ATOM 465 O GLU A 104 2.798 5.474 -9.395 1.00 1.00 O ATOM 466 CB GLU A 104 4.556 3.410 -10.779 1.00 1.00 C ATOM 467 CG GLU A 104 6.048 3.127 -10.961 1.00 1.00 C ATOM 468 CD GLU A 104 6.347 2.654 -12.386 1.00 1.00 C ATOM 469 OE1 GLU A 104 5.622 1.802 -12.920 1.00 1.00 O ATOM 470 OE2 GLU A 104 7.372 3.207 -12.940 1.00 1.00 O ATOM 0 H GLU A 104 2.426 2.475 -9.683 1.00 1.00 H new ATOM 0 HA GLU A 104 5.081 3.247 -8.721 1.00 1.00 H new ATOM 0 HB2 GLU A 104 3.972 2.612 -11.237 1.00 1.00 H new ATOM 0 HB3 GLU A 104 4.292 4.334 -11.294 1.00 1.00 H new ATOM 0 HG2 GLU A 104 6.622 4.028 -10.745 1.00 1.00 H new ATOM 0 HG3 GLU A 104 6.367 2.368 -10.247 1.00 1.00 H new ATOM 476 N VAL A 105 4.658 5.574 -8.112 1.00 1.00 N ATOM 477 CA VAL A 105 4.423 6.942 -7.683 1.00 1.00 C ATOM 478 C VAL A 105 3.902 7.760 -8.867 1.00 1.00 C ATOM 479 O VAL A 105 4.605 7.940 -9.859 1.00 1.00 O ATOM 480 CB VAL A 105 5.697 7.523 -7.069 1.00 1.00 C ATOM 481 CG1 VAL A 105 5.465 8.952 -6.572 1.00 1.00 C ATOM 482 CG2 VAL A 105 6.221 6.630 -5.942 1.00 1.00 C ATOM 0 H VAL A 105 5.503 5.147 -7.732 1.00 1.00 H new ATOM 0 HA VAL A 105 3.660 6.974 -6.905 1.00 1.00 H new ATOM 0 HB VAL A 105 6.457 7.558 -7.849 1.00 1.00 H new ATOM 0 HG11 VAL A 105 6.387 9.341 -6.140 1.00 1.00 H new ATOM 0 HG12 VAL A 105 5.161 9.583 -7.407 1.00 1.00 H new ATOM 0 HG13 VAL A 105 4.681 8.951 -5.814 1.00 1.00 H new ATOM 0 HG21 VAL A 105 7.128 7.067 -5.523 1.00 1.00 H new ATOM 0 HG22 VAL A 105 5.464 6.547 -5.162 1.00 1.00 H new ATOM 0 HG23 VAL A 105 6.445 5.639 -6.337 1.00 1.00 H new ATOM 492 N GLY A 106 2.673 8.235 -8.721 1.00 1.00 N ATOM 493 CA GLY A 106 2.050 9.029 -9.766 1.00 1.00 C ATOM 494 C GLY A 106 0.922 8.252 -10.447 1.00 1.00 C ATOM 495 O GLY A 106 0.569 8.538 -11.591 1.00 1.00 O ATOM 0 H GLY A 106 2.093 8.085 -7.895 1.00 1.00 H new ATOM 0 HA2 GLY A 106 1.655 9.951 -9.340 1.00 1.00 H new ATOM 0 HA3 GLY A 106 2.798 9.314 -10.506 1.00 1.00 H new ATOM 499 N GLN A 107 0.386 7.287 -9.715 1.00 1.00 N ATOM 500 CA GLN A 107 -0.695 6.466 -10.234 1.00 1.00 C ATOM 501 C GLN A 107 -1.849 6.411 -9.230 1.00 1.00 C ATOM 502 O GLN A 107 -1.680 6.770 -8.066 1.00 1.00 O ATOM 503 CB GLN A 107 -0.200 5.060 -10.579 1.00 1.00 C ATOM 504 CG GLN A 107 -1.061 4.429 -11.675 1.00 1.00 C ATOM 505 CD GLN A 107 -1.752 3.161 -11.166 1.00 1.00 C ATOM 506 OE1 GLN A 107 -2.948 2.973 -11.316 1.00 1.00 O ATOM 507 NE2 GLN A 107 -0.935 2.306 -10.558 1.00 1.00 N ATOM 0 H GLN A 107 0.680 7.055 -8.766 1.00 1.00 H new ATOM 0 HA GLN A 107 -1.061 6.922 -11.154 1.00 1.00 H new ATOM 0 HB2 GLN A 107 0.838 5.107 -10.909 1.00 1.00 H new ATOM 0 HB3 GLN A 107 -0.223 4.433 -9.687 1.00 1.00 H new ATOM 0 HG2 GLN A 107 -1.810 5.146 -12.012 1.00 1.00 H new ATOM 0 HG3 GLN A 107 -0.440 4.188 -12.537 1.00 1.00 H new ATOM 0 HE21 GLN A 107 0.057 2.526 -10.466 1.00 1.00 H new ATOM 0 HE22 GLN A 107 -1.300 1.430 -10.183 1.00 1.00 H new ATOM 514 N LYS A 108 -2.994 5.957 -9.718 1.00 1.00 N ATOM 515 CA LYS A 108 -4.174 5.851 -8.878 1.00 1.00 C ATOM 516 C LYS A 108 -4.462 4.374 -8.595 1.00 1.00 C ATOM 517 O LYS A 108 -3.790 3.494 -9.131 1.00 1.00 O ATOM 518 CB LYS A 108 -5.352 6.596 -9.510 1.00 1.00 C ATOM 519 CG LYS A 108 -5.883 5.846 -10.733 1.00 1.00 C ATOM 520 CD LYS A 108 -7.311 6.281 -11.066 1.00 1.00 C ATOM 521 CE LYS A 108 -7.311 7.500 -11.991 1.00 1.00 C ATOM 522 NZ LYS A 108 -8.353 8.465 -11.577 1.00 1.00 N ATOM 0 H LYS A 108 -3.129 5.659 -10.684 1.00 1.00 H new ATOM 0 HA LYS A 108 -4.001 6.334 -7.916 1.00 1.00 H new ATOM 0 HB2 LYS A 108 -6.149 6.712 -8.776 1.00 1.00 H new ATOM 0 HB3 LYS A 108 -5.039 7.598 -9.802 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -5.234 6.032 -11.588 1.00 1.00 H new ATOM 0 HG3 LYS A 108 -5.861 4.773 -10.544 1.00 1.00 H new ATOM 0 HD2 LYS A 108 -7.844 5.458 -11.543 1.00 1.00 H new ATOM 0 HD3 LYS A 108 -7.847 6.518 -10.147 1.00 1.00 H new ATOM 0 HE2 LYS A 108 -6.333 7.980 -11.969 1.00 1.00 H new ATOM 0 HE3 LYS A 108 -7.488 7.184 -13.019 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 -8.339 9.286 -12.215 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 -9.286 8.008 -11.621 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 -8.167 8.780 -10.603 1.00 1.00 H new ATOM 531 N VAL A 109 -5.461 4.149 -7.754 1.00 1.00 N ATOM 532 CA VAL A 109 -5.845 2.795 -7.395 1.00 1.00 C ATOM 533 C VAL A 109 -7.341 2.763 -7.073 1.00 1.00 C ATOM 534 O VAL A 109 -7.864 3.680 -6.442 1.00 1.00 O ATOM 535 CB VAL A 109 -4.975 2.294 -6.241 1.00 1.00 C ATOM 536 CG1 VAL A 109 -3.537 2.049 -6.704 1.00 1.00 C ATOM 537 CG2 VAL A 109 -5.012 3.267 -5.062 1.00 1.00 C ATOM 0 H VAL A 109 -6.016 4.882 -7.311 1.00 1.00 H new ATOM 0 HA VAL A 109 -5.677 2.115 -8.230 1.00 1.00 H new ATOM 0 HB VAL A 109 -5.385 1.343 -5.903 1.00 1.00 H new ATOM 0 HG11 VAL A 109 -2.940 1.693 -5.864 1.00 1.00 H new ATOM 0 HG12 VAL A 109 -3.532 1.300 -7.496 1.00 1.00 H new ATOM 0 HG13 VAL A 109 -3.113 2.979 -7.082 1.00 1.00 H new ATOM 0 HG21 VAL A 109 -4.385 2.886 -4.256 1.00 1.00 H new ATOM 0 HG22 VAL A 109 -4.640 4.240 -5.382 1.00 1.00 H new ATOM 0 HG23 VAL A 109 -6.037 3.369 -4.707 1.00 1.00 H new ATOM 547 N ASN A 110 -7.987 1.697 -7.522 1.00 1.00 N ATOM 548 CA ASN A 110 -9.412 1.532 -7.290 1.00 1.00 C ATOM 549 C ASN A 110 -9.647 0.273 -6.452 1.00 1.00 C ATOM 550 O ASN A 110 -8.958 -0.731 -6.629 1.00 1.00 O ATOM 551 CB ASN A 110 -10.169 1.370 -8.610 1.00 1.00 C ATOM 552 CG ASN A 110 -10.474 2.732 -9.238 1.00 1.00 C ATOM 553 OD1 ASN A 110 -9.600 3.429 -9.726 1.00 1.00 O ATOM 554 ND2 ASN A 110 -11.759 3.070 -9.199 1.00 1.00 N ATOM 0 H ASN A 110 -7.550 0.939 -8.045 1.00 1.00 H new ATOM 0 HA ASN A 