USER MOD reduce.3.24.130724 H: found=0, std=0, add=604, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 603 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 160 SER OG : rot -167:sc= 0.374 USER MOD Set 1.2: A 163 SER OG : rot 77:sc= 0.394 USER MOD Set 2.1: A 157 ASN : amide:sc= -0.011 K(o=-0.011,f=-2.5!) USER MOD Set 2.2: A 158 HIS : no HD1:sc= 0 X(o=-0.011,f=-0.011) USER MOD Single : A 100 HIS : no HD1:sc= -0.206 X(o=-0.21,f=-0.001) USER MOD Single : A 101 MET CE :methyl -178:sc= -0.324 (180deg=-0.349) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 CYS SG : rot -150:sc= -0.132 USER MOD Single : A 113 SER OG : rot -120:sc= 0.115 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 HIS : no HD1:sc= -0.0502 X(o=-0.05,f=0) USER MOD Single : A 129 ASN : amide:sc= -0.0122 K(o=-0.012,f=-0.86) USER MOD Single : A 134 CYS SG : rot 170:sc= -0.888 USER MOD Single : A 138 SER OG : rot -83:sc= 0.915 USER MOD Single : A 145 SER OG : rot -43:sc= 0.991 USER MOD Single : A 146 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 155 THR OG1 : rot 180:sc=-0.00126 USER MOD Single : A 164 TYR OH : rot 178:sc= 1.04 USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= 0.608 K(o=0.61,f=-7.7!) USER MOD ----------------------------------------------------------------- ATOM 306 N HIS A 100 62.230 9.016 -11.571 1.00 25.00 N ATOM 307 CA HIS A 100 62.619 10.214 -10.841 1.00 25.00 C ATOM 308 C HIS A 100 63.722 9.759 -9.894 1.00 25.00 C ATOM 309 O HIS A 100 64.000 8.557 -9.812 1.00 25.00 O ATOM 310 CB HIS A 100 61.437 10.787 -10.050 1.00 25.00 C ATOM 311 CG HIS A 100 60.855 9.832 -9.057 1.00 25.00 C ATOM 312 ND1 HIS A 100 59.874 8.915 -9.351 1.00 25.00 N ATOM 313 CD2 HIS A 100 61.122 9.653 -7.734 1.00 25.00 C ATOM 314 CE1 HIS A 100 59.582 8.254 -8.240 1.00 25.00 C ATOM 315 NE2 HIS A 100 60.312 8.662 -7.224 1.00 25.00 N ATOM 0 HA HIS A 100 62.951 11.005 -11.514 1.00 25.00 H new ATOM 0 HB2 HIS A 100 61.764 11.686 -9.527 1.00 25.00 H new ATOM 0 HB3 HIS A 100 60.657 11.090 -10.749 1.00 25.00 H new ATOM 0 HD2 HIS A 100 61.858 10.205 -7.169 1.00 25.00 H new ATOM 0 HE1 HIS A 100 58.836 7.476 -8.176 1.00 25.00 H new ATOM 0 HE2 HIS A 100 60.284 8.318 -6.264 1.00 25.00 H new ATOM 323 N MET A 101 64.326 10.697 -9.184 1.00 25.00 N ATOM 324 CA MET A 101 65.357 10.410 -8.193 1.00 25.00 C ATOM 325 C MET A 101 65.214 11.427 -7.065 1.00 25.00 C ATOM 326 O MET A 101 64.547 12.451 -7.231 1.00 25.00 O ATOM 327 CB MET A 101 66.748 10.512 -8.827 1.00 25.00 C ATOM 328 CG MET A 101 67.100 11.915 -9.289 1.00 25.00 C ATOM 329 SD MET A 101 68.657 11.974 -10.151 1.00 25.00 S ATOM 330 CE MET A 101 68.788 13.728 -10.353 1.00 25.00 C ATOM 0 H MET A 101 64.114 11.690 -9.278 1.00 25.00 H new ATOM 0 HA MET A 101 65.240 9.397 -7.808 1.00 25.00 H new ATOM 0 HB2 MET A 101 67.493 10.178 -8.105 1.00 25.00 H new ATOM 0 HB3 MET A 101 66.802 9.833 -9.678 1.00 25.00 H new ATOM 0 HG2 MET A 101 66.311 12.288 -9.943 1.00 25.00 H new ATOM 0 HG3 MET A 101 67.140 12.580 -8.426 1.00 25.00 H new ATOM 0 HE1 MET A 101 69.694 13.963 -10.911 1.00 25.00 H new ATOM 0 HE2 MET A 101 67.920 14.097 -10.899 1.00 25.00 H new ATOM 0 HE3 MET A 101 68.831 14.205 -9.374 1.00 25.00 H new ATOM 340 N LEU A 102 65.828 11.145 -5.930 1.00 25.00 N ATOM 341 CA LEU A 102 65.762 12.028 -4.764 1.00 25.00 C ATOM 342 C LEU A 102 67.128 12.644 -4.480 1.00 25.00 C ATOM 343 O LEU A 102 68.138 11.943 -4.463 1.00 25.00 O ATOM 344 CB LEU A 102 65.297 11.212 -3.548 1.00 25.00 C ATOM 345 CG LEU A 102 64.887 12.025 -2.304 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.525 12.702 -2.504 1.00 25.00 C ATOM 347 CD2 LEU A 102 64.832 11.106 -1.092 1.00 25.00 C ATOM 0 H LEU A 102 66.386 10.303 -5.784 1.00 25.00 H new ATOM 0 HA LEU A 102 65.057 12.835 -4.964 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.450 10.597 -3.851 1.00 25.00 H new ATOM 0 HB3 LEU A 102 66.100 10.531 -3.264 1.00 25.00 H new ATOM 0 HG LEU A 102 65.631 12.805 -2.145 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.265 13.267 -1.609 1.00 25.00 H new ATOM 0 HD12 LEU A 102 63.576 13.378 -3.358 1.00 25.00 H new ATOM 0 HD13 LEU A 102 62.765 11.943 -2.687 1.00 25.00 H new ATOM 0 HD21 LEU A 102 64.542 11.681 -0.212 1.00 25.00 H new ATOM 0 HD22 LEU A 102 64.101 10.317 -1.267 1.00 25.00 H new ATOM 0 HD23 LEU A 102 65.814 10.661 -0.928 1.00 25.00 H new ATOM 359 N LEU A 103 67.168 13.946 -4.249 1.00 25.00 N ATOM 360 CA LEU A 103 68.414 14.640 -3.906 1.00 25.00 C ATOM 361 C LEU A 103 68.199 15.381 -2.604 1.00 25.00 C ATOM 362 O LEU A 103 67.076 15.738 -2.284 1.00 25.00 O ATOM 363 CB LEU A 103 68.781 15.661 -4.989 1.00 25.00 C ATOM 364 CG LEU A 103 69.089 15.127 -6.394 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.432 16.315 -7.289 1.00 25.00 C ATOM 366 CD2 LEU A 103 70.243 14.147 -6.379 1.00 25.00 C ATOM 0 H LEU A 103 66.350 14.553 -4.291 1.00 25.00 H new ATOM 0 HA LEU A 103 69.219 13.910 -3.820 1.00 25.00 H new ATOM 0 HB2 LEU A 103 67.959 16.372 -5.073 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.651 16.219 -4.643 1.00 25.00 H new ATOM 0 HG LEU A 103 68.216 14.595 -6.771 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.655 15.960 -8.295 1.00 25.00 H new ATOM 0 HD12 LEU A 103 68.585 17.000 -7.325 1.00 25.00 H new ATOM 0 HD13 LEU A 103 70.301 16.835 -6.886 1.00 25.00 H new ATOM 0 HD21 LEU A 103 70.431 13.791 -7.392 1.00 25.00 H new ATOM 0 HD22 LEU A 103 71.136 14.642 -5.997 1.00 25.00 H new ATOM 0 HD23 LEU A 103 69.994 13.302 -5.738 1.00 25.00 H new ATOM 378 N THR A 104 69.277 15.650 -1.880 1.00 25.00 N ATOM 379 CA THR A 104 69.196 16.410 -0.627 1.00 25.00 C ATOM 380 C THR A 104 69.805 17.793 -0.848 1.00 25.00 C ATOM 381 O THR A 104 70.852 17.915 -1.463 1.00 25.00 O ATOM 382 CB THR A 104 69.944 15.689 0.507 1.00 25.00 C ATOM 383 OG1 THR A 104 69.493 14.336 0.594 1.00 25.00 O ATOM 384 CG2 THR A 104 69.694 16.351 1.863 1.00 25.00 C ATOM 0 H THR A 104 70.220 15.356 -2.133 1.00 25.00 H new ATOM 0 HA THR A 104 68.149 16.500 -0.336 1.00 25.00 H new ATOM 0 HB THR A 104 71.008 15.739 0.275 1.00 25.00 H new ATOM 0 HG1 THR A 104 69.972 13.877 1.316 1.00 25.00 H new ATOM 0 HG21 THR A 104 70.240 15.812 2.637 1.00 25.00 H new ATOM 0 HG22 THR A 104 70.036 17.385 1.831 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.628 16.328 2.088 1.00 25.00 H new ATOM 392 N VAL A 105 69.143 18.833 -0.364 1.00 25.00 N ATOM 393 CA VAL A 105 69.626 20.203 -0.521 1.00 25.00 C ATOM 394 C VAL A 105 69.734 20.859 0.849 1.00 25.00 C ATOM 395 O VAL A 105 68.786 20.858 1.624 1.00 25.00 O ATOM 396 CB VAL A 105 68.670 21.034 -1.417 1.00 25.00 C ATOM 397 CG1 VAL A 105 69.231 22.452 -1.642 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.457 20.338 -2.770 1.00 25.00 C ATOM 0 H VAL A 105 68.263 18.756 0.145 1.00 25.00 H new ATOM 0 HA VAL A 105 70.604 20.171 -1.001 1.00 25.00 H new ATOM 0 HB VAL A 105 67.711 21.112 -0.905 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.546 23.018 -2.273 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.341 22.956 -0.682 1.00 25.00 H new ATOM 0 HG13 VAL A 105 70.203 22.385 -2.131 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.784 20.936 -3.385 1.00 25.00 H new ATOM 0 HG22 VAL A 105 69.415 20.232 -3.279 1.00 25.00 H new ATOM 0 HG23 VAL A 105 68.021 19.352 -2.607 1.00 25.00 H new ATOM 408 N TYR A 106 70.901 21.421 1.136 1.00 25.00 N ATOM 409 CA TYR A 106 71.150 22.113 2.393 1.00 25.00 C ATOM 410 C TYR A 106 71.365 23.597 2.137 1.00 25.00 C ATOM 411 O TYR A 106 72.355 23.997 1.528 1.00 25.00 O ATOM 412 CB TYR A 106 72.370 21.499 3.089 1.00 25.00 C ATOM 413 CG TYR A 106 72.687 22.097 4.452 1.00 25.00 C ATOM 414 CD1 TYR A 106 71.664 22.580 5.303 1.00 25.00 C ATOM 415 CD2 TYR A 106 74.020 22.163 4.914 1.00 25.00 C ATOM 416 CE1 TYR A 106 71.962 23.110 6.578 1.00 25.00 C ATOM 417 CE2 TYR A 106 74.322 22.701 6.197 1.00 25.00 C ATOM 418 CZ TYR A 106 73.281 23.167 7.011 1.00 25.00 C ATOM 419 OH TYR A 106 73.533 23.699 8.247 1.00 25.00 O ATOM 0 H TYR A 106 71.701 21.410 0.504 1.00 25.00 H new ATOM 0 HA TYR A 106 70.284 22.000 3.045 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.205 20.428 3.206 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.240 21.619 2.443 1.00 25.00 H new ATOM 0 HD1 TYR A 106 70.637 22.543 4.971 1.00 25.00 H new ATOM 0 HD2 TYR A 106 74.820 21.801 4.286 1.00 25.00 H new ATOM 0 HE1 TYR A 106 71.167 23.470 7.214 1.00 25.00 H new ATOM 0 HE2 TYR A 106 75.345 22.750 6.540 1.00 25.00 H new ATOM 0 HH TYR A 106 74.497 23.676 8.423 1.00 25.00 H new ATOM 429 N CYS A 107 70.433 24.410 2.596 1.00 25.00 N ATOM 430 CA CYS A 107 70.503 25.861 2.442 1.00 25.00 C ATOM 431 C CYS A 107 71.079 26.440 3.721 1.00 25.00 C ATOM 432 O CYS A 107 70.633 26.091 4.806 1.00 25.00 O ATOM 433 CB CYS A 107 69.097 26.424 2.211 1.00 25.00 C ATOM 434 SG CYS A 107 69.040 28.233 2.130 1.00 25.00 S ATOM 0 H CYS A 107 69.600 24.087 3.089 1.00 25.00 H new ATOM 0 HA CYS A 107 71.130 26.122 1.589 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.700 26.015 1.282 1.00 25.00 H new ATOM 0 HB3 CYS A 107 68.443 26.084 3.014 1.00 25.00 H new ATOM 0 HG CYS A 107 67.886 