USER MOD reduce.3.24.130724 H: found=0, std=0, add=699, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 699 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 133 ASN : amide:sc= -4.76! C(o=-5.9!,f=-0.83!) USER MOD Set 1.2: A 148 THR OG1 : rot -122:sc= -1.18! USER MOD Set 2.1: A 98 HIS : no HD1:sc= -0.365 K(o=0.52,f=-0.77) USER MOD Set 2.2: A 119 THR OG1 : rot 108:sc= 0.889 USER MOD Set 3.1: A 78 SER OG : rot -152:sc= -0.136 USER MOD Set 3.2: A 82 HIS : no HD1:sc= -2.71! C(o=-2.8!,f=-3.4!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -0.958 K(o=-0.96,f=-7!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 77 THR OG1 : rot -150:sc= 0 USER MOD Single : A 85 SER OG : rot 166:sc= 0.894 USER MOD Single : A 93 THR OG1 : rot 5:sc= -0.701 USER MOD Single : A 95 SER OG : rot 180:sc= -0.343 USER MOD Single : A 105 ASN : amide:sc= -0.0642 K(o=-0.064,f=-2!) USER MOD Single : A 106 ASN : amide:sc= -0.546 X(o=-0.55,f=-0.8) USER MOD Single : A 109 ASN : amide:sc= -0.666 K(o=-0.67,f=-4.8!) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 ASN : amide:sc= -0.0868 K(o=-0.087,f=-2.1!) USER MOD Single : A 128 SER OG : rot 46:sc= 0.0715 USER MOD Single : A 138 GLN : amide:sc= -7.32! C(o=-7.3!,f=-5.2!) USER MOD Single : A 141 LYS NZ :NH3+ 159:sc= -0.0609 (180deg=-0.523) USER MOD ----------------------------------------------------------------- ATOM 416 N GLY A 54 -13.829 -7.601 -4.442 1.00 0.00 N ATOM 417 CA GLY A 54 -13.049 -6.329 -4.467 1.00 0.00 C ATOM 418 C GLY A 54 -11.787 -6.457 -3.611 1.00 0.00 C ATOM 419 O GLY A 54 -11.749 -6.020 -2.478 1.00 0.00 O ATOM 0 HA2 GLY A 54 -12.776 -6.083 -5.493 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -13.666 -5.510 -4.096 1.00 0.00 H new ATOM 423 N LEU A 55 -10.749 -7.042 -4.154 1.00 0.00 N ATOM 424 CA LEU A 55 -9.463 -7.202 -3.398 1.00 0.00 C ATOM 425 C LEU A 55 -8.358 -6.414 -4.098 1.00 0.00 C ATOM 426 O LEU A 55 -8.453 -6.069 -5.258 1.00 0.00 O ATOM 427 CB LEU A 55 -9.078 -8.697 -3.330 1.00 0.00 C ATOM 428 CG LEU A 55 -9.635 -9.335 -2.047 1.00 0.00 C ATOM 429 CD1 LEU A 55 -11.132 -9.026 -1.901 1.00 0.00 C ATOM 430 CD2 LEU A 55 -9.421 -10.852 -2.111 1.00 0.00 C ATOM 0 H LEU A 55 -10.735 -7.421 -5.101 1.00 0.00 H new ATOM 0 HA LEU A 55 -9.591 -6.821 -2.385 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.468 -9.220 -4.203 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -7.993 -8.801 -3.355 1.00 0.00 H new ATOM 0 HG LEU A 55 -9.112 -8.923 -1.184 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -11.511 -9.485 -0.988 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -11.278 -7.947 -1.852 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -11.672 -9.427 -2.759 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -9.813 -11.313 -1.205 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -9.942 -11.257 -2.979 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -8.356 -11.066 -2.195 1.00 0.00 H new ATOM 442 N ALA A 56 -7.306 -6.133 -3.381 1.00 0.00 N ATOM 443 CA ALA A 56 -6.162 -5.379 -3.959 1.00 0.00 C ATOM 444 C ALA A 56 -4.869 -6.059 -3.523 1.00 0.00 C ATOM 445 O ALA A 56 -4.828 -6.736 -2.512 1.00 0.00 O ATOM 446 CB ALA A 56 -6.177 -3.942 -3.442 1.00 0.00 C ATOM 0 H ALA A 56 -7.190 -6.399 -2.403 1.00 0.00 H new ATOM 0 HA ALA A 56 -6.236 -5.366 -5.046 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -5.337 -3.393 -3.868 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -7.110 -3.460 -3.733 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.094 -3.945 -2.355 1.00 0.00 H new ATOM 452 N LEU A 57 -3.812 -5.897 -4.281 1.00 0.00 N ATOM 453 CA LEU A 57 -2.511 -6.542 -3.923 1.00 0.00 C ATOM 454 C LEU A 57 -1.395 -5.498 -3.954 1.00 0.00 C ATOM 455 O LEU A 57 -1.461 -4.512 -4.670 1.00 0.00 O ATOM 456 CB LEU A 57 -2.191 -7.658 -4.929 1.00 0.00 C ATOM 457 CG LEU A 57 -3.265 -8.773 -4.856 1.00 0.00 C ATOM 458 CD1 LEU A 57 -4.380 -8.502 -5.877 1.00 0.00 C ATOM 459 CD2 LEU A 57 -2.627 -10.136 -5.169 1.00 0.00 C ATOM 0 H LEU A 57 -3.795 -5.343 -5.137 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.586 -6.967 -2.922 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.152 -7.247 -5.938 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.207 -8.077 -4.717 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.685 -8.783 -3.850 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.129 -9.292 -5.816 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.847 -7.542 -5.659 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.956 -8.480 -6.881 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -3.388 -10.915 -5.116 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -2.198 -10.116 -6.171 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.842 -10.346 -4.443 1.00 0.00 H new ATOM 471 N LEU A 58 -0.367 -5.720 -3.174 1.00 0.00 N ATOM 472 CA LEU A 58 0.788 -4.770 -3.123 1.00 0.00 C ATOM 473 C LEU A 58 2.019 -5.477 -3.690 1.00 0.00 C ATOM 474 O LEU A 58 2.290 -6.614 -3.364 1.00 0.00 O ATOM 475 CB LEU A 58 1.050 -4.367 -1.663 1.00 0.00 C ATOM 476 CG LEU A 58 0.024 -3.306 -1.207 1.00 0.00 C ATOM 477 CD1 LEU A 58 -0.145 -3.367 0.316 1.00 0.00 C ATOM 478 CD2 LEU A 58 0.517 -1.901 -1.586 1.00 0.00 C ATOM 0 H LEU A 58 -0.277 -6.531 -2.561 1.00 0.00 H new ATOM 0 HA LEU A 58 0.570 -3.876 -3.706 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.986 -5.244 -1.019 1.00 0.00 H new ATOM 0 HB3 LEU A 58 2.061 -3.972 -1.564 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.928 -3.510 -1.698 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -0.870 -2.617 0.632 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -0.499 -4.357 0.603 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.813 -3.171 0.797 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.213 -1.159 -1.261 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.473 -1.707 -1.099 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.641 -1.838 -2.667 1.00 0.00 H new ATOM 490 N VAL A 59 2.757 -4.811 -4.545 1.00 0.00 N ATOM 491 CA VAL A 59 3.975 -5.429 -5.163 1.00 0.00 C ATOM 492 C VAL A 59 5.202 -4.581 -4.815 1.00 0.00 C ATOM 493 O VAL A 59 5.176 -3.368 -4.891 1.00 0.00 O ATOM 494 CB VAL A 59 3.793 -5.489 -6.687 1.00 0.00 C ATOM 495 CG1 VAL A 59 5.124 -5.837 -7.366 1.00 0.00 C ATOM 496 CG2 VAL A 59 2.758 -6.567 -7.024 1.00 0.00 C ATOM 0 H VAL A 59 2.566 -3.855 -4.845 1.00 0.00 H new ATOM 0 HA VAL A 59 4.116 -6.439 -4.779 1.00 0.00 H new ATOM 0 HB VAL A 59 3.455 -4.517 -7.046 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.982 -5.877 -8.446 1.00 0.00 H new ATOM 0 HG12 VAL A 59 5.865 -5.075 -7.125 1.00 0.00 H new ATOM 0 HG13 VAL A 59 5.471 -6.807 -7.010 1.00 0.00 H new ATOM 0 HG21 VAL A 59 2.623 -6.616 -8.104 1.00 0.00 H new ATOM 0 HG22 VAL A 59 3.106 -7.533 -6.657 1.00 0.00 H new ATOM 0 HG23 VAL A 59 1.808 -6.320 -6.550 1.00 0.00 H new ATOM 506 N VAL A 60 6.271 -5.218 -4.425 1.00 0.00 N ATOM 507 CA VAL A 60 7.503 -4.468 -4.059 1.00 0.00 C ATOM 508 C VAL A 60 8.147 -3.890 -5.321 1.00 0.00 C ATOM 509 O VAL A 60 8.670 -4.607 -6.150 1.00 0.00 O ATOM 510 CB VAL A 60 8.475 -5.431 -3.378 1.00 0.00 C ATOM 511 CG1 VAL A 60 9.629 -4.649 -2.751 1.00 0.00 C ATOM 512 CG2 VAL A 60 7.726 -6.204 -2.288 1.00 0.00 C ATOM 0 H VAL A 60 6.344 -6.232 -4.344 1.00 0.00 H new ATOM 0 HA VAL A 60 7.255 -3.650 -3.383 1.00 0.00 H new ATOM 0 HB VAL A 60 8.878 -6.125 -4.115 1.00 0.00 H new ATOM 0 HG11 VAL A 60 10.318 -5.342 -2.267 1.00 0.00 H new ATOM 0 HG12 VAL A 60 10.157 -4.095 -3.527 1.00 0.00 H new ATOM 0 HG13 VAL A 60 9.236 -3.952 -2.011 1.00 0.00 H new ATOM 0 HG21 VAL A 60 8.411 -6.894 -1.796 1.00 0.00 H new ATOM 0 HG22 VAL A 60 7.327 -5.504 -1.554 1.00 0.00 H new ATOM 0 HG23 VAL A 60 6.906 -6.765 -2.737 1.00 0.00 H new ATOM 522 N LYS A 61 8.114 -2.594 -5.469 1.00 0.00 N ATOM 523 CA LYS A 61 8.722 -1.963 -6.673 1.00 0.00 C ATOM 524 C LYS A 61 10.233 -2.203 -6.673 1.00 0.00 C ATOM 525 O LYS A 61 10.816 -2.549 -7.682 1.00 0.00 O ATOM 526 CB LYS A 61 8.442 -0.458 -6.650 1.00 0.00 C ATOM 527 CG LYS A 61 8.714 0.138 -8.033 1.00 0.00 C ATOM 528 CD LYS A 61 8.328 1.617 -8.030 1.00 0.00 C ATOM 529 CE LYS A 61 8.581 2.220 -9.413 1.00 0.00 C ATOM 530 NZ LYS A 61 8.181 3.656 -9.405 1.00 0.00 N ATOM 0 H LYS A 61 7.691 -1.944 -4.806 1.00 0.00 H new ATOM 0 HA LYS A 61 8.289 -2.402 -7.572 1.00 0.00 H new ATOM 0 HB2 LYS A 61 7.407 -0.275 -6.362 1.00 0.00 H new ATOM 0 HB3 LYS A 61 9.071 0.027 -5.904 1.00 0.00 H new ATOM 0 HG2 LYS A 61 9.767 0.026 -8.289 1.00 0.00 H new ATOM 0 HG3 LYS A 61 8.143 -0.397 -8.791 1.00 0.00 H new ATOM 0 HD2 LYS A 61 7.277 1.728 -7.761 1.00 0.00 H new ATOM 0 HD3 LYS A 61 8.908 2.152 -7.278 1.00 0.00 H new ATOM 0 HE2 LYS A 61 9.634 2.126 -9.676 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.014 1.677 -10.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 8.352 4.069 -10.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 7.171 3.734 -9.