110 -9.774 2.420 -6.773 1.00 1.00 H new ATOM 0 HB2 ASN A 110 -9.577 0.771 -9.302 1.00 1.00 H new ATOM 0 HB3 ASN A 110 -11.099 0.829 -8.436 1.00 1.00 H new ATOM 0 HD21 ASN A 110 -12.064 3.960 -9.593 1.00 1.00 H new ATOM 0 HD22 ASN A 110 -12.440 2.439 -8.775 1.00 1.00 H new ATOM 560 N VAL A 111 -10.621 0.368 -5.560 1.00 1.00 N ATOM 561 CA VAL A 111 -10.954 -0.750 -4.694 1.00 1.00 C ATOM 562 C VAL A 111 -10.894 -2.049 -5.501 1.00 1.00 C ATOM 563 O VAL A 111 -11.747 -2.296 -6.351 1.00 1.00 O ATOM 564 CB VAL A 111 -12.317 -0.517 -4.040 1.00 1.00 C ATOM 565 CG1 VAL A 111 -12.960 -1.842 -3.625 1.00 1.00 C ATOM 566 CG2 VAL A 111 -12.197 0.432 -2.845 1.00 1.00 C ATOM 0 H VAL A 111 -11.191 1.202 -5.418 1.00 1.00 H new ATOM 0 HA VAL A 111 -10.229 -0.835 -3.884 1.00 1.00 H new ATOM 0 HB VAL A 111 -12.966 -0.046 -4.778 1.00 1.00 H new ATOM 0 HG11 VAL A 111 -13.928 -1.648 -3.163 1.00 1.00 H new ATOM 0 HG12 VAL A 111 -13.098 -2.471 -4.505 1.00 1.00 H new ATOM 0 HG13 VAL A 111 -12.313 -2.353 -2.912 1.00 1.00 H new ATOM 0 HG21 VAL A 111 -13.180 0.581 -2.398 1.00 1.00 H new ATOM 0 HG22 VAL A 111 -11.523 0.001 -2.104 1.00 1.00 H new ATOM 0 HG23 VAL A 111 -11.802 1.391 -3.180 1.00 1.00 H new ATOM 576 N GLY A 112 -9.875 -2.844 -5.206 1.00 1.00 N ATOM 577 CA GLY A 112 -9.692 -4.111 -5.892 1.00 1.00 C ATOM 578 C GLY A 112 -8.342 -4.154 -6.612 1.00 1.00 C ATOM 579 O GLY A 112 -8.044 -5.112 -7.322 1.00 1.00 O ATOM 0 H GLY A 112 -9.168 -2.635 -4.501 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -9.752 -4.929 -5.174 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -10.497 -4.259 -6.612 1.00 1.00 H new ATOM 583 N ASP A 113 -7.563 -3.103 -6.403 1.00 1.00 N ATOM 584 CA ASP A 113 -6.252 -3.009 -7.022 1.00 1.00 C ATOM 585 C ASP A 113 -5.173 -3.249 -5.964 1.00 1.00 C ATOM 586 O ASP A 113 -5.253 -2.715 -4.859 1.00 1.00 O ATOM 587 CB ASP A 113 -6.024 -1.620 -7.622 1.00 1.00 C ATOM 588 CG ASP A 113 -6.237 -1.526 -9.134 1.00 1.00 C ATOM 589 OD1 ASP A 113 -7.139 -0.821 -9.611 1.00 1.00 O ATOM 590 OD2 ASP A 113 -5.416 -2.224 -9.844 1.00 1.00 O ATOM 0 H ASP A 113 -7.815 -2.309 -5.814 1.00 1.00 H new ATOM 0 HA ASP A 113 -6.199 -3.757 -7.813 1.00 1.00 H new ATOM 0 HB2 ASP A 113 -6.694 -0.914 -7.131 1.00 1.00 H new ATOM 0 HB3 ASP A 113 -5.006 -1.305 -7.393 1.00 1.00 H new ATOM 595 N THR A 114 -4.190 -4.054 -6.340 1.00 1.00 N ATOM 596 CA THR A 114 -3.096 -4.371 -5.436 1.00 1.00 C ATOM 597 C THR A 114 -2.389 -3.091 -4.985 1.00 1.00 C ATOM 598 O THR A 114 -2.209 -2.165 -5.775 1.00 1.00 O ATOM 599 CB THR A 114 -2.169 -5.359 -6.146 1.00 1.00 C ATOM 600 OG1 THR A 114 -2.986 -6.506 -6.365 1.00 1.00 O ATOM 601 CG2 THR A 114 -1.049 -5.869 -5.235 1.00 1.00 C ATOM 0 H THR A 114 -4.128 -4.496 -7.257 1.00 1.00 H new ATOM 0 HA THR A 114 -3.460 -4.842 -4.523 1.00 1.00 H new ATOM 0 HB THR A 114 -1.735 -4.882 -7.024 1.00 1.00 H new ATOM 0 HG1 THR A 114 -2.464 -7.197 -6.823 1.00 1.00 H new ATOM 0 HG21 THR A 114 -0.420 -6.567 -5.788 1.00 1.00 H new ATOM 0 HG22 THR A 114 -0.445 -5.028 -4.895 1.00 1.00 H new ATOM 0 HG23 THR A 114 -1.483 -6.376 -4.373 1.00 1.00 H new ATOM 609 N LEU A 115 -2.007 -3.081 -3.716 1.00 1.00 N ATOM 610 CA LEU A 115 -1.324 -1.930 -3.150 1.00 1.00 C ATOM 611 C LEU A 115 0.112 -2.321 -2.793 1.00 1.00 C ATOM 612 O LEU A 115 1.021 -1.496 -2.872 1.00 1.00 O ATOM 613 CB LEU A 115 -2.118 -1.361 -1.973 1.00 1.00 C ATOM 614 CG LEU A 115 -2.203 -2.250 -0.729 1.00 1.00 C ATOM 615 CD1 LEU A 115 -1.055 -1.952 0.237 1.00 1.00 C ATOM 616 CD2 LEU A 115 -3.570 -2.118 -0.054 1.00 1.00 C ATOM 0 H LEU A 115 -2.157 -3.851 -3.064 1.00 1.00 H new ATOM 0 HA LEU A 115 -1.263 -1.124 -3.882 1.00 1.00 H new ATOM 0 HB2 LEU A 115 -1.672 -0.409 -1.685 1.00 1.00 H new ATOM 0 HB3 LEU A 115 -3.131 -1.148 -2.313 1.00 1.00 H new ATOM 0 HG LEU A 115 -2.098 -3.289 -1.043 1.00 1.00 H new ATOM 0 HD11 LEU A 115 -1.139 -2.597 1.112 1.00 1.00 H new ATOM 0 HD12 LEU A 115 -0.103 -2.138 -0.261 1.00 1.00 H new ATOM 0 HD13 LEU A 115 -1.104 -0.909 0.549 1.00 1.00 H new ATOM 0 HD21 LEU A 115 -3.604 -2.759 0.827 1.00 1.00 H new ATOM 0 HD22 LEU A 115 -3.730 -1.082 0.245 1.00 1.00 H new ATOM 0 HD23 LEU A 115 -4.351 -2.418 -0.752 1.00 1.00 H new ATOM 627 N CYS A 116 0.271 -3.578 -2.407 1.00 1.00 N ATOM 628 CA CYS A 116 1.580 -4.087 -2.037 1.00 1.00 C ATOM 629 C CYS A 116 1.436 -5.567 -1.675 1.00 1.00 C ATOM 630 O CYS A 116 0.393 -6.170 -1.921 1.00 1.00 O ATOM 631 CB CYS A 116 2.201 -3.278 -0.897 1.00 1.00 C ATOM 632 SG CYS A 116 1.410 -3.726 0.692 1.00 1.00 S ATOM 0 H CYS A 116 -0.485 -4.259 -2.342 1.00 1.00 H new ATOM 0 HA CYS A 116 2.263 -3.985 -2.880 1.00 1.00 H new ATOM 0 HB2 CYS A 116 3.273 -3.470 -0.846 1.00 1.00 H new ATOM 0 HB3 CYS A 116 2.077 -2.212 -1.087 1.00 1.00 H new ATOM 0 HG CYS A 116 2.040 -3.145 1.669 1.00 1.00 H new ATOM 637 N ILE A 117 2.497 -6.107 -1.095 1.00 1.00 N ATOM 638 CA ILE A 117 2.502 -7.504 -0.695 1.00 1.00 C ATOM 639 C ILE A 117 3.110 -7.628 0.703 1.00 1.00 C ATOM 640 O ILE A 117 4.020 -6.881 1.058 1.00 1.00 O ATOM 641 CB ILE A 117 3.204 -8.361 -1.750 1.00 1.00 C ATOM 642 CG1 ILE A 117 2.612 -8.116 -3.140 1.00 1.00 C ATOM 643 CG2 ILE A 117 3.171 -9.841 -1.365 1.00 1.00 C ATOM 644 CD1 ILE A 117 2.984 -9.246 -4.101 1.00 1.00 C ATOM 0 H ILE A 117 3.360 -5.602 -0.892 1.00 1.00 H new ATOM 0 HA ILE A 117 1.483 -7.886 -0.634 1.00 1.00 H new ATOM 0 HB ILE A 117 4.252 -8.062 -1.790 1.00 1.00 H new ATOM 0 HG12 ILE A 117 1.527 -8.037 -3.068 1.00 1.00 H new ATOM 0 HG13 ILE A 117 2.976 -7.166 -3.532 1.00 1.00 H new ATOM 0 HG21 ILE A 117 3.677 -10.428 -2.132 1.00 1.00 H new ATOM 0 HG22 ILE A 117 3.677 -9.980 -0.409 1.00 