28.651 2.560 1.00 25.00 H new ATOM 440 N VAL A 108 72.070 27.311 3.594 1.00 25.00 N ATOM 441 CA VAL A 108 72.746 27.899 4.748 1.00 25.00 C ATOM 442 C VAL A 108 72.708 29.422 4.692 1.00 25.00 C ATOM 443 O VAL A 108 73.079 30.030 3.676 1.00 25.00 O ATOM 444 CB VAL A 108 74.225 27.427 4.813 1.00 25.00 C ATOM 445 CG1 VAL A 108 74.887 27.894 6.124 1.00 25.00 C ATOM 446 CG2 VAL A 108 74.309 25.897 4.714 1.00 25.00 C ATOM 0 H VAL A 108 72.429 27.630 2.694 1.00 25.00 H new ATOM 0 HA VAL A 108 72.218 27.566 5.641 1.00 25.00 H new ATOM 0 HB VAL A 108 74.755 27.869 3.969 1.00 25.00 H new ATOM 0 HG11 VAL A 108 75.922 27.553 6.150 1.00 25.00 H new ATOM 0 HG12 VAL A 108 74.862 28.982 6.177 1.00 25.00 H new ATOM 0 HG13 VAL A 108 74.346 27.477 6.973 1.00 25.00 H new ATOM 0 HG21 VAL A 108 75.353 25.586 4.761 1.00 25.00 H new ATOM 0 HG22 VAL A 108 73.759 25.448 5.541 1.00 25.00 H new ATOM 0 HG23 VAL A 108 73.875 25.569 3.769 1.00 25.00 H new ATOM 456 N ARG A 109 72.324 30.042 5.803 1.00 25.00 N ATOM 457 CA ARG A 109 72.371 31.495 5.942 1.00 25.00 C ATOM 458 C ARG A 109 73.253 31.816 7.128 1.00 25.00 C ATOM 459 O ARG A 109 73.262 31.094 8.111 1.00 25.00 O ATOM 460 CB ARG A 109 70.972 32.068 6.186 1.00 25.00 C ATOM 461 CG ARG A 109 70.039 31.946 4.990 1.00 25.00 C ATOM 462 CD ARG A 109 68.831 32.875 5.125 1.00 25.00 C ATOM 463 NE ARG A 109 69.211 34.291 4.968 1.00 25.00 N ATOM 464 CZ ARG A 109 68.933 35.282 5.807 1.00 25.00 C ATOM 465 NH1 ARG A 109 68.272 35.101 6.925 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 69.344 36.482 5.513 1.00 25.00 N ATOM 0 H ARG A 109 71.973 29.556 6.628 1.00 25.00 H new ATOM 0 HA ARG A 109 72.763 31.936 5.026 1.00 25.00 H new ATOM 0 HB2 ARG A 109 70.524 31.556 7.038 1.00 25.00 H new ATOM 0 HB3 ARG A 109 71.063 33.120 6.458 1.00 25.00 H new ATOM 0 HG2 ARG A 109 70.583 32.185 4.077 1.00 25.00 H new ATOM 0 HG3 ARG A 109 69.698 30.915 4.897 1.00 25.00 H new ATOM 0 HD2 ARG A 109 68.085 32.613 4.375 1.00 25.00 H new ATOM 0 HD3 ARG A 109 68.367 32.729 6.100 1.00 25.00 H new ATOM 0 HE ARG A 109 69.741 34.534 4.131 1.00 25.00 H new ATOM 0 HH11 ARG A 109 67.948 34.168 7.181 1.00 25.00 H new ATOM 0 HH12 ARG A 109 68.082 35.893 7.539 1.00 25.00 H new ATOM 0 HH21 ARG A 109 69.868 36.645 4.653 1.00 25.00 H new ATOM 0 HH22 ARG A 109 69.142 37.259 6.143 1.00 25.00 H new ATOM 480 N ARG A 110 73.956 32.936 7.066 1.00 25.00 N ATOM 481 CA ARG A 110 74.781 33.389 8.185 1.00 25.00 C ATOM 482 C ARG A 110 73.933 33.738 9.398 1.00 25.00 C ATOM 483 O ARG A 110 74.431 33.837 10.510 1.00 25.00 O ATOM 484 CB ARG A 110 75.587 34.622 7.760 1.00 25.00 C ATOM 485 CG ARG A 110 76.809 34.303 6.906 1.00 25.00 C ATOM 486 CD ARG A 110 78.079 34.151 7.757 1.00 25.00 C ATOM 487 NE ARG A 110 78.038 32.970 8.651 1.00 25.00 N ATOM 488 CZ ARG A 110 77.765 32.994 9.954 1.00 25.00 C ATOM 489 NH1 ARG A 110 77.529 34.105 10.605 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 77.716 31.869 10.611 1.00 25.00 N ATOM 0 H ARG A 110 73.975 33.552 6.253 1.00 25.00 H new ATOM 0 HA ARG A 110 75.451 32.575 8.460 1.00 25.00 H new ATOM 0 HB2 ARG A 110 74.934 35.295 7.204 1.00 25.00 H new ATOM 0 HB3 ARG A 110 75.911 35.157 8.653 1.00 25.00 H new ATOM 0 HG2 ARG A 110 76.633 33.383 6.349 1.00 25.00 H new ATOM 0 HG3 ARG A 110 76.956 35.096 6.173 1.00 25.00 H new ATOM 0 HD2 ARG A 110 78.944 34.072 7.098 1.00 25.00 H new ATOM 0 HD3 ARG A 110 78.217 35.050 8.358 1.00 25.00 H new ATOM 0 HE ARG A 110 78.236 32.061 8.233 1.00 25.00 H new ATOM 0 HH11 ARG A 110 77.550 34.998 10.113 1.00 25.00 H new ATOM 0 HH12 ARG A 110 77.324 34.077 11.604 1.00 25.00 H new ATOM 0 HH21 ARG A 110 77.886 30.988 10.126 1.00 25.00 H new ATOM 0 HH22 ARG A 110 77.508 31.870 11.610 1.00 25.00 H new ATOM 504 N ASP A 111 72.650 33.917 9.144 1.00 25.00 N ATOM 505 CA ASP A 111 71.661 34.306 10.140 1.00 25.00 C ATOM 506 C ASP A 111 71.028 33.077 10.824 1.00 25.00 C ATOM 507 O ASP A 111 69.973 33.172 11.431 1.00 25.00 O ATOM 508 CB ASP A 111 70.594 35.101 9.393 1.00 25.00 C ATOM 509 CG ASP A 111 69.764 35.991 10.296 1.00 25.00 C ATOM 510 OD1 ASP A 111 70.260 36.409 11.360 1.00 25.00 O ATOM 511 OD2 ASP A 111 68.664 36.383 9.847 1.00 25.00 O1- ATOM 0 H ASP A 111 72.253 33.793 8.213 1.00 25.00 H new ATOM 0 HA ASP A 111 72.127 34.894 10.930 1.00 25.00 H new ATOM 0 HB2 ASP A 111 71.075 35.716 8.632 1.00 25.00 H new ATOM 0 HB3 ASP A 111 69.934 34.408 8.872 1.00 25.00 H new ATOM 516 N LEU A 112 71.679 31.924 10.663 1.00 25.00 N ATOM 517 CA LEU A 112 71.249 30.632 11.242 1.00 25.00 C ATOM 518 C LEU A 112 69.843 30.196 10.823 1.00 25.00 C ATOM 519 O LEU A 112 69.205 29.402 11.493 1.00 25.00 O ATOM 520 CB LEU A 112 71.357 30.646 12.779 1.00 25.00 C ATOM 521 CG LEU A 112 72.740 30.982 13.373 1.00 25.00 C ATOM 522 CD1 LEU A 112 72.636 31.034 14.908 1.00 25.00 C ATOM 523 CD2 LEU A 112 73.802 29.949 12.960 1.00 25.00 C ATOM 0 H LEU A 112 72.538 31.851 10.117 1.00 25.00 H new ATOM 0 HA LEU A 112 71.938 29.894 10.831 1.00 25.00 H new ATOM 0 HB2 LEU A 112 70.637 31.368 13.164 1.00 25.00 H new ATOM 0 HB3 LEU A 112 71.056 29.666 13.150 1.00 25.00 H new ATOM 0 HG LEU A 112 73.050 31.952 12.984 1.00 25.00 H new ATOM 0 HD11 LEU A 112 73.612 31.271 15.331 1.00 25.00 H new ATOM 0 HD12 LEU A 112 71.918 31.801 15.198 1.00 25.00 H new ATOM 0 HD13 LEU A 112 72.304 30.066 15.283 1.00 25.00 H new ATOM 0 HD21 LEU A 112 74.763 30.220 13.398 1.00 25.00 H new ATOM 0 HD22 LEU A 112 73.507 28.962 13.315 1.00 25.00 H new ATOM 0 HD23 LEU A 112 73.890 29.932 11.874 1.00 25.00 H new ATOM 535 N SER A 113 69.398 30.684 9.675 1.00 25.00 N ATOM 536 CA SER A 113 68.103 30.309 9.100 1.00 25.00 C ATOM 537 C SER A 113 68.292 29.108 8.179 1.00 25.00 C ATOM 538 O SER A 113 67.617 28.958 7.165 1.00 25.00 O ATOM 539 CB SER A 113 67.533 31.479 8.323 1.00 25.00 C ATOM 540 OG SER A 113 68.213 32.673 8.679 1.00 25.00 O ATOM 0 H SER A 113 69.921 31.353 9.110 1.00 25.00 H new ATOM 0 HA SER A 113 67.408 30.044 9.897 1.00 25.00 H new ATOM 0 HB2 SER A 113 67.633 31.299 7.253 1.00 25.00 H new ATOM 0 HB3 SER A 113 66.468 31.581 8.531 1.00 25.00 H new ATOM 0 HG SER A 113 67.573 33.316 9.050 1.00 25.00 H new ATOM 546 N GLU A 114 69.329 28.347 8.467 1.00 25.00 N ATOM 547 CA GLU A 114 69.735 27.238 7.629 1.00 25.00 C ATOM 548 C GLU A 114 68.736 26.088 7.767 1.00 25.00 C ATOM 549 O GLU A 114 68.134 25.887 8.822 1.00 25.00 O ATOM 550 CB GLU A 114 71.167 26.816 8.006 1.00 25.00 C ATOM 551 CG GLU A 114 71.397 26.487 9.489 1.00 25.00 C ATOM 552 CD GLU A 114 72.873 26.590 9.883 1.00 25.00 C ATOM 553 OE1 GLU A 114 73.503 27.627 9.554 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 73.397 25.669 10.539 1.00 25.00 O1- ATOM 0 H GLU A 114 69.915 28.481 9.291 1.00 25.00 H new ATOM 0 HA GLU A 114 69.739 27.536 6.581 1.00 25.00 H new ATOM 0 HB2 GLU A 114 71.436 25.942 7.413 1.00 25.00 H new ATOM 0 HB3 GLU A 114 71.849 27.617 7.721 1.00 25.00 H new ATOM 0 HG2 GLU A 114 70.810 27.168 10.106 1.00 25.00 H new ATOM 0 HG3 GLU A 114 71.037 25.479 9.696 1.00 25.00 H new ATOM 561 N VAL A 115 68.527 25.370 6.673 1.00 25.00 N ATOM 562 CA VAL A 115 67.516 24.322 6.605 1.00 25.00 C ATOM 563 C VAL A 115 67.961 23.294 5.563 1.00 25.00 C ATOM 564 O VAL A 115 68.569 23.644 4.556 1.00 25.00 O ATOM 565 CB VAL A 115 66.100 24.933 6.234 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.122 25.640 4.855 1.00 25.00 C ATOM 567 CG2 VAL A 115 64.998 23.864 6.268 1.00 25.00 C ATOM 0 H VAL A 115 69.052 25.496 5.808 1.00 25.00 H new ATOM 0 HA VAL A 115 67.413 23.838 7.576 1.00 25.00 H new ATOM 0 HB VAL A 115 65.873 25.682 6.993 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.134 26.045 4.638 1.00 25.00 H new ATOM 0 HG12 VAL A 115 66.850 26.451 4.873 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.398 24.922 4.082 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.042 24.319 6.009 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.232 23.077 5.551 1.00 25.00 H new ATOM 0 HG23 VAL A 115 64.937 23.436 7.269 1.00 25.00 H new ATOM 577 N THR A 116 67.671 22.027 5.805 1.00 25.00 N ATOM 578 CA THR A 116 67.989 20.964 4.854 1.00 25.00 C ATOM 579 C THR A 116 66.687 20.250 4.541 1.00 25.00 C ATOM 580 O THR A 116 65.828 20.109 5.409 1.00 25.00 O ATOM 581 CB THR A 116 69.089 19.995 5.400 1.00 25.00 C ATOM 582 OG1 THR A 116 69.312 18.934 4.469 1.00 25.00 O ATOM 583 CG2 THR A 116 68.723 19.389 6.746 1.00 25.00 C ATOM 0 H THR A 116 67.213 21.703 6.657 1.00 25.00 H new ATOM 0 HA THR A 116 68.417 21.381 3.942 1.00 25.00 H new ATOM 0 HB THR A 116 69.991 20.592 5.532 1.00 25.00 H new ATOM 0 HG1 THR A 116 70.003 18.333 4.817 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.522 18.725 7.076 1.00 25.00 H new ATOM 0 HG22 THR A 116 68.587 20.185 7.478 1.00 25.00 H new ATOM 0 HG23 THR A 116 67.797 18.822 6.650 1.00 25.00 H new ATOM 591 N PHE A 117 66.525 19.862 3.286 1.00 25.00 N ATOM 592 CA PHE A 117 65.296 19.242 2.801 1.00 25.00 C ATOM 593 C PHE A 117 65.700 18.372 1.620 1.00 25.00 C ATOM 594 O PHE A 117 66.855 18.405 1.201 1.00 25.00 O ATOM 595 CB PHE A 117 64.283 20.317 2.379 1.00 25.00 C ATOM 596 CG PHE A 117 64.831 21.326 