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 8.741 4.168 -8.694 1.00 0.00 H new ATOM 544 N ARG A 62 10.873 -2.017 -5.546 1.00 0.00 N ATOM 545 CA ARG A 62 12.353 -2.227 -5.467 1.00 0.00 C ATOM 546 C ARG A 62 12.717 -2.871 -4.127 1.00 0.00 C ATOM 547 O ARG A 62 12.078 -2.637 -3.121 1.00 0.00 O ATOM 548 CB ARG A 62 13.065 -0.878 -5.584 1.00 0.00 C ATOM 549 CG ARG A 62 12.929 -0.348 -7.011 1.00 0.00 C ATOM 550 CD ARG A 62 13.617 1.013 -7.115 1.00 0.00 C ATOM 551 NE ARG A 62 13.499 1.521 -8.512 1.00 0.00 N ATOM 552 CZ ARG A 62 14.407 1.221 -9.406 1.00 0.00 C ATOM 553 NH1 ARG A 62 15.416 0.452 -9.091 1.00 0.00 N ATOM 554 NH2 ARG A 62 14.299 1.684 -10.620 1.00 0.00 N ATOM 0 H ARG A 62 10.433 -1.727 -4.673 1.00 0.00 H new ATOM 0 HA ARG A 62 12.664 -2.882 -6.280 1.00 0.00 H new ATOM 0 HB2 ARG A 62 12.636 -0.166 -4.879 1.00 0.00 H new ATOM 0 HB3 ARG A 62 14.118 -0.988 -5.325 1.00 0.00 H new ATOM 0 HG2 ARG A 62 13.377 -1.049 -7.715 1.00 0.00 H new ATOM 0 HG3 ARG A 62 11.876 -0.257 -7.278 1.00 0.00 H new ATOM 0 HD2 ARG A 62 13.161 1.718 -6.420 1.00 0.00 H new ATOM 0 HD3 ARG A 62 14.667 0.925 -6.836 1.00 0.00 H new ATOM 0 HE ARG A 62 12.705 2.106 -8.773 1.00 0.00 H new ATOM 0 HH11 ARG A 62 15.499 0.082 -8.144 1.00 0.00 H new ATOM 0 HH12 ARG A 62 16.120 0.222 -9.792 1.00 0.00 H new ATOM 0 HH21 ARG A 62 13.509 2.278 -10.871 1.00 0.00 H new ATOM 0 HH22 ARG A 62 15.005 1.452 -11.319 1.00 0.00 H new ATOM 568 N GLY A 63 13.749 -3.674 -4.106 1.00 0.00 N ATOM 569 CA GLY A 63 14.170 -4.327 -2.831 1.00 0.00 C ATOM 570 C GLY A 63 14.874 -5.650 -3.149 1.00 0.00 C ATOM 571 O GLY A 63 14.993 -6.034 -4.295 1.00 0.00 O ATOM 0 H GLY A 63 14.320 -3.906 -4.919 1.00 0.00 H new ATOM 0 HA2 GLY A 63 14.839 -3.670 -2.276 1.00 0.00 H new ATOM 0 HA3 GLY A 63 13.302 -4.507 -2.197 1.00 0.00 H new ATOM 575 N PRO A 64 15.337 -6.350 -2.142 1.00 0.00 N ATOM 576 CA PRO A 64 16.038 -7.657 -2.332 1.00 0.00 C ATOM 577 C PRO A 64 15.183 -8.641 -3.139 1.00 0.00 C ATOM 578 O PRO A 64 15.677 -9.352 -3.991 1.00 0.00 O ATOM 579 CB PRO A 64 16.257 -8.171 -0.896 1.00 0.00 C ATOM 580 CG PRO A 64 16.219 -6.948 -0.037 1.00 0.00 C ATOM 581 CD PRO A 64 15.246 -5.984 -0.719 1.00 0.00 C ATOM 0 HA PRO A 64 16.967 -7.551 -2.892 1.00 0.00 H new ATOM 0 HB2 PRO A 64 15.481 -8.880 -0.608 1.00 0.00 H new ATOM 0 HB3 PRO A 64 17.212 -8.689 -0.803 1.00 0.00 H new ATOM 0 HG2 PRO A 64 15.885 -7.190 0.972 1.00 0.00 H new ATOM 0 HG3 PRO A 64 17.210 -6.503 0.053 1.00 0.00 H new ATOM 0 HD2 PRO A 64 14.231 -6.102 -0.339 1.00 0.00 H new ATOM 0 HD3 PRO A 64 15.529 -4.945 -0.553 1.00 0.00 H new ATOM 589 N ASN A 65 13.900 -8.672 -2.873 1.00 0.00 N ATOM 590 CA ASN A 65 12.979 -9.591 -3.614 1.00 0.00 C ATOM 591 C ASN A 65 12.011 -8.753 -4.447 1.00 0.00 C ATOM 592 O ASN A 65 10.814 -8.964 -4.430 1.00 0.00 O ATOM 593 CB ASN A 65 12.193 -10.441 -2.612 1.00 0.00 C ATOM 594 CG ASN A 65 11.285 -9.539 -1.775 1.00 0.00 C ATOM 595 OD1 ASN A 65 11.401 -8.331 -1.821 1.00 0.00 O ATOM 596 ND2 ASN A 65 10.378 -10.078 -1.007 1.00 0.00 N ATOM 0 H ASN A 65 13.446 -8.093 -2.166 1.00 0.00 H new ATOM 0 HA ASN A 65 13.554 -10.247 -4.267 1.00 0.00 H new ATOM 0 HB2 ASN A 65 11.597 -11.185 -3.140 1.00 0.00 H new ATOM 0 HB3 ASN A 65 12.880 -10.985 -1.964 1.00 0.00 H new ATOM 0 HD21 ASN A 65 9.767 -9.485 -0.446 1.00 0.00 H new ATOM 0 HD22 ASN A 65 10.280 -11.093 -0.968 1.00 0.00 H new ATOM 603 N ALA A 66 12.525 -7.801 -5.175 1.00 0.00 N ATOM 604 CA ALA A 66 11.647 -6.941 -6.013 1.00 0.00 C ATOM 605 C ALA A 66 10.790 -7.823 -6.921 1.00 0.00 C ATOM 606 O ALA A 66 11.212 -8.237 -7.983 1.00 0.00 O ATOM 607 CB ALA A 66 12.514 -6.014 -6.869 1.00 0.00 C ATOM 0 H ALA A 66 13.520 -7.582 -5.225 1.00 0.00 H new ATOM 0 HA ALA A 66 10.999 -6.343 -5.372 1.00 0.00 H new ATOM 0 HB1 ALA A 66 11.873 -5.382 -7.484 1.00 0.00 H new ATOM 0 HB2 ALA A 66 13.127 -5.387 -6.221 1.00 0.00 H new ATOM 0 HB3 ALA A 66 13.160 -6.611 -7.512 1.00 0.00 H new ATOM 613 N GLY A 67 9.587 -8.116 -6.510 1.00 0.00 N ATOM 614 CA GLY A 67 8.694 -8.974 -7.341 1.00 0.00 C ATOM 615 C GLY A 67 7.680 -9.666 -6.429 1.00 0.00 C ATOM 616 O GLY A 67 6.667 -10.164 -6.874 1.00 0.00 O ATOM 0 H GLY A 67 9.182 -7.797 -5.630 1.00 0.00 H new ATOM 0 HA2 GLY A 67 8.178 -8.369 -8.087 1.00 0.00 H new ATOM 0 HA3 GLY A 67 9.281 -9.716 -7.882 1.00 0.00 H new ATOM 620 N SER A 68 7.949 -9.694 -5.155 1.00 0.00 N ATOM 621 CA SER A 68 7.009 -10.345 -4.200 1.00 0.00 C ATOM 622 C SER A 68 5.668 -9.610 -4.222 1.00 0.00 C ATOM 623 O SER A 68 5.608 -8.421 -4.467 1.00 0.00 O ATOM 624 CB SER A 68 7.599 -10.274 -2.791 1.00 0.00 C ATOM 625 OG SER A 68 6.678 -10.836 -1.865 1.00 0.00 O ATOM 0 H SER A 68 8.785 -9.292 -4.731 1.00 0.00 H new ATOM 0 HA SER A 68 6.858 -11.386 -4.487 1.00 0.00 H new ATOM 0 HB2 SER A 68 8.545 -10.814 -2.753 1.00 0.00 H new ATOM 0 HB3 SER A 68 7.812 -9.239 -2.526 1.00 0.00 H new ATOM 0 HG SER A 68 7.055 -10.793 -0.961 1.00 0.00 H new ATOM 631 N ARG A 69 4.593 -10.313 -3.959 1.00 0.00 N ATOM 632 CA ARG A 69 3.238 -9.674 -3.951 1.00 0.00 C ATOM 633 C ARG A 69 2.507 -10.054 -2.660 1.00 0.00 C ATOM 634 O ARG A 69 2.802 -11.059 -2.045 1.00 0.00 O ATOM 635 CB ARG A 69 2.431 -10.157 -5.162 1.00 0.00 C ATOM 636 CG ARG A 69 2.285 -11.683 -5.126 1.00 0.00 C ATOM 637 CD ARG A 69 1.469 -12.145 -6.336 1.00 0.00 C ATOM 638 NE ARG A 69 1.359 -13.634 -6.325 1.00 0.00 N ATOM 639 CZ ARG A 69 0.393 -14.225 -5.670 1.00 0.00 C ATOM 640 NH1 ARG A 69 -0.465 -13.520 -4.986 1.00 0.00 N ATOM 641 NH2 ARG A 69 0.294 -15.526 -5.694 1.00 0.00 N ATOM 0 H ARG A 69 4.596 -11.311 -3.748 1.00 0.00 H new ATOM 0 HA ARG A 69 3.347 -8.591 -4.003 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.446 -9.690 -5.162 1.00 0.00 H new ATOM 0 HB3 ARG A 69 2.927 -9.853 -6.084 1.00 0.00 H new ATOM 0 HG2 ARG A 69 3.268 -12.154 -5.135 1.00 0.00 H new ATOM 0 HG3 ARG A 69 1.793 -11.991 -4.203 1.00 0.00 H new ATOM 0 HD2 ARG A 69 0.476 -11.696 -6.311 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.946 -11.812 -7.258 1.00 0.00 H new ATOM 0 HE ARG A 69 2.043 -14.195 -6.833 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -0.384 -12.504 -4.960 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -1.217 -13.985 -4.477 1.00 0.00 H new ATOM 0 HH21 ARG A 69 0.969 -16.079 -6.222 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -0.458 -15.990 -5.184 1.00 0.00 H new ATOM 655 N PHE A 70 1.554 -9.250 -2.246 1.00 0.00 N ATOM 656 CA PHE A 70 0.788 -9.546 -0.991 1.00 0.00 C ATOM 657 C PHE A 70 -0.711 -9.494 -1.290 1.00 0.00 C ATOM 658 O PHE A 70 -1.161 -8.713 -2.106 1.00 0.00 O ATOM 659 CB PHE A 70 1.125 -8.497 0.073 1.00 0.00 C ATOM 660 CG PHE A 70 2.593 -8.588 0.422 1.00 0.00 C ATOM 661 CD1 PHE A 70 3.069 -9.681 1.156 1.00 0.00 C ATOM 662 CD2 PHE A 70 3.480 -7.585 0.007 1.00 0.00 C ATOM 663 CE1 PHE A 70 4.429 -9.772 1.475 1.00 0.00 C ATOM 664 CE2 PHE A 70 4.839 -7.677 0.325 1.00 0.00 C ATOM 665 CZ PHE A 70 5.315 -8.770 1.059 1.00 0.00 C ATOM 0 H PHE A 70 1.272 -8.396 -2.727 1.00 0.00 H new ATOM 0 HA PHE A 70 1.058 -10.537 -0.626 1.00 0.00 H new ATOM 0 HB2 PHE A 70 0.889 -7.499 -0.297 1.00 0.00 H new ATOM 0 HB3 PHE A 70 0.518 -8.658 0.964 1.00 0.00 H new ATOM 0 HD1 PHE A 70 2.387 -10.454 1.476 1.00 0.00 H new ATOM 0 HD2 PHE A 70 3.114 -6.741 -0.559 1.00 0.00 H new ATOM 0 HE1 PHE A 70 4.795 -10.615 2.042 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.522 -6.904 0.004 1.00 0.00 H new ATOM 0 HZ PHE A 70 6.364 -8.841 1.304 1.00 0.00 H new ATOM 675 N LEU A 71 -1.486 -10.322 -0.629 1.00 0.00 N ATOM 676 CA LEU A 71 -2.967 -10.338 -0.859 1.00 0.00 C ATOM 677 C LEU A 71 -3.675 -9.677 0.322 1.00 0.00 C ATOM 678 O LEU A 71 -3.495 -10.063 1.460 1.00 0.00 O ATOM 679 CB LEU A 71 -3.444 -11.790 -0.982 1.00 0.00 C ATOM 680 CG LEU A 71 -4.950 -11.839 -1.289 1.00 0.00 C ATOM 681 CD1 LEU A 71 -5.258 -11.120 -2.616 1.00 0.00 C ATOM 682 CD2 LEU A 71 -5.380 -13.306 -1.382 1.00 0.00 C ATOM 0 H LEU A 71 -1.154 -10.992 0.065 1.00 0.00 H new ATOM 0 HA LEU A 71 -3.198 -9.793 -1.775 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -2.889 -12.295 -1.773 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -3.238 -12.326 -0.056 1.00 0.00 H new ATOM 0 HG LEU A 71 -5.499 -11.334 -0.494 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.329 -11.166 -2.815 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -4.946 -10.078 -2.546 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -4.717 -11.607 -3.428 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.447 -13.359 -1.599 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -4.822 -13.799 -2.178 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -5.178 -13.805 -0.434 1.00 0.00 H new ATOM 694 N LEU A 72 -4.488 -8.690 0.059 1.00 0.00 N ATOM 695 CA LEU A 72 -5.223 -8.004 1.162 1.00 0.00 C ATOM 696 C LEU A 72 -6.625 -8.607 1.277 1.00 0.00 C ATOM 697 O LEU A 72 -7.599 -8.036 0.827 1.00 0.00 O ATOM 698 CB LEU A 72 -5.321 -6.512 0.844 1.00 0.00 C ATOM 699 CG LEU A 72 -3.913 -5.940 0.631 1.00 0.00 C ATOM 700 CD1 LEU A 72 -4.023 -4.460 0.258 1.00 0.00 C ATOM 701 CD2 LEU A 72 -3.082 -6.092 1.919 1.00 0.00 C ATOM 0 H LEU A 72 -4.676 -8.327 -0.876 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.695 -8.137 2.106 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -5.926 -6.359 -0.050 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -5.819 -5.987 1.660 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.418 -6.485 -0.173 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -3.025 -4.048 0.105 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -4.602 -4.358 -0.660 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -4.520 -3.918 1.062 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.084 -5.683 1.759 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -3.569 -5.553 2.732 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -3.004 -7.148 2.179 1.00 0.00 H new ATOM 713 N ASP A 73 -6.730 -9.763 1.876 1.00 0.00 N ATOM 714 CA ASP A 73 -8.061 -10.424 2.027 1.00 0.00 C ATOM 715 C ASP A 73 -8.693 -9.997 3.353 1.00 0.00 C ATOM 716 O ASP A 73 -9.660 -10.579 3.802 1.00 0.00 O ATOM 717 CB ASP A 73 -7.873 -11.942 2.017 1.00 0.00 C ATOM 718 CG ASP A 73 -9.240 -12.625 1.968 1.00 0.00 C ATOM 719 OD1 ASP A 73 -9.949 -12.420 0.997 1.00 0.00 O ATOM 720 OD2 ASP A 73 -9.556 -13.338 2.905 1.00 0.00 O ATOM 0 H ASP A 73 -5.946 -10.282 2.270 1.00 0.00 H new ATOM 0 HA ASP A 73 -8.712 -10.130 1.204 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -7.275 -12.239 1.156 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -7.329 -12.258 2.907 1.00 0.00 H new ATOM 725 N GLN A 74 -8.148 -8.984 3.982 1.00 0.00 N ATOM 726 CA GLN A 74 -8.700 -8.499 5.287 1.00 0.00 C ATOM 727 C GLN A 74 -8.982 -6.997 5.194 1.00 0.00 C ATOM 728 O GLN A 74 -8.233 -6.250 4.596 1.00 0.00 O ATOM 729 CB GLN A 74 -7.682 -8.767 6.395 1.00 0.00 C ATOM 730 CG GLN A 74 -7.587 -10.275 6.635 1.00 0.00 C ATOM 731 CD GLN A 74 -6.557 -10.558 7.727 1.00 0.00 C ATOM 732 OE1 GLN A 74 -6.017 -9.645 8.318 1.00 0.00 O ATOM 733 NE2 GLN A 74 -6.261 -11.794 8.023 1.00 0.00 N ATOM 0 H GLN A 74 -7.336 -8.467 3.644 1.00 0.00 H new ATOM 0 HA GLN A 74 -9.628 -9.025 5.513 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -6.707 -8.369 6.114 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -7.981 -8.259 7.312 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -8.560 -10.668 6.929 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -7.303 -10.783 5.713 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -6.715 -12.560 7.526 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -5.576 -11.994 8.751 1.00 0.00 H new ATOM 742 N ALA A 75 -10.068 -6.557 5.771 1.00 0.00 N ATOM 743 CA ALA A 75 -10.423 -5.108 5.711 1.00 0.00 C ATOM 744 C ALA A 75 -9.323 -4.260 6.359 1.00 0.00 C ATOM 745 O ALA