1.00 H new ATOM 0 HG23 ILE A 117 2.136 -10.172 -1.279 1.00 1.00 H new ATOM 0 HD11 ILE A 117 2.551 -9.047 -5.081 1.00 1.00 H new ATOM 0 HD12 ILE A 117 4.069 -9.306 -4.189 1.00 1.00 H new ATOM 0 HD13 ILE A 117 2.598 -10.191 -3.719 1.00 1.00 H new ATOM 655 N VAL A 118 2.582 -8.579 1.460 1.00 1.00 N ATOM 656 CA VAL A 118 3.062 -8.812 2.813 1.00 1.00 C ATOM 657 C VAL A 118 3.465 -10.279 2.961 1.00 1.00 C ATOM 658 O VAL A 118 2.644 -11.175 2.770 1.00 1.00 O ATOM 659 CB VAL A 118 2.000 -8.378 3.825 1.00 1.00 C ATOM 660 CG1 VAL A 118 2.426 -8.734 5.252 1.00 1.00 C ATOM 661 CG2 VAL A 118 1.700 -6.883 3.700 1.00 1.00 C ATOM 0 H VAL A 118 1.827 -9.197 1.163 1.00 1.00 H new ATOM 0 HA VAL A 118 3.949 -8.211 3.013 1.00 1.00 H new ATOM 0 HB VAL A 118 1.083 -8.923 3.602 1.00 1.00 H new ATOM 0 HG11 VAL A 118 1.654 -8.415 5.952 1.00 1.00 H new ATOM 0 HG12 VAL A 118 2.565 -9.812 5.332 1.00 1.00 H new ATOM 0 HG13 VAL A 118 3.362 -8.229 5.489 1.00 1.00 H new ATOM 0 HG21 VAL A 118 0.942 -6.602 4.431 1.00 1.00 H new ATOM 0 HG22 VAL A 118 2.610 -6.313 3.884 1.00 1.00 H new ATOM 0 HG23 VAL A 118 1.334 -6.668 2.696 1.00 1.00 H new ATOM 671 N GLU A 119 4.731 -10.481 3.299 1.00 1.00 N ATOM 672 CA GLU A 119 5.253 -11.826 3.476 1.00 1.00 C ATOM 673 C GLU A 119 5.273 -12.197 4.960 1.00 1.00 C ATOM 674 O GLU A 119 5.837 -11.471 5.778 1.00 1.00 O ATOM 675 CB GLU A 119 6.647 -11.956 2.859 1.00 1.00 C ATOM 676 CG GLU A 119 6.845 -13.342 2.240 1.00 1.00 C ATOM 677 CD GLU A 119 7.956 -13.319 1.187 1.00 1.00 C ATOM 678 OE1 GLU A 119 7.706 -13.636 0.016 1.00 1.00 O ATOM 679 OE2 GLU A 119 9.113 -12.954 1.625 1.00 1.00 O ATOM 0 H GLU A 119 5.410 -9.736 3.455 1.00 1.00 H new ATOM 0 HA GLU A 119 4.594 -12.523 2.957 1.00 1.00 H new ATOM 0 HB2 GLU A 119 6.784 -11.190 2.096 1.00 1.00 H new ATOM 0 HB3 GLU A 119 7.405 -11.783 3.623 1.00 1.00 H new ATOM 0 HG2 GLU A 119 7.094 -14.061 3.021 1.00 1.00 H new ATOM 0 HG3 GLU A 119 5.913 -13.677 1.784 1.00 1.00 H new ATOM 685 N ALA A 120 4.650 -13.326 5.262 1.00 1.00 N ATOM 686 CA ALA A 120 4.590 -13.804 6.634 1.00 1.00 C ATOM 687 C ALA A 120 4.023 -15.225 6.651 1.00 1.00 C ATOM 688 O ALA A 120 3.632 -15.753 5.611 1.00 1.00 O ATOM 689 CB ALA A 120 3.757 -12.834 7.475 1.00 1.00 C ATOM 0 H ALA A 120 4.182 -13.924 4.581 1.00 1.00 H new ATOM 0 HA ALA A 120 5.588 -13.843 7.071 1.00 1.00 H new ATOM 0 HB1 ALA A 120 3.711 -13.191 8.504 1.00 1.00 H new ATOM 0 HB2 ALA A 120 4.218 -11.846 7.454 1.00 1.00 H new ATOM 0 HB3 ALA A 120 2.748 -12.773 7.067 1.00 1.00 H new ATOM 695 N MET A 121 3.997 -15.803 7.842 1.00 1.00 N ATOM 696 CA MET A 121 3.485 -17.153 8.008 1.00 1.00 C ATOM 697 C MET A 121 3.977 -18.067 6.884 1.00 1.00 C ATOM 698 O MET A 121 3.195 -18.818 6.303 1.00 1.00 O ATOM 699 CB MET A 121 1.955 -17.122 8.009 1.00 1.00 C ATOM 700 CG MET A 121 1.417 -16.589 6.680 1.00 1.00 C ATOM 701 SD MET A 121 -0.348 -16.842 6.589 1.00 1.00 S ATOM 702 CE MET A 121 -0.408 -18.626 6.635 1.00 1.00 C ATOM 0 H MET A 121 4.322 -15.361 8.702 1.00 1.00 H new ATOM 0 HA MET A 121 3.850 -17.546 8.957 1.00 1.00 H new ATOM 0 HB2 MET A 121 1.567 -18.125 8.186 1.00 1.00 H new ATOM 0 HB3 MET A 121 1.601 -16.494 8.827 1.00 1.00 H new ATOM 0 HG2 MET A 121 1.646 -15.527 6.585 1.00 1.00 H new ATOM 0 HG3 MET A 121 1.909 -17.096 5.850 1.00 1.00 H new ATOM 0 HE1 MET A 121 -1.169 -18.982 5.941 1.00 1.00 H new ATOM 0 HE2 MET A 121 0.563 -19.030 6.348 1.00 1.00 H new ATOM 0 HE3 MET A 121 -0.654 -18.956 7.644 1.00 1.00 H new ATOM 710 N LYS A 122 5.270 -17.975 6.612 1.00 1.00 N ATOM 711 CA LYS A 122 5.875 -18.784 5.569 1.00 1.00 C ATOM 712 C LYS A 122 4.947 -18.820 4.353 1.00 1.00 C ATOM 713 O LYS A 122 4.625 -19.893 3.845 1.00 1.00 O ATOM 714 CB LYS A 122 6.236 -20.169 6.108 1.00 1.00 C ATOM 715 CG LYS A 122 7.382 -20.789 5.304 1.00 1.00 C ATOM 716 CD LYS A 122 8.737 -20.283 5.801 1.00 1.00 C ATOM 717 CE LYS A 122 9.475 -21.370 6.584 1.00 1.00 C ATOM 718 NZ LYS A 122 10.751 -20.847 7.121 1.00 1.00 N ATOM 0 H LYS A 122 5.916 -17.352 7.097 1.00 1.00 H new ATOM 0 HA LYS A 122 6.814 -18.340 5.240 1.00 1.00 H new ATOM 0 HB2 LYS A 122 6.523 -20.092 7.157 1.00 1.00 H new ATOM 0 HB3 LYS A 122 5.362 -20.819 6.064 1.00 1.00 H new ATOM 0 HG2 LYS A 122 7.343 -21.875 5.387 1.00 1.00 H new ATOM 0 HG3 LYS A 122 7.264 -20.545 4.248 1.00 1.00 H new ATOM 0 HD2 LYS A 122 9.344 -19.965 4.953 1.00 1.00 H new ATOM 0 HD3 LYS A 122 8.592 -19.408 6.435 1.00 1.00 H new ATOM 0 HE2 LYS A 122 8.848 -21.726 7.402 1.00 1.00 H new ATOM 0 HE3 LYS A 122 9.670 -22.225 5.936 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 11.239 -21.598 7.650 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 11.354 -20.529 6.335 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 10.558 -20.046 7.756 1.00 1.00 H new ATOM 727 N MET A 123 4.543 -17.634 3.923 1.00 1.00 N ATOM 728 CA MET A 123 3.657 -17.516 2.776 1.00 1.00 C ATOM 729 C MET A 123 3.511 -16.055 2.344 1.00 1.00 C ATOM 730 O MET A 123 3.511 -15.154 3.181 1.00 1.00 O ATOM 731 CB MET A 123 2.281 -18.083 3.133 1.00 1.00 C ATOM 732 CG MET A 123 1.575 -18.629 1.891 1.00 1.00 C ATOM 733 SD MET A 123 2.519 -19.975 1.194 1.00 1.00 S ATOM 734 CE MET A 123 2.176 -21.249 2.397 1.00 1.00 C ATOM 0 H MET A 123 4.812 -16.746 4.347 1.00 1.00 H new ATOM 0 HA MET A 123 4.088 -18.079 1.948 1.00 1.00 H new ATOM 0 HB2 MET A 123 2.391 -18.877 3.872 1.00 1.00 H new ATOM 0 HB3 MET A 123 1.670 -17.305 3.590 1.00 1.00 H new ATOM 0 HG2 MET A 123 0.574 -18.973 2.153 1.00 1.00 H new ATOM 0 HG3 MET A 123 1.456 -17.836 1.152 1.00 1.00 H new ATOM 0 HE1 MET A 123 3.111 -21.596 2.837 1.00 1.00 H new ATOM 0 HE2 MET A 123 1.534 -20.846 3.181 1.00 1.00 H new ATOM 0 HE3 MET A 123 1.673 -22.084 1.909 1.00 1.00 H new ATOM 742 N MET A 124 3.391 -15.867 1.039 1.00 1.00 N ATOM 743 CA MET A 124 3.245 -14.532 0.485 1.00 1.00 C ATOM 744 C MET A 124 1.768 -14.160 0.331 1.00 1.00 C ATOM 745 O MET A 124 0.981 -14.940 -0.202 1.00 1.00 O ATOM 746 CB MET A 124 3.932 -14.467 -0.880 1.00 1.00 C ATOM 747 CG MET A 124 4.665 -13.136 -1.062 1.00 1.00 C ATOM 748 SD MET A 124 4.980 -12.845 -2.795 1.00 1.00 S ATOM 749 CE MET A 124 6.494 -11.908 -2.681 1.00 1.00 C ATOM 0 H MET A 124 3.392 -16.617 0.348 1.00 1.00 H new ATOM 0 HA MET A 124 3.710 -13.823 1.170 1.00 1.00 H new ATOM 0 HB2 MET A 124 4.639 -15.291 -0.975 1.00 1.00 H new ATOM 0 HB3 MET A 124 3.191 -14.589 -1.670 1.00 1.00 H new ATOM 0 HG2 MET A 124 4.067 -12.323 -0.651 1.00 1.00 H new ATOM 0 HG3 MET A 124 5.605 -13.151 -0.510 1.00 1.00 H new ATOM 0 HE1 MET A 124 6.786 -11.566 -3.674 1.00 1.00 H new ATOM 0 HE2 MET A 124 6.341 -11.046 -2.031 1.00 1.00 H new ATOM 0 HE3 MET A 124 7.282 -12.538 -2.268 1.00 1.00 H new ATOM 757 N ASN A 125 1.438 -12.970 0.809 1.00 1.00 N ATOM 758 CA ASN A 125 0.070 -12.486 0.732 1.00 1.00 C ATOM 759 C ASN A 125 0.054 -11.126 0.031 1.00 1.00 C ATOM 760 O ASN A 125 1.028 -10.377 0.098 1.00 1.00 O ATOM 761 CB ASN A 125 -0.529 -12.305 2.128 1.00 1.00 C ATOM 762 CG ASN A 125 -0.338 -13.564 2.975 1.00 1.00 C ATOM 763 OD1 ASN A 125 -1.040 -14.552 2.834 1.00 1.00 O ATOM 764 ND2 ASN A 125 0.651 -13.476 3.860 1.00 1.00 N ATOM 0 H ASN A 125 2.094 -12.326 1.251 1.00 1.00 H new ATOM 0 HA ASN A 125 -0.517 -13.220 0.180 1.00 1.00 H new ATOM 0 HB2 ASN A 125 -0.058 -11.455 2.622 1.00 1.00 H new ATOM 0 HB3 ASN A 125 -1.591 -12.076 2.045 1.00 1.00 H new ATOM 0 HD21 ASN A 125 0.860 -14.265 4.472 1.00 1.00 H new ATOM 0 HD22 ASN A 125 1.201 -12.619 3.927 1.00 1.00 H new ATOM 770 N GLN A 126 -1.063 -10.847 -0.625 1.00 1.00 N ATOM 771 CA GLN A 126 -1.219 -9.591 -1.338 1.00 1.00 C ATOM 772 C GLN A 126 -2.192 -8.675 -0.592 1.00 1.00 C ATOM 773 O GLN A 126 -3.064 -9.149 0.133 1.00 1.00 O ATOM 774 CB GLN A 126 -1.684 -9.830 -2.776 1.00 1.00 C ATOM 775 CG GLN A 126 -0.526 -10.313 -3.653 1.00 1.00 C ATOM 776 CD GLN A 126 -0.937 -11.531 -4.482 1.00 1.00 C ATOM 777 OE1 GLN A 126 -1.713 -12.370 -4.056 1.00 1.00 O ATOM 778 NE2 GLN A 126 -0.375 -11.581 -5.686 1.00 1.00 N ATOM 0 H GLN A 126 -1.869 -11.470 -0.678 1.00 1.00 H new ATOM 0 HA GLN A 126 -0.248 -9.098 -1.383 1.00 1.00 H new ATOM 0 HB2 GLN A 126 -2.485 -10.569 -2.785 1.00 1.00 H new ATOM 0 HB3 GLN A 126 -2.096 -8.908 -3.187 1.00 1.00 H new ATOM 0 HG2 GLN A 126 -0.207 -9.509 -4.316 1.00 1.00 H new ATOM 0 HG3 GLN A 126 0.328 -10.567 -3.026 1.00 1.00 H new ATOM 0 HE21 GLN A 126 0.267 -10.845 -5.980 1.00 1.00 H new ATOM 0 HE22 GLN A 126 -0.586 -12.356 -6.315 1.00 1.00 H new ATOM 785 N ILE A 127 -2.008 -7.379 -0.797 1.00 1.00 N ATOM 786 CA ILE A 127 -2.860 -6.393 -0.153 1.00 1.00 C ATOM 787 C ILE A 127 -3.667 -5.648 -1.220 1.00 1.00 C ATOM 788 O ILE A 127 -3.099 -4.959 -2.065 1.00 1.00 O ATOM 789 CB ILE A 127 -2.029 -5.472 0.743 1.00 1.00 C ATOM 790 CG1 ILE A 127 -1.017 -6.273 1.564 1.00 1.00 C ATOM 791 CG2 ILE A 127 -2.930 -4.608 1.628 1.00 1.00 C ATOM 792 CD1 ILE A 127 -1.695 -6.959 2.751 1.00 1.00 C ATOM 0 H ILE A 127 -1.283 -6.989 -1.399 1.00 1.00 H new ATOM 0 HA ILE A 127 -3.577 -6.881 0.507 1.00 1.00 H new ATOM 0 HB ILE A 127 -1.462 -4.795 0.104 1.00 1.00 H new ATOM 0 HG12 ILE A 127 -0.540 -7.021 0.931 1.00 1.00 H new ATOM 0 HG13 ILE A 127 -0.229 -5.611 1.923 1.00 1.00 H new ATOM 0 HG21 ILE A 127 -2.314 -3.963 2.255 1.00 1.00 H new ATOM 0 HG22 ILE A 127 -3.576 -3.994 1.000 1.00 1.00 H new ATOM 0 HG23 ILE A 127 -3.543 -5.250 2.260 1.00 1.00 H new ATOM 0 HD11 ILE A 127 -0.954 -7.522 3.318 1.00 1.00 H new ATOM 0 HD12 ILE A 127 -2.150 -6.206 3.395 1.00 1.00 H new ATOM 0 HD13 ILE A 127 -2.466 -7.639 2.387 1.00 1.00 H new ATOM 803 N GLU A 128 -4.979 -5.813 -1.144 1.00 1.00 N ATOM 804 CA GLU A 128 -5.870 -5.166 -2.092 1.00 1.00 C ATOM 805 C GLU A 128 -6.399 -3.853 -1.511 1.00 1.00 C ATOM 806 O GLU A 128 -7.013 -3.844 -0.446 1.00 1.00 O ATOM 807 CB GLU A 128 -7.021 -6.094 -2.484 1.00 1.00 C ATOM 808 CG GLU A 128 -8.039 -5.365 -3.365 1.00 1.00 C ATOM 809 CD GLU A 128 -9.379 -5.212 -2.642 1.00 1.00 C ATOM 810 OE1 GLU A 128 -10.079 -4.208 -2.841 1.00 1.00 O ATOM 811 OE2 GLU A 128 -9.684 -6.182 -1.849 1.00 1.00 O ATOM 0 H GLU A 128 -5.447 -6.385 -0.441 1.00 1.00 H new ATOM 0 HA GLU A 128 -5.305 -4.940 -2.996 1.00 1.00 H new ATOM 0 HB2 GLU A 128 -6.629 -6.961 -3.016 1.00 1.00 H new ATOM 0 HB3 GLU A 128 -7.513 -6.468 -1.586 1.00 1.00 H new ATOM 0 HG2 GLU A 128 -7.653 -4.382 -3.636 1.00 1.00 H new ATOM 0 HG3 GLU A 128 -8.184 -5.917 -4.293 1.00 1.00 H new ATOM 817 N ALA A 129 -6.140 -2.775 -2.238 1.00 1.00 N ATOM 818 CA ALA A 129 -6.582 -1.459 -1.808 1.00 1.00 C ATOM 819 C ALA A 129 -7.992 -1.565 -1.224 1.00 1.00 C ATOM 820 O ALA A 129 -8.868 -2.194 -1.816 1.00 1.00 O ATOM 821 CB ALA A 129 -6.512 -0.487 -2.988 1.00 1.00 C ATOM 0 H ALA A 129 -5.630 -2.786 -3.121 1.00 1.00 H new ATOM 0 HA ALA A 129 -5.929 -1.071 -1.026 1.00 1.00 H new ATOM 0 HB1 ALA A 129 -6.843 0.500 -2.666 1.00 1.00 H new ATOM 0 HB2 ALA A 129 -5.485 -0.426 -3.348 1.00 1.00 H new ATOM 0 HB3 ALA A 129 -7.158 -0.843 -3.791 1.00 1.00 H new ATOM 827 N ASP A 130 -8.168 -0.941 -0.068 1.00 1.00 N ATOM 828 CA ASP A 130 -9.456 -0.957 0.603 1.00 1.00 C ATOM 829 C ASP A 130 -9.996 0.471 0.696 1.00 1.00 C ATOM 830 O ASP A 130 -10.933 0.737 1.448 1.00 1.00 O ATOM 831 CB ASP A 130 -9.330 -1.508 2.025 1.00 1.00 C ATOM 832 CG ASP A 130 -10.657 -1.812 2.722 1.00 