1.399 1.00 25.00 C ATOM 597 CD1 PHE A 117 65.473 22.494 1.868 1.00 25.00 C ATOM 598 CD2 PHE A 117 64.686 21.131 0.015 1.00 25.00 C ATOM 599 CE1 PHE A 117 65.956 23.464 0.960 1.00 25.00 C ATOM 600 CE2 PHE A 117 65.168 22.090 -0.901 1.00 25.00 C ATOM 601 CZ PHE A 117 65.805 23.265 -0.421 1.00 25.00 C ATOM 0 H PHE A 117 67.244 19.967 2.570 1.00 25.00 H new ATOM 0 HA PHE A 117 64.813 18.646 3.575 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.415 19.829 1.935 1.00 25.00 H new ATOM 0 HB3 PHE A 117 63.934 20.842 3.268 1.00 25.00 H new ATOM 0 HD1 PHE A 117 65.596 22.647 2.930 1.00 25.00 H new ATOM 0 HD2 PHE A 117 64.201 20.238 -0.351 1.00 25.00 H new ATOM 0 HE1 PHE A 117 66.440 24.356 1.328 1.00 25.00 H new ATOM 0 HE2 PHE A 117 65.053 21.931 -1.963 1.00 25.00 H new ATOM 0 HZ PHE A 117 66.173 24.004 -1.117 1.00 25.00 H new ATOM 611 N SER A 118 64.770 17.603 1.079 1.00 25.00 N ATOM 612 CA SER A 118 65.050 16.765 -0.075 1.00 25.00 C ATOM 613 C SER A 118 64.073 17.116 -1.185 1.00 25.00 C ATOM 614 O SER A 118 63.000 17.646 -0.919 1.00 25.00 O ATOM 615 CB SER A 118 64.945 15.287 0.298 1.00 25.00 C ATOM 616 OG SER A 118 63.656 14.988 0.808 1.00 25.00 O ATOM 0 H SER A 118 63.811 17.542 1.422 1.00 25.00 H new ATOM 0 HA SER A 118 66.068 16.945 -0.421 1.00 25.00 H new ATOM 0 HB2 SER A 118 65.147 14.671 -0.578 1.00 25.00 H new ATOM 0 HB3 SER A 118 65.702 15.040 1.042 1.00 25.00 H new ATOM 0 HG SER A 118 63.608 14.037 1.039 1.00 25.00 H new ATOM 622 N LEU A 119 64.467 16.852 -2.422 1.00 25.00 N ATOM 623 CA LEU A 119 63.650 17.164 -3.587 1.00 25.00 C ATOM 624 C LEU A 119 63.565 15.958 -4.497 1.00 25.00 C ATOM 625 O LEU A 119 64.549 15.254 -4.710 1.00 25.00 O ATOM 626 CB LEU A 119 64.260 18.330 -4.375 1.00 25.00 C ATOM 627 CG LEU A 119 63.773 19.743 -4.013 1.00 25.00 C ATOM 628 CD1 LEU A 119 64.572 20.763 -4.815 1.00 25.00 C ATOM 629 CD2 LEU A 119 62.277 19.904 -4.311 1.00 25.00 C ATOM 0 H LEU A 119 65.361 16.416 -2.647 1.00 25.00 H new ATOM 0 HA LEU A 119 62.655 17.441 -3.239 1.00 25.00 H new ATOM 0 HB2 LEU A 119 65.342 18.300 -4.243 1.00 25.00 H new ATOM 0 HB3 LEU A 119 64.063 18.164 -5.434 1.00 25.00 H new ATOM 0 HG LEU A 119 63.923 19.904 -2.945 1.00 25.00 H new ATOM 0 HD11 LEU A 119 64.233 21.768 -4.565 1.00 25.00 H new ATOM 0 HD12 LEU A 119 65.631 20.666 -4.575 1.00 25.00 H new ATOM 0 HD13 LEU A 119 64.424 20.585 -5.880 1.00 25.00 H new ATOM 0 HD21 LEU A 119 61.960 20.912 -4.046 1.00 25.00 H new ATOM 0 HD22 LEU A 119 62.097 19.735 -5.373 1.00 25.00 H new ATOM 0 HD23 LEU A 119 61.710 19.179 -3.727 1.00 25.00 H new ATOM 641 N GLN A 120 62.382 15.749 -5.047 1.00 25.00 N ATOM 642 CA GLN A 120 62.128 14.655 -5.986 1.00 25.00 C ATOM 643 C GLN A 120 62.134 15.257 -7.386 1.00 25.00 C ATOM 644 O GLN A 120 61.288 16.085 -7.716 1.00 25.00 O ATOM 645 CB GLN A 120 60.773 14.005 -5.697 1.00 25.00 C ATOM 646 CG GLN A 120 60.491 12.799 -6.572 1.00 25.00 C ATOM 647 CD GLN A 120 59.106 12.233 -6.359 1.00 25.00 C ATOM 648 OE1 GLN A 120 58.707 11.930 -5.249 1.00 25.00 O ATOM 649 NE2 GLN A 120 58.361 12.099 -7.425 1.00 25.00 N ATOM 0 H GLN A 120 61.565 16.330 -4.859 1.00 25.00 H new ATOM 0 HA GLN A 120 62.891 13.882 -5.891 1.00 25.00 H new ATOM 0 HB2 GLN A 120 60.738 13.703 -4.650 1.00 25.00 H new ATOM 0 HB3 GLN A 120 59.985 14.744 -5.842 1.00 25.00 H new ATOM 0 HG2 GLN A 120 60.607 13.080 -7.619 1.00 25.00 H new ATOM 0 HG3 GLN A 120 61.231 12.025 -6.366 1.00 25.00 H new ATOM 0 HE21 GLN A 120 58.727 12.363 -8.340 1.00 25.00 H new ATOM 0 HE22 GLN A 120 57.413 11.731 -7.342 1.00 25.00 H new ATOM 658 N VAL A 121 63.114 14.879 -8.186 1.00 25.00 N ATOM 659 CA VAL A 121 63.334 15.482 -9.501 1.00 25.00 C ATOM 660 C VAL A 121 63.686 14.433 -10.537 1.00 25.00 C ATOM 661 O VAL A 121 64.020 13.302 -10.198 1.00 25.00 O ATOM 662 CB VAL A 121 64.485 16.526 -9.428 1.00 25.00 C ATOM 663 CG1 VAL A 121 64.032 17.767 -8.663 1.00 25.00 C ATOM 664 CG2 VAL A 121 65.732 15.923 -8.739 1.00 25.00 C ATOM 0 H VAL A 121 63.783 14.146 -7.949 1.00 25.00 H new ATOM 0 HA VAL A 121 62.406 15.971 -9.797 1.00 25.00 H new ATOM 0 HB VAL A 121 64.746 16.807 -10.448 1.00 25.00 H new ATOM 0 HG11 VAL A 121 64.849 18.487 -8.621 1.00 25.00 H new ATOM 0 HG12 VAL A 121 63.178 18.216 -9.171 1.00 25.00 H new ATOM 0 HG13 VAL A 121 63.745 17.485 -7.650 1.00 25.00 H new ATOM 0 HG21 VAL A 121 66.523 16.671 -8.700 1.00 25.00 H new ATOM 0 HG22 VAL A 121 65.474 15.614 -7.726 1.00 25.00 H new ATOM 0 HG23 VAL A 121 66.078 15.058 -9.305 1.00 25.00 H new ATOM 674 N ASP A 122 63.622 14.809 -11.806 1.00 25.00 N ATOM 675 CA ASP A 122 64.016 13.923 -12.898 1.00 25.00 C ATOM 676 C ASP A 122 65.551 13.932 -12.994 1.00 25.00 C ATOM 677 O ASP A 122 66.204 14.867 -12.531 1.00 25.00 O ATOM 678 CB ASP A 122 63.392 14.419 -14.212 1.00 25.00 C ATOM 679 CG ASP A 122 63.296 13.327 -15.274 1.00 25.00 C ATOM 680 OD1 ASP A 122 64.344 12.758 -15.667 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 62.176 13.047 -15.722 1.00 25.00 O1- ATOM 0 H ASP A 122 63.299 15.728 -12.109 1.00 25.00 H new ATOM 0 HA ASP A 122 63.666 12.907 -12.714 1.00 25.00 H new ATOM 0 HB2 ASP A 122 62.395 14.811 -14.010 1.00 25.00 H new ATOM 0 HB3 ASP A 122 63.986 15.246 -14.601 1.00 25.00 H new ATOM 686 N ALA A 123 66.126 12.925 -13.625 1.00 25.00 N ATOM 687 CA ALA A 123 67.559 12.894 -13.860 1.00 25.00 C ATOM 688 C ALA A 123 67.908 13.994 -14.873 1.00 25.00 C ATOM 689 O ALA A 123 68.958 14.631 -14.786 1.00 25.00 O ATOM 690 CB ALA A 123 67.966 11.518 -14.399 1.00 25.00 C ATOM 0 H ALA A 123 65.621 12.115 -13.985 1.00 25.00 H new ATOM 0 HA ALA A 123 68.100 13.069 -12.930 1.00 25.00 H new ATOM 0 HB1 ALA A 123 69.042 11.499 -14.574 1.00 25.00 H new ATOM 0 HB2 ALA A 123 67.703 10.750 -13.672 1.00 25.00 H new ATOM 0 HB3 ALA A 123 67.443 11.325 -15.336 1.00 25.00 H new ATOM 696 N ASP A 124 67.015 14.216 -15.829 1.00 25.00 N ATOM 697 CA ASP A 124 67.242 15.205 -16.889 1.00 25.00 C ATOM 698 C ASP A 124 66.685 16.586 -16.521 1.00 25.00 C ATOM 699 O ASP A 124 66.511 17.457 -17.366 1.00 25.00 O ATOM 700 CB ASP A 124 66.609 14.723 -18.198 1.00 25.00 C ATOM 701 CG ASP A 124 67.329 15.276 -19.428 1.00 25.00 C ATOM 702 OD1 ASP A 124 68.547 15.572 -19.331 1.00 25.00 O ATOM 703 OD2 ASP A 124 66.703 15.333 -20.508 1.00 25.00 O1- ATOM 0 H ASP A 124 66.123 13.726 -15.897 1.00 25.00 H new ATOM 0 HA ASP A 124 68.320 15.307 -17.014 1.00 25.00 H new ATOM 0 HB2 ASP A 124 66.627 13.634 -18.228 1.00 25.00 H new ATOM 0 HB3 ASP A 124 65.562 15.025 -18.226 1.00 25.00 H new ATOM 708 N PHE A 125 66.405 16.783 -15.243 1.00 25.00 N ATOM 709 CA PHE A 125 65.852 18.048 -14.768 1.00 25.00 C ATOM 710 C PHE A 125 66.897 19.157 -14.907 1.00 25.00 C ATOM 711 O PHE A 125 68.036 19.021 -14.449 1.00 25.00 O ATOM 712 CB PHE A 125 65.432 17.892 -13.310 1.00 25.00 C ATOM 713 CG PHE A 125 64.325 18.799 -12.882 1.00 25.00 C ATOM 714 CD1 PHE A 125 63.008 18.558 -13.304 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.575 19.868 -12.008 1.00 25.00 C ATOM 716 CE1 PHE A 125 61.940 19.375 -12.871 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.508 20.689 -11.553 1.00 25.00 C ATOM 718 CZ PHE A 125 62.190 20.443 -11.991 1.00 25.00 C ATOM 0 H PHE A 125 66.550 16.085 -14.513 1.00 25.00 H new ATOM 0 HA PHE A 125 64.981 18.318 -15.366 1.00 25.00 H new ATOM 0 HB2 PHE A 125 65.124 16.860 -13.143 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.299 18.073 -12.674 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.808 17.733 -13.972 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.584 20.068 -11.679 1.00 25.00 H new ATOM 0 HE1 PHE A 125 60.935 19.180 -13.215 1.00 25.00 H new ATOM 0 HE2 PHE A 125 63.707 21.502 -10.871 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.379 21.070 -11.653 1.00 25.00 H new ATOM 728 N GLU A 126 66.503 20.248 -15.545 1.00 25.00 N ATOM 729 CA GLU A 126 67.390 21.390 -15.781 1.00 25.00 C ATOM 730 C GLU A 126 67.791 22.044 -14.466 1.00 25.00 C ATOM 731 O GLU A 126 66.961 22.195 -13.571 1.00 25.00 O ATOM 732 CB GLU A 126 66.650 22.437 -16.618 1.00 25.00 C ATOM 733 CG GLU A 126 66.924 22.365 -18.104 1.00 25.00 C ATOM 734 CD GLU A 126 68.206 23.089 -18.462 1.00 25.00 C ATOM 735 OE1 GLU A 126 69.284 22.602 -18.064 1.00 25.00 O ATOM 736 OE2 GLU A 126 68.135 24.183 -19.062 1.00 25.00 O1- ATOM 0 H GLU A 126 65.561 20.372 -15.916 1.00 25.00 H new ATOM 0 HA GLU A 126 68.280 21.030 -16.297 1.00 25.00 H new ATOM 0 HB2 GLU A 126 65.579 22.323 -16.454 1.00 25.00 H new ATOM 0 HB3 GLU A 126 66.924 23.429 -16.259 1.00 25.00 H new ATOM 0 HG2 GLU A 126 66.994 21.322 -18.413 1.00 25.00 H new ATOM 0 HG3 GLU A 126 66.090 22.804 -18.652 1.00 25.00 H new ATOM 743 N LEU A 127 69.029 22.512 -14.371 1.00 25.00 N ATOM 744 CA LEU A 127 69.477 23.233 -13.172 1.00 25.00 C ATOM 745 C LEU A 127 68.690 24.531 -13.021 1.00 25.00 C ATOM 746 O LEU A 127 68.438 24.997 -11.907 1.00 25.00 O ATOM 747 CB LEU A 127 70.975 23.549 -13.237 1.00 25.00 C ATOM 748 CG LEU A 127 71.903 22.817 -12.249 1.00 25.00 C ATOM 749 CD1 LEU A 127 71.573 23.200 -10.797 1.00 25.00 C ATOM 750 CD2 LEU A 127 71.834 21.307 -12.417 1.00 25.00 C ATOM 0 H LEU A 127 