A 75 -8.901 -3.261 5.812 1.00 0.00 O ATOM 746 CB ALA A 75 -11.740 -4.880 6.455 1.00 0.00 C ATOM 0 H ALA A 75 -10.728 -7.141 6.284 1.00 0.00 H new ATOM 0 HA ALA A 75 -10.527 -4.813 4.667 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -12.003 -3.823 6.414 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -12.529 -5.469 5.987 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -11.628 -5.186 7.495 1.00 0.00 H new ATOM 752 N ILE A 76 -8.863 -4.644 7.525 1.00 0.00 N ATOM 753 CA ILE A 76 -7.795 -3.854 8.222 1.00 0.00 C ATOM 754 C ILE A 76 -6.463 -4.597 8.135 1.00 0.00 C ATOM 755 O ILE A 76 -6.323 -5.695 8.635 1.00 0.00 O ATOM 756 CB ILE A 76 -8.182 -3.686 9.694 1.00 0.00 C ATOM 757 CG1 ILE A 76 -9.651 -3.257 9.792 1.00 0.00 C ATOM 758 CG2 ILE A 76 -7.284 -2.635 10.355 1.00 0.00 C ATOM 759 CD1 ILE A 76 -9.894 -1.994 8.956 1.00 0.00 C ATOM 0 H ILE A 76 -9.181 -5.473 8.027 1.00 0.00 H new ATOM 0 HA ILE A 76 -7.695 -2.878 7.747 1.00 0.00 H new ATOM 0 HB ILE A 76 -8.050 -4.636 10.211 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -10.296 -4.063 9.442 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -9.913 -3.068 10.833 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -7.566 -2.522 11.402 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -6.244 -2.954 10.292 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.403 -1.681 9.842 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -10.941 -1.701 9.035 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -9.262 -1.186 9.325 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -9.652 -2.196 7.913 1.00 0.00 H new ATOM 771 N THR A 77 -5.481 -3.994 7.509 1.00 0.00 N ATOM 772 CA THR A 77 -4.134 -4.639 7.383 1.00 0.00 C ATOM 773 C THR A 77 -3.080 -3.704 7.979 1.00 0.00 C ATOM 774 O THR A 77 -2.940 -2.570 7.569 1.00 0.00 O ATOM 775 CB THR A 77 -3.831 -4.880 5.901 1.00 0.00 C ATOM 776 OG1 THR A 77 -4.828 -5.732 5.352 1.00 0.00 O ATOM 777 CG2 THR A 77 -2.459 -5.537 5.752 1.00 0.00 C ATOM 0 H THR A 77 -5.555 -3.074 7.076 1.00 0.00 H new ATOM 0 HA THR A 77 -4.121 -5.591 7.914 1.00 0.00 H new ATOM 0 HB THR A 77 -3.829 -3.927 5.372 1.00 0.00 H new ATOM 0 HG1 THR A 77 -4.441 -6.262 4.624 1.00 0.00 H new ATOM 0 HG21 THR A 77 -2.249 -5.706 4.696 1.00 0.00 H new ATOM 0 HG22 THR A 77 -1.695 -4.884 6.174 1.00 0.00 H new ATOM 0 HG23 THR A 77 -2.453 -6.491 6.280 1.00 0.00 H new ATOM 785 N SER A 78 -2.334 -4.171 8.945 1.00 0.00 N ATOM 786 CA SER A 78 -1.286 -3.308 9.569 1.00 0.00 C ATOM 787 C SER A 78 0.019 -3.435 8.779 1.00 0.00 C ATOM 788 O SER A 78 0.167 -4.313 7.951 1.00 0.00 O ATOM 789 CB SER A 78 -1.056 -3.753 11.017 1.00 0.00 C ATOM 790 OG SER A 78 0.140 -3.162 11.507 1.00 0.00 O ATOM 0 H SER A 78 -2.404 -5.113 9.330 1.00 0.00 H new ATOM 0 HA SER A 78 -1.615 -2.269 9.557 1.00 0.00 H new ATOM 0 HB2 SER A 78 -1.902 -3.458 11.638 1.00 0.00 H new ATOM 0 HB3 SER A 78 -0.986 -4.840 11.069 1.00 0.00 H new ATOM 0 HG SER A 78 0.531 -3.738 12.197 1.00 0.00 H new ATOM 796 N ALA A 79 0.965 -2.560 9.029 1.00 0.00 N ATOM 797 CA ALA A 79 2.276 -2.608 8.301 1.00 0.00 C ATOM 798 C ALA A 79 3.410 -2.739 9.320 1.00 0.00 C ATOM 799 O ALA A 79 3.331 -2.221 10.417 1.00 0.00 O ATOM 800 CB ALA A 79 2.458 -1.315 7.500 1.00 0.00 C ATOM 0 H ALA A 79 0.885 -1.807 9.713 1.00 0.00 H new ATOM 0 HA ALA A 79 2.291 -3.461 7.623 1.00 0.00 H new ATOM 0 HB1 ALA A 79 3.410 -1.346 6.970 1.00 0.00 H new ATOM 0 HB2 ALA A 79 1.645 -1.215 6.781 1.00 0.00 H new ATOM 0 HB3 ALA A 79 2.449 -0.462 8.179 1.00 0.00 H new ATOM 806 N GLY A 80 4.468 -3.428 8.965 1.00 0.00 N ATOM 807 CA GLY A 80 5.622 -3.600 9.905 1.00 0.00 C ATOM 808 C GLY A 80 5.649 -5.029 10.451 1.00 0.00 C ATOM 809 O GLY A 80 5.680 -5.986 9.703 1.00 0.00 O ATOM 0 H GLY A 80 4.583 -3.882 8.059 1.00 0.00 H new ATOM 0 HA2 GLY A 80 6.557 -3.382 9.389 1.00 0.00 H new ATOM 0 HA3 GLY A 80 5.539 -2.890 10.728 1.00 0.00 H new ATOM 813 N ARG A 81 5.654 -5.179 11.756 1.00 0.00 N ATOM 814 CA ARG A 81 5.700 -6.548 12.366 1.00 0.00 C ATOM 815 C ARG A 81 4.319 -6.951 12.886 1.00 0.00 C ATOM 816 O ARG A 81 3.658 -6.198 13.572 1.00 0.00 O ATOM 817 CB ARG A 81 6.684 -6.541 13.538 1.00 0.00 C ATOM 818 CG ARG A 81 8.105 -6.378 13.005 1.00 0.00 C ATOM 819 CD ARG A 81 9.086 -6.322 14.175 1.00 0.00 C ATOM 820 NE ARG A 81 10.469 -6.183 13.643 1.00 0.00 N ATOM 821 CZ ARG A 81 11.473 -6.045 14.462 1.00 0.00 C ATOM 822 NH1 ARG A 81 11.268 -6.036 15.750 1.00 0.00 N ATOM 823 NH2 ARG A 81 12.682 -5.921 13.991 1.00 0.00 N ATOM 0 H ARG A 81 5.628 -4.410 12.426 1.00 0.00 H new ATOM 0 HA ARG A 81 6.016 -7.261 11.604 1.00 0.00 H new ATOM 0 HB2 ARG A 81 6.445 -5.728 14.223 1.00 0.00 H new ATOM 0 HB3 ARG A 81 6.600 -7.469 14.103 1.00 0.00 H new ATOM 0 HG2 ARG A 81 8.355 -7.210 12.347 1.00 0.00 H new ATOM 0 HG3 ARG A 81 8.179 -5.467 12.411 1.00 0.00 H new ATOM 0 HD2 ARG A 81 8.847 -5.481 14.826 1.00 0.00 H new ATOM 0 HD3 ARG A 81 9.004 -7.226 14.778 1.00 0.00 H new ATOM 0 HE ARG A 81 10.631 -6.196 12.636 1.00 0.00 H new ATOM 0 HH11 ARG A 81 10.321 -6.137 16.116 1.00 0.00 H new ATOM 0 HH12 ARG A 81 12.054 -5.928 16.391 1.00 0.00 H new ATOM 0 HH21 ARG A 81 12.840 -5.932 12.983 1.00 0.00 H new ATOM 0 HH22 ARG A 81 13.470 -5.813 14.630 1.00 0.00 H new ATOM 837 N HIS A 82 3.893 -8.146 12.583 1.00 0.00 N ATOM 838 CA HIS A 82 2.569 -8.619 13.073 1.00 0.00 C ATOM 839 C HIS A 82 2.285 -10.011 12.456 1.00 0.00 C ATOM 840 O HIS A 82 2.237 -10.139 11.249 1.00 0.00 O ATOM 841 CB HIS A 82 1.477 -7.604 12.648 1.00 0.00 C ATOM 842 CG HIS A 82 1.107 -6.726 13.820 1.00 0.00 C ATOM 843 ND1 HIS A 82 1.146 -5.342 13.757 1.00 0.00 N ATOM 844 CD2 HIS A 82 0.713 -7.032 15.098 1.00 0.00 C ATOM 845 CE1 HIS A 82 0.785 -4.872 14.967 1.00 0.00 C ATOM 846 NE2 HIS A 82 0.510 -5.861 15.821 1.00 0.00 N ATOM 0 H HIS A 82 4.408 -8.818 12.014 1.00 0.00 H new ATOM 0 HA HIS A 82 2.567 -8.699 14.160 1.00 0.00 H new ATOM 0 HB2 HIS A 82 1.840 -6.991 11.823 1.00 0.00 H new ATOM 0 HB3 HIS A 82 0.596 -8.134 12.287 1.00 0.00 H new ATOM 0 HD2 HIS A 82 0.580 -8.032 15.485 1.00 0.00 H new ATOM 0 HE1 HIS A 82 0.725 -3.823 15.216 1.00 0.00 H new ATOM 0 HE2 HIS A 82 0.215 -5.776 16.794 1.00 0.00 H new ATOM 854 N PRO A 83 2.103 -11.050 13.254 1.00 0.00 N ATOM 855 CA PRO A 83 1.837 -12.415 12.712 1.00 0.00 C ATOM 856 C PRO A 83 0.409 -12.529 12.168 1.00 0.00 C ATOM 857 O PRO A 83 0.076 -13.451 11.451 1.00 0.00 O ATOM 858 CB PRO A 83 2.055 -13.337 13.920 1.00 0.00 C ATOM 859 CG PRO A 83 1.741 -12.491 15.112 1.00 0.00 C ATOM 860 CD PRO A 83 2.113 -11.049 14.734 1.00 0.00 C ATOM 0 HA PRO A 83 2.484 -12.668 11.872 1.00 0.00 H new ATOM 0 HB2 PRO A 83 1.404 -14.210 13.873 1.00 0.00 H new ATOM 0 HB3 PRO A 83 3.080 -13.705 13.956 1.00 0.00 H new ATOM 0 HG2 PRO A 83 0.685 -12.564 15.372 1.00 0.00 H new ATOM 0 HG3 PRO A 83 2.307 -12.822 15.983 1.00 0.00 H new ATOM 0 HD2 PRO A 83 1.396 -10.334 15.137 1.00 0.00 H new ATOM 0 HD3 PRO A 83 3.092 -10.774 15.126 1.00 0.00 H new ATOM 868 N ASP A 84 -0.432 -11.589 12.507 1.00 0.00 N ATOM 869 CA ASP A 84 -1.846 -11.616 12.022 1.00 0.00 C ATOM 870 C ASP A 84 -1.978 -10.723 10.785 1.00 0.00 C ATOM 871 O ASP A 84 -2.871 -10.889 9.977 1.00 0.00 O ATOM 872 CB ASP A 84 -2.756 -11.074 13.128 1.00 0.00 C ATOM 873 CG ASP A 84 -4.220 -11.229 12.711 1.00 0.00 C ATOM 874 OD1 ASP A 84 -4.454 -11.616 11.578 1.00 0.00 O ATOM 875 OD2 ASP A 84 -5.080 -10.953 13.531 1.00 0.00 O ATOM 0 H ASP A 84 -0.199 -10.796 13.105 1.00 0.00 H new ATOM 0 HA ASP A 84 -2.130 -12.637 11.767 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -2.574 -11.611 14.059 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -2.530 -10.024 13.317 1.00 0.00 H new ATOM 880 N SER A 85 -1.101 -9.766 10.644 1.00 0.00 N ATOM 881 CA SER A 85 -1.171 -8.842 9.476 1.00 0.00 C ATOM 882 C SER A 85 -0.692 -9.543 8.204 1.00 0.00 C ATOM 883 O SER A 85 0.273 -10.283 8.212 1.00 0.00 O ATOM 884 CB SER A 85 -0.288 -7.626 9.747 1.00 0.00 C ATOM 885 OG SER A 85 -0.310 -6.766 8.616 1.00 0.00 O ATOM 0 H SER A 85 -0.335 -9.584 11.292 1.00 0.00 H new ATOM 0 HA SER A 85 -2.206 -8.531 9.334 1.00 0.00 H new ATOM 0 HB2 SER A 85 -0.644 -7.094 10.629 1.00 0.00 H new ATOM 0 HB3 SER A 85 0.733 -7.944 9.956 1.00 0.00 H new ATOM 0 HG SER A 85 0.061 -5.893 8.862 1.00 0.00 H new ATOM 891 N ASP A 86 -1.354 -9.301 7.106 1.00 0.00 N ATOM 892 CA ASP A 86 -0.943 -9.934 5.820 1.00 0.00 C ATOM 893 C ASP A 86 0.445 -9.429 5.417 1.00 0.00 C ATOM 894 O ASP A 86 1.277 -10.177 4.942 1.00 0.00 O ATOM 895 CB ASP A 86 -1.950 -9.564 4.726 1.00 0.00 C ATOM 896 CG ASP A 86 -3.262 -10.318 4.957 1.00 0.00 C ATOM 897 OD1 ASP A 86 -3.248 -11.274 5.714 1.00 0.00 O ATOM 898 OD2 ASP A 86 -4.258 -9.924 4.373 1.00 0.00 O ATOM 0 H ASP A 86 -2.167 -8.688 7.044 1.00 0.00 H new ATOM 0 HA ASP A 86 -0.914 -11.016 5.945 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -2.131 -8.489 4.733 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -1.544 -9.813 3.745 1.00 0.00 H new ATOM 903 N ILE A 87 0.693 -8.159 5.589 1.00 0.00 N ATOM 904 CA ILE A 87 2.018 -7.589 5.203 1.00 0.00 C ATOM 905 C ILE A 87 3.027 -7.780 6.334 1.00 0.00 C ATOM 906 O ILE A 87 2.772 -7.441 7.472 1.00 0.00 O ATOM 907 CB ILE A 87 1.858 -6.095 4.921 1.00 0.00 C ATOM 908 CG1 ILE A 87 0.926 -5.901 3.720 1.00 0.00 C ATOM 909 CG2 ILE A 87 3.226 -5.482 4.612 1.00 0.00 C ATOM 910 CD1 ILE A 87 0.555 -4.421 3.586 1.00 0.00 C ATOM 0 H ILE A 87 0.033 -7.488 5.982 1.00 0.00 H new ATOM 0 HA ILE A 87 2.380 -8.103 4.313 1.00 0.00 H new ATOM 0 HB ILE A 87 1.432 -5.604 5.796 1.00 0.00 H new ATOM 0 HG12 ILE A 87 1.415 -6.247 2.809 1.00 0.00 H new ATOM 0 HG13 ILE A 87 0.025 -6.501 3.846 1.00 0.00 H new ATOM 0 HG21 ILE A 87 3.110 -4.417 4.411 1.00 0.00 H new ATOM 0 HG22 ILE A 87 3.888 -5.620 5.467 1.00 0.00 H new ATOM 0 HG23 ILE A 87 3.655 -5.972 3.738 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -0.108 -4.288 2.731 1.00 0.00 H new ATOM 0 HD12 ILE A 87 0.049 -4.089 4.492 1.00 0.00 H new ATOM 0 HD13 ILE A 87 1.460 -3.831 3.439 1.00 0.00 H new ATOM 922 N PHE A 88 4.182 -8.313 6.017 1.00 0.00 N ATOM 923 CA PHE A 88 5.242 -8.525 7.050 1.00 0.00 C ATOM 924 C PHE A 88 6.551 -7.929 6.532 1.00 0.00 C ATOM 925 O PHE A 88 7.371 -8.619 5.959 1.00 0.00 O ATOM 926 CB PHE A 88 5.429 -10.025 7.280 1.00 0.00 C ATOM 927 CG PHE A 88 6.446 -10.242 8.376 1.00 0.00 C ATOM 928 CD1 PHE A 88 6.086 -10.031 9.711 1.00 0.00 