1.00 C ATOM 833 OD1 ASP A 130 -11.714 -1.888 2.076 1.00 1.00 O ATOM 834 OD2 ASP A 130 -10.578 -1.977 3.999 1.00 1.00 O ATOM 0 H ASP A 130 -7.439 -0.421 0.421 1.00 1.00 H new ATOM 0 HA ASP A 130 -10.127 -1.594 0.027 1.00 1.00 H new ATOM 0 HB2 ASP A 130 -8.736 -2.422 1.993 1.00 1.00 H new ATOM 0 HB3 ASP A 130 -8.776 -0.789 2.629 1.00 1.00 H new ATOM 839 N LYS A 131 -9.383 1.353 -0.080 1.00 1.00 N ATOM 840 CA LYS A 131 -9.791 2.748 -0.095 1.00 1.00 C ATOM 841 C LYS A 131 -9.221 3.428 -1.342 1.00 1.00 C ATOM 842 O LYS A 131 -8.173 4.068 -1.280 1.00 1.00 O ATOM 843 CB LYS A 131 -9.397 3.435 1.214 1.00 1.00 C ATOM 844 CG LYS A 131 -10.477 3.241 2.281 1.00 1.00 C ATOM 845 CD LYS A 131 -10.005 2.276 3.370 1.00 1.00 C ATOM 846 CE LYS A 131 -11.190 1.730 4.169 1.00 1.00 C ATOM 847 NZ LYS A 131 -10.752 0.637 5.065 1.00 1.00 N ATOM 0 H LYS A 131 -8.607 1.129 -0.703 1.00 1.00 H new ATOM 0 HA LYS A 131 -10.876 2.827 -0.156 1.00 1.00 H new ATOM 0 HB2 LYS A 131 -8.450 3.029 1.571 1.00 1.00 H new ATOM 0 HB3 LYS A 131 -9.241 4.499 1.038 1.00 1.00 H new ATOM 0 HG2 LYS A 131 -10.729 4.203 2.727 1.00 1.00 H new ATOM 0 HG3 LYS A 131 -11.386 2.856 1.818 1.00 1.00 H new ATOM 0 HD2 LYS A 131 -9.456 1.451 2.917 1.00 1.00 H new ATOM 0 HD3 LYS A 131 -9.315 2.788 4.040 1.00 1.00 H new ATOM 0 HE2 LYS A 131 -11.640 2.531 4.756 1.00 1.00 H new ATOM 0 HE3 LYS A 131 -11.958 1.364 3.487 1.00 1.00 H new ATOM 0 HZ1 LYS A 131 -11.312 0.661 5.941 1.00 1.00 H new ATOM 0 HZ2 LYS A 131 -10.890 -0.278 4.590 1.00 1.00 H new ATOM 0 HZ3 LYS A 131 -9.745 0.759 5.295 1.00 1.00 H new ATOM 856 N SER A 132 -9.937 3.265 -2.444 1.00 1.00 N ATOM 857 CA SER A 132 -9.516 3.855 -3.704 1.00 1.00 C ATOM 858 C SER A 132 -8.942 5.253 -3.462 1.00 1.00 C ATOM 859 O SER A 132 -9.412 5.977 -2.586 1.00 1.00 O ATOM 860 CB SER A 132 -10.679 3.924 -4.695 1.00 1.00 C ATOM 861 OG SER A 132 -11.561 5.005 -4.409 1.00 1.00 O ATOM 0 H SER A 132 -10.806 2.733 -2.491 1.00 1.00 H new ATOM 0 HA SER A 132 -8.742 3.221 -4.136 1.00 1.00 H new ATOM 0 HB2 SER A 132 -10.287 4.034 -5.706 1.00 1.00 H new ATOM 0 HB3 SER A 132 -11.234 2.986 -4.668 1.00 1.00 H new ATOM 0 HG SER A 132 -12.289 5.016 -5.065 1.00 1.00 H new ATOM 866 N GLY A 133 -7.933 5.588 -4.252 1.00 1.00 N ATOM 867 CA GLY A 133 -7.290 6.886 -4.133 1.00 1.00 C ATOM 868 C GLY A 133 -6.002 6.936 -4.958 1.00 1.00 C ATOM 869 O GLY A 133 -5.701 6.006 -5.703 1.00 1.00 O ATOM 0 H GLY A 133 -7.545 4.984 -4.977 1.00 1.00 H new ATOM 0 HA2 GLY A 133 -7.972 7.666 -4.470 1.00 1.00 H new ATOM 0 HA3 GLY A 133 -7.064 7.090 -3.086 1.00 1.00 H new ATOM 873 N THR A 134 -5.276 8.032 -4.795 1.00 1.00 N ATOM 874 CA THR A 134 -4.027 8.217 -5.513 1.00 1.00 C ATOM 875 C THR A 134 -2.839 8.100 -4.556 1.00 1.00 C ATOM 876 O THR A 134 -3.018 8.055 -3.341 1.00 1.00 O ATOM 877 CB THR A 134 -4.092 9.561 -6.240 1.00 1.00 C ATOM 878 OG1 THR A 134 -4.940 9.311 -7.357 1.00 1.00 O ATOM 879 CG2 THR A 134 -2.754 9.954 -6.868 1.00 1.00 C ATOM 0 H THR A 134 -5.529 8.802 -4.175 1.00 1.00 H new ATOM 0 HA THR A 134 -3.881 7.436 -6.259 1.00 1.00 H new ATOM 0 HB THR A 134 -4.405 10.336 -5.541 1.00 1.00 H new ATOM 0 HG1 THR A 134 -5.038 10.132 -7.883 1.00 1.00 H new ATOM 0 HG21 THR A 134 -2.857 10.916 -7.371 1.00 1.00 H new ATOM 0 HG22 THR A 134 -1.995 10.031 -6.089 1.00 1.00 H new ATOM 0 HG23 THR A 134 -2.455 9.196 -7.592 1.00 1.00 H new ATOM 887 N VAL A 135 -1.650 8.055 -5.142 1.00 1.00 N ATOM 888 CA VAL A 135 -0.433 7.946 -4.356 1.00 1.00 C ATOM 889 C VAL A 135 -0.311 9.163 -3.439 1.00 1.00 C ATOM 890 O VAL A 135 -0.821 10.237 -3.755 1.00 1.00 O ATOM 891 CB VAL A 135 0.773 7.771 -5.282 1.00 1.00 C ATOM 892 CG1 VAL A 135 1.064 9.061 -6.051 1.00 1.00 C ATOM 893 CG2 VAL A 135 2.004 7.310 -4.499 1.00 1.00 C ATOM 0 H VAL A 135 -1.505 8.092 -6.151 1.00 1.00 H new ATOM 0 HA VAL A 135 -0.468 7.063 -3.718 1.00 1.00 H new ATOM 0 HB VAL A 135 0.529 6.995 -6.008 1.00 1.00 H new ATOM 0 HG11 VAL A 135 1.925 8.910 -6.702 1.00 1.00 H new ATOM 0 HG12 VAL A 135 0.196 9.329 -6.654 1.00 1.00 H new ATOM 0 HG13 VAL A 135 1.278 9.864 -5.346 1.00 1.00 H new ATOM 0 HG21 VAL A 135 2.846 7.193 -5.181 1.00 1.00 H new ATOM 0 HG22 VAL A 135 2.251 8.052 -3.740 1.00 1.00 H new ATOM 0 HG23 VAL A 135 1.792 6.355 -4.017 1.00 1.00 H new ATOM 903 N LYS A 136 0.368 8.956 -2.321 1.00 1.00 N ATOM 904 CA LYS A 136 0.564 10.024 -1.355 1.00 1.00 C ATOM 905 C LYS A 136 2.028 10.045 -0.914 1.00 1.00 C ATOM 906 O LYS A 136 2.656 11.103 -0.884 1.00 1.00 O ATOM 907 CB LYS A 136 -0.425 9.886 -0.196 1.00 1.00 C ATOM 908 CG LYS A 136 -0.991 11.249 0.209 1.00 1.00 C ATOM 909 CD LYS A 136 -0.022 11.993 1.131 1.00 1.00 C ATOM 910 CE LYS A 136 -0.703 12.376 2.446 1.00 1.00 C ATOM 911 NZ LYS A 136 0.308 12.728 3.470 1.00 1.00 N ATOM 0 H LYS A 136 0.790 8.064 -2.062 1.00 1.00 H new ATOM 0 HA LYS A 136 0.354 10.992 -1.810 1.00 1.00 H new ATOM 0 HB2 LYS A 136 -1.239 9.222 -0.486 1.00 1.00 H new ATOM 0 HB3 LYS A 136 0.072 9.427 0.658 1.00 1.00 H new ATOM 0 HG2 LYS A 136 -1.182 11.847 -0.682 1.00 1.00 H new ATOM 0 HG3 LYS A 136 -1.948 11.114 0.714 1.00 1.00 H new ATOM 0 HD2 LYS A 136 0.845 11.365 1.336 1.00 1.00 H new ATOM 0 HD3 LYS A 136 0.344 12.890 0.632 1.00 1.00 H new ATOM 0 HE2 LYS A 136 -1.373 13.220 2.283 1.00 1.00 H new ATOM 0 HE3 LYS A 136 -1.315 11.547 2.801 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 -0.107 12.622 4.418 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 1.129 12.096 3.379 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 0.612 13.713 3.333 1.00 1.00 H new ATOM 920 N ALA A 137 2.531 8.865 -0.583 1.00 1.00 N ATOM 921 CA ALA A 137 3.910 8.735 -0.145 1.00 1.00 C ATOM 922 C ALA A 137 4.114 7.354 0.480 1.00 1.00 C ATOM 923 O ALA A 137 3.309 6.914 1.301 1.00 1.00 O ATOM 924 CB ALA A 137 4.247 9.869 0.825 1.00 1.00 C ATOM 0 H ALA A 137 2.008 7.990 -0.609 1.00 1.00 H new ATOM 0 HA ALA A 137 4.591 8.817 -0.992 1.00 1.00 H new ATOM 0 HB1 ALA A 137 5.282 9.771 1.154 1.00 1.00 H new ATOM 0 HB2 ALA A 137 4.114 10.828 0.324 1.00 1.00 H new ATOM 0 HB3 ALA A 137 3.585 9.817 1.690 1.00 1.00 H new ATOM 930 N ILE A 138 5.194 6.707 0.069 1.00 1.00 N ATOM 931 CA ILE A 138 5.514 5.384 0.578 1.00 1.00 C ATOM 932 C ILE A 138 6.630 5.499 1.620 1.00 1.00 C ATOM 933 O ILE A 138 7.649 6.141 1.374 1.00 1.00 O ATOM 934 CB ILE A 138 5.844 4.432 -0.573 1.00 1.00 C ATOM 935 CG1 ILE A 138 5.079 4.819 -1.841 1.00 1.00 C ATOM 936 CG2 ILE A 138 5.590 2.978 -0.172 1.00 1.00 C ATOM 937 CD1 ILE A 138 5.939 5.698 -2.752 1.00 1.00 C ATOM 0 H ILE A 138 5.859 7.074 -0.611 1.00 1.00 H new ATOM 0 HA ILE A 138 4.650 4.951 1.082 1.00 1.00 H new ATOM 0 HB ILE A 138 6.907 4.523 -0.797 1.00 1.00 H new ATOM 0 HG12 ILE A 138 4.777 3.919 -2.377 1.00 1.00 H new ATOM 0 HG13 ILE A 138 4.167 5.351 -1.572 1.00 1.00 H new ATOM 0 HG21 ILE A 138 5.833 2.322 -1.008 1.00 1.00 H new ATOM 0 HG22 ILE A 138 6.215 2.722 0.683 1.00 1.00 H new ATOM 0 HG23 ILE A 138 4.541 2.852 0.095 1.00 1.00 H new ATOM 0 HD11 ILE A 138 5.373 5.959 -3.646 1.00 1.00 H new ATOM 0 HD12 ILE A 138 6.219 6.608 -2.221 1.00 1.00 H new ATOM 0 HD13 ILE A 138 6.839 5.154 -3.039 1.00 1.00 H new ATOM 948 N LEU A 139 6.398 4.867 2.760 1.00 1.00 N ATOM 949 CA LEU A 139 7.370 4.890 3.840 1.00 1.00 C ATOM 950 C LEU A 139 8.146 3.572 3.851 1.00 1.00 C ATOM 951 O LEU A 139 9.369 3.568 3.974 1.00 1.00 O ATOM 952 CB LEU A 139 6.686 5.212 5.170 1.00 1.00 C ATOM 953 CG LEU A 139 5.253 5.743 5.077 1.00 1.00 C ATOM 954 CD1 LEU A 139 4.638 5.906 6.468 1.00 1.00 C ATOM 955 CD2 LEU A 139 5.202 7.042 4.271 1.00 1.00 C ATOM 0 H LEU A 139 5.551 4.335 2.960 1.00 1.00 H new ATOM 0 HA LEU A 139 8.097 5.687 3.681 1.00 1.00 H new ATOM 0 HB2 LEU A 139 6.679 4.309 5.780 1.00 1.00 H new ATOM 0 HB3 LEU A 139 7.292 5.948 5.698 1.00 1.00 H new ATOM 0 HG LEU A 139 4.650 5.009 4.543 1.00 1.00 H new ATOM 0 HD11 LEU A 139 3.620 6.284 6.374 1.00 1.00 H new ATOM 0 HD12 LEU A 139 4.621 4.941 6.974 1.00 1.00 H new ATOM 0 HD13 LEU A 139 5.234 6.609 7.049 1.00 1.00 H new ATOM 0 HD21 LEU A 139 4.173 7.398 4.220 1.00 1.00 H new ATOM 0 HD22 LEU A 139 5.823 7.795 4.755 1.00 1.00 H new ATOM 0 HD23 LEU A 139 5.573 6.859 3.263 1.00 1.00 H new ATOM 966 N VAL A 140 7.401 2.484 3.720 1.00 1.00 N ATOM 967 CA VAL A 140 8.004 1.162 3.713 1.00 1.00 C ATOM 968 C VAL A 140 8.686 0.923 2.364 1.00 1.00 C ATOM 969 O VAL A 140 8.156 1.303 1.321 1.00 1.00 O ATOM 970 CB VAL A 140 6.949 0.103 4.044 1.00 1.00 C ATOM 971 CG1 VAL A 140 5.879 0.036 2.953 1.00 1.00 C ATOM 972 CG2 VAL A 140 7.596 -1.265 4.263 1.00 1.00 C ATOM 0 H VAL A 140 6.386 2.491 3.618 1.00 1.00 H new ATOM 0 HA VAL A 140 8.772 1.090 4.483 1.00 1.00 H new ATOM 0 HB VAL A 140 6.461 0.395 4.974 1.00 1.00 H new ATOM 0 HG11 VAL A 140 5.142 -0.724 3.212 1.00 1.00 H new ATOM 0 HG12 VAL A 140 5.387 1.005 2.866 1.00 1.00 H new ATOM 0 HG13 VAL A 140 6.345 -0.221 2.002 1.00 1.00 H new ATOM 0 HG21 VAL A 140 6.825 -1.999 4.497 1.00 1.00 H new ATOM 0 HG22 VAL A 140 8.123 -1.567 3.358 1.00 1.00 H new ATOM 0 HG23 VAL A 140 8.302 -1.205 5.091 1.00 1.00 H new ATOM 982 N GLU A 141 9.851 0.296 2.428 1.00 1.00 N ATOM 983 CA GLU A 141 10.611 0.003 1.225 1.00 1.00 C ATOM 984 C GLU A 141 10.423 -1.460 0.822 1.00 1.00 C ATOM 985 O GLU A 141 10.501 -2.355 1.663 1.00 1.00 O ATOM 986 CB GLU A 141 12.093 0.333 1.419 1.00 1.00 C ATOM 987 CG GLU A 141 12.525 1.475 0.497 1.00 1.00 C ATOM 988 CD GLU A 141 13.427 2.465 1.237 1.00 1.00 C ATOM 989 OE1 GLU A 141 14.580 2.676 0.833 1.00 1.00 O ATOM 990 OE2 GLU A 141 12.890 3.026 2.268 1.00 1.00 O ATOM 0 H GLU A 141 10.288 -0.018 3.295 1.00 1.00 H new ATOM 0 HA GLU A 141 10.235 0.633 0.418 1.00 1.00 H new ATOM 0 HB2 GLU A 141 12.275 0.610 2.457 1.00 1.00 H new ATOM 0 HB3 GLU A 141 12.696 -0.552 1.215 1.00 1.00 H new ATOM 0 HG2 GLU A 141 13.054 1.070 -0.366 1.00 1.00 H new ATOM 0 HG3 GLU A 141 11.645 1.993 0.117 1.00 1.00 H new ATOM 996 N SER A 142 10.179 -1.661 -0.465 1.00 1.00 N ATOM 997 CA SER A 142 9.979 -3.000 -0.990 1.00 1.00 C ATOM 998 C SER A 142 11.031 -3.950 -0.413 1.00 1.00 C ATOM 999 O SER A 142 12.142 -4.040 -0.930 1.00 1.00 O ATOM 1000 CB SER A 142 10.040 -3.008 -2.518 1.00 1.00 C ATOM 1001 OG SER A 142 11.340 -2.687 -3.003 1.00 1.00 O ATOM 0 H SER A 142 10.115 -0.917 -1.160 1.00 1.00 H new ATOM 0 HA SER A 142 8.987 -3.340 -0.691 1.00 1.00 H new ATOM 0 HB2 SER A 142 9.748 -3.991 -2.887 1.00 1.00 H new ATOM 0 HB3 SER A 142 9.319 -2.292 -2.913 1.00 1.00 H new ATOM 0 HG SER A 142 12.016 -3.059 -2.398 1.00 1.00 H new ATOM 1006 N GLY A 143 10.642 -4.635 0.653 1.00 1.00 N ATOM 1007 CA GLY A 143 11.536 -5.576 1.306 1.00 1.00 C ATOM 1008 C GLY A 143 11.557 -5.352 2.820 1.00 1.00 C ATOM 1009 O GLY A 143 11.685 -6.302 3.590 1.00 1.00 O ATOM 0 H GLY A 143 9.719 -4.557 1.081 1.00 1.00 H new ATOM 0 HA2 GLY A 143 11.217 -6.596 1.090 1.00 1.00 H new ATOM 0 HA3 GLY A 143 12.543 -5.465 0.904 1.00 1.00 H new ATOM 1013 N GLN A 144 11.429 -4.090 3.201 1.00 1.00 N ATOM 1014 CA GLN A 144 11.431 -3.728 4.608 1.00 1.00 C ATOM 1015 C GLN A 144 10.294 -4.443 5.342 1.00 1.00 C ATOM 1016 O GLN A 144 9.226 -4.664 4.773 1.00 1.00 O ATOM 1017 CB GLN A 144 11.331 -2.213 4.786 1.00 1.00 C ATOM 1018 CG GLN A 144 12.689 -1.612 5.151 1.00 1.00 C ATOM 1019 CD GLN A 144 13.601 -1.532 3.925 1.00 1.00 