69.738 22.411 -15.097 1.00 25.00 H new ATOM 0 HA LEU A 127 69.299 22.590 -12.310 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.321 23.330 -14.247 1.00 25.00 H new ATOM 0 HB3 LEU A 127 71.099 24.621 -13.083 1.00 25.00 H new ATOM 0 HG LEU A 127 72.921 23.134 -12.476 1.00 25.00 H new ATOM 0 HD11 LEU A 127 72.242 22.670 -10.120 1.00 25.00 H new ATOM 0 HD12 LEU A 127 71.701 24.275 -10.666 1.00 25.00 H new ATOM 0 HD13 LEU A 127 70.541 22.928 -10.574 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.504 20.830 -11.701 1.00 25.00 H new ATOM 0 HD22 LEU A 127 70.813 20.968 -12.241 1.00 25.00 H new ATOM 0 HD23 LEU A 127 72.136 21.039 -13.430 1.00 25.00 H new ATOM 762 N HIS A 128 68.260 25.086 -14.143 1.00 25.00 N ATOM 763 CA HIS A 128 67.412 26.272 -14.141 1.00 25.00 C ATOM 764 C HIS A 128 66.109 26.005 -13.384 1.00 25.00 C ATOM 765 O HIS A 128 65.673 26.814 -12.574 1.00 25.00 O ATOM 766 CB HIS A 128 67.099 26.681 -15.580 1.00 25.00 C ATOM 767 CG HIS A 128 66.383 27.993 -15.693 1.00 25.00 C ATOM 768 ND1 HIS A 128 65.714 28.411 -16.813 1.00 25.00 N ATOM 769 CD2 HIS A 128 66.227 29.005 -14.792 1.00 25.00 C ATOM 770 CE1 HIS A 128 65.189 29.605 -16.568 1.00 25.00 C ATOM 771 NE2 HIS A 128 65.476 30.023 -15.350 1.00 25.00 N ATOM 0 H HIS A 128 68.485 24.733 -15.073 1.00 25.00 H new ATOM 0 HA HIS A 128 67.944 27.080 -13.638 1.00 25.00 H new ATOM 0 HB2 HIS A 128 68.031 26.736 -16.143 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.491 25.905 -16.045 1.00 25.00 H new ATOM 0 HD2 HIS A 128 66.631 29.010 -13.790 1.00 25.00 H new ATOM 0 HE1 HIS A 128 64.599 30.166 -17.278 1.00 25.00 H new ATOM 0 HE2 HIS A 128 65.203 30.904 -14.915 1.00 25.00 H new ATOM 779 N ASN A 129 65.504 24.848 -13.610 1.00 25.00 N ATOM 780 CA ASN A 129 64.268 24.508 -12.911 1.00 25.00 C ATOM 781 C ASN A 129 64.586 24.068 -11.487 1.00 25.00 C ATOM 782 O ASN A 129 63.812 24.300 -10.563 1.00 25.00 O ATOM 783 CB ASN A 129 63.513 23.397 -13.646 1.00 25.00 C ATOM 784 CG ASN A 129 62.912 23.865 -14.948 1.00 25.00 C ATOM 785 OD1 ASN A 129 62.464 24.993 -15.068 1.00 25.00 O ATOM 786 ND2 ASN A 129 62.890 22.996 -15.925 1.00 25.00 N ATOM 0 H ASN A 129 65.840 24.138 -14.260 1.00 25.00 H new ATOM 0 HA ASN A 129 63.632 25.393 -12.883 1.00 25.00 H new ATOM 0 HB2 ASN A 129 64.194 22.569 -13.842 1.00 25.00 H new ATOM 0 HB3 ASN A 129 62.721 23.014 -13.002 1.00 25.00 H new ATOM 0 HD21 ASN A 129 62.488 23.252 -16.827 1.00 25.00 H new ATOM 0 HD22 ASN A 129 63.275 22.062 -15.785 1.00 25.00 H new ATOM 793 N PHE A 130 65.734 23.436 -11.301 1.00 25.00 N ATOM 794 CA PHE A 130 66.131 22.954 -9.982 1.00 25.00 C ATOM 795 C PHE A 130 66.297 24.086 -8.982 1.00 25.00 C ATOM 796 O PHE A 130 65.825 23.991 -7.859 1.00 25.00 O ATOM 797 CB PHE A 130 67.428 22.154 -10.069 1.00 25.00 C ATOM 798 CG PHE A 130 67.754 21.421 -8.807 1.00 25.00 C ATOM 799 CD1 PHE A 130 66.972 20.323 -8.409 1.00 25.00 C ATOM 800 CD2 PHE A 130 68.848 21.806 -8.011 1.00 25.00 C ATOM 801 CE1 PHE A 130 67.274 19.598 -7.230 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.165 21.093 -6.826 1.00 25.00 C ATOM 803 CZ PHE A 130 68.377 19.984 -6.438 1.00 25.00 C ATOM 0 H PHE A 130 66.407 23.244 -12.043 1.00 25.00 H new ATOM 0 HA PHE A 130 65.327 22.309 -9.628 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.352 21.438 -10.888 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.248 22.830 -10.311 1.00 25.00 H new ATOM 0 HD1 PHE A 130 66.127 20.027 -9.012 1.00 25.00 H new ATOM 0 HD2 PHE A 130 69.452 22.652 -8.304 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.664 18.755 -6.939 1.00 25.00 H new ATOM 0 HE2 PHE A 130 70.007 21.396 -6.221 1.00 25.00 H new ATOM 0 HZ PHE A 130 68.618 19.435 -5.540 1.00 25.00 H new ATOM 813 N ARG A 131 66.927 25.182 -9.391 1.00 25.00 N ATOM 814 CA ARG A 131 67.099 26.322 -8.486 1.00 25.00 C ATOM 815 C ARG A 131 65.751 26.966 -8.167 1.00 25.00 C ATOM 816 O ARG A 131 65.590 27.526 -7.095 1.00 25.00 O ATOM 817 CB ARG A 131 68.109 27.352 -9.033 1.00 25.00 C ATOM 818 CG ARG A 131 67.673 28.118 -10.280 1.00 25.00 C ATOM 819 CD ARG A 131 67.407 29.596 -9.987 1.00 25.00 C ATOM 820 NE ARG A 131 68.638 30.317 -9.595 1.00 25.00 N ATOM 821 CZ ARG A 131 68.711 31.615 -9.315 1.00 25.00 C ATOM 822 NH1 ARG A 131 67.669 32.407 -9.385 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 69.857 32.123 -8.954 1.00 25.00 N ATOM 0 H ARG A 131 67.321 25.309 -10.323 1.00 25.00 H new ATOM 0 HA ARG A 131 67.520 25.942 -7.555 1.00 25.00 H new ATOM 0 HB2 ARG A 131 68.326 28.073 -8.245 1.00 25.00 H new ATOM 0 HB3 ARG A 131 69.042 26.834 -9.256 1.00 25.00 H new ATOM 0 HG2 ARG A 131 68.446 28.034 -11.044 1.00 25.00 H new ATOM 0 HG3 ARG A 131 66.771 27.662 -10.687 1.00 25.00 H new ATOM 0 HD2 ARG A 131 66.977 30.068 -10.870 1.00 25.00 H new ATOM 0 HD3 ARG A 131 66.669 29.680 -9.189 1.00 25.00 H new ATOM 0 HE ARG A 131 69.500 29.775 -9.535 1.00 25.00 H new ATOM 0 HH11 ARG A 131 66.762 32.033 -9.662 1.00 25.00 H new ATOM 0 HH12 ARG A 131 67.766 33.398 -9.162 1.00 25.00 H new ATOM 0 HH21 ARG A 131 70.682 31.526 -8.890 1.00 25.00 H new ATOM 0 HH22 ARG A 131 69.928 33.117 -8.736 1.00 25.00 H new ATOM 837 N ALA A 132 64.782 26.862 -9.068 1.00 25.00 N ATOM 838 CA ALA A 132 63.444 27.392 -8.811 1.00 25.00 C ATOM 839 C ALA A 132 62.716 26.511 -7.783 1.00 25.00 C ATOM 840 O ALA A 132 62.058 27.020 -6.884 1.00 25.00 O ATOM 841 CB ALA A 132 62.642 27.465 -10.123 1.00 25.00 C ATOM 0 H ALA A 132 64.894 26.418 -9.980 1.00 25.00 H new ATOM 0 HA ALA A 132 63.534 28.399 -8.404 1.00 25.00 H new ATOM 0 HB1 ALA A 132 61.647 27.861 -9.920 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.156 28.119 -10.828 1.00 25.00 H new ATOM 0 HB3 ALA A 132 62.554 26.467 -10.552 1.00 25.00 H new ATOM 847 N LEU A 133 62.868 25.196 -7.889 1.00 25.00 N ATOM 848 CA LEU A 133 62.254 24.293 -6.916 1.00 25.00 C ATOM 849 C LEU A 133 62.908 24.510 -5.554 1.00 25.00 C ATOM 850 O LEU A 133 62.240 24.514 -4.529 1.00 25.00 O ATOM 851 CB LEU A 133 62.425 22.831 -7.351 1.00 25.00 C ATOM 852 CG LEU A 133 61.202 22.210 -8.047 1.00 25.00 C ATOM 853 CD1 LEU A 133 60.867 22.902 -9.374 1.00 25.00 C ATOM 854 CD2 LEU A 133 61.464 20.725 -8.300 1.00 25.00 C ATOM 0 H LEU A 133 63.402 24.734 -8.626 1.00 25.00 H new ATOM 0 HA LEU A 133 61.187 24.507 -6.853 1.00 25.00 H new ATOM 0 HB2 LEU A 133 63.279 22.766 -8.025 1.00 25.00 H new ATOM 0 HB3 LEU A 133 62.666 22.233 -6.472 1.00 25.00 H new ATOM 0 HG LEU A 133 60.346 22.343 -7.385 1.00 25.00 H new ATOM 0 HD11 LEU A 133 59.996 22.425 -9.823 1.00 25.00 H new ATOM 0 HD12 LEU A 133 60.650 23.954 -9.191 1.00 25.00 H new ATOM 0 HD13 LEU A 133 61.716 22.819 -10.052 1.00 25.00 H new ATOM 0 HD21 LEU A 133 60.599 20.282 -8.793 1.00 25.00 H new ATOM 0 HD22 LEU A 133 62.341 20.614 -8.937 1.00 25.00 H new ATOM 0 HD23 LEU A 133 61.639 20.219 -7.350 1.00 25.00 H new ATOM 866 N CYS A 134 64.210 24.736 -5.560 1.00 25.00 N ATOM 867 CA CYS A 134 64.955 25.009 -4.341 1.00 25.00 C ATOM 868 C CYS A 134 64.451 26.296 -3.687 1.00 25.00 C ATOM 869 O CYS A 134 64.279 26.351 -2.478 1.00 25.00 O ATOM 870 CB CYS A 134 66.444 25.143 -4.677 1.00 25.00 C ATOM 871 SG CYS A 134 67.497 25.368 -3.232 1.00 25.00 S ATOM 0 H CYS A 134 64.780 24.736 -6.406 1.00 25.00 H new ATOM 0 HA CYS A 134 64.811 24.185 -3.642 1.00 25.00 H new ATOM 0 HB2 CYS A 134 66.767 24.252 -5.216 1.00 25.00 H new ATOM 0 HB3 CYS A 134 66.581 25.989 -5.350 1.00 25.00 H new ATOM 0 HG CYS A 134 68.744 25.258 -3.582 1.00 25.00 H new ATOM 877 N GLU A 135 64.209 27.324 -4.492 1.00 25.00 N ATOM 878 CA GLU A 135 63.703 28.607 -3.998 1.00 25.00 C ATOM 879 C GLU A 135 62.347 28.424 -3.315 1.00 25.00 C ATOM 880 O GLU A 135 62.096 28.989 -2.251 1.00 25.00 O ATOM 881 CB GLU A 135 63.590 29.588 -5.180 1.00 25.00 C ATOM 882 CG GLU A 135 63.172 31.002 -4.816 1.00 25.00 C ATOM 883 CD GLU A 135 63.456 31.992 -5.944 1.00 25.00 C ATOM 884 OE1 GLU A 135 62.974 31.781 -7.073 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 64.241 32.946 -5.710 1.00 25.00 O1- ATOM 0 H GLU A 135 64.356 27.296 -5.501 1.00 25.00 H new ATOM 0 HA GLU A 135 64.394 29.010 -3.258 1.00 25.00 H new ATOM 0 HB2 GLU A 135 64.554 29.632 -5.687 1.00 25.00 H new ATOM 0 HB3 GLU A 135 62.871 29.188 -5.895 1.00 25.00 H new ATOM 0 HG2 GLU A 135 62.108 31.016 -4.581 1.00 25.00 H new ATOM 0 HG3 GLU A 135 63.701 31.316 -3.916 1.00 25.00 H new ATOM 892 N LEU A 136 61.495 27.592 -3.906 1.00 25.00 N ATOM 893 CA LEU A 136 60.171 27.327 -3.351 1.00 25.00 C ATOM 894 C LEU A 136 60.255 26.632 -1.993 1.00 25.00 C ATOM 895 O LEU A 136 59.562 27.022 -1.058 1.00 25.00 O ATOM 896 CB LEU A 136 59.367 26.476 -4.345 1.00 25.00 C ATOM 897 CG LEU A 136 57.875 26.235 -4.043 1.00 25.00 C ATOM 898 CD1 LEU A 136 57.121 26.075 -5.367 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.644 24.989 -3.179 1.00 25.00 C ATOM 0 H LEU A 136 61.698 27.089 -4.770 1.00 25.00 H new ATOM 0 HA LEU A 136 59.666 28.280 -3.191 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.438 26.949 -5.325 1.00 25.00 H new ATOM 0 HB3 LEU A 136 59.854 25.504 -4.424 1.00 25.00 H new ATOM 0 HG LEU A 136 57.508 27.094 -3.482 1.00 