C ATOM 929 CD2 PHE A 88 7.746 -10.657 8.059 1.00 0.00 C ATOM 930 CE1 PHE A 88 7.024 -10.233 10.730 1.00 0.00 C ATOM 931 CE2 PHE A 88 8.684 -10.859 9.078 1.00 0.00 C ATOM 932 CZ PHE A 88 8.322 -10.647 10.414 1.00 0.00 C ATOM 0 H PHE A 88 4.437 -8.613 5.076 1.00 0.00 H new ATOM 0 HA PHE A 88 4.955 -8.046 7.986 1.00 0.00 H new ATOM 0 HB2 PHE A 88 4.479 -10.483 7.555 1.00 0.00 H new ATOM 0 HB3 PHE A 88 5.761 -10.506 6.360 1.00 0.00 H new ATOM 0 HD1 PHE A 88 5.084 -9.712 9.956 1.00 0.00 H new ATOM 0 HD2 PHE A 88 8.024 -10.821 7.028 1.00 0.00 H new ATOM 0 HE1 PHE A 88 6.745 -10.069 11.761 1.00 0.00 H new ATOM 0 HE2 PHE A 88 9.686 -11.178 8.834 1.00 0.00 H new ATOM 0 HZ PHE A 88 9.045 -10.803 11.201 1.00 0.00 H new ATOM 942 N LEU A 89 6.748 -6.648 6.726 1.00 0.00 N ATOM 943 CA LEU A 89 8.000 -5.981 6.243 1.00 0.00 C ATOM 944 C LEU A 89 8.893 -5.623 7.434 1.00 0.00 C ATOM 945 O LEU A 89 8.594 -4.729 8.202 1.00 0.00 O ATOM 946 CB LEU A 89 7.621 -4.706 5.483 1.00 0.00 C ATOM 947 CG LEU A 89 6.908 -5.072 4.170 1.00 0.00 C ATOM 948 CD1 LEU A 89 6.242 -3.819 3.593 1.00 0.00 C ATOM 949 CD2 LEU A 89 7.914 -5.636 3.144 1.00 0.00 C ATOM 0 H LEU A 89 6.091 -6.030 7.202 1.00 0.00 H new ATOM 0 HA LEU A 89 8.545 -6.658 5.585 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.971 -4.085 6.099 1.00 0.00 H new ATOM 0 HB3 LEU A 89 8.515 -4.120 5.270 1.00 0.00 H new ATOM 0 HG LEU A 89 6.157 -5.834 4.377 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.735 -4.072 2.662 1.00 0.00 H new ATOM 0 HD12 LEU A 89 5.516 -3.431 4.308 1.00 0.00 H new ATOM 0 HD13 LEU A 89 7.000 -3.061 3.398 1.00 0.00 H new ATOM 0 HD21 LEU A 89 7.390 -5.889 2.222 1.00 0.00 H new ATOM 0 HD22 LEU A 89 8.678 -4.887 2.934 1.00 0.00 H new ATOM 0 HD23 LEU A 89 8.385 -6.531 3.551 1.00 0.00 H new ATOM 961 N ASP A 90 9.996 -6.313 7.583 1.00 0.00 N ATOM 962 CA ASP A 90 10.933 -6.025 8.713 1.00 0.00 C ATOM 963 C ASP A 90 12.097 -5.174 8.202 1.00 0.00 C ATOM 964 O ASP A 90 12.016 -3.963 8.149 1.00 0.00 O ATOM 965 CB ASP A 90 11.485 -7.345 9.256 1.00 0.00 C ATOM 966 CG ASP A 90 10.378 -8.095 9.991 1.00 0.00 C ATOM 967 OD1 ASP A 90 9.365 -7.481 10.276 1.00 0.00 O ATOM 968 OD2 ASP A 90 10.561 -9.272 10.254 1.00 0.00 O ATOM 0 H ASP A 90 10.290 -7.070 6.965 1.00 0.00 H new ATOM 0 HA ASP A 90 10.402 -5.490 9.501 1.00 0.00 H new ATOM 0 HB2 ASP A 90 11.871 -7.954 8.438 1.00 0.00 H new ATOM 0 HB3 ASP A 90 12.319 -7.153 9.931 1.00 0.00 H new ATOM 973 N ASP A 91 13.173 -5.813 7.818 1.00 0.00 N ATOM 974 CA ASP A 91 14.367 -5.079 7.297 1.00 0.00 C ATOM 975 C ASP A 91 14.613 -3.797 8.104 1.00 0.00 C ATOM 976 O ASP A 91 14.086 -3.612 9.183 1.00 0.00 O ATOM 977 CB ASP A 91 14.147 -4.729 5.820 1.00 0.00 C ATOM 978 CG ASP A 91 12.784 -4.059 5.643 1.00 0.00 C ATOM 979 OD1 ASP A 91 12.632 -2.940 6.106 1.00 0.00 O ATOM 980 OD2 ASP A 91 11.916 -4.674 5.046 1.00 0.00 O ATOM 0 H ASP A 91 13.276 -6.827 7.844 1.00 0.00 H new ATOM 0 HA ASP A 91 15.243 -5.720 7.396 1.00 0.00 H new ATOM 0 HB2 ASP A 91 14.937 -4.063 5.473 1.00 0.00 H new ATOM 0 HB3 ASP A 91 14.200 -5.632 5.211 1.00 0.00 H new ATOM 985 N VAL A 92 15.428 -2.920 7.589 1.00 0.00 N ATOM 986 CA VAL A 92 15.734 -1.656 8.314 1.00 0.00 C ATOM 987 C VAL A 92 14.516 -0.722 8.281 1.00 0.00 C ATOM 988 O VAL A 92 13.622 -0.878 7.477 1.00 0.00 O ATOM 989 CB VAL A 92 16.932 -0.970 7.650 1.00 0.00 C ATOM 990 CG1 VAL A 92 18.140 -1.912 7.675 1.00 0.00 C ATOM 991 CG2 VAL A 92 16.585 -0.625 6.199 1.00 0.00 C ATOM 0 H VAL A 92 15.899 -3.026 6.690 1.00 0.00 H new ATOM 0 HA VAL A 92 15.973 -1.885 9.353 1.00 0.00 H new ATOM 0 HB VAL A 92 17.172 -0.056 8.193 1.00 0.00 H new ATOM 0 HG11 VAL A 92 18.992 -1.424 7.202 1.00 0.00 H new ATOM 0 HG12 VAL A 92 18.389 -2.157 8.707 1.00 0.00 H new ATOM 0 HG13 VAL A 92 17.900 -2.827 7.133 1.00 0.00 H new ATOM 0 HG21 VAL A 92 17.438 -0.137 5.727 1.00 0.00 H new ATOM 0 HG22 VAL A 92 16.343 -1.538 5.656 1.00 0.00 H new ATOM 0 HG23 VAL A 92 15.726 0.046 6.180 1.00 0.00 H new ATOM 1001 N THR A 93 14.488 0.242 9.166 1.00 0.00 N ATOM 1002 CA THR A 93 13.349 1.214 9.228 1.00 0.00 C ATOM 1003 C THR A 93 12.014 0.475 9.360 1.00 0.00 C ATOM 1004 O THR A 93 11.898 -0.492 10.084 1.00 0.00 O ATOM 1005 CB THR A 93 13.328 2.086 7.967 1.00 0.00 C ATOM 1006 OG1 THR A 93 13.088 1.279 6.823 1.00 0.00 O ATOM 1007 CG2 THR A 93 14.673 2.793 7.815 1.00 0.00 C ATOM 0 H THR A 93 15.218 0.401 9.861 1.00 0.00 H new ATOM 0 HA THR A 93 13.490 1.847 10.104 1.00 0.00 H new ATOM 0 HB THR A 93 12.532 2.825 8.058 1.00 0.00 H new ATOM 0 HG1 THR A 93 12.904 0.359 7.105 1.00 0.00 H new ATOM 0 HG21 THR A 93 14.659 3.413 6.919 1.00 0.00 H new ATOM 0 HG22 THR A 93 14.855 3.420 8.688 1.00 0.00 H new ATOM 0 HG23 THR A 93 15.467 2.051 7.730 1.00 0.00 H new ATOM 1015 N VAL A 94 11.000 0.941 8.672 1.00 0.00 N ATOM 1016 CA VAL A 94 9.653 0.296 8.757 1.00 0.00 C ATOM 1017 C VAL A 94 9.338 -0.050 10.218 1.00 0.00 C ATOM 1018 O VAL A 94 9.643 -1.123 10.699 1.00 0.00 O ATOM 1019 CB VAL A 94 9.629 -0.969 7.899 1.00 0.00 C ATOM 1020 CG1 VAL A 94 8.182 -1.436 7.736 1.00 0.00 C ATOM 1021 CG2 VAL A 94 10.220 -0.663 6.520 1.00 0.00 C ATOM 0 H VAL A 94 11.049 1.748 8.050 1.00 0.00 H new ATOM 0 HA VAL A 94 8.897 0.988 8.385 1.00 0.00 H new ATOM 0 HB VAL A 94 10.218 -1.749 8.381 1.00 0.00 H new ATOM 0 HG11 VAL A 94 8.158 -2.338 7.125 1.00 0.00 H new ATOM 0 HG12 VAL A 94 7.756 -1.650 8.716 1.00 0.00 H new ATOM 0 HG13 VAL A 94 7.599 -0.653 7.251 1.00 0.00 H new ATOM 0 HG21 VAL A 94 10.203 -1.565 5.908 1.00 0.00 H new ATOM 0 HG22 VAL A 94 9.630 0.115 6.036 1.00 0.00 H new ATOM 0 HG23 VAL A 94 11.249 -0.321 6.633 1.00 0.00 H new ATOM 1031 N SER A 95 8.742 0.870 10.927 1.00 0.00 N ATOM 1032 CA SER A 95 8.412 0.635 12.362 1.00 0.00 C ATOM 1033 C SER A 95 7.301 -0.411 12.501 1.00 0.00 C ATOM 1034 O SER A 95 6.713 -0.848 11.532 1.00 0.00 O ATOM 1035 CB SER A 95 7.947 1.950 12.989 1.00 0.00 C ATOM 1036 OG SER A 95 7.526 1.712 14.326 1.00 0.00 O ATOM 0 H SER A 95 8.467 1.785 10.569 1.00 0.00 H new ATOM 0 HA SER A 95 9.302 0.266 12.871 1.00 0.00 H new ATOM 0 HB2 SER A 95 8.757 2.679 12.975 1.00 0.00 H new ATOM 0 HB3 SER A 95 7.128 2.373 12.408 1.00 0.00 H new ATOM 0 HG SER A 95 7.229 2.554 14.730 1.00 0.00 H new ATOM 1042 N ARG A 96 7.010 -0.808 13.713 1.00 0.00 N ATOM 1043 CA ARG A 96 5.938 -1.820 13.941 1.00 0.00 C ATOM 1044 C ARG A 96 4.609 -1.278 13.414 1.00 0.00 C ATOM 1045 O ARG A 96 3.861 -1.977 12.761 1.00 0.00 O ATOM 1046 CB ARG A 96 5.818 -2.094 15.444 1.00 0.00 C ATOM 1047 CG ARG A 96 4.773 -3.184 15.696 1.00 0.00 C ATOM 1048 CD ARG A 96 4.690 -3.470 17.196 1.00 0.00 C ATOM 1049 NE ARG A 96 5.962 -4.098 17.652 1.00 0.00 N ATOM 1050 CZ ARG A 96 6.113 -4.432 18.905 1.00 0.00 C ATOM 1051 NH1 ARG A 96 5.150 -4.214 19.756 1.00 0.00 N ATOM 1052 NH2 ARG A 96 7.226 -4.982 19.304 1.00 0.00 N ATOM 0 H ARG A 96 7.472 -0.472 14.558 1.00 0.00 H new ATOM 0 HA ARG A 96 6.186 -2.744 13.418 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.783 -2.405 15.843 1.00 0.00 H new ATOM 0 HB3 ARG A 96 5.536 -1.180 15.967 1.00 0.00 H new ATOM 0 HG2 ARG A 96 3.801 -2.865 15.321 1.00 0.00 H new ATOM 0 HG3 ARG A 96 5.041 -4.092 15.156 1.00 0.00 H new ATOM 0 HD2 ARG A 96 4.511 -2.545 17.744 1.00 0.00 H new ATOM 0 HD3 ARG A 96 3.850 -4.132 17.405 1.00 0.00 H new ATOM 0 HE ARG A 96 6.715 -4.267 16.985 1.00 0.00 H new ATOM 0 HH11 ARG A 96 4.280 -3.783 19.443 1.00 0.00 H new ATOM 0 HH12 ARG A 96 5.266 -4.474 20.735 1.00 0.00 H new ATOM 0 HH21 ARG A 96 7.979 -5.151 18.637 1.00 0.00 H new ATOM 0 HH22 ARG A 96 7.344 -5.243 20.283 1.00 0.00 H new ATOM 1066 N ARG A 97 4.315 -0.031 13.692 1.00 0.00 N ATOM 1067 CA ARG A 97 3.039 0.588 13.212 1.00 0.00 C ATOM 1068 C ARG A 97 3.370 1.833 12.388 1.00 0.00 C ATOM 1069 O ARG A 97 3.032 2.941 12.750 1.00 0.00 O ATOM 1070 CB ARG A 97 2.183 0.976 14.418 1.00 0.00 C ATOM 1071 CG ARG A 97 1.749 -0.295 15.149 1.00 0.00 C ATOM 1072 CD ARG A 97 0.868 0.073 16.344 1.00 0.00 C ATOM 1073 NE ARG A 97 1.678 0.814 17.354 1.00 0.00 N ATOM 1074 CZ ARG A 97 2.399 0.162 18.228 1.00 0.00 C ATOM 1075 NH1 ARG A 97 2.420 -1.143 18.217 1.00 0.00 N ATOM 1076 NH2 ARG A 97 3.100 0.816 19.111 1.00 0.00 N ATOM 0 H ARG A 97 4.911 0.591 14.237 1.00 0.00 H new ATOM 0 HA ARG A 97 2.488 -0.121 12.594 1.00 0.00 H new ATOM 0 HB2 ARG A 97 2.749 1.622 15.089 1.00 0.00 H new ATOM 0 HB3 ARG A 97 1.309 1.541 14.093 1.00 0.00 H new ATOM 0 HG2 ARG A 97 1.202 -0.948 14.469 1.00 0.00 H new ATOM 0 HG3 ARG A 97 2.625 -0.849 15.487 1.00 0.00 H new ATOM 0 HD2 ARG A 97 0.029 0.686 16.015 1.00 0.00 H new ATOM 0 HD3 ARG A 97 0.448 -0.828 16.790 1.00 0.00 H new ATOM 0 HE ARG A 97 1.669 1.834 17.363 1.00 0.00 H new ATOM 0 HH11 ARG A 97 1.873 -1.656 17.526 1.00 0.00 H new ATOM 0 HH12 ARG A 97 2.983 -1.650 18.900 1.00 0.00 H new ATOM 0 HH21 ARG A 97 3.086 1.836 19.120 1.00 0.00 H new ATOM 0 HH22 ARG A 97 3.663 0.308 19.793 1.00 0.00 H new ATOM 1090 N HIS A 98 4.036 1.650 11.279 1.00 0.00 N ATOM 1091 CA HIS A 98 4.402 2.809 10.416 1.00 0.00 C ATOM 1092 C HIS A 98 3.224 3.169 9.510 1.00 0.00 C ATOM 1093 O HIS A 98 2.995 4.322 9.198 1.00 0.00 O ATOM 1094 CB HIS A 98 5.609 2.434 9.555 1.00 0.00 C ATOM 1095 CG HIS A 98 6.120 3.656 8.844 1.00 0.00 C ATOM 1096 ND1 HIS A 98 5.571 4.101 7.650 1.00 0.00 N ATOM 1097 CD2 HIS A 98 7.130 4.536 9.142 1.00 0.00 C ATOM 1098 CE1 HIS A 98 6.248 5.203 7.278 1.00 0.00 C ATOM 1099 NE2 HIS A 98 7.211 5.512 8.152 1.00 0.00 N ATOM 0 H HIS A 98 4.344 0.741 10.932 1.00 0.00 H new ATOM 0 HA HIS A 98 4.649 3.666 11.043 1.00 0.00 H new ATOM 0 HB2 HIS A 98 6.395 2.008 10.179 1.00 0.00 H new ATOM 0 HB3 HIS A 98 5.328 1.670 8.830 1.00 0.00 H new ATOM 0 HD2 HIS A 98 7.766 4.480 10.013 1.00 0.00 H new ATOM 0 HE1 HIS A 98 6.039 5.769 6.382 1.00 0.00 H new ATOM 0 HE2 HIS A 98 7.864 6.294 8.104 1.00 0.00 H new ATOM 1107 N ALA A 99 2.481 2.188 9.071 1.00 0.00 N ATOM 1108 CA ALA A 99 1.324 2.465 8.172 1.00 0.00 C ATOM 1109 C ALA A 99 0.241 1.404 8.379 1.00 0.00 C ATOM 1110 O ALA A 99 0.520 0.264 8.699 1.00 0.00 O ATOM 1111 CB ALA A 99 1.794 2.427 6.717 1.00 0.00 C ATOM 0 H ALA A 99 2.626 1.204 9.297 1.00 0.00 H new ATOM 0 HA ALA A 99 0.916 3.449 8.404 1.00 0.00 H new ATOM 0 HB1 ALA A 99 0.951 2.629 6.057 1.00 0.00 H new ATOM 0 HB2 ALA A 99 2.564 3.183 6.564 1.00 0.00 H new ATOM 0 HB3 ALA A 99 2.203 1.442 6.492 1.00 0.00 H new ATOM 1117 N GLU A 100 -0.998 1.777 8.185 1.00 0.00 N ATOM 1118 CA GLU A 100 -2.125 0.810 8.348 1.00 0.00 C ATOM 1119 C GLU A 100 -3.162 1.085 7.261 1.00 0.00 C ATOM 1120 O GLU A 100 -3.516 2.217 7.002 1.00 0.00 O ATOM 1121 CB GLU A 100 -2.759 0.992 9.731 1.00 0.00 C ATOM 1122 CG GLU A 100 -3.917 0.007 9.909 1.00 0.00 C ATOM 1123 CD GLU A 100 -4.487 0.140 11.323 1.00 0.00 C ATOM 1124 OE1 GLU A 100 -3.828 0.745 12.151 1.00 0.00 O ATOM 1125 OE2 GLU A 100 -5.573 -0.367 11.553 1.00 0.00 O ATOM 0 H GLU A 100 -1.280 2.720 7.918 1.00 0.00 H new ATOM 0 HA GLU A 100 -1.759 -0.213 8.260 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -2.011 0.831 10.507 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -3.120 2.014 9.843 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -4.695 0.206 9.172 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -3.571 -1.013 9.739 1.00 0.00 H new ATOM 1132 N PHE A 101 -3.642 0.055 6.616 1.00 0.00 N ATOM 1133 CA PHE A 101 -4.653 0.240 5.530 1.00 0.00 C ATOM 1134 C PHE A 101 -6.050 -0.077 6.064 1.00 0.00 C ATOM 1135 O PHE A 101 -6.225 -0.945 6.896 1.00 0.00 O ATOM 1136 CB PHE A 101 -4.326 -0.706 4.372 1.00 0.00 C ATOM 1137 CG PHE A 101 -2.950 -0.386 3.835 1.00 0.00 C ATOM 1138 CD1 PHE A 101 -2.784 0.662 2.924 1.00 0.00 C ATOM 1139 CD2 PHE A 101 -1.844 -1.139 4.246 1.00 0.00 C ATOM 1140 CE1 PHE A 101 -1.510 0.963 2.426 1.00 0.00 C ATOM 1141 CE2 PHE A 101 -0.570 -0.839 3.749 1.00 0.00 C ATOM 1142 CZ PHE A 101 -0.403 0.211 2.839 1.00 0.00 C ATOM 0 H PHE A 101 -3.376 -0.913 6.795 1.00 0.00 H new ATOM 0 HA PHE A 101 -4.627 1.273 5.183 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -4.364 -1.741 4.712 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -5.070 -0.602 3.582 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -3.639 1.240 2.604 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -1.973 -1.951 4.946 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -1.381 1.774 1.724 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.284 -1.418 4.068 1.00 0.00 H new ATOM 0 HZ PHE A 101 0.580 0.441 2.455 1.00 0.00 H new ATOM 1152 N ARG A 102 -7.045 0.625 5.583 1.00 0.00 N ATOM 1153 CA ARG A 102 -8.451 0.386 6.037 1.00 0.00 C ATOM 1154 C ARG A 102 -9.363 0.273 4.814 1.00 0.00 C ATOM 1155 O ARG A 102 -9.310 1.084 3.912 1.00 0.00 O ATOM 1156 CB ARG A 102 -8.909 1.557 6.909 1.00 0.00 C ATOM 1157 CG ARG A 102 -10.336 1.299 7.401 1.00 0.00 C ATOM 1158 CD ARG A 102 -10.723 2.369 8.421 1.00 0.00 C ATOM 1159 NE ARG A 102 -9.910 2.191 9.656 1.00 0.00 N ATOM 1160 CZ ARG A 102 -9.963 3.086 10.603 1.00 0.00 C ATOM 1161 NH1 ARG A 102 -10.719 4.139 10.460 1.00 0.00 N ATOM 1162 NH2 ARG A 102 -9.260 2.927 11.690 1.00 0.00 N ATOM 0 H ARG A 102 -6.942 1.363 4.886 1.00 0.00 H new ATOM 0 HA ARG A 102 -8.499 -0.537 6.615 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -8.236 1.677 7.758 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -8.872 2.485 6.339 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -11.030 1.314 6.561 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.403 0.309 7.853 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -10.558 3.362 8.003 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -11.785 2.295 8.657 1.00 0.00 H new ATOM 0 HE ARG A 102 -9.313 1.371 9.761 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -11.267 4.261 9.609 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -10.762 4.840 11.199 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -8.669 2.103 11.799 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -9.301 3.627 12.431 1.00 0.00 H new ATOM 1176 N LEU A 103 -10.199 -0.732 4.776 1.00 0.00 N ATOM 1177 CA LEU A 103 -11.121 -0.907 3.610 1.00 0.00 C ATOM 1178 C LEU A 103 -12.440 -0.180 3.884 1.00 0.00 C ATOM 1179 O LEU A 103 -13.036 -0.337 4.931 1.00 0.00 O ATOM 1180 CB LEU A 103 -11.385 -2.404 3.398 1.00 0.00 C ATOM 1181 CG LEU A 103 -12.403 -2.619 2.266 1.00 0.00 C ATOM 1182 CD1 LEU A 103 -11.919 -1.940 0.975 1.00 0.00 C ATOM 1183 CD2 LEU A 103 -12.557 -4.125 2.026 1.00 0.00 C ATOM 0 H LEU A 103 -10.284 -1.442 5.503 1.00 0.00 H new ATOM 0 HA LEU A 103 -10.664 -0.488 2.714 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -10.452 -2.913 3.157 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -11.760 -2.847 4.321 1.00 0.00 H new ATOM 0 HG LEU A 103 -13.360 -2.181 2.550 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -12.650 -2.101 0.183 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -11.802 -0.870 1.148 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -10.961 -2.366 0.677 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -13.277 -4.294 1.225 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -11.593 -4.549 1.743 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -12.911 -4.605 2.939 1.00 0.00 H new ATOM 1195 N GLU A 104 -12.895 0.619 2.947 1.00 0.00 N ATOM 1196 CA GLU A 104 -14.179 1.369 3.136 1.00 0.00 C ATOM 1197 C GLU A 104 -15.053 1.200 1.889 1.00 0.00 C ATOM 1198 O GLU A 104 -14.571 1.211 0.775 1.00 0.00 O ATOM 1199 CB GLU A 104 -13.869 2.856 3.343 1.00 0.00 C ATOM 1200 CG GLU A 104 -15.153 3.610 3.708 1.00 0.00 C ATOM 1201 CD GLU A 104 -15.609 3.197 5.110 1.00 0.00 C ATOM 1202 OE1 GLU A 104 -14.854 2.510 5.780 1.00 0.00 O ATOM 1203 OE2 GLU A 104 -16.706 3.573 5.489 1.00 0.00 O ATOM 0 H GLU A 104 -12.429 0.785 2.055 1.00 0.00 H new ATOM 0 HA GLU A 104 -14.707 0.980 4.007 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -13.129 2.976 4.134 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -13.436 3.276 2.435 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -14.978 4.685 3.673 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -15.935 3.391 2.981 1.00 0.00 H new ATOM 1210 N ASN A 105 -16.337 1.048 2.075 1.00 0.00 N ATOM 1211 CA ASN A 105 -17.257 0.882 0.911 1.00 0.00 C ATOM 1212 C ASN A 105 -16.747 -0.233 -0.008 1.00 0.00 C ATOM 1213 O ASN A 105 -17.160 -1.370 0.094 1.00 0.00 O ATOM 1214 CB ASN A 105 -17.328 2.193 0.124 1.00 0.00 C ATOM 1215 CG ASN A 105 -18.112 3.228 0.932 1.00 0.00 C ATOM 1216 OD1 ASN A 105 -18.820 2.884 1.856 1.00 0.00 O ATOM 1217 ND2 ASN A 105 -18.020 4.491 0.616 1.00 0.00 N ATOM 0 H ASN A 105 -16.791 1.032 2.988 1.00 0.00 H new ATOM 0 HA ASN A 105 -18.249 0.618 1.278 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -16.323 2.561 -0.082 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -17.810 2.026 -0.839 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -18.543 5.189 1.145 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -17.425 4.780 -0.160 1.00 0.00 H new ATOM 1224 N ASN A 106 -15.863 0.089 -0.912 1.00 0.00 N ATOM 1225 CA ASN A 106 -15.334 -0.945 -1.846 1.00 0.00 C ATOM 1226 C ASN A 106 -13.959 -0.514 -2.357 1.00 0.00 C ATOM 1227 O ASN A 106 -13.498 -0.973 -3.382 1.00 0.00 O ATOM 1228 CB ASN A 106 -16.293 -1.087 -3.029 1.00 0.00 C ATOM 1229 CG ASN A 106 -15.880 -2.283 -3.885 1.00 0.00 C ATOM 1230 OD1 ASN A 106 -15.389 -2.117 -4.985 1.00 0.00 O ATOM 1231 ND2 ASN A 106 -16.058 -3.491 -3.426 1.00 0.00 N ATOM 0 H ASN A 106 -15.483 1.026 -1.044 1.00 0.00 H new ATOM 0 HA ASN A 106 -15.245 -1.899 -1.326 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -17.313 -1.220 -2.669 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -16.283 -0.177 -3.629 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -15.785 -4.296 -3.990 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -16.470 -3.630 -2.503 1.00 0.00 H new ATOM 1238 N GLU A 107 -13.305 0.373 -1.648 1.00 0.00 N ATOM 1239 CA GLU A 107 -11.955 0.853 -2.080 1.00 0.00 C ATOM 1240 C GLU A 107 -11.009 0.851 -0.881 1.00 0.00 C ATOM 1241 O GLU A 107 -11.382 1.203 0.221 1.00 0.00 O ATOM 1242 CB GLU A 107 -12.079 2.279 -2.626 1.00 0.00 C ATOM 1243 CG GLU A 107 -12.914 2.271 -3.911 1.00 0.00 C ATOM 1244 CD GLU A 107 -12.179 1.489 -5.002 1.00 0.00 C ATOM 1245 OE1 GLU A 107 -10.976 1.326 -4.879 1.00 0.00 O ATOM 1246 OE2 GLU A 107 -12.833 1.065 -5.942 1.00 0.00 O ATOM 0 H GLU A 107 -13.651 0.788 -0.783 1.00 0.00 H new ATOM 0 HA GLU A 107 -11.562 0.195 -2.855 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -12.546 2.924 -1.882 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -11.089 2.689 -2.827 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -13.887 1.819 -3.720 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -13.096 3.293 -4.243 1.00 0.00 H new ATOM 1253 N PHE A 108 -9.785 0.450 -1.091 1.00 0.00 N ATOM 1254 CA PHE A 108 -8.803 0.414 0.026 1.00 0.00 C ATOM 1255 C PHE A 108 -8.297 1.827 0.323 1.00 0.00 C ATOM 1256 O PHE A 108 -8.175 2.654 -0.559 1.00 0.00 O ATOM 1257 CB PHE A 108 -7.623 -0.483 -0.360 1.00 0.00 C ATOM 1258 CG PHE A 108 -8.052 -1.932 -0.317 1.00 0.00 C ATOM 1259 CD1 PHE A 108 -8.028 -2.631 0.895 1.00 0.00 C ATOM 1260 CD2 PHE A 108 -8.473 -2.575 -1.488 1.00 0.00 C ATOM 1261 CE1 PHE A 108 -8.424 -3.974 0.938 1.00 0.00 C ATOM 1262 CE2 PHE A 108 -8.869 -3.918 -1.444 1.00 0.00 C ATOM 1263 CZ PHE A 108 -8.844 -4.617 -0.232 1.00 0.00 C ATOM 0 H PHE A 108 -9.422 0.144 -1.994 1.00 0.00 H new ATOM 0 HA PHE A 108 -9.289 0.015 0.917 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -7.270 -0.227 -1.359 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -6.790 -0.319 0.324 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -7.704 -2.135 1.798 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -8.492 -2.036 -2.424 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -8.405 -4.513 1.874 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -9.194 -4.414 -2.346 1.00 0.00 H new ATOM 0 HZ PHE A 108 -9.149 -5.653 -0.199 1.00 0.00 H new ATOM 1273 N ASN A 109 -8.001 2.100 1.569 1.00 0.00 N ATOM 1274 CA ASN A 109 -7.496 3.450 1.970 1.00 0.00 C ATOM 1275 C ASN A 109 -6.165 3.285 2.703 1.00 0.00 C ATOM 1276 O ASN A 109 -5.839 2.214 3.175 1.00 0.00 O ATOM 1277 CB ASN A 109 -8.511 4.115 2.905 1.00 0.00 C ATOM 1278 CG ASN A 109 -9.760 4.507 2.111 1.00 0.00 C ATOM 1279 OD1 ASN A 109 -9.718 4.609 0.902 1.00 0.00 O ATOM 1280 ND2 ASN A 109 -10.879 4.732 2.747 1.00 0.00 N ATOM 0 H ASN A 109 -8.089 1.435 2.337 1.00 0.00 H new ATOM 0 HA ASN A 109 -7.357 4.071 1.085 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -8.780 3.432 3.711 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -8.070 4.998 3.368 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -11.717 4.993 2.228 