C ATOM 1020 OE1 GLN A 144 13.469 -2.280 2.971 1.00 1.00 O ATOM 1021 NE2 GLN A 144 14.532 -0.584 4.004 1.00 1.00 N ATOM 0 H GLN A 144 11.323 -3.304 2.559 1.00 1.00 H new ATOM 0 HA GLN A 144 12.377 -4.049 5.043 1.00 1.00 H new ATOM 0 HB2 GLN A 144 10.964 -1.759 3.866 1.00 1.00 H new ATOM 0 HB3 GLN A 144 10.606 -1.982 5.566 1.00 1.00 H new ATOM 0 HG2 GLN A 144 12.549 -0.616 5.570 1.00 1.00 H new ATOM 0 HG3 GLN A 144 13.163 -2.218 5.923 1.00 1.00 H new ATOM 0 HE21 GLN A 144 14.587 0.009 4.832 1.00 1.00 H new ATOM 0 HE22 GLN A 144 15.190 -0.450 3.236 1.00 1.00 H new ATOM 1028 N PRO A 145 10.571 -4.795 6.626 1.00 1.00 N ATOM 1029 CA PRO A 145 9.583 -5.480 7.442 1.00 1.00 C ATOM 1030 C PRO A 145 8.490 -4.516 7.905 1.00 1.00 C ATOM 1031 O PRO A 145 8.636 -3.301 7.783 1.00 1.00 O ATOM 1032 CB PRO A 145 10.374 -6.079 8.594 1.00 1.00 C ATOM 1033 CG PRO A 145 11.691 -5.323 8.635 1.00 1.00 C ATOM 1034 CD PRO A 145 11.825 -4.551 7.332 1.00 1.00 C ATOM 0 HA PRO A 145 9.050 -6.257 6.894 1.00 1.00 H new ATOM 0 HB2 PRO A 145 9.834 -5.973 9.535 1.00 1.00 H new ATOM 0 HB3 PRO A 145 10.541 -7.145 8.440 1.00 1.00 H new ATOM 0 HG2 PRO A 145 11.714 -4.643 9.486 1.00 1.00 H new ATOM 0 HG3 PRO A 145 12.525 -6.015 8.757 1.00 1.00 H new ATOM 0 HD2 PRO A 145 11.975 -3.487 7.516 1.00 1.00 H new ATOM 0 HD3 PRO A 145 12.680 -4.898 6.752 1.00 1.00 H new ATOM 1039 N VAL A 146 7.417 -5.094 8.427 1.00 1.00 N ATOM 1040 CA VAL A 146 6.299 -4.301 8.908 1.00 1.00 C ATOM 1041 C VAL A 146 5.629 -5.028 10.076 1.00 1.00 C ATOM 1042 O VAL A 146 5.850 -6.221 10.277 1.00 1.00 O ATOM 1043 CB VAL A 146 5.336 -4.003 7.758 1.00 1.00 C ATOM 1044 CG1 VAL A 146 6.067 -3.342 6.588 1.00 1.00 C ATOM 1045 CG2 VAL A 146 4.611 -5.272 7.306 1.00 1.00 C ATOM 0 H VAL A 146 7.299 -6.102 8.527 1.00 1.00 H new ATOM 0 HA VAL A 146 6.646 -3.338 9.281 1.00 1.00 H new ATOM 0 HB VAL A 146 4.586 -3.302 8.123 1.00 1.00 H new ATOM 0 HG11 VAL A 146 5.359 -3.141 5.784 1.00 1.00 H new ATOM 0 HG12 VAL A 146 6.514 -2.405 6.921 1.00 1.00 H new ATOM 0 HG13 VAL A 146 6.849 -4.008 6.225 1.00 1.00 H new ATOM 0 HG21 VAL A 146 3.933 -5.031 6.487 1.00 1.00 H new ATOM 0 HG22 VAL A 146 5.341 -6.007 6.968 1.00 1.00 H new ATOM 0 HG23 VAL A 146 4.042 -5.683 8.140 1.00 1.00 H new ATOM 1055 N GLU A 147 4.824 -4.278 10.814 1.00 1.00 N ATOM 1056 CA GLU A 147 4.121 -4.836 11.957 1.00 1.00 C ATOM 1057 C GLU A 147 2.755 -4.166 12.118 1.00 1.00 C ATOM 1058 O GLU A 147 2.475 -3.155 11.475 1.00 1.00 O ATOM 1059 CB GLU A 147 4.952 -4.700 13.233 1.00 1.00 C ATOM 1060 CG GLU A 147 5.872 -3.479 13.161 1.00 1.00 C ATOM 1061 CD GLU A 147 6.814 -3.430 14.364 1.00 1.00 C ATOM 1062 OE1 GLU A 147 6.494 -2.792 15.378 1.00 1.00 O ATOM 1063 OE2 GLU A 147 7.915 -4.087 14.222 1.00 1.00 O ATOM 0 H GLU A 147 4.643 -3.289 10.643 1.00 1.00 H new ATOM 0 HA GLU A 147 3.964 -5.900 11.778 1.00 1.00 H new ATOM 0 HB2 GLU A 147 4.290 -4.611 14.094 1.00 1.00 H new ATOM 0 HB3 GLU A 147 5.548 -5.601 13.381 1.00 1.00 H new ATOM 0 HG2 GLU A 147 6.454 -3.512 12.240 1.00 1.00 H new ATOM 0 HG3 GLU A 147 5.273 -2.569 13.127 1.00 1.00 H new ATOM 1069 N PHE A 148 1.940 -4.756 12.980 1.00 1.00 N ATOM 1070 CA PHE A 148 0.610 -4.229 13.234 1.00 1.00 C ATOM 1071 C PHE A 148 0.683 -2.825 13.838 1.00 1.00 C ATOM 1072 O PHE A 148 1.483 -2.574 14.739 1.00 1.00 O ATOM 1073 CB PHE A 148 -0.060 -5.169 14.238 1.00 1.00 C ATOM 1074 CG PHE A 148 -1.573 -5.297 14.057 1.00 1.00 C ATOM 1075 CD1 PHE A 148 -2.076 -6.103 13.083 1.00 1.00 C ATOM 1076 CD2 PHE A 148 -2.417 -4.605 14.869 1.00 1.00 C ATOM 1077 CE1 PHE A 148 -3.481 -6.222 12.915 1.00 1.00 C ATOM 1078 CE2 PHE A 148 -3.822 -4.724 14.700 1.00 1.00 C ATOM 1079 CZ PHE A 148 -4.324 -5.529 13.726 1.00 1.00 C ATOM 0 H PHE A 148 2.175 -5.594 13.512 1.00 1.00 H new ATOM 0 HA PHE A 148 0.051 -4.166 12.301 1.00 1.00 H new ATOM 0 HB2 PHE A 148 0.391 -6.158 14.151 1.00 1.00 H new ATOM 0 HB3 PHE A 148 0.146 -4.812 15.247 1.00 1.00 H new ATOM 0 HD1 PHE A 148 -1.407 -6.652 12.438 1.00 1.00 H new ATOM 0 HD2 PHE A 148 -2.018 -3.965 15.642 1.00 1.00 H new ATOM 0 HE1 PHE A 148 -3.880 -6.863 12.143 1.00 1.00 H new ATOM 0 HE2 PHE A 148 -4.492 -4.175 15.345 1.00 1.00 H new ATOM 0 HZ PHE A 148 -5.393 -5.618 13.597 1.00 1.00 H new ATOM 1088 N ASP A 149 -0.162 -1.947 13.319 1.00 1.00 N ATOM 1089 CA ASP A 149 -0.203 -0.575 13.795 1.00 1.00 C ATOM 1090 C ASP A 149 0.871 0.243 13.076 1.00 1.00 C ATOM 1091 O ASP A 149 0.926 1.463 13.219 1.00 1.00 O ATOM 1092 CB ASP A 149 0.076 -0.506 15.298 1.00 1.00 C ATOM 1093 CG ASP A 149 1.516 -0.147 15.672 1.00 1.00 C ATOM 1094 OD1 ASP A 149 2.037 0.905 15.272 1.00 1.00 O ATOM 1095 OD2 ASP A 149 2.117 -1.012 16.417 1.00 1.00 O ATOM 0 H ASP A 149 -0.824 -2.159 12.573 1.00 1.00 H new ATOM 0 HA ASP A 149 -1.198 -0.178 13.594 1.00 1.00 H new ATOM 0 HB2 ASP A 149 -0.593 0.230 15.743 1.00 1.00 H new ATOM 0 HB3 ASP A 149 -0.169 -1.470 15.743 1.00 1.00 H new ATOM 1100 N GLU A 150 1.698 -0.462 12.319 1.00 1.00 N ATOM 1101 CA GLU A 150 2.768 0.183 11.577 1.00 1.00 C ATOM 1102 C GLU A 150 2.254 0.669 10.219 1.00 1.00 C ATOM 1103 O GLU A 150 1.427 0.010 9.593 1.00 1.00 O ATOM 1104 CB GLU A 150 3.962 -0.758 11.406 1.00 1.00 C ATOM 1105 CG GLU A 150 5.279 -0.024 11.667 1.00 1.00 C ATOM 1106 CD GLU A 150 6.078 0.146 10.373 1.00 1.00 C ATOM 1107 OE1 GLU A 150 7.305 0.319 10.419 1.00 1.00 O ATOM 1108 OE2 GLU A 150 5.378 0.094 9.290 1.00 1.00 O ATOM 0 H GLU A 150 1.649 -1.474 12.203 1.00 1.00 H new ATOM 0 HA GLU A 150 3.108 1.048 12.146 1.00 1.00 H new ATOM 0 HB2 GLU A 150 3.868 -1.599 12.093 1.00 1.00 H new ATOM 0 HB3 GLU A 150 3.964 -1.169 10.396 1.00 1.00 H new