25.00 H new ATOM 0 HD11 LEU A 136 56.064 25.904 -5.165 1.00 25.00 H new ATOM 0 HD12 LEU A 136 57.235 26.981 -5.962 1.00 25.00 H new ATOM 0 HD13 LEU A 136 57.527 25.226 -5.917 1.00 25.00 H new ATOM 0 HD21 LEU A 136 56.577 24.866 -2.996 1.00 25.00 H new ATOM 0 HD22 LEU A 136 58.027 24.110 -3.698 1.00 25.00 H new ATOM 0 HD23 LEU A 136 58.164 25.104 -2.228 1.00 25.00 H new ATOM 911 N GLU A 137 61.094 25.610 -1.885 1.00 25.00 N ATOM 912 CA GLU A 137 61.213 24.843 -0.635 1.00 25.00 C ATOM 913 C GLU A 137 61.915 25.633 0.471 1.00 25.00 C ATOM 914 O GLU A 137 61.558 25.544 1.642 1.00 25.00 O ATOM 915 CB GLU A 137 62.027 23.571 -0.892 1.00 25.00 C ATOM 916 CG GLU A 137 61.363 22.551 -1.824 1.00 25.00 C ATOM 917 CD GLU A 137 60.183 21.804 -1.194 1.00 25.00 C ATOM 918 OE1 GLU A 137 59.973 21.888 0.034 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 59.477 21.104 -1.951 1.00 25.00 O1- ATOM 0 H GLU A 137 61.702 25.288 -2.638 1.00 25.00 H new ATOM 0 HA GLU A 137 60.200 24.612 -0.307 1.00 25.00 H new ATOM 0 HB2 GLU A 137 62.990 23.854 -1.316 1.00 25.00 H new ATOM 0 HB3 GLU A 137 62.229 23.088 0.064 1.00 25.00 H new ATOM 0 HG2 GLU A 137 61.017 23.065 -2.720 1.00 25.00 H new ATOM 0 HG3 GLU A 137 62.111 21.825 -2.142 1.00 25.00 H new ATOM 926 N SER A 138 62.953 26.372 0.105 1.00 25.00 N ATOM 927 CA SER A 138 63.756 27.100 1.090 1.00 25.00 C ATOM 928 C SER A 138 63.148 28.444 1.495 1.00 25.00 C ATOM 929 O SER A 138 63.437 28.952 2.574 1.00 25.00 O ATOM 930 CB SER A 138 65.165 27.322 0.557 1.00 25.00 C ATOM 931 OG SER A 138 65.144 28.086 -0.633 1.00 25.00 O ATOM 0 H SER A 138 63.261 26.486 -0.861 1.00 25.00 H new ATOM 0 HA SER A 138 63.780 26.478 1.984 1.00 25.00 H new ATOM 0 HB2 SER A 138 65.766 27.832 1.310 1.00 25.00 H new ATOM 0 HB3 SER A 138 65.641 26.360 0.367 1.00 25.00 H new ATOM 0 HG SER A 138 64.961 27.499 -1.396 1.00 25.00 H new ATOM 937 N GLY A 139 62.320 29.018 0.632 1.00 25.00 N ATOM 938 CA GLY A 139 61.655 30.275 0.949 1.00 25.00 C ATOM 939 C GLY A 139 62.579 31.475 0.998 1.00 25.00 C ATOM 940 O GLY A 139 62.255 32.487 1.623 1.00 25.00 O ATOM 0 H GLY A 139 62.094 28.637 -0.287 1.00 25.00 H new ATOM 0 HA2 GLY A 139 60.879 30.459 0.206 1.00 25.00 H new ATOM 0 HA3 GLY A 139 61.156 30.176 1.913 1.00 25.00 H new ATOM 944 N ILE A 140 63.733 31.376 0.355 1.00 25.00 N ATOM 945 CA ILE A 140 64.716 32.467 0.338 1.00 25.00 C ATOM 946 C ILE A 140 65.034 32.848 -1.109 1.00 25.00 C ATOM 947 O ILE A 140 65.020 31.992 -1.989 1.00 25.00 O ATOM 948 CB ILE A 140 66.035 32.070 1.081 1.00 25.00 C ATOM 949 CG1 ILE A 140 66.679 30.815 0.449 1.00 25.00 C ATOM 950 CG2 ILE A 140 65.755 31.791 2.570 1.00 25.00 C ATOM 951 CD1 ILE A 140 67.877 31.099 -0.435 1.00 25.00 C ATOM 0 H ILE A 140 64.020 30.548 -0.167 1.00 25.00 H new ATOM 0 HA ILE A 140 64.282 33.319 0.862 1.00 25.00 H new ATOM 0 HB ILE A 140 66.725 32.909 0.987 1.00 25.00 H new ATOM 0 HG12 ILE A 140 66.985 30.138 1.247 1.00 25.00 H new ATOM 0 HG13 ILE A 140 65.925 30.293 -0.140 1.00 25.00 H new ATOM 0 HG21 ILE A 140 66.684 31.517 3.070 1.00 25.00 H new ATOM 0 HG22 ILE A 140 65.343 32.686 3.037 1.00 25.00 H new ATOM 0 HG23 ILE A 140 65.040 30.973 2.659 1.00 25.00 H new ATOM 0 HD11 ILE A 140 68.264 30.162 -0.835 1.00 25.00 H new ATOM 0 HD12 ILE A 140 67.577 31.748 -1.257 1.00 25.00 H new ATOM 0 HD13 ILE A 140 68.653 31.591 0.151 1.00 25.00 H new ATOM 963 N PRO A 141 65.309 34.141 -1.378 1.00 25.00 N ATOM 964 CA PRO A 141 65.605 34.485 -2.777 1.00 25.00 C ATOM 965 C PRO A 141 66.858 33.803 -3.327 1.00 25.00 C ATOM 966 O PRO A 141 67.978 34.027 -2.845 1.00 25.00 O ATOM 967 CB PRO A 141 65.804 36.007 -2.727 1.00 25.00 C ATOM 968 CG PRO A 141 65.093 36.444 -1.503 1.00 25.00 C ATOM 969 CD PRO A 141 65.345 35.342 -0.521 1.00 25.00 C ATOM 0 HA PRO A 141 64.808 34.153 -3.442 1.00 25.00 H new ATOM 0 HB2 PRO A 141 66.862 36.266 -2.683 1.00 25.00 H new ATOM 0 HB3 PRO A 141 65.394 36.488 -3.615 1.00 25.00 H new ATOM 0 HG2 PRO A 141 65.475 37.398 -1.139 1.00 25.00 H new ATOM 0 HG3 PRO A 141 64.027 36.578 -1.687 1.00 25.00 H new ATOM 0 HD2 PRO A 141 66.307 35.456 -0.021 1.00 25.00 H new ATOM 0 HD3 PRO A 141 64.583 35.309 0.257 1.00 25.00 H new ATOM 977 N ALA A 142 66.681 33.003 -4.364 1.00 25.00 N ATOM 978 CA ALA A 142 67.787 32.302 -5.009 1.00 25.00 C ATOM 979 C ALA A 142 68.735 33.310 -5.663 1.00 25.00 C ATOM 980 O ALA A 142 69.920 33.035 -5.864 1.00 25.00 O ATOM 981 CB ALA A 142 67.244 31.311 -6.040 1.00 25.00 C ATOM 0 H ALA A 142 65.770 32.819 -4.785 1.00 25.00 H new ATOM 0 HA ALA A 142 68.348 31.744 -4.259 1.00 25.00 H new ATOM 0 HB1 ALA A 142 68.075 30.791 -6.518 1.00 25.00 H new ATOM 0 HB2 ALA A 142 66.600 30.586 -5.543 1.00 25.00 H new ATOM 0 HB3 ALA A 142 66.670 31.849 -6.795 1.00 25.00 H new ATOM 987 N ALA A 143 68.204 34.481 -5.985 1.00 25.00 N ATOM 988 CA ALA A 143 68.982 35.562 -6.589 1.00 25.00 C ATOM 989 C ALA A 143 70.118 36.058 -5.670 1.00 25.00 C ATOM 990 O ALA A 143 71.106 36.597 -6.141 1.00 25.00 O ATOM 991 CB ALA A 143 68.044 36.728 -6.942 1.00 25.00 C ATOM 0 H ALA A 143 67.222 34.712 -5.836 1.00 25.00 H new ATOM 0 HA ALA A 143 69.452 35.168 -7.490 1.00 25.00 H new ATOM 0 HB1 ALA A 143 68.621 37.536 -7.392 1.00 25.00 H new ATOM 0 HB2 ALA A 143 67.287 36.385 -7.648 1.00 25.00 H new ATOM 0 HB3 ALA A 143 67.558 37.091 -6.036 1.00 25.00 H new ATOM 997 N GLU A 144 69.957 35.861 -4.370 1.00 25.00 N ATOM 998 CA GLU A 144 70.927 36.328 -3.383 1.00 25.00 C ATOM 999 C GLU A 144 71.865 35.200 -2.944 1.00 25.00 C ATOM 1000 O GLU A 144 72.546 35.306 -1.912 1.00 25.00 O ATOM 1001 CB GLU A 144 70.165 36.867 -2.164 1.00 25.00 C ATOM 1002 CG GLU A 144 69.260 38.054 -2.491 1.00 25.00 C ATOM 1003 CD GLU A 144 68.484 38.554 -1.272 1.00 25.00 C ATOM 1004 OE1 GLU A 144 68.546 37.909 -0.204 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 67.793 39.582 -1.398 1.00 25.00 O1- ATOM 0 H GLU A 144 69.155 35.376 -3.968 1.00 25.00 H new ATOM 0 HA GLU A 144 71.536 37.112 -3.833 1.00 25.00 H new ATOM 0 HB2 GLU A 144 69.561 36.065 -1.739 1.00 25.00 H new ATOM 0 HB3 GLU A 144 70.882 37.166 -1.399 1.00 25.00 H new ATOM 0 HG2 GLU A 144 69.865 38.868 -2.891 1.00 25.00 H new ATOM 0 HG3 GLU A 144 68.556 37.766 -3.272 1.00 25.00 H new ATOM 1012 N SER A 145 71.882 34.108 -3.698 1.00 25.00 N ATOM 1013 CA SER A 145 72.632 32.922 -3.299 1.00 25.00 C ATOM 1014 C SER A 145 73.484 32.284 -4.393 1.00 25.00 C ATOM 1015 O SER A 145 73.287 32.521 -5.583 1.00 25.00 O ATOM 1016 CB SER A 145 71.642 31.869 -2.801 1.00 25.00 C ATOM 1017 OG SER A 145 70.897 31.315 -3.872 1.00 25.00 O ATOM 0 H SER A 145 71.388 34.018 -4.586 1.00 25.00 H new ATOM 0 HA SER A 145 73.328 33.261 -2.532 1.00 25.00 H new ATOM 0 HB2 SER A 145 72.181 31.076 -2.282 1.00 25.00 H new ATOM 0 HB3 SER A 145 70.963 32.319 -2.077 1.00 25.00 H new ATOM 0 HG SER A 145 70.623 32.030 -4.484 1.00 25.00 H new ATOM 1023 N GLN A 146 74.387 31.409 -3.965 1.00 25.00 N ATOM 1024 CA GLN A 146 75.157 30.565 -4.879 1.00 25.00 C ATOM 1025 C GLN A 146 74.945 29.131 -4.442 1.00 25.00 C ATOM 1026 O GLN A 146 74.722 28.863 -3.257 1.00 25.00 O ATOM 1027 CB GLN A 146 76.649 30.900 -4.856 1.00 25.00 C ATOM 1028 CG GLN A 146 77.013 32.110 -5.704 1.00 25.00 C ATOM 1029 CD GLN A 146 78.497 32.163 -5.994 1.00 25.00 C ATOM 1030 OE1 GLN A 146 79.310 32.392 -5.109 1.00 25.00 O ATOM 1031 NE2 GLN A 146 78.858 31.895 -7.225 1.00 25.00 N ATOM 0 H GLN A 146 74.607 31.263 -2.980 1.00 25.00 H new ATOM 0 HA GLN A 146 74.817 30.731 -5.901 1.00 25.00 H new ATOM 0 HB2 GLN A 146 76.956 31.082 -3.826 1.00 25.00 H new ATOM 0 HB3 GLN A 146 77.213 30.036 -5.209 1.00 25.00 H new ATOM 0 HG2 GLN A 146 76.460 32.077 -6.642 1.00 25.00 H new ATOM 0 HG3 GLN A 146 76.710 33.021 -5.188 1.00 25.00 H new ATOM 0 HE21 GLN A 146 78.150 31.709 -7.935 1.00 25.00 H new ATOM 0 HE22 GLN A 146 79.847 31.872 -7.473 1.00 25.00 H new ATOM 1040 N ILE A 147 75.004 28.222 -5.403 1.00 25.00 N ATOM 1041 CA ILE A 147 74.706 26.813 -5.172 1.00 25.00 C ATOM 1042 C ILE A 147 75.942 25.979 -5.561 1.00 25.00 C ATOM 1043 O ILE A 147 76.638 26.298 -6.527 1.00 25.00 O ATOM 1044 CB ILE A 147 73.404 26.440 -5.956 1.00 25.00 C ATOM 1045 CG1 ILE A 147 72.897 25.052 -5.541 1.00 25.00 C ATOM 1046 CG2 ILE A 147 73.616 26.568 -7.492 1.00 25.00 C ATOM 1047 CD1 ILE A 147 71.478 24.713 -6.074 1.00 25.00 C ATOM 0 H ILE A 147 75.260 28.438 -6.366 1.00 25.00 H new ATOM 0 HA ILE A 147 74.505 26.598 -4.122 1.00 25.00 H new ATOM 0 HB ILE A 147 72.624 27.154 -5.692 1.00 25.00 H new ATOM 0 HG12 ILE A 147 73.598 24.298 -5.899 1.00 25.00 H new ATOM 0 HG13 ILE A 147 72.890 24.989 -4.453 1.00 25.00 H new ATOM 0 HG21 ILE A 147 72.694 26.302 -8.010 1.00 25.00 H new ATOM 0 HG22 ILE A 147 73.887 27.595 -7.738 1.00 25.00 H new ATOM 0 HG23 ILE A 147 74.415 25.897 -7.806 1.00 25.00 H new ATOM 0 HD11 ILE A 147 71.192 23.716 -5.738 1.00 25.00 H new ATOM 0 HD12 ILE A 147 70.763 25.443 -5.695 1.00 25.00 H new ATOM 0 HD13 ILE A 147 71.482 24.741 -7.164 1.00 25.00 H new ATOM 1059 N VAL A 148 76.278 25.011 -4.720 1.00 25.00 N ATOM 1060 CA VAL A 148 77.541 24.268 -4.786 1.00 25.00 C ATOM 1061 C VAL A 148 77.287 22.761 -4.691 1.00 25.00 C ATOM 1062 O VAL A 148 76.517 22.312 -3.851 1.00 25.00 O ATOM 1063 CB VAL A 148 78.459 24.703 -3.582 1.00 25.00 C ATOM 1064 CG1 VAL A 148 79.790 23.941 -3.568 1.00 25.00 C ATOM 1065 CG2 VAL A 148 78.739 26.222 -3.637 1.00 25.00 C ATOM 0 H VAL A 148 75.673 24.710 -3.956 1.00 25.00 H new ATOM 0 HA VAL A 148 78.026 24.488 -5.737 1.00 25.00 H new ATOM 0 HB VAL A 148 77.919 24.460 -2.667 1.00 25.00 H new ATOM 0 HG11 VAL A 148 80.391 24.273 -2.721 1.00 25.00 H new ATOM 0 HG12 VAL A 148 79.596 22.872 -3.478 1.00 25.00 H new ATOM 0 HG13 VAL A 148 80.330 24.135 -4.494 1.00 25.00 H new ATOM 0 HG21 VAL A 148 79.375 26.505 -2.798 1.00 25.00 H new ATOM 0 HG22 VAL A 148 79.243 26.465 -4.572 1.00 25.00 H new ATOM 0 HG23 VAL A 148 77.797 26.768 -3.579 1.00 25.00 H new ATOM 1075 N TYR A 149 77.966 21.990 -5.523 1.00 25.00 N ATOM 1076 CA TYR A 149 77.898 20.527 -5.484 1.00 25.00 C ATOM 1077 C TYR A 149 79.311 20.024 -5.757 1.00 25.00 C ATOM 1078 O TYR A 149 80.036 20.656 -6.521 1.00 25.00 O ATOM 1079 CB TYR A 149 76.935 20.012 -6.551 1.00 25.00 C ATOM 1080 CG TYR A 149 77.175 18.574 -6.917 1.00 25.00 C ATOM 1081 CD1 TYR A 149 76.801 17.527 -6.048 1.00 25.00 C ATOM 1082 CD2 TYR A 149 77.801 18.243 -8.134 1.00 25.00 C ATOM 1083 CE1 TYR A 149 77.050 16.169 -6.396 1.00 25.00 C ATOM 1084 CE2 TYR A 149 78.040 16.893 -8.487 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.656 15.870 -7.617 1.00 25.00 C ATOM 1086 OH TYR A 149 77.877 14.569 -7.969 1.00 25.00 O ATOM 0 H TYR A 149 78.583 22.355 -6.248 1.00 25.00 H new ATOM 0 HA TYR A 149 77.533 20.174 -4.520 1.00 25.00 H new ATOM 0 HB2 TYR A 149 75.912 20.124 -6.193 1.00 25.00 H new ATOM 0 HB3 TYR A 149 77.029 20.629 -7.445 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.321 17.758 -5.109 1.00 25.00 H new ATOM 0 HD2 TYR A 149 78.103 19.031 -8.808 1.00 25.00 H new ATOM 0 HE1 TYR A 149 76.772 15.375 -5.719 1.00 25.00 H new ATOM 0 HE2 TYR A 149 78.518 16.655 -9.426 1.00 25.00 H new ATOM 0 HH TYR A 149 78.306 14.537 -8.850 1.00 25.00 H new ATOM 1096 N ALA A 150 79.714 18.936 -5.103 1.00 25.00 N ATOM 1097 CA ALA A 150 81.068 18.374 -5.247 1.00 25.00 C ATOM 1098 C ALA A 150 82.146 19.459 -5.052 1.00 25.00 C ATOM 1099 O ALA A 150 83.083 19.578 -5.834 1.00 25.00 O ATOM 1100 CB ALA A 150 81.221 17.680 -6.612 1.00 25.00 C ATOM 0 H ALA A 150 79.118 18.416 -4.459 1.00 25.00 H new ATOM 0 HA ALA A 150 81.210 17.627 -4.466 1.00 25.00 H new ATOM 0 HB1 ALA A 150 82.227 17.271 -6.701 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.493 16.873 -6.694 1.00 25.00 H new ATOM 0 HB3 ALA A 150 81.052 18.404 -7.409 1.00 25.00 H new ATOM 1106 N GLU A 151 81.946 20.262 -4.009 1.00 25.00 N ATOM 1107 CA GLU A 151 82.838 21.375 -3.626 1.00 25.00 C ATOM 1108 C GLU A 151 83.018 22.483 -4.680 1.00 25.00 C ATOM 1109 O GLU A 151 83.816 23.402 -4.489 1.00 25.00 O ATOM 1110 CB GLU A 151 84.221 20.846 -3.193 1.00 25.00 C ATOM 1111 CG GLU A 151 84.165 19.798 -2.086 1.00 25.00 C ATOM 1112 CD GLU A 151 85.544 19.506 -1.510 1.00 25.00 C ATOM 1113 OE1 GLU A 151 86.483 19.238 -2.286 1.00 25.00 O ATOM 1114 OE2 GLU A 151 85.686 19.576 -0.267 1.00 25.00 O1- ATOM 0 H GLU A 151 81.144 20.162 -3.387 1.00 25.00 H new ATOM 0 HA GLU A 151 82.323 21.850 -2.791 1.00 25.00 H new ATOM 0 HB2 GLU A 151 84.722 20.417 -4.060 1.00 25.00 H new ATOM 0 HB3 GLU A 151 84.830 21.685 -2.855 1.00 25.00 H new ATOM 0 HG2 GLU A 151 83.505 20.145 -1.291 1.00 25.00 H new ATOM 0 HG3 GLU A 151 83.733 18.877 -2.479 1.00 25.00 H new ATOM 1121 N ARG A 152 82.258 22.438 -5.772 1.00 25.00 N ATOM 1122 CA ARG A 152 82.366 23.462 -6.819 1.00 25.00 C ATOM 1123 C ARG A 152 81.025 24.127 -7.105 1.00 25.00 C ATOM 1124 O ARG A 152 79.979 23.489 -7.018 1.00 25.00 O ATOM 1125 CB ARG A 152 82.907 22.836 -8.102 1.00 25.00 C ATOM 1126 CG ARG A 152 84.259 22.140 -7.916 1.00 25.00 C ATOM 1127 CD ARG A 152 85.111 22.260 -9.165 1.00 25.00 C ATOM 1128 NE ARG A 152 85.604 23.638 -9.337 1.00 25.00 N ATOM 1129 CZ ARG A 152 86.193 24.113 -10.425 1.00 25.00 C ATOM 1130 NH1 ARG A 152 86.392 23.371 -11.488 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 86.593 25.359 -10.446 1.00 25.00 N ATOM 0 H ARG A 152 81.566 21.712 -5.958 1.00 25.00 H new ATOM 0 HA ARG A 152 83.051 24.229 -6.459 1.00 25.00 H new ATOM 0 HB2 ARG A 152 82.183 22.113 -8.478 1.00 25.00 H new ATOM 0 HB3 ARG A 152 83.007 23.611 -8.862 1.00 25.00 H new ATOM 0 HG2 ARG A 152 84.785 22.581 -7.069 1.00 25.00 H new ATOM 0 HG3 ARG A 152 84.100 21.088 -7.680 1.00 25.00 H new ATOM 0 HD2 ARG A 152 85.955 21.573 -9.101 1.00 25.00 H new ATOM 0 HD3 ARG A 152 84.527 21.967 -10.038 1.00 25.00 H new ATOM 0 HE ARG A 152 85.482 24.280 -8.554 1.00 25.00 H new ATOM 0 HH11 ARG A 152 86.090 22.397 -11.494 1.00 25.00 H new ATOM 0 HH12 ARG A 152 86.849 23.768 -12.309 1.00 25.00 H new ATOM 0 HH21 ARG A 152 86.450 25.954 -9.630 1.00 25.00 H new ATOM 0 HH22 ARG A 152 87.047 25.735 -11.278 1.00 25.00 H new ATOM 1145 N PRO A 153 81.037 25.428 -7.440 1.00 25.00 N ATOM 1146 CA PRO A 153 79.723 26.011 -7.723 1.00 25.00 C ATOM 1147 C PRO A 153 79.148 25.513 -9.043 1.00 25.00 C ATOM 1148 O PRO A 153 79.885 25.243 -9.996 1.00 25.00 O ATOM 1149 CB PRO A 153 80.016 27.508 -7.777 1.00 25.00 C ATOM 1150 CG PRO A 153 81.414 27.587 -8.273 1.00 25.00 C ATOM 1151 CD PRO A 153 82.112 26.428 -7.593 1.00 25.00 C ATOM 0 HA PRO A 153 78.975 25.742 -6.978 1.00 25.00 H new ATOM 0 HB2 PRO A 153 79.327 28.025 -8.444 1.00 25.00 H new ATOM 0 HB3 PRO A 153 79.915 27.969 -6.795 1.00 25.00 H new ATOM 0 HG2 PRO A 153 81.458 27.498 -9.358 1.00 25.00 H new ATOM 0 HG3 PRO A 153 81.876 28.539 -8.013 1.00 25.00 H new ATOM 0 HD2 PRO A 153 82.935 26.045 -8.196 1.00 25.00 H new ATOM 0 HD3 PRO A 153 82.531 26.719 -6.630 1.00 25.00 H new ATOM 1159 N LEU A 154 77.834 25.427 -9.109 1.00 25.00 N ATOM 1160 CA LEU A 154 77.160 25.055 -10.347 1.00 25.00 C ATOM 1161 C LEU A 154 76.882 26.373 -11.063 1.00 0.00 C ATOM 1162 O LEU A 154 76.287 27.271 -10.474 1.00 25.00 O ATOM 1163 CB LEU A 154 75.853 24.297 -10.075 1.00 25.00 C ATOM 1164 CG LEU A 154 75.990 22.986 -9.275 1.00 25.00 C ATOM 1165 CD1 LEU A 154 75.208 23.086 -7.972 1.00 25.00 C ATOM 1166 CD2 LEU A 154 75.486 21.801 -10.072 1.00 25.00 C ATOM 0 H LEU A 154 77.209 25.608 -8.324 1.00 25.00 H new ATOM 0 HA LEU A 154 77.774 24.383 -10.946 1.00 25.00 H new ATOM 0 HB2 LEU A 154 75.176 24.960 -9.536 1.00 25.00 H new ATOM 0 HB3 LEU A 154 75.382 24.069 -11.031 1.00 25.00 H new ATOM 0 HG LEU A 154 77.048 22.835 -9.061 1.00 25.00 H new ATOM 0 HD11 LEU A 154 75.311 22.155 -7.414 1.00 25.00 H new ATOM 0 HD12 LEU A 154 75.598 23.911 -7.376 1.00 25.00 H new ATOM 0 HD13 LEU A 154 74.155 23.263 -8.192 1.00 25.00 H new ATOM 0 HD21 LEU A 154 75.596 20.892 -9.481 1.00 25.00 H new ATOM 0 HD22 LEU A 154 74.435 21.949 -10.318 1.00 25.00 H new ATOM 0 HD23 LEU A 154 76.064 21.708 -10.991 1.00 25.00 H new ATOM 1178 N THR A 155 77.376 26.516 -12.282 1.00 25.00 N ATOM 1179 CA THR A 155 77.270 27.785 -13.012 1.00 25.00 C ATOM 1180 C THR A 155 76.366 27.683 -14.231 1.00 25.00 C ATOM 1181 O THR A 155 75.551 28.568 -14.482 1.00 25.00 O ATOM 1182 CB THR A 155 78.662 28.249 -13.471 1.00 25.00 C ATOM 1183 OG1 THR A 155 79.281 27.203 -14.230 1.00 25.00 O ATOM 1184 CG2 THR A 155 79.554 28.544 -12.268 1.00 25.00 C ATOM 0 H THR A 155 77.855 25.775 -12.793 1.00 25.00 H new ATOM 0 HA THR A 155 76.831 28.506 -12.322 1.00 25.00 H new ATOM 0 HB THR A 155 78.543 29.151 -14.070 1.00 25.00 H new ATOM 0 HG1 THR A 155 80.168 27.495 -14.526 1.00 25.00 H new ATOM 0 HG21 THR A 155 80.535 28.871 -12.614 1.00 25.00 H new ATOM 0 HG22 THR A 155 79.102 29.330 -11.664 1.00 25.00 H new ATOM 0 HG23 THR A 155 79.664 27.642 -11.666 1.00 25.00 H new ATOM 1192 N ASP A 156 76.504 26.612 -14.989 1.00 25.00 N ATOM 1193 CA ASP A 156 75.728 26.450 -16.210 1.00 25.00 C ATOM 1194 C ASP A 156 74.364 25.912 -15.834 1.00 25.00 C ATOM 1195 O ASP A 156 74.205 24.729 -15.545 1.00 25.00 O ATOM 1196 CB ASP A 156 76.424 25.494 -17.179 1.00 25.00 C ATOM 1197 CG ASP A 156 77.837 25.918 -17.498 1.00 25.00 C ATOM 1198 OD1 ASP A 156 78.073 27.119 -17.736 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 78.740 25.051 -17.421 1.00 25.00 O1- ATOM 0 H ASP A 156 77.142 25.843 -14.785 1.00 25.00 H new ATOM 0 HA ASP A 156 75.631 27.413 -16.712 1.00 25.00 H new ATOM 0 HB2 ASP A 156 76.437 24.493 -16.749 1.00 25.00 H new ATOM 0 HB3 ASP A 156 75.849 25.436 -18.103 1.00 25.00 H new ATOM 1204 N ASN A 157 73.379 26.792 -15.805 1.00 25.00 N ATOM 1205 CA ASN A 157 72.020 26.399 -15.435 1.00 25.00 C ATOM 1206 C ASN A 157 71.341 25.654 -16.588 1.00 25.00 C ATOM 1207 O ASN A 157 70.302 25.040 -16.400 1.00 25.00 O ATOM 1208 CB ASN A 157 71.184 27.623 -15.016 1.00 25.00 C ATOM 1209 CG ASN A 157 70.848 28.528 -16.176 1.00 25.00 C ATOM 1210 OD1 ASN A 157 69.903 28.296 -16.895 1.00 25.00 O ATOM 1211 ND2 ASN A 157 71.603 29.583 -16.335 1.00 25.00 N ATOM 0 H ASN A 157 73.488 27.781 -16.031 1.00 25.00 H new ATOM 0 HA ASN A 157 72.086 25.727 -14.580 1.00 25.00 H new ATOM 0 HB2 ASN A 157 70.261 27.283 -14.547 1.00 25.00 H new ATOM 0 HB3 ASN A 157 71.732 28.192 -14.265 1.00 25.00 H new ATOM 0 HD21 ASN A 157 71.404 30.244 -17.086 1.00 25.00 H new ATOM 0 HD22 ASN A 157 72.391 29.745 -15.708 1.00 25.00 H new ATOM 1218 N HIS A 158 71.983 25.693 -17.750 1.00 25.00 N ATOM 1219 CA HIS A 158 71.498 25.041 -18.968 1.00 25.00 C ATOM 1220 C HIS A 158 72.022 23.611 -19.098 1.00 25.00 C ATOM 1221 O HIS A 158 72.314 23.137 -20.193 1.00 25.00 O ATOM 1222 CB HIS A 158 71.932 25.848 -20.195 1.00 25.00 C ATOM 1223 CG HIS A 158 71.508 27.283 -20.142 1.00 25.00 C ATOM 1224 ND1 HIS A 158 70.207 27.695 -20.029 1.00 25.00 N ATOM 1225 CD2 HIS A 158 72.241 28.428 -20.192 1.00 25.00 C ATOM 1226 CE1 HIS A 158 70.190 29.022 -20.006 1.00 25.00 C ATOM 1227 NE2 HIS A 158 71.404 29.530 -20.094 1.00 25.00 N ATOM 0 H HIS A 158 72.868 26.184 -17.878 1.00 25.00 H new ATOM 0 HA HIS A 158 70.411 24.999 -18.906 1.00 25.00 H new ATOM 0 HB2 HIS A 158 73.017 25.800 -20.287 1.00 25.00 H new ATOM 0 HB3 HIS A 158 71.516 25.386 -21.090 1.00 25.00 H new ATOM 0 HD2 HIS A 158 73.315 28.472 -20.293 1.00 25.00 H new ATOM 0 HE1 HIS A 158 69.291 29.614 -19.925 1.00 25.00 H new ATOM 0 HE2 HIS A 158 71.669 30.515 -20.091 1.00 25.00 H new ATOM 1235 N ARG A 159 72.213 22.955 -17.967 1.00 25.00 N ATOM 1236 CA ARG A 159 72.677 21.579 -17.935 1.00 25.00 C ATOM 1237 C ARG A 159 71.810 20.838 -16.950 1.00 25.00 C ATOM 1238 O ARG A 159 71.447 21.380 -15.910 1.00 25.00 O ATOM 1239 CB ARG A 159 74.139 21.503 -17.518 1.00 25.00 C ATOM 1240 CG ARG A 159 75.087 22.066 -18.562 1.00 25.00 C ATOM 1241 CD ARG A 159 76.529 21.985 -18.091 1.00 25.00 C ATOM 1242 NE ARG A 159 77.039 20.609 -18.166 1.00 25.00 N ATOM 1243 CZ ARG A 159 78.040 20.117 -17.444 1.00 25.00 C ATOM 1244 NH1 ARG A 159 78.695 20.846 -16.574 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 78.386 18.871 -17.602 1.00 25.00 N ATOM 0 H ARG A 159 72.051 23.361 -17.045 1.00 25.00 H new ATOM 0 HA ARG A 159 72.605 21.134 -18.928 1.00 25.00 H new ATOM 0 HB2 ARG A 159 74.273 22.048 -16.583 1.00 25.00 H new ATOM 0 HB3 ARG A 159 74.401 20.463 -17.321 1.00 25.00 H new ATOM 0 HG2 ARG A 159 74.974 21.514 -19.495 1.00 25.00 H new ATOM 0 HG3 ARG A 159 74.827 23.104 -18.772 1.00 25.00 H new ATOM 0 HD2 ARG A 159 77.151 22.639 -18.702 1.00 25.00 H new ATOM 0 HD3 ARG A 159 76.599 22.346 -17.065 1.00 25.00 H new ATOM 0 HE ARG A 159 76.587 19.979 -18.828 1.00 25.00 H new ATOM 0 HH11 ARG A 159 78.441 21.824 -16.434 1.00 25.00 H new ATOM 0 HH12 ARG A 159 79.459 20.435 -16.037 1.00 25.00 H new ATOM 0 HH21 ARG A 159 77.890 18.285 -18.274 1.00 25.00 H new ATOM 0 HH22 ARG A 159 79.153 18.481 -17.054 1.00 25.00 H new ATOM 1259 N SER A 160 71.492 19.598 -17.270 1.00 25.00 N ATOM 1260 CA SER A 160 70.658 18.789 -16.395 1.00 25.00 C ATOM 1261 C SER A 160 71.465 18.265 -15.216 1.00 25.00 C ATOM 1262 O SER A 160 72.703 18.244 -15.248 1.00 25.00 O ATOM 1263 CB SER A 160 70.034 17.632 -17.173 1.00 25.00 C ATOM 1264 OG SER A 160 71.024 16.797 -17.755 1.00 25.00 O ATOM 0 H SER A 160 71.795 19.129 -18.124 1.00 25.00 H new ATOM 0 HA SER A 160 69.857 19.418 -16.007 1.00 25.00 H new ATOM 0 HB2 SER A 160 69.406 17.041 -16.506 1.00 25.00 H new ATOM 0 HB3 SER A 160 69.385 18.027 -17.955 1.00 25.00 H new ATOM 0 HG SER A 160 70.604 16.195 -18.404 1.00 25.00 H new ATOM 1270 N LEU A 161 70.770 17.813 -14.187 1.00 25.00 N ATOM 1271 CA LEU A 161 71.412 17.265 -12.989 1.00 25.00 C ATOM 1272 C LEU A 161 72.298 16.059 -13.336 1.00 25.00 C ATOM 1273 O LEU A 161 73.431 15.920 -12.837 1.00 25.00 O ATOM 1274 CB LEU A 161 70.318 16.846 -11.997 1.00 25.00 C ATOM 1275 CG LEU A 161 69.537 18.011 -11.366 1.00 25.00 C ATOM 1276 CD1 LEU A 161 68.256 17.484 -10.782 1.00 25.00 C ATOM 1277 CD2 LEU A 161 70.332 18.716 -10.270 1.00 25.00 C ATOM 0 H LEU A 161 69.751 17.812 -14.151 1.00 25.00 H new ATOM 0 HA LEU A 161 72.052 18.028 -12.546 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.614 16.191 -12.510 1.00 25.00 H new ATOM 0 HB3 LEU A 161 70.775 16.260 -11.200 1.00 25.00 H new ATOM 0 HG LEU A 161 69.338 18.740 -12.151 1.00 25.00 H new ATOM 0 HD11 LEU A 161 67.696 18.304 -10.333 1.00 25.00 H new ATOM 0 HD12 LEU A 161 67.658 17.026 -11.570 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.483 16.739 -10.019 1.00 25.00 H new ATOM 0 HD21 LEU A 161 69.738 19.531 -9.856 1.00 25.00 H new ATOM 0 HD22 LEU A 161 70.573 18.005 -9.480 1.00 25.00 H new ATOM 0 HD23 LEU A 161 71.254 19.117 -10.690 1.00 25.00 H new ATOM 1289 N ALA A 162 71.818 15.222 -14.246 1.00 25.00 N ATOM 1290 CA ALA A 162 72.577 14.065 -14.722 1.00 25.00 C ATOM 1291 C ALA A 162 73.901 14.480 -15.369 1.00 25.00 C ATOM 1292 O ALA A 162 74.878 13.739 -15.300 1.00 25.00 O ATOM 1293 CB ALA A 162 71.731 13.268 -15.722 1.00 25.00 C ATOM 0 H ALA A 162 70.898 15.321 -14.675 1.00 25.00 H new ATOM 0 HA ALA A 162 72.814 13.442 -13.860 1.00 25.00 H new ATOM 0 HB1 ALA A 162 72.299 12.407 -16.074 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.818 12.925 -15.235 1.00 25.00 H new ATOM 0 HB3 ALA A 162 71.473 13.904 -16.569 1.00 25.00 H new ATOM 1299 N SER A 163 73.952 15.662 -15.966 1.00 25.00 N ATOM 1300 CA SER A 163 75.175 16.140 -16.608 1.00 25.00 C ATOM 1301 C SER A 163 76.236 16.541 -15.584 1.00 25.00 C ATOM 1302 O SER A 163 77.422 16.616 -15.905 1.00 25.00 O ATOM 1303 CB SER A 163 74.871 17.339 -17.510 1.00 25.00 C ATOM 1304 OG SER A 163 73.941 16.999 -18.524 1.00 25.00 O ATOM 0 H SER A 163 73.165 16.308 -16.021 1.00 25.00 H new ATOM 0 HA SER A 163 75.566 15.316 -17.205 1.00 25.00 H new ATOM 0 HB2 SER A 163 74.474 18.157 -16.909 1.00 25.00 H new ATOM 0 HB3 SER A 163 75.794 17.697 -17.966 1.00 25.00 H new ATOM 0 HG SER A 163 73.039 16.966 -18.143 1.00 25.00 H new ATOM 1310 N TYR A 164 75.824 16.773 -14.344 1.00 25.00 N ATOM 1311 CA TYR A 164 76.764 17.094 -13.272 1.00 25.00 C ATOM 1312 C TYR A 164 77.032 15.836 -12.450 1.00 25.00 C ATOM 1313 O TYR A 164 77.893 15.826 -11.579 1.00 25.00 O ATOM 1314 CB TYR A 164 76.184 18.181 -12.369 1.00 25.00 C ATOM 1315 CG TYR A 164 76.254 19.574 -12.945 1.00 25.00 C ATOM 1316 CD1 TYR A 164 77.455 20.311 -12.895 1.00 25.00 C ATOM 1317 CD2 TYR A 164 75.120 20.182 -13.518 1.00 25.00 C ATOM 1318 CE1 TYR A 164 77.520 21.636 -13.401 1.00 25.00 C ATOM 1319 CE2 TYR A 164 75.180 21.511 -14.019 1.00 25.00 C ATOM 1320 CZ TYR A 164 76.376 22.228 -13.950 1.00 25.00 C ATOM 1321 OH TYR A 164 76.434 23.509 -14.412 1.00 25.00 O ATOM 0 H TYR A 164 74.847 16.745 -14.054 1.00 25.00 H new ATOM 0 HA TYR A 164 77.694 17.459 -13.707 1.00 25.00 H new ATOM 0 HB2 TYR A 164 75.142 17.941 -12.156 1.00 25.00 H new ATOM 0 HB3 TYR A 164 76.715 18.167 -11.417 1.00 25.00 H new ATOM 0 HD1 TYR A 164 78.338 19.861 -12.466 1.00 25.00 H new ATOM 0 HD2 TYR A 164 74.193 19.631 -13.578 1.00 25.00 H new ATOM 0 HE1 TYR A 164 78.449 22.186 -13.363 1.00 25.00 H new ATOM 0 HE2 TYR A 164 74.301 21.966 -14.453 1.00 25.00 H new ATOM 0 HH TYR A 164 75.566 23.760 -14.791 1.00 25.00 H new ATOM 1331 N GLY A 165 76.292 14.776 -12.749 1.00 25.00 N ATOM 1332 CA GLY A 165 76.447 13.524 -12.030 1.00 25.00 C ATOM 1333 C GLY A 165 75.645 13.444 -10.748 1.00 25.00 C ATOM 1334 O GLY A 165 75.946 12.621 -9.891 1.00 25.00 O ATOM 0 H GLY A 165 75.582 14.761 -13.482 1.00 25.00 H new ATOM 0 HA2 GLY A 165 76.151 12.703 -12.683 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.502 13.380 -11.796 1.00 25.00 H new ATOM 1338 N LEU A 166 74.610 14.266 -10.612 1.00 25.00 N ATOM 1339 CA LEU A 166 73.787 14.225 -9.404 1.00 25.00 C ATOM 1340 C LEU A 166 72.984 12.937 -9.351 1.00 25.00 C ATOM 1341 O LEU A 166 71.879 12.851 -9.877 1.00 25.00 O ATOM 1342 CB LEU A 166 72.829 15.420 -9.337 1.00 25.00 C ATOM 1343 CG LEU A 166 73.271 16.711 -8.629 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.589 16.449 -7.178 1.00 25.00 C ATOM 1345 CD2 LEU A 166 74.445 17.371 -9.313 1.00 25.00 C ATOM 0 H LEU A 166 74.323 14.956 -11.306 1.00 25.00 H new ATOM 0 HA LEU A 166 74.462 14.271 -8.550 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.565 15.684 -10.361 1.00 25.00 H new ATOM 0 HB3 LEU A 166 71.915 15.078 -8.851 1.00 25.00 H new ATOM 0 HG LEU A 166 72.431 17.403 -8.687 1.00 25.00 H new ATOM 0 HD11 LEU A 166 73.899 17.378 -6.700 1.00 25.00 H new ATOM 0 HD12 LEU A 166 72.703 16.061 -6.676 1.00 25.00 H new ATOM 0 HD13 LEU A 166 74.395 15.719 -7.108 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.717 18.278 -8.774 1.00 25.00 H new ATOM 0 HD22 LEU A 166 75.293 16.686 -9.322 1.00 25.00 H new ATOM 0 HD23 LEU A 166 74.173 17.626 -10.337 1.00 25.00 H new ATOM 1357 N LYS A 167 73.564 11.920 -8.745 1.00 25.00 N ATOM 1358 CA LYS A 167 72.874 10.644 -8.521 1.00 25.00 C ATOM 1359 C LYS A 167 71.960 10.723 -7.302 1.00 25.00 C ATOM 1360 O LYS A 167 72.112 11.583 -6.452 1.00 25.00 O ATOM 1361 CB LYS A 167 73.879 9.502 -8.310 1.00 25.00 C ATOM 1362 CG LYS A 167 74.902 9.342 -9.441 1.00 25.00 C ATOM 1363 CD LYS A 167 74.243 9.225 -10.820 1.00 25.00 C ATOM 1364 CE LYS A 167 75.286 9.111 -11.906 1.00 25.00 C ATOM 1365 NZ LYS A 167 74.617 9.184 -13.242 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.521 11.944 -8.392 1.00 25.00 H new ATOM 0 HA LYS A 167 72.278 10.442 -9.411 1.00 25.00 H new ATOM 0 HB2 LYS A 167 74.413 9.672 -7.375 1.00 25.00 H new ATOM 0 HB3 LYS A 167 73.330 8.567 -8.198 1.00 25.00 H new ATOM 0 HG2 LYS A 167 75.579 10.196 -9.437 1.00 25.00 H new ATOM 0 HG3 LYS A 167 75.508 8.455 -9.255 1.00 25.00 H new ATOM 0 HD2 LYS A 167 73.591 8.352 -10.843 1.00 25.00 H new ATOM 0 HD3 LYS A 167 73.615 10.097 -11.003 1.00 25.00 H new ATOM 0 HE2 LYS A 167 76.018 9.912 -11.809 1.00 25.00 H new ATOM 0 HE3 LYS A 167 75.828 8.170 -11.809 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 75.332 9.106 -13.993 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 73.934 8.405 -13.331 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 74.119 10.092 -13.332 1.00 25.00 H new ATOM 1379 N ASP A 168 71.025 9.785 -7.216 1.00 25.00 N ATOM 1380 CA ASP A 168 70.113 9.708 -6.079 1.00 25.00 C ATOM 1381 C ASP A 168 70.905 9.637 -4.778 1.00 25.00 C ATOM 1382 O ASP A 168 71.850 8.846 -4.652 1.00 25.00 O ATOM 1383 CB ASP A 168 69.220 8.473 -6.222 1.00 25.00 C ATOM 1384 CG ASP A 168 68.014 8.508 -5.306 1.00 25.00 C ATOM 1385 OD1 ASP A 168 68.171 8.495 -4.076 1.00 25.00 O ATOM 1386 OD2 ASP A 168 66.891 8.530 -5.844 1.00 25.00 O1- ATOM 0 H ASP A 168 70.877 9.064 -7.922 1.00 25.00 H new ATOM 0 HA ASP A 168 69.488 10.601 -6.058 1.00 25.00 H new ATOM 0 HB2 ASP A 168 68.883 8.392 -7.255 1.00 25.00 H new ATOM 0 HB3 ASP A 168 69.807 7.580 -6.008 1.00 25.00 H new ATOM 1391 N GLY A 169 70.552 10.506 -3.838 1.00 25.00 N ATOM 1392 CA GLY A 169 71.230 10.558 -2.555 1.00 25.00 C ATOM 1393 C GLY A 169 72.320 11.609 -2.464 1.00 25.00 C ATOM 1394 O GLY A 169 72.816 11.871 -1.365 1.00 25.00 O ATOM 0 H GLY A 169 69.798 11.184 -3.944 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.492 10.749 -1.776 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.666 9.581 -2.349 1.00 25.00 H new ATOM 1398 N ASP A 170 72.697 12.227 -3.578 1.00 25.00 N ATOM 1399 CA ASP A 170 73.719 13.276 -3.544 1.00 25.00 C ATOM 1400 C ASP A 170 73.213 14.509 -2.797 1.00 25.00 C ATOM 1401 O ASP A 170 71.995 14.770 -2.723 1.00 25.00 O ATOM 1402 CB ASP A 170 74.152 13.696 -4.950 1.00 25.00 C ATOM 1403 CG ASP A 170 75.375 12.935 -5.440 1.00 25.00 C ATOM 1404 OD1 ASP A 170 76.353 12.832 -4.663 1.00 25.00 O ATOM 1405 OD2 ASP A 170 75.400 12.514 -6.616 1.00 25.00 O1- ATOM 0 H ASP A 170 72.319 12.027 -4.504 1.00 25.00 H new ATOM 0 HA ASP A 170 74.578 12.855 -3.022 1.00 25.00 H new ATOM 0 HB2 ASP A 170 73.327 13.534 -5.643 1.00 25.00 H new ATOM 0 HB3 ASP A 170 74.368 14.764 -4.955 1.00 25.00 H new ATOM 1410 N VAL A 171 74.152 15.266 -2.238 1.00 25.00 N ATOM 1411 CA VAL A 171 73.838 16.447 -1.434 1.00 25.00 C ATOM 1412 C VAL A 171 74.331 17.723 -2.123 1.00 25.00 C ATOM 1413 O VAL A 171 75.488 17.816 -2.548 1.00 25.00 O ATOM 1414 CB VAL A 171 74.478 16.347 -0.010 1.00 25.00 C ATOM 1415 CG1 VAL A 171 74.039 17.539 0.879 1.00 25.00 C ATOM 1416 CG2 VAL A 171 74.064 15.024 0.661 1.00 25.00 C ATOM 0 H VAL A 171 75.151 15.080 -2.328 1.00 25.00 H new ATOM 0 HA VAL A 171 72.754 16.491 -1.332 1.00 25.00 H new ATOM 0 HB VAL A 171 75.562 16.377 -0.121 1.00 25.00 H new ATOM 0 HG11 VAL A 171 74.497 17.447 1.864 1.00 25.00 H new ATOM 0 HG12 VAL A 171 74.357 18.474 0.417 1.00 25.00 H new ATOM 0 HG13 VAL A 171 72.954 17.536 0.982 1.00 25.00 H new ATOM 0 HG21 VAL A 171 74.514 14.962 1.652 1.00 25.00 H new ATOM 0 HG22 VAL A 171 72.978 14.986 0.752 1.00 25.00 H new ATOM 0 HG23 VAL A 171 74.406 14.186 0.054 1.00 25.00 H new ATOM 1426 N VAL A 172 73.446 18.706 -2.216 1.00 25.00 N ATOM 1427 CA VAL A 172 73.753 20.002 -2.821 1.00 25.00 C ATOM 1428 C VAL A 172 73.729 21.043 -1.707 1.00 25.00 C ATOM 1429 O VAL A 172 72.867 20.999 -0.841 1.00 25.00 O ATOM 1430 CB VAL A 172 72.696 20.362 -3.907 1.00 25.00 C ATOM 1431 CG1 VAL A 172 73.089 21.644 -4.637 1.00 25.00 C ATOM 1432 CG2 VAL A 172 72.550 19.218 -4.917 1.00 25.00 C ATOM 0 H VAL A 172 72.488 18.630 -1.873 1.00 25.00 H new ATOM 0 HA VAL A 172 74.730 19.972 -3.304 1.00 25.00 H new ATOM 0 HB VAL A 172 71.740 20.518 -3.407 1.00 25.00 H new ATOM 0 HG11 VAL A 172 72.338 21.878 -5.391 1.00 25.00 H new ATOM 0 HG12 VAL A 172 73.153 22.464 -3.922 1.00 25.00 H new ATOM 0 HG13 VAL A 172 74.057 21.506 -5.119 1.00 25.00 H new ATOM 0 HG21 VAL A 172 71.807 19.488 -5.668 1.00 25.00 H new ATOM 0 HG22 VAL A 172 73.509 19.038 -5.403 1.00 25.00 H new ATOM 0 HG23 VAL A 172 72.230 18.314 -4.399 1.00 25.00 H new ATOM 1442 N ILE A 173 74.681 21.963 -1.700 1.00 25.00 N ATOM 1443 CA ILE A 173 74.786 22.973 -0.647 1.00 25.00 C ATOM 1444 C ILE A 173 74.542 24.349 -1.258 1.00 25.00 C ATOM 1445 O ILE A 173 75.137 24.691 -2.267 1.00 25.00 O ATOM 1446 CB ILE A 173 76.198 22.947 0.023 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.531 21.523 0.527 1.00 25.00 C ATOM 1448 CG2 ILE A 173 76.264 23.955 1.212 1.00 25.00 C ATOM 1449 CD1 ILE A 173 77.454 20.711 -0.411 1.00 25.00 C ATOM 0 H ILE A 173 75.402 22.035 -2.418 1.00 25.00 H new ATOM 0 HA ILE A 173 74.042 22.757 0.120 1.00 25.00 H new ATOM 0 HB ILE A 173 76.933 23.240 -0.727 1.00 25.00 H new ATOM 0 HG12 ILE A 173 77.005 21.599 1.506 1.00 25.00 H new ATOM 0 HG13 ILE A 173 75.600 20.973 0.665 1.00 25.00 H new ATOM 0 HG21 ILE A 173 77.255 23.920 1.664 1.00 25.00 H new ATOM 0 HG22 ILE A 173 76.067 24.963 0.846 1.00 25.00 H new ATOM 0 HG23 ILE A 173 75.516 23.687 1.958 1.00 25.00 H new ATOM 0 HD11 ILE A 173 77.635 19.726 0.020 1.00 25.00 H new ATOM 0 HD12 ILE A 173 76.976 20.599 -1.384 1.00 25.00 H new ATOM 0 HD13 ILE A 173 78.402 21.235 -0.531 1.00 25.00 H new ATOM 1461 N LEU A 174 73.681 25.146 -0.646 1.00 25.00 N ATOM 1462 CA LEU A 174 73.375 26.495 -1.128 1.00 25.00 C ATOM 1463 C LEU A 174 73.713 27.494 -0.028 1.00 25.00 C ATOM 1464 O LEU A 174 73.438 27.254 1.142 1.00 25.00 O ATOM 1465 CB LEU A 174 71.890 26.566 -1.510 1.00 25.00 C ATOM 1466 CG LEU A 174 71.420 27.919 -2.074 1.00 25.00 C ATOM 1467 CD1 LEU A 174 70.449 27.722 -3.227 1.00 25.00 C ATOM 1468 CD2 LEU A 174 70.743 28.741 -0.985 1.00 25.00 C ATOM 0 H LEU A 174 73.172 24.882 0.198 1.00 25.00 H new ATOM 0 HA LEU A 174 73.966 26.736 -2.011 1.00 25.00 H new ATOM 0 HB2 LEU A 174 71.685 25.792 -2.249 1.00 25.00 H new ATOM 0 HB3 LEU A 174 71.293 26.331 -0.628 1.00 25.00 H new ATOM 0 HG LEU A 174 72.300 28.449 -2.439 1.00 25.00 H new ATOM 0 HD11 LEU A 174 70.133 28.694 -3.607 1.00 25.00 H new ATOM 0 HD12 LEU A 174 70.939 27.163 -4.024 1.00 25.00 H new ATOM 0 HD13 LEU A 174 69.578 27.168 -2.878 1.00 25.00 H new ATOM 0 HD21 LEU A 174 70.416 29.695 -1.399 1.00 25.00 H new ATOM 0 HD22 LEU A 174 69.880 28.197 -0.602 1.00 25.00 H new ATOM 0 HD23 LEU A 174 71.448 28.920 -0.173 1.00 25.00 H new ATOM 1480 N ARG A 175 74.327 28.612 -0.394 1.00 25.00 N ATOM 1481 CA ARG A 175 74.691 29.655 0.576 1.00 25.00 C ATOM 1482 C ARG A 175 74.071 30.980 0.188 1.00 25.00 C ATOM 1483 O ARG A 175 74.300 31.481 -0.905 1.00 25.00 O ATOM 1484 CB ARG A 175 76.210 29.833 0.629 1.00 25.00 C ATOM 1485 CG ARG A 175 76.944 28.663 1.241 1.00 25.00 C ATOM 1486 CD ARG A 175 78.421 28.992 1.309 1.00 25.00 C ATOM 1487 NE ARG A 175 79.187 27.941 1.998 1.00 25.00 N ATOM 1488 CZ ARG A 175 80.496 27.968 2.212 1.00 25.00 C ATOM 1489 NH1 ARG A 175 81.250 28.961 1.815 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 81.059 26.981 2.847 1.00 25.00 N ATOM 0 H ARG A 175 74.587 28.827 -1.357 1.00 25.00 H new ATOM 0 HA ARG A 175 74.320 29.342 1.552 1.00 25.00 H new ATOM 0 HB2 ARG A 175 76.582 29.993 -0.383 1.00 25.00 H new ATOM 0 HB3 ARG A 175 76.441 30.732 1.200 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.558 28.456 2.239 1.00 25.00 H new ATOM 0 HG3 ARG A 175 76.785 27.765 0.645 1.00 25.00 H new ATOM 0 HD2 ARG A 175 78.811 29.122 0.299 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.558 29.940 1.828 1.00 25.00 H new ATOM 0 HE ARG A 175 78.671 27.129 2.337 1.00 25.00 H new ATOM 0 HH11 ARG A 175 80.835 29.751 1.322 1.00 25.00 H new ATOM 0 HH12 ARG A 175 82.253 28.945 1.999 1.00 25.00 H new ATOM 0 HH21 ARG A 175 80.494 26.197 3.175 1.00 25.00 H new ATOM 0 HH22 ARG A 175 82.065 26.991 3.017 1.00 25.00 H new ATOM 1504 N GLN A 176 73.302 31.559 1.118 1.00 25.00 N ATOM 1505 CA GLN A 176 72.648 32.869 0.938 1.00 25.00 C ATOM 1506 C GLN A 176 73.165 33.878 1.968 1.00 25.00 C ATOM 1507 O GLN A 176 73.397 33.613 3.136 1.00 25.00 O ATOM 1508 CB GLN A 176 71.111 32.708 0.998 1.00 25.00 C ATOM 1509 CG GLN A 176 70.360 33.946 0.447 1.00 25.00 C ATOM 1510 CD GLN A 176 69.864 34.861 1.536 1.00 25.00 C ATOM 1511 OE1 GLN A 176 70.448 35.066 2.577 1.00 25.00 O ATOM 1512 NE2 GLN A 176 68.697 35.420 1.317 1.00 25.00 N ATOM 1513 OXT GLN A 176 73.420 34.954 1.502 1.00 25.00 O ATOM 0 H GLN A 176 73.112 31.132 2.025 1.00 25.00 H new ATOM 0 HA GLN A 176 72.900 33.263 -0.047 1.00 25.00 H new ATOM 0 HB2 GLN A 176 70.819 31.827 0.427 1.00 25.00 H new ATOM 0 HB3 GLN A 176 70.808 32.533 2.030 1.00 25.00 H new ATOM 0 HG2 GLN A 176 71.023 34.503 -0.215 1.00 25.00 H new ATOM 0 HG3 GLN A 176 69.514 33.614 -0.155 1.00 25.00 H new ATOM 0 HE21 GLN A 176 68.205 35.247 0.440 1.00 25.00 H new ATOM 0 HE22 GLN A 176 68.282 36.027 2.024 1.00 25.00 H new