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -10.914 4.646 3.763 1.00 0.00 H new ATOM 1287 N VAL A 110 -5.391 4.339 2.791 1.00 0.00 N ATOM 1288 CA VAL A 110 -4.066 4.264 3.486 1.00 0.00 C ATOM 1289 C VAL A 110 -3.986 5.372 4.535 1.00 0.00 C ATOM 1290 O VAL A 110 -4.330 6.513 4.281 1.00 0.00 O ATOM 1291 CB VAL A 110 -2.942 4.440 2.455 1.00 0.00 C ATOM 1292 CG1 VAL A 110 -3.222 5.668 1.586 1.00 0.00 C ATOM 1293 CG2 VAL A 110 -1.598 4.618 3.172 1.00 0.00 C ATOM 0 H VAL A 110 -5.622 5.256 2.408 1.00 0.00 H new ATOM 0 HA VAL A 110 -3.957 3.296 3.974 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.899 3.552 1.824 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.421 5.788 0.856 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -4.171 5.537 1.065 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -3.274 6.556 2.216 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.806 4.742 2.434 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.640 5.500 3.811 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.391 3.738 3.781 1.00 0.00 H new ATOM 1303 N VAL A 111 -3.537 5.034 5.717 1.00 0.00 N ATOM 1304 CA VAL A 111 -3.415 6.037 6.820 1.00 0.00 C ATOM 1305 C VAL A 111 -1.992 5.981 7.375 1.00 0.00 C ATOM 1306 O VAL A 111 -1.443 4.920 7.596 1.00 0.00 O ATOM 1307 CB VAL A 111 -4.421 5.700 7.928 1.00 0.00 C ATOM 1308 CG1 VAL A 111 -4.128 6.542 9.177 1.00 0.00 C ATOM 1309 CG2 VAL A 111 -5.838 6.005 7.435 1.00 0.00 C ATOM 0 H VAL A 111 -3.245 4.090 5.969 1.00 0.00 H new ATOM 0 HA VAL A 111 -3.624 7.038 6.444 1.00 0.00 H new ATOM 0 HB VAL A 111 -4.335 4.643 8.180 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -4.847 6.296 9.958 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -3.120 6.328 9.531 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -4.209 7.600 8.929 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -6.556 5.767 8.220 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -5.915 7.062 7.182 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.053 5.404 6.552 1.00 0.00 H new ATOM 1319 N ASP A 112 -1.389 7.116 7.597 1.00 0.00 N ATOM 1320 CA ASP A 112 0.001 7.131 8.134 1.00 0.00 C ATOM 1321 C ASP A 112 -0.047 6.998 9.657 1.00 0.00 C ATOM 1322 O ASP A 112 -0.493 7.886 10.354 1.00 0.00 O ATOM 1323 CB ASP A 112 0.673 8.454 7.757 1.00 0.00 C ATOM 1324 CG ASP A 112 2.165 8.385 8.085 1.00 0.00 C ATOM 1325 OD1 ASP A 112 2.643 7.297 8.360 1.00 0.00 O ATOM 1326 OD2 ASP A 112 2.805 9.424 8.057 1.00 0.00 O ATOM 0 H ASP A 112 -1.799 8.035 7.430 1.00 0.00 H new ATOM 0 HA ASP A 112 0.569 6.301 7.713 1.00 0.00 H new ATOM 0 HB2 ASP A 112 0.533 8.655 6.695 1.00 0.00 H new ATOM 0 HB3 ASP A 112 0.209 9.277 8.301 1.00 0.00 H new ATOM 1331 N VAL A 113 0.411 5.889 10.176 1.00 0.00 N ATOM 1332 CA VAL A 113 0.396 5.682 11.655 1.00 0.00 C ATOM 1333 C VAL A 113 1.746 6.102 12.238 1.00 0.00 C ATOM 1334 O VAL A 113 2.750 5.444 12.040 1.00 0.00 O ATOM 1335 CB VAL A 113 0.155 4.199 11.952 1.00 0.00 C ATOM 1336 CG1 VAL A 113 -0.175 4.016 13.436 1.00 0.00 C ATOM 1337 CG2 VAL A 113 -1.013 3.686 11.101 1.00 0.00 C ATOM 0 H VAL A 113 0.797 5.114 9.637 1.00 0.00 H new ATOM 0 HA VAL A 113 -0.397 6.281 12.103 1.00 0.00 H new ATOM 0 HB VAL A 113 1.055 3.634 11.710 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -0.346 2.960 13.643 1.00 0.00 H new ATOM 0 HG12 VAL A 113 0.658 4.374 14.041 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -1.072 4.584 13.682 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -1.182 2.631 11.314 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -1.913 4.253 11.339 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.775 3.809 10.044 1.00 0.00 H new ATOM 1405 N THR A 119 4.240 9.143 6.038 1.00 0.00 N ATOM 1406 CA THR A 119 4.041 8.460 4.726 1.00 0.00 C ATOM 1407 C THR A 119 3.403 9.430 3.725 1.00 0.00 C ATOM 1408 O THR A 119 2.520 10.192 4.065 1.00 0.00 O ATOM 1409 CB THR A 119 3.119 7.251 4.915 1.00 0.00 C ATOM 1410 OG1 THR A 119 3.598 6.452 5.989 1.00 0.00 O ATOM 1411 CG2 THR A 119 3.091 6.421 3.630 1.00 0.00 C ATOM 0 HA THR A 119 5.007 8.131 4.344 1.00 0.00 H new ATOM 0 HB THR A 119 2.111 7.597 5.143 1.00 0.00 H new ATOM 0 HG1 THR A 119 3.003 6.552 6.762 1.00 0.00 H new ATOM 0 HG21 THR A 119 2.435 5.561 3.766 1.00 0.00 H new ATOM 0 HG22 THR A 119 2.720 7.034 2.809 1.00 0.00 H new ATOM 0 HG23 THR A 119 4.098 6.075 3.398 1.00 0.00 H new ATOM 1419 N TYR A 120 3.846 9.402 2.489 1.00 0.00 N ATOM 1420 CA TYR A 120 3.271 10.314 1.446 1.00 0.00 C ATOM 1421 C TYR A 120 2.966 9.507 0.185 1.00 0.00 C ATOM 1422 O TYR A 120 3.521 8.449 -0.034 1.00 0.00 O ATOM 1423 CB TYR A 120 4.279 11.422 1.111 1.00 0.00 C ATOM 1424 CG TYR A 120 5.559 10.814 0.589 1.00 0.00 C ATOM 1425 CD1 TYR A 120 5.703 10.543 -0.779 1.00 0.00 C ATOM 1426 CD2 TYR A 120 6.605 10.528 1.471 1.00 0.00 C ATOM 1427 CE1 TYR A 120 6.893 9.985 -1.261 1.00 0.00 C ATOM 1428 CE2 TYR A 120 7.796 9.971 0.990 1.00 0.00 C ATOM 1429 CZ TYR A 120 7.940 9.699 -0.376 1.00 0.00 C ATOM 1430 OH TYR A 120 9.114 9.150 -0.849 1.00 0.00 O ATOM 0 H TYR A 120 4.585 8.783 2.156 1.00 0.00 H new ATOM 0 HA TYR A 120 2.355 10.766 1.826 1.00 0.00 H new ATOM 0 HB2 TYR A 120 3.857 12.096 0.366 1.00 0.00 H new ATOM 0 HB3 TYR A 120 4.486 12.018 2.000 1.00 0.00 H new ATOM 0 HD1 TYR A 120 4.896 10.765 -1.461 1.00 0.00 H new ATOM 0 HD2 TYR A 120 6.494 10.737 2.525 1.00 0.00 H new ATOM 0 HE1 TYR A 120 7.004 9.775 -2.315 1.00 0.00 H new ATOM 0 HE2 TYR A 120 8.604 9.751 1.672 1.00 0.00 H new ATOM 0 HH TYR A 120 9.736 9.016 -0.104 1.00 0.00 H new ATOM 1440 N VAL A 121 2.073 10.000 -0.644 1.00 0.00 N ATOM 1441 CA VAL A 121 1.703 9.272 -1.902 1.00 0.00 C ATOM 1442 C VAL A 121 2.043 10.147 -3.115 1.00 0.00 C ATOM 1443 O VAL A 121 1.660 11.298 -3.188 1.00 0.00 O ATOM 1444 CB VAL A 121 0.196 8.968 -1.881 1.00 0.00 C ATOM 1445 CG1 VAL A 121 -0.608 10.260 -2.062 1.00 0.00 C ATOM 1446 CG2 VAL A 121 -0.148 7.992 -3.010 1.00 0.00 C ATOM 0 H VAL A 121 1.581 10.882 -0.501 1.00 0.00 H new ATOM 0 HA VAL A 121 2.260 8.338 -1.969 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.059 8.522 -0.920 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -1.674 10.031 -2.045 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -0.373 10.951 -1.253 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -0.350 10.718 -3.017 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -1.217 7.778 -2.993 1.00 0.00 H new ATOM 0 HG22 VAL A 121 0.118 8.437 -3.969 1.00 0.00 H new ATOM 0 HG23 VAL A 121 0.410 7.066 -2.873 1.00 0.00 H new ATOM 1456 N ASN A 122 2.763 9.606 -4.063 1.00 0.00 N ATOM 1457 CA ASN A 122 3.133 10.396 -5.274 1.00 0.00 C ATOM 1458 C ASN A 122 3.829 11.695 -4.857 1.00 0.00 C ATOM 1459 O ASN A 122 3.631 12.733 -5.452 1.00 0.00 O ATOM 1460 CB ASN A 122 1.877 10.703 -6.096 1.00 0.00 C ATOM 1461 CG ASN A 122 1.372 9.409 -6.739 1.00 0.00 C ATOM 1462 OD1 ASN A 122 2.107 8.449 -6.855 1.00 0.00 O ATOM 1463 ND2 ASN A 122 0.139 9.339 -7.163 1.00 0.00 N ATOM 0 H ASN A 122 3.112 8.648 -4.050 1.00 0.00 H new ATOM 0 HA ASN A 122 3.821 9.814 -5.888 1.00 0.00 H new ATOM 0 HB2 ASN A 122 1.105 11.132 -5.457 1.00 0.00 H new ATOM 0 HB3 ASN A 122 2.102 11.442 -6.865 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -0.205 8.479 -7.591 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -0.480 10.144 -7.067 1.00 0.00 H new ATOM 1470 N ARG A 123 4.647 11.633 -3.839 1.00 0.00 N ATOM 1471 CA ARG A 123 5.383 12.843 -3.361 1.00 0.00 C ATOM 1472 C ARG A 123 4.385 13.897 -2.865 1.00 0.00 C ATOM 1473 O ARG A 123 4.479 15.063 -3.191 1.00 0.00 O ATOM 1474 CB ARG A 123 6.227 13.419 -4.506 1.00 0.00 C ATOM 1475 CG ARG A 123 7.265 14.392 -3.942 1.00 0.00 C ATOM 1476 CD ARG A 123 8.161 14.889 -5.077 1.00 0.00 C ATOM 1477 NE ARG A 123 9.164 15.847 -4.529 1.00 0.00 N ATOM 1478 CZ ARG A 123 10.135 16.283 -5.283 1.00 0.00 C ATOM 1479 NH1 ARG A 123 10.231 15.886 -6.522 1.00 0.00 N ATOM 1480 NH2 ARG A 123 11.013 17.118 -4.798 1.00 0.00 N ATOM 0 H ARG A 123 4.840 10.782 -3.310 1.00 0.00 H new ATOM 0 HA ARG A 123 6.040 12.563 -2.538 1.00 0.00 H new ATOM 0 HB2 ARG A 123 6.725 12.613 -5.045 1.00 0.00 H new ATOM 0 HB3 ARG A 123 5.585 13.932 -5.222 1.00 0.00 H new ATOM 0 HG2 ARG A 123 6.767 15.234 -3.461 1.00 0.00 H new ATOM 0 HG3 ARG A 123 7.866 13.898 -3.178 1.00 0.00 H new ATOM 0 HD2 ARG A 123 8.666 14.048 -5.552 1.00 0.00 H new ATOM 0 HD3 ARG A 123 7.559 15.375 -5.845 1.00 0.00 H new ATOM 0 HE ARG A 123 9.090 16.162 -3.562 1.00 0.00 H new ATOM 0 HH11 ARG A 123 9.546 15.233 -6.903 1.00 0.00 H new ATOM 0 HH12 ARG A 123 10.991 16.228 -7.110 1.00 0.00 H new ATOM 0 HH21 ARG A 123 10.940 17.430 -3.829 1.00 0.00 H new ATOM 0 HH22 ARG A 123 11.772 17.459 -5.387 1.00 0.00 H new ATOM 1494 N GLU A 124 3.428 13.493 -2.072 1.00 0.00 N ATOM 1495 CA GLU A 124 2.423 14.465 -1.542 1.00 0.00 C ATOM 1496 C GLU A 124 1.961 14.007 -0.148 1.00 0.00 C ATOM 1497 O GLU A 124 0.999 13.275 -0.029 1.00 0.00 O ATOM 1498 CB GLU A 124 1.222 14.515 -2.492 1.00 0.00 C ATOM 1499 CG GLU A 124 1.677 15.031 -3.861 1.00 0.00 C ATOM 1500 CD GLU A 124 0.460 15.444 -4.690 1.00 0.00 C ATOM 1501 OE1 GLU A 124 -0.014 16.552 -4.499 1.00 0.00 O ATOM 1502 OE2 GLU A 124 0.025 14.647 -5.505 1.00 0.00 O ATOM 0 H GLU A 124 3.298 12.529 -1.767 1.00 0.00 H new ATOM 0 HA GLU A 124 2.869 15.457 -1.468 1.00 0.00 H new ATOM 0 HB2 GLU A 124 0.783 13.523 -2.593 1.00 0.00 H new ATOM 0 HB3 GLU A 124 0.449 15.166 -2.084 1.00 0.00 H new ATOM 0 HG2 GLU A 124 2.348 15.881 -3.735 1.00 0.00 H new ATOM 0 HG3 GLU A 124 2.238 14.256 -4.383 1.00 0.00 H new ATOM 1509 N PRO A 125 2.639 14.422 0.901 1.00 0.00 N ATOM 1510 CA PRO A 125 2.270 14.027 2.298 1.00 0.00 C ATOM 1511 C PRO A 125 0.813 14.365 2.635 1.00 0.00 C ATOM 1512 O PRO A 125 0.345 15.458 2.389 1.00 0.00 O ATOM 1513 CB PRO A 125 3.244 14.836 3.181 1.00 0.00 C ATOM 1514 CG PRO A 125 4.396 15.175 2.286 1.00 0.00 C ATOM 1515 CD PRO A 125 3.823 15.295 0.874 1.00 0.00 C ATOM 0 HA PRO A 125 2.348 12.950 2.448 1.00 0.00 H new ATOM 0 HB2 PRO A 125 2.768 15.737 3.569 1.00 0.00 H new ATOM 0 HB3 PRO A 125 3.572 14.253 4.042 1.00 0.00 H new ATOM 0 HG2 PRO A 125 4.867 16.108 2.595 1.00 0.00 H new ATOM 0 HG3 PRO A 125 5.163 14.402 2.330 1.00 0.00 H new ATOM 0 HD2 PRO A 125 3.556 16.325 0.637 1.00 0.00 H new ATOM 0 HD3 PRO A 125 4.542 14.971 0.122 1.00 0.00 H new ATOM 1523 N VAL A 