ATOM 0 HG2 GLU A 150 5.074 0.954 12.103 1.00 1.00 H new ATOM 0 HG3 GLU A 150 5.871 -0.580 12.394 1.00 1.00 H new ATOM 1114 N PRO A 151 2.780 1.850 9.796 1.00 1.00 N ATOM 1115 CA PRO A 151 2.384 2.432 8.525 1.00 1.00 C ATOM 1116 C PRO A 151 3.028 1.685 7.355 1.00 1.00 C ATOM 1117 O PRO A 151 4.044 1.013 7.527 1.00 1.00 O ATOM 1118 CB PRO A 151 2.813 3.888 8.608 1.00 1.00 C ATOM 1119 CG PRO A 151 3.842 3.956 9.724 1.00 1.00 C ATOM 1120 CD PRO A 151 3.762 2.659 10.512 1.00 1.00 C ATOM 0 HA PRO A 151 1.312 2.356 8.344 1.00 1.00 H new ATOM 0 HB2 PRO A 151 3.239 4.224 7.663 1.00 1.00 H new ATOM 0 HB3 PRO A 151 1.962 4.534 8.822 1.00 1.00 H new ATOM 0 HG2 PRO A 151 4.842 4.092 9.313 1.00 1.00 H new ATOM 0 HG3 PRO A 151 3.645 4.810 10.373 1.00 1.00 H new ATOM 0 HD2 PRO A 151 4.731 2.161 10.554 1.00 1.00 H new ATOM 0 HD3 PRO A 151 3.452 2.839 11.541 1.00 1.00 H new ATOM 1125 N LEU A 152 2.411 1.828 6.192 1.00 1.00 N ATOM 1126 CA LEU A 152 2.912 1.175 4.994 1.00 1.00 C ATOM 1127 C LEU A 152 3.108 2.220 3.893 1.00 1.00 C ATOM 1128 O LEU A 152 4.226 2.676 3.657 1.00 1.00 O ATOM 1129 CB LEU A 152 1.993 0.021 4.589 1.00 1.00 C ATOM 1130 CG LEU A 152 1.883 -1.132 5.589 1.00 1.00 C ATOM 1131 CD1 LEU A 152 0.919 -2.207 5.083 1.00 1.00 C ATOM 1132 CD2 LEU A 152 3.261 -1.706 5.918 1.00 1.00 C ATOM 0 H LEU A 152 1.569 2.386 6.053 1.00 1.00 H new ATOM 0 HA LEU A 152 3.886 0.725 5.185 1.00 1.00 H new ATOM 0 HB2 LEU A 152 0.994 0.422 4.416 1.00 1.00 H new ATOM 0 HB3 LEU A 152 2.345 -0.381 3.639 1.00 1.00 H new ATOM 0 HG LEU A 152 1.468 -0.740 6.518 1.00 1.00 H new ATOM 0 HD11 LEU A 152 0.859 -3.015 5.812 1.00 1.00 H new ATOM 0 HD12 LEU A 152 -0.070 -1.771 4.942 1.00 1.00 H new ATOM 0 HD13 LEU A 152 1.280 -2.602 4.133 1.00 1.00 H new ATOM 0 HD21 LEU A 152 3.154 -2.524 6.631 1.00 1.00 H new ATOM 0 HD22 LEU A 152 3.727 -2.078 5.006 1.00 1.00 H new ATOM 0 HD23 LEU A 152 3.886 -0.926 6.352 1.00 1.00 H new ATOM 1143 N VAL A 153 2.004 2.569 3.249 1.00 1.00 N ATOM 1144 CA VAL A 153 2.042 3.552 2.178 1.00 1.00 C ATOM 1145 C VAL A 153 0.904 4.555 2.375 1.00 1.00 C ATOM 1146 O VAL A 153 -0.209 4.176 2.736 1.00 1.00 O ATOM 1147 CB VAL A 153 1.990 2.848 0.821 1.00 1.00 C ATOM 1148 CG1 VAL A 153 2.360 3.810 -0.310 1.00 1.00 C ATOM 1149 CG2 VAL A 153 2.895 1.614 0.807 1.00 1.00 C ATOM 0 H VAL A 153 1.078 2.189 3.447 1.00 1.00 H new ATOM 0 HA VAL A 153 2.977 4.111 2.203 1.00 1.00 H new ATOM 0 HB VAL A 153 0.965 2.514 0.657 1.00 1.00 H new ATOM 0 HG11 VAL A 153 2.315 3.284 -1.264 1.00 1.00 H new ATOM 0 HG12 VAL A 153 1.659 4.644 -0.322 1.00 1.00 H new ATOM 0 HG13 VAL A 153 3.370 4.187 -0.151 1.00 1.00 H new ATOM 0 HG21 VAL A 153 2.839 1.133 -0.169 1.00 1.00 H new ATOM 0 HG22 VAL A 153 3.924 1.915 1.005 1.00 1.00 H new ATOM 0 HG23 VAL A 153 2.568 0.914 1.576 1.00 1.00 H new ATOM 1159 N VAL A 154 1.223 5.818 2.127 1.00 1.00 N ATOM 1160 CA VAL A 154 0.242 6.879 2.272 1.00 1.00 C ATOM 1161 C VAL A 154 -0.463 7.103 0.933 1.00 1.00 C ATOM 1162 O VAL A 154 0.187 7.360 -0.080 1.00 1.00 O ATOM 1163 CB VAL A 154 0.914 8.143 2.812 1.00 1.00 C ATOM 1164 CG1 VAL A 154 -0.127 9.196 3.197 1.00 1.00 C ATOM 1165 CG2 VAL A 154 1.827 7.815 3.996 1.00 1.00 C ATOM 0 H VAL A 154 2.147 6.129 1.827 1.00 1.00 H new ATOM 0 HA VAL A 154 -0.521 6.597 2.998 1.00 1.00 H new ATOM 0 HB VAL A 154 1.533 8.559 2.017 1.00 1.00 H new ATOM 0 HG11 VAL A 154 0.377 10.084 3.578 1.00 1.00 H new ATOM 0 HG12 VAL A 154 -0.717 9.462 2.320 1.00 1.00 H new ATOM 0 HG13 VAL A 154 -0.784 8.793 3.968 1.00 1.00 H new ATOM 0 HG21 VAL A 154 2.292 8.731 4.361 1.00 1.00 H new ATOM 0 HG22 VAL A 154 1.239 7.363 4.795 1.00 1.00 H new ATOM 0 HG23 VAL A 154 2.601 7.117 3.676 1.00 1.00 H new ATOM 1175 N ILE A 155 -1.783 6.998 0.970 1.00 1.00 N ATOM 1176 CA ILE A 155 -2.583 7.185 -0.228 1.00 1.00 C ATOM 1177 C ILE A 155 -3.462 8.426 -0.061 1.00 1.00 C ATOM 1178 O ILE A 155 -3.683 8.888 1.058 1.00 1.00 O ATOM 1179 CB ILE A 155 -3.368 5.914 -0.553 1.00 1.00 C ATOM 1180 CG1 ILE A 155 -2.486 4.892 -1.273 1.00 1.00 C ATOM 1181 CG2 ILE A 155 -4.635 6.239 -1.349 1.00 1.00 C ATOM 1182 CD1 ILE A 155 -1.788 3.968 -0.272 1.00 1.00 C ATOM 0 H ILE A 155 -2.319 6.786 1.812 1.00 1.00 H new ATOM 0 HA ILE A 155 -1.941 7.363 -1.090 1.00 1.00 H new ATOM 0 HB ILE A 155 -3.685 5.460 0.386 1.00 1.00 H new ATOM 0 HG12 ILE A 155 -3.094 4.300 -1.957 1.00 1.00 H new ATOM 0 HG13 ILE A 155 -1.740 5.410 -1.876 1.00 1.00 H new ATOM 0 HG21 ILE A 155 -5.174 5.317 -1.567 1.00 1.00 H new ATOM 0 HG22 ILE A 155 -5.272 6.903 -0.764 1.00 1.00 H new ATOM 0 HG23 ILE A 155 -4.362 6.729 -2.284 1.00 1.00 H new ATOM 0 HD11 ILE A 155 -1.167 3.251 -0.810 1.00 1.00 H new ATOM 0 HD12 ILE A 155 -1.162 4.561 0.395 1.00 1.00 H new ATOM 0 HD13 ILE A 155 -2.537 3.433 0.313 1.00 1.00 H new ATOM 1193 N GLU A 156 -3.941 8.930 -1.188 1.00 1.00 N ATOM 1194 CA GLU A 156 -4.792 10.108 -1.179 1.00 1.00 C ATOM 1195 C GLU A 156 -5.182 10.492 -2.609 1.00 1.00 C ATOM 1196 O GLU A 156 -4.411 11.144 -3.312 1.00 1.00 O ATOM 1197 CB GLU A 156 -4.107 11.275 -0.466 1.00 1.00 C ATOM 1198 CG GLU A 156 -4.951 12.547 -0.558 1.00 1.00 C ATOM 1199 CD GLU A 156 -4.679 13.474 0.627 1.00 1.00 C ATOM 1200 OE1 GLU A 156 -3.535 13.911 0.822 1.00 1.00 O ATOM 1201 OE2 GLU A 156 -5.706 13.737 1.362 1.00 1.00 O ATOM 0 H GLU A 156 -3.756 8.544 -2.114 1.00 1.00 H new ATOM 0 HA GLU A 156 -5.701 9.871 -0.626 1.00 1.00 H new ATOM 0 HB2 GLU A 156 -3.942 11.019 0.581 1.00 1.00 H new ATOM 0 HB3 GLU A 156 -3.127 11.452 -0.910 1.00 1.00 H new ATOM 0 HG2 GLU A 156 -4.729 13.068 -1.490 1.00 1.00 H new ATOM 0 HG3 GLU A 156 -6.009 12.285 -0.583 1.00 1.00 H new