126 0.094 13.430 3.203 1.00 0.00 N ATOM 1524 CA VAL A 126 -1.334 13.694 3.565 1.00 0.00 C ATOM 1525 C VAL A 126 -1.733 12.835 4.765 1.00 0.00 C ATOM 1526 O VAL A 126 -1.156 11.796 5.022 1.00 0.00 O ATOM 1527 CB VAL A 126 -2.244 13.357 2.382 1.00 0.00 C ATOM 1528 CG1 VAL A 126 -1.983 14.337 1.238 1.00 0.00 C ATOM 1529 CG2 VAL A 126 -1.970 11.928 1.904 1.00 0.00 C ATOM 0 H VAL A 126 0.433 12.496 3.432 1.00 0.00 H new ATOM 0 HA VAL A 126 -1.442 14.749 3.818 1.00 0.00 H new ATOM 0 HB VAL A 126 -3.284 13.436 2.698 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -2.632 14.095 0.396 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -2.189 15.353 1.575 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -0.941 14.263 0.926 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -2.621 11.695 1.062 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -0.929 11.842 1.592 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -2.164 11.229 2.717 1.00 0.00 H new ATOM 1539 N ASP A 127 -2.728 13.258 5.495 1.00 0.00 N ATOM 1540 CA ASP A 127 -3.186 12.471 6.675 1.00 0.00 C ATOM 1541 C ASP A 127 -3.735 11.119 6.203 1.00 0.00 C ATOM 1542 O ASP A 127 -3.505 10.093 6.813 1.00 0.00 O ATOM 1543 CB ASP A 127 -4.287 13.252 7.404 1.00 0.00 C ATOM 1544 CG ASP A 127 -4.751 12.463 8.629 1.00 0.00 C ATOM 1545 OD1 ASP A 127 -4.311 11.336 8.784 1.00 0.00 O ATOM 1546 OD2 ASP A 127 -5.539 13.000 9.392 1.00 0.00 O ATOM 0 H ASP A 127 -3.246 14.120 5.324 1.00 0.00 H new ATOM 0 HA ASP A 127 -2.350 12.302 7.354 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -3.913 14.229 7.709 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -5.127 13.428 6.733 1.00 0.00 H new ATOM 1551 N SER A 128 -4.463 11.114 5.118 1.00 0.00 N ATOM 1552 CA SER A 128 -5.036 9.838 4.597 1.00 0.00 C ATOM 1553 C SER A 128 -5.430 10.021 3.130 1.00 0.00 C ATOM 1554 O SER A 128 -5.676 11.123 2.680 1.00 0.00 O ATOM 1555 CB SER A 128 -6.272 9.464 5.415 1.00 0.00 C ATOM 1556 OG SER A 128 -6.907 8.339 4.822 1.00 0.00 O ATOM 0 H SER A 128 -4.687 11.943 4.567 1.00 0.00 H new ATOM 0 HA SER A 128 -4.294 9.044 4.678 1.00 0.00 H new ATOM 0 HB2 SER A 128 -5.987 9.235 6.442 1.00 0.00 H new ATOM 0 HB3 SER A 128 -6.963 10.306 5.456 1.00 0.00 H new ATOM 0 HG SER A 128 -6.234 7.661 4.604 1.00 0.00 H new ATOM 1562 N ALA A 129 -5.492 8.953 2.377 1.00 0.00 N ATOM 1563 CA ALA A 129 -5.871 9.077 0.937 1.00 0.00 C ATOM 1564 C ALA A 129 -6.504 7.771 0.457 1.00 0.00 C ATOM 1565 O ALA A 129 -6.279 6.717 1.018 1.00 0.00 O ATOM 1566 CB ALA A 129 -4.627 9.381 0.100 1.00 0.00 C ATOM 0 H ALA A 129 -5.297 8.004 2.695 1.00 0.00 H new ATOM 0 HA ALA A 129 -6.589 9.889 0.824 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -4.908 9.471 -0.949 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -4.181 10.317 0.438 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -3.905 8.573 0.215 1.00 0.00 H new ATOM 1572 N VAL A 130 -7.300 7.834 -0.578 1.00 0.00 N ATOM 1573 CA VAL A 130 -7.957 6.599 -1.101 1.00 0.00 C ATOM 1574 C VAL A 130 -7.038 5.936 -2.132 1.00 0.00 C ATOM 1575 O VAL A 130 -6.532 6.576 -3.032 1.00 0.00 O ATOM 1576 CB VAL A 130 -9.289 6.976 -1.753 1.00 0.00 C ATOM 1577 CG1 VAL A 130 -9.919 5.735 -2.390 1.00 0.00 C ATOM 1578 CG2 VAL A 130 -10.232 7.535 -0.683 1.00 0.00 C ATOM 0 H VAL A 130 -7.524 8.690 -1.085 1.00 0.00 H new ATOM 0 HA VAL A 130 -8.142 5.901 -0.285 1.00 0.00 H new ATOM 0 HB VAL A 130 -9.119 7.728 -2.523 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -10.868 6.006 -2.854 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -9.246 5.334 -3.148 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -10.093 4.981 -1.623 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -11.183 7.806 -1.142 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -10.401 6.779 0.084 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -9.784 8.419 -0.229 1.00 0.00 H new ATOM 1588 N LEU A 131 -6.805 4.661 -1.992 1.00 0.00 N ATOM 1589 CA LEU A 131 -5.907 3.949 -2.944 1.00 0.00 C ATOM 1590 C LEU A 131 -6.643 3.670 -4.258 1.00 0.00 C ATOM 1591 O LEU A 131 -7.844 3.485 -4.287 1.00 0.00 O ATOM 1592 CB LEU A 131 -5.451 2.627 -2.318 1.00 0.00 C ATOM 1593 CG LEU A 131 -4.541 2.904 -1.108 1.00 0.00 C ATOM 1594 CD1 LEU A 131 -4.324 1.600 -0.329 1.00 0.00 C ATOM 1595 CD2 LEU A 131 -3.178 3.466 -1.568 1.00 0.00 C ATOM 0 H LEU A 131 -7.200 4.078 -1.254 1.00 0.00 H new ATOM 0 HA LEU A 131 -5.040 4.575 -3.153 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -6.318 2.045 -2.006 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -4.916 2.031 -3.057 1.00 0.00 H new ATOM 0 HG LEU A 131 -5.022 3.644 -0.468 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -3.680 1.792 0.529 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -5.285 1.218 0.017 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -3.853 0.862 -0.979 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -2.550 3.655 -0.697 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -2.687 2.743 -2.219 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -3.333 4.398 -2.112 1.00 0.00 H new ATOM 1607 N ALA A 132 -5.922 3.643 -5.350 1.00 0.00 N ATOM 1608 CA ALA A 132 -6.554 3.381 -6.678 1.00 0.00 C ATOM 1609 C ALA A 132 -5.536 2.692 -7.596 1.00 0.00 C ATOM 1610 O ALA A 132 -4.351 2.687 -7.332 1.00 0.00 O ATOM 1611 CB ALA A 132 -7.002 4.707 -7.303 1.00 0.00 C ATOM 0 H ALA A 132 -4.913 3.793 -5.378 1.00 0.00 H new ATOM 0 HA ALA A 132 -7.422 2.735 -6.550 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -7.463 4.515 -8.272 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -7.725 5.193 -6.647 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -6.137 5.357 -7.435 1.00 0.00 H new ATOM 1617 N ASN A 133 -5.995 2.101 -8.667 1.00 0.00 N ATOM 1618 CA ASN A 133 -5.065 1.396 -9.600 1.00 0.00 C ATOM 1619 C ASN A 133 -3.975 2.353 -10.093 1.00 0.00 C ATOM 1620 O ASN A 133 -4.231 3.495 -10.411 1.00 0.00 O ATOM 1621 CB ASN A 133 -5.862 0.882 -10.801 1.00 0.00 C ATOM 1622 CG ASN A 133 -6.753 -0.277 -10.359 1.00 0.00 C ATOM 1623 OD1 ASN A 133 -7.890 -0.075 -9.982 1.00 0.00 O ATOM 1624 ND2 ASN A 133 -6.283 -1.493 -10.390 1.00 0.00 N ATOM 0 H ASN A 133 -6.978 2.076 -8.938 1.00 0.00 H new ATOM 0 HA ASN A 133 -4.594 0.566 -9.074 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -6.470 1.684 -11.218 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -5.183 0.554 -11.588 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -6.870 -2.274 -10.098 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -5.328 -1.663 -10.707 1.00 0.00 H new ATOM 1631 N GLY A 134 -2.756 1.883 -10.165 1.00 0.00 N ATOM 1632 CA GLY A 134 -1.643 2.751 -10.645 1.00 0.00 C ATOM 1633 C GLY A 134 -1.167 3.661 -9.511 1.00 0.00 C ATOM 1634 O GLY A 134 -0.442 4.612 -9.732 1.00 0.00 O ATOM 0 H GLY A 134 -2.485 0.933 -9.911 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -0.817 2.135 -11.000 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -1.978 3.353 -11.490 1.00 0.00 H new ATOM 1638 N ASP A 135 -1.562 3.383 -8.300 1.00 0.00 N ATOM 1639 CA ASP A 135 -1.123 4.239 -7.160 1.00 0.00 C ATOM 1640 C ASP A 135 0.269 3.801 -6.694 1.00 0.00 C ATOM 1641 O ASP A 135 0.603 2.633 -6.714 1.00 0.00 O ATOM 1642 CB ASP A 135 -2.128 4.114 -6.005 1.00 0.00 C ATOM 1643 CG ASP A 135 -3.323 5.041 -6.255 1.00 0.00 C ATOM 1644 OD1 ASP A 135 -3.428 5.554 -7.358 1.00 0.00 O ATOM 1645 OD2 ASP A 135 -4.103 5.231 -5.338 1.00 0.00 O ATOM 0 H ASP A 135 -2.168 2.602 -8.049 1.00 0.00 H new ATOM 0 HA ASP A 135 -1.079 5.279 -7.483 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -2.468 3.082 -5.917 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -1.646 4.372 -5.062 1.00 0.00 H new ATOM 1650 N GLU A 136 1.078 4.741 -6.268 1.00 0.00 N ATOM 1651 CA GLU A 136 2.457 4.415 -5.780 1.00 0.00 C ATOM 1652 C GLU A 136 2.521 4.703 -4.279 1.00 0.00 C ATOM 1653 O GLU A 136 2.189 5.783 -3.836 1.00 0.00 O ATOM 1654 CB GLU A 136 3.479 5.292 -6.515 1.00 0.00 C ATOM 1655 CG GLU A 136 4.892 4.728 -6.321 1.00 0.00 C ATOM 1656 CD GLU A 136 5.323 4.904 -4.863 1.00 0.00 C ATOM 1657 OE1 GLU A 136 4.911 5.879 -4.258 1.00 0.00 O ATOM 1658 OE2 GLU A 136 6.063 4.062 -4.378 1.00 0.00 O ATOM 0 H GLU A 136 0.839 5.732 -6.237 1.00 0.00 H new ATOM 0 HA GLU A 136 2.685 3.366 -5.969 1.00 0.00 H new ATOM 0 HB2 GLU A 136 3.238 5.333 -7.577 1.00 0.00 H new ATOM 0 HB3 GLU A 136 3.432 6.314 -6.138 1.00 0.00 H new ATOM 0 HG2 GLU A 136 4.913 3.672 -6.591 1.00 0.00 H new ATOM 0 HG3 GLU A 136 5.592 5.240 -6.981 1.00 0.00 H new ATOM 1665 N VAL A 137 2.938 3.737 -3.495 1.00 0.00 N ATOM 1666 CA VAL A 137 3.023 3.934 -2.010 1.00 0.00 C ATOM 1667 C VAL A 137 4.453 3.650 -1.542 1.00 0.00 C ATOM 1668 O VAL A 137 5.046 2.652 -1.900 1.00 0.00 O ATOM 1669 CB VAL A 137 2.050 2.970 -1.313 1.00 0.00 C ATOM 1670 CG1 VAL A 137 2.309 2.965 0.198 1.00 0.00 C ATOM 1671 CG2 VAL A 137 0.611 3.422 -1.576 1.00 0.00 C ATOM 0 H VAL A 137 3.225 2.814 -3.821 1.00 0.00 H new ATOM 0 HA VAL A 137 2.757 4.961 -1.759 1.00 0.00 H new ATOM 0 HB VAL A 137 2.201 1.965 -1.707 1.00 0.00 H new ATOM 0 HG11 VAL A 137 1.615 2.279 0.684 1.00 0.00 H new ATOM 0 HG12 VAL A 137 3.332 2.643 0.391 1.00 0.00 H new ATOM 0 HG13 VAL A 137 2.164 3.970 0.595 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -0.081 2.739 -1.082 1.00 0.00 H new ATOM 0 HG22 VAL A 137 0.469 4.429 -1.184 1.00 0.00 H new ATOM 0 HG23 VAL A 137 0.419 3.420 -2.649 1.00 0.00 H new ATOM 1681 N GLN A 138 5.003 4.528 -0.739 1.00 0.00 N ATOM 1682 CA GLN A 138 6.396 4.338 -0.219 1.00 0.00 C ATOM 1683 C GLN A 138 6.349 4.262 1.307 1.00 0.00 C ATOM 1684 O GLN A 138 5.783 5.118 1.957 1.00 0.00 O ATOM 1685 CB GLN A 138 7.264 5.528 -0.647 1.00 0.00 C ATOM 1686 CG GLN A 138 8.683 5.378 -0.076 1.00 0.00 C ATOM 1687 CD GLN A 138 8.718 5.866 1.375 1.00 0.00 C ATOM 1688 OE1 GLN A 138 8.168 6.901 1.693 1.00 0.00 O ATOM 1689 NE2 GLN A 138 9.348 5.157 2.272 1.00 0.00 N ATOM 0 H GLN A 138 4.541 5.379 -0.417 1.00 0.00 H new ATOM 0 HA GLN A 138 6.821 3.418 -0.621 1.00 0.00 H new ATOM 0 HB2 GLN A 138 7.305 5.586 -1.735 1.00 0.00 H new ATOM 0 HB3 GLN A 138 6.818 6.458 -0.295 1.00 0.00 H new ATOM 0 HG2 GLN A 138 8.995 4.335 -0.125 1.00 0.00 H new ATOM 0 HG3 GLN A 138 9.389 5.951 -0.678 1.00 0.00 H new ATOM 0 HE21 GLN A 138 9.809 4.288 2.003 1.00 0.00 H new ATOM 0 HE22 GLN A 138 9.379 5.472 3.242 1.00 0.00 H new ATOM 1698 N ILE A 139 6.932 3.237 1.880 1.00 0.00 N ATOM 1699 CA ILE A 139 6.925 3.083 3.372 1.00 0.00 C ATOM 1700 C ILE A 139 8.357 3.024 3.899 1.00 0.00 C ATOM 1701 O ILE A 139 9.167 2.237 3.451 1.00 0.00 O ATOM 1702 CB ILE A 139 6.193 1.790 3.738 1.00 0.00 C ATOM 1703 CG1 ILE A 139 4.721 1.913 3.332 1.00 0.00 C ATOM 1704 CG2 ILE A 139 6.293 1.550 5.246 1.00 0.00 C ATOM 1705 CD1 ILE A 139 4.037 0.551 3.457 1.00 0.00 C ATOM 0 H ILE A 139 7.416 2.494 1.376 1.00 0.00 H new ATOM 0 HA ILE A 139 6.418 3.937 3.821 1.00 0.00 H new ATOM 0 HB ILE A 139 6.649 0.951 3.212 1.00 0.00 H new ATOM 0 HG12 ILE A 139 4.218 2.643 3.967 1.00 0.00 H new ATOM 0 HG13 ILE A 139 4.645 2.276 2.307 1.00 0.00 H new ATOM 0 HG21 ILE A 139 5.771 0.629 5.503 1.00 0.00 H new ATOM 0 HG22 ILE A 139 7.341 1.465 5.532 1.00 0.00 H new ATOM 0 HG23 ILE A 139 5.838 2.385 5.778 1.00 0.00 H new ATOM 0 HD11 ILE A 139 2.990 0.642 3.168 1.00 0.00 H new ATOM 0 HD12 ILE A 139 4.533 -0.167 2.804 1.00 0.00 H new ATOM 0 HD13 ILE A 139 4.099 0.206 4.489 1.00 0.00 H new ATOM 1717 N GLY A 140 8.670 3.851 4.857 1.00 0.00 N ATOM 1718 CA GLY A 140 10.043 3.849 5.429 1.00 0.00 C ATOM 1719 C GLY A 140 11.067 4.029 4.309 1.00 0.00 C ATOM 1720 O GLY A 140 11.249 5.114 3.791 1.00 0.00 O ATOM 0 H GLY A 140 8.031 4.530 5.269 1.00 0.00 H new ATOM 0 HA2 GLY A 140 10.144 4.651 6.160 1.00 0.00 H new ATOM 0 HA3 GLY A 140 10.227 2.913 5.956 1.00 0.00 H new ATOM 1724 N LYS A 141 11.740 2.968 3.936 1.00 0.00 N ATOM 1725 CA LYS A 141 12.770 3.046 2.851 1.00 0.00 C ATOM 1726 C LYS A 141 12.336 2.172 1.672 1.00 0.00 C ATOM 1727 O LYS A 141 12.736 2.386 0.546 1.00 0.00 O ATOM 1728 CB LYS A 141 14.100 2.533 3.403 1.00 0.00 C ATOM 1729 CG LYS A 141 15.199 2.716 2.358 1.00 0.00 C ATOM 1730 CD LYS A 141 16.531 2.245 2.945 1.00 0.00 C ATOM 1731 CE LYS A 141 17.645 2.434 1.914 1.00 0.00 C ATOM 1732 NZ LYS A 141 17.789 3.883 1.602 1.00 0.00 N ATOM 0 H LYS A 141 11.619 2.040 4.341 1.00 0.00 H new ATOM 0 HA LYS A 141 12.879 4.076 2.512 1.00 0.00 H new ATOM 0 HB2 LYS A 141 14.358 3.073 4.314 1.00 0.00 H new ATOM 0 HB3 LYS A 141 14.011 1.480 3.670 1.00 0.00 H new ATOM 0 HG2 LYS A 141 14.962 2.147 1.459 1.00 0.00 H new ATOM 0 HG3 LYS A 141 15.267 3.763 2.063 1.00 0.00 H new ATOM 0 HD2 LYS A 141 16.760 2.808 3.850 1.00 0.00 H new ATOM 0 HD3 LYS A 141 16.462 1.196 3.232 1.00 0.00 H new ATOM 0 HE2 LYS A 141 18.584 2.039 2.301 1.00 0.00 H new ATOM 0 HE3 LYS A 141 17.414 1.876 1.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 18.733 4.060 1.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 17.063 4.163 0.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 17.672 4.439 2.473 1.00 0.00 H new ATOM 1746 N PHE A 142 11.529 1.181 1.928 1.00 0.00 N ATOM 1747 CA PHE A 142 11.072 0.279 0.836 1.00 0.00 C ATOM 1748 C PHE A 142 9.998 0.972 -0.002 1.00 0.00 C ATOM 1749 O PHE A 142 9.159 1.686 0.512 1.00 0.00 O ATOM 1750 CB PHE A 142 10.495 -0.993 1.461 1.00 0.00 C ATOM 1751 CG PHE A 142 11.628 -1.871 1.946 1.00 0.00 C ATOM 1752 CD1 PHE A 142 12.400 -1.470 3.045 1.00 0.00 C ATOM 1753 CD2 PHE A 142 11.914 -3.075 1.293 1.00 0.00 C ATOM 1754 CE1 PHE A 142 13.455 -2.275 3.490 1.00 0.00 C ATOM 1755 CE2 PHE A 142 12.970 -3.878 1.738 1.00 0.00 C ATOM 1756 CZ PHE A 142 13.740 -3.480 2.836 1.00 0.00 C ATOM 0 H PHE A 142 11.164 0.956 2.854 1.00 0.00 H new ATOM 0 HA PHE A 142 11.913 0.030 0.189 1.00 0.00 H new ATOM 0 HB2 PHE A 142 9.837 -0.737 2.291 1.00 0.00 H new ATOM 0 HB3 PHE A 142 9.891 -1.530 0.729 1.00 0.00 H new ATOM 0 HD1 PHE A 142 12.181 -0.540 3.548 1.00 0.00 H new ATOM 0 HD2 PHE A 142 11.320 -3.384 0.446 1.00 0.00 H new ATOM 0 HE1 PHE A 142 14.049 -1.967 4.338 1.00 0.00 H new ATOM 0 HE2 PHE A 142 13.191 -4.807 1.233 1.00 0.00 H new ATOM 0 HZ PHE A 142 14.554 -4.102 3.179 1.00 0.00 H new ATOM 1766 N ARG A 143 10.012 0.751 -1.295 1.00 0.00 N ATOM 1767 CA ARG A 143 8.990 1.373 -2.191 1.00 0.00 C ATOM 1768 C ARG A 143 8.021 0.288 -2.658 1.00 0.00 C ATOM 1769 O ARG A 143 8.422 -0.807 -2.999 1.00 0.00 O ATOM 1770 CB ARG A 143 9.681 1.992 -3.409 1.00 0.00 C ATOM 1771 CG ARG A 143 10.515 3.195 -2.967 1.00 0.00 C ATOM 1772 CD ARG A 143 11.208 3.810 -4.184 1.00 0.00 C ATOM 1773 NE ARG A 143 12.050 4.960 -3.745 1.00 0.00 N ATOM 1774 CZ ARG A 143 11.530 6.154 -3.628 1.00 0.00 C ATOM 1775 NH1 ARG A 143 10.260 6.343 -3.862 1.00 0.00 N ATOM 1776 NH2 ARG A 143 12.281 7.156 -3.263 1.00 0.00 N ATOM 0 H ARG A 143 10.695 0.161 -1.770 1.00 0.00 H new ATOM 0 HA ARG A 143 8.450 2.151 -1.651 1.00 0.00 H new ATOM 0 HB2 ARG A 143 10.319 1.252 -3.893 1.00 0.00 H new ATOM 0 HB3 ARG A 143 8.938 2.302 -4.144 1.00 0.00 H new ATOM 0 HG2 ARG A 143 9.877 3.936 -2.485 1.00 0.00 H new ATOM 0 HG3 ARG A 143 11.257 2.886 -2.230 1.00 0.00 H new ATOM 0 HD2 ARG A 143 11.825 3.062 -4.682 1.00 0.00 H new ATOM 0 HD3 ARG A 143 10.466 4.144 -4.909 1.00 0.00 H new ATOM 0 HE ARG A 143 13.037 4.814 -3.535 1.00 0.00 H new ATOM 0 HH11 ARG A 143 9.670 5.558 -4.137 1.00 0.00 H new ATOM 0 HH12 ARG A 143 9.858 7.276 -3.770 1.00 0.00 H new ATOM 0 HH21 ARG A 143 13.271 7.007 -3.070 1.00 0.00 H new ATOM 0 HH22 ARG A 143 11.878 8.088 -3.171 1.00 0.00 H new ATOM 1790 N LEU A 144 6.745 0.580 -2.667 1.00 0.00 N ATOM 1791 CA LEU A 144 5.735 -0.432 -3.105 1.00 0.00 C ATOM 1792 C LEU A 144 4.706 0.238 -4.014 1.00 0.00 C ATOM 1793 O LEU A 144 4.492 1.433 -3.945 1.00 0.00 O ATOM 1794 CB LEU A 144 5.020 -1.023 -1.881 1.00 0.00 C ATOM 1795 CG LEU A 144 6.022 -1.809 -0.996 1.00 0.00 C ATOM 1796 CD1 LEU A 144 6.605 -0.891 0.089 1.00 0.00 C ATOM 1797 CD2 LEU A 144 5.308 -2.989 -0.321 1.00 0.00 C ATOM 0 H LEU A 144 6.357 1.481 -2.388 1.00 0.00 H new ATOM 0 HA LEU A 144 6.242 -1.231 -3.646 1.00 0.00 H new ATOM 0 HB2 LEU A 144 4.561 -0.224 -1.299 1.00 0.00 H new ATOM 0 HB3 LEU A 144 4.216 -1.684 -2.206 1.00 0.00 H new ATOM 0 HG LEU A 144 6.828 -2.179 -1.630 1.00 0.00 H new ATOM 0 HD11 LEU A 144 7.307 -1.454 0.704 1.00 0.00 H new ATOM 0 HD12 LEU A 144 7.124 -0.056 -0.381 1.00 0.00 H new ATOM 0 HD13 LEU A 144 5.798 -0.510 0.716 1.00 0.00 H new ATOM 0 HD21 LEU A 144 6.017 -3.537 0.299 1.00 0.00 H new ATOM 0 HD22 LEU A 144 4.495 -2.615 0.302 1.00 0.00 H new ATOM 0 HD23 LEU A 144 4.904 -3.654 -1.084 1.00 0.00 H new ATOM 1809 N VAL A 145 4.066 -0.529 -4.864 1.00 0.00 N ATOM 1810 CA VAL A 145 3.035 0.038 -5.791 1.00 0.00 C ATOM 1811 C VAL A 145 1.690 -0.639 -5.516 1.00 0.00 C ATOM 1812 O VAL A 145 1.595 -1.846 -5.422 1.00 0.00 O ATOM 1813 CB VAL A 145 3.458 -0.218 -7.241 1.00 0.00 C ATOM 1814 CG1 VAL A 145 3.531 -1.724 -7.498 1.00 0.00 C ATOM 1815 CG2 VAL A 145 2.436 0.414 -8.192 1.00 0.00 C ATOM 0 H VAL A 145 4.215 -1.534 -4.956 1.00 0.00 H new ATOM 0 HA VAL A 145 2.942 1.112 -5.630 1.00 0.00 H new ATOM 0 HB VAL A 145 4.439 0.226 -7.414 1.00 0.00 H new ATOM 0 HG11 VAL A 145 3.832 -1.903 -8.530 1.00 0.00 H new ATOM 0 HG12 VAL A 145 4.261 -2.173 -6.824 1.00 0.00 H new ATOM 0 HG13 VAL A 145 2.552 -2.171 -7.323 1.00 0.00 H new ATOM 0 HG21 VAL A 145 2.737 0.232 -9.223 1.00 0.00 H new ATOM 0 HG22 VAL A 145 1.455 -0.027 -8.017 1.00 0.00 H new ATOM 0 HG23 VAL A 145 2.388 1.488 -8.013 1.00 0.00 H new ATOM 1825 N PHE A 146 0.650 0.140 -5.367 1.00 0.00 N ATOM 1826 CA PHE A 146 -0.699 -0.437 -5.079 1.00 0.00 C ATOM 1827 C PHE A 146 -1.482 -0.612 -6.382 1.00 0.00 C ATOM 1828 O PHE A 146 -1.732 0.337 -7.110 1.00 0.00 O ATOM 1829 CB PHE A 146 -1.452 0.517 -4.147 1.00 0.00 C ATOM 1830 CG PHE A 146 -2.867 0.030 -3.942 1.00 0.00 C ATOM 1831 CD1 PHE A 146 -3.877 0.433 -4.824 1.00 0.00 C ATOM 1832 CD2 PHE A 146 -3.173 -0.810 -2.864 1.00 0.00 C ATOM 1833 CE1 PHE A 146 -5.191 -0.004 -4.631 1.00 0.00 C ATOM 1834 CE2 PHE A 146 -4.490 -1.247 -2.671 1.00 0.00 C ATOM 1835 CZ PHE A 146 -5.498 -0.844 -3.555 1.00 0.00 C ATOM 0 H PHE A 146 0.677 1.158 -5.433 1.00 0.00 H new ATOM 0 HA PHE A 146 -0.589 -1.412 -4.604 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -0.939 0.582 -3.188 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -1.462 1.521 -4.572 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -3.641 1.082 -5.654 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -2.395 -1.120 -2.182 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -5.969 0.307 -5.312 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -4.728 -1.895 -1.840 1.00 0.00 H new ATOM 0 HZ PHE A 146 -6.513 -1.182 -3.406 1.00 0.00 H new ATOM 1845 N LEU A 147 -1.868 -1.833 -6.678 1.00 0.00 N ATOM 1846 CA LEU A 147 -2.640 -2.116 -7.930 1.00 0.00 C ATOM 1847 C LEU A 147 -3.822 -3.033 -7.599 1.00 0.00 C ATOM 1848 O LEU A 147 -3.766 -3.827 -6.680 1.00 0.00 O ATOM 1849 CB LEU A 147 -1.716 -2.802 -8.949 1.00 0.00 C ATOM 1850 CG LEU A 147 -0.763 -1.767 -9.587 1.00 0.00 C ATOM 1851 CD1 LEU A 147 0.506 -2.466 -10.087 1.00 0.00 C ATOM 1852 CD2 LEU A 147 -1.442 -1.085 -10.785 1.00 0.00 C ATOM 0 H LEU A 147 -1.679 -2.651 -6.100 1.00 0.00 H new ATOM 0 HA LEU A 147 -3.016 -1.184 -8.353 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -1.138 -3.585 -8.457 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -2.312 -3.285 -9.724 1.00 0.00 H new ATOM 0 HG LEU A 147 -0.511 -1.023 -8.831 1.00 0.00 H new ATOM 0 HD11 LEU A 147 1.174 -1.731 -10.536 1.00 0.00 H new ATOM 0 HD12 LEU A 147 1.009 -2.950 -9.250 1.00 0.00 H new ATOM 0 HD13 LEU A 147 0.239 -3.216 -10.832 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -0.759 -0.358 -11.225 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -1.703 -1.836 -11.531 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -2.346 -0.577 -10.450 1.00 0.00 H new ATOM 1864 N THR A 148 -4.893 -2.920 -8.346 1.00 0.00 N ATOM 1865 CA THR A 148 -6.101 -3.770 -8.099 1.00 0.00 C ATOM 1866 C THR A 148 -6.515 -4.443 -9.408 1.00 0.00 C ATOM 1867 O THR A 148 -6.154 -4.005 -10.482 1.00 0.00 O ATOM 1868 CB THR A 148 -7.243 -2.881 -7.599 1.00 0.00 C ATOM 1869 OG1 THR A 148 -7.869 -2.245 -8.705 1.00 0.00 O ATOM 1870 CG2 THR A 148 -6.684 -1.822 -6.647 1.00 0.00 C ATOM 0 H THR A 148 -4.983 -2.268 -9.125 1.00 0.00 H new ATOM 0 HA THR A 148 -5.875 -4.531 -7.352 1.00 0.00 H new ATOM 0 HB THR A 148 -7.976 -3.492 -7.072 1.00 0.00 H new ATOM 0 HG1 THR A 148 -7.824 -1.273 -8.592 1.00 0.00 H new ATOM 0 HG21 THR A 148 -7.496 -1.188 -6.290 1.00 0.00 H new ATOM 0 HG22 THR A 148 -6.206 -2.312 -5.798 1.00 0.00 H new ATOM 0 HG23 THR A 148 -5.951 -1.210 -7.173 1.00 0.00 H new