USER MOD reduce.3.24.130724 H: found=0, std=0, add=379, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 379 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 100 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 121 CYS SG : rot 113:sc= 0.21 USER MOD Single : A 85 LYS NZ :NH3+ -161:sc= -0.132 (180deg=-0.709) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 HIS : no HD1:sc= -0.481 K(o=-0.48,f=-1.3) USER MOD Single : A 91 MET CE :methyl -165:sc= -0.183 (180deg=-0.792) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -2.32 K(o=-2.3,f=-3) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot -69:sc= 0.806 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot 120:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ -159:sc= -0.0495 (180deg=-0.262) USER MOD Single : A 126 GLN : amide:sc= -0.161 X(o=-0.16,f=-0.32) USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc=-0.00371 X(o=-0.0037,f=-0.0037) USER MOD Single : A 135 HIS : no HD1:sc= -0.0185 X(o=-0.019,f=0) USER MOD ----------------------------------------------------------------- ATOM 462 N VAL A 82 68.314 8.417 -49.712 1.00 0.00 N ATOM 463 CA VAL A 82 68.325 9.078 -51.012 1.00 0.00 C ATOM 464 C VAL A 82 68.401 8.061 -52.144 1.00 0.00 C ATOM 465 O VAL A 82 68.969 6.980 -51.986 1.00 0.00 O ATOM 466 CB VAL A 82 69.508 10.056 -51.134 1.00 0.00 C ATOM 467 CG1 VAL A 82 69.392 10.878 -52.408 1.00 0.00 C ATOM 468 CG2 VAL A 82 69.581 10.959 -49.912 1.00 0.00 C ATOM 0 HA VAL A 82 67.392 9.637 -51.092 1.00 0.00 H new ATOM 0 HB VAL A 82 70.431 9.478 -51.186 1.00 0.00 H new ATOM 0 HG11 VAL A 82 70.237 11.563 -52.477 1.00 0.00 H new ATOM 0 HG12 VAL A 82 69.393 10.213 -53.272 1.00 0.00 H new ATOM 0 HG13 VAL A 82 68.463 11.448 -52.390 1.00 0.00 H new ATOM 0 HG21 VAL A 82 70.423 11.644 -50.015 1.00 0.00 H new ATOM 0 HG22 VAL A 82 68.657 11.531 -49.826 1.00 0.00 H new ATOM 0 HG23 VAL A 82 69.716 10.351 -49.018 1.00 0.00 H new ATOM 478 N VAL A 83 67.826 8.414 -53.289 1.00 0.00 N ATOM 479 CA VAL A 83 67.830 7.532 -54.451 1.00 0.00 C ATOM 480 C VAL A 83 69.235 7.384 -55.023 1.00 0.00 C ATOM 481 O VAL A 83 69.822 8.350 -55.510 1.00 0.00 O ATOM 482 CB VAL A 83 66.890 8.054 -55.554 1.00 0.00 C ATOM 483 CG1 VAL A 83 66.754 7.027 -56.669 1.00 0.00 C ATOM 484 CG2 VAL A 83 65.529 8.404 -54.973 1.00 0.00 C ATOM 0 H VAL A 83 67.351 9.305 -53.437 1.00 0.00 H new ATOM 0 HA VAL A 83 67.475 6.559 -54.112 1.00 0.00 H new ATOM 0 HB VAL A 83 67.323 8.961 -55.977 1.00 0.00 H new ATOM 0 HG11 VAL A 83 66.086 7.413 -57.439 1.00 0.00 H new ATOM 0 HG12 VAL A 83 67.734 6.830 -57.104 1.00 0.00 H new ATOM 0 HG13 VAL A 83 66.344 6.102 -56.264 1.00 0.00 H new ATOM 0 HG21 VAL A 83 64.878 8.771 -55.767 1.00 0.00 H new ATOM 0 HG22 VAL A 83 65.086 7.516 -54.522 1.00 0.00 H new ATOM 0 HG23 VAL A 83 65.646 9.177 -54.213 1.00 0.00 H new ATOM 494 N GLU A 84 69.768 6.168 -54.962 1.00 0.00 N ATOM 495 CA GLU A 84 71.105 5.893 -55.474 1.00 0.00 C ATOM 496 C GLU A 84 71.094 5.791 -56.997 1.00 0.00 C ATOM 497 O GLU A 84 71.841 6.489 -57.683 1.00 0.00 O ATOM 498 CB GLU A 84 71.652 4.599 -54.869 1.00 0.00 C ATOM 499 CG GLU A 84 73.163 4.595 -54.703 1.00 0.00 C ATOM 500 CD GLU A 84 73.895 4.651 -56.030 1.00 0.00 C ATOM 501 OE1 GLU A 84 74.034 3.591 -56.675 1.00 0.00 O ATOM 502 OE2 GLU A 84 74.329 5.754 -56.423 1.00 0.00 O ATOM 0 H GLU A 84 69.294 5.358 -54.563 1.00 0.00 H new ATOM 0 HA GLU A 84 71.753 6.721 -55.187 1.00 0.00 H new ATOM 0 HB2 GLU A 84 71.188 4.438 -53.896 1.00 0.00 H new ATOM 0 HB3 GLU A 84 71.362 3.761 -55.503 1.00 0.00 H new ATOM 0 HG2 GLU A 84 73.460 5.447 -54.092 1.00 0.00 H new ATOM 0 HG3 GLU A 84 73.463 3.696 -54.164 1.00 0.00 H new ATOM 509 N LYS A 85 70.242 4.915 -57.518 1.00 0.00 N ATOM 510 CA LYS A 85 70.131 4.719 -58.959 1.00 0.00 C ATOM 511 C LYS A 85 68.926 3.847 -59.299 1.00 0.00 C ATOM 512 O LYS A 85 68.257 3.322 -58.409 1.00 0.00 O ATOM 513 CB LYS A 85 71.408 4.079 -59.507 1.00 0.00 C ATOM 514 CG LYS A 85 71.783 2.780 -58.815 1.00 0.00 C ATOM 515 CD LYS A 85 71.446 1.573 -59.673 1.00 0.00 C ATOM 516 CE LYS A 85 72.578 1.237 -60.632 1.00 0.00 C ATOM 517 NZ LYS A 85 72.478 2.010 -61.901 1.00 0.00 N ATOM 0 H LYS A 85 69.618 4.329 -56.964 1.00 0.00 H new ATOM 0 HA LYS A 85 69.993 5.695 -59.423 1.00 0.00 H new ATOM 0 HB2 LYS A 85 71.281 3.889 -60.573 1.00 0.00 H new ATOM 0 HB3 LYS A 85 72.231 4.786 -59.405 1.00 0.00 H new ATOM 0 HG2 LYS A 85 72.850 2.781 -58.590 1.00 0.00 H new ATOM 0 HG3 LYS A 85 71.257 2.709 -57.863 1.00 0.00 H new ATOM 0 HD2 LYS A 85 71.244 0.715 -59.032 1.00 0.00 H new ATOM 0 HD3 LYS A 85 70.535 1.770 -60.238 1.00 0.00 H new ATOM 0 HE2 LYS A 85 73.534 1.447 -60.153 1.00 0.00 H new ATOM 0 HE3 LYS A 85 72.561 0.170 -60.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 73.046 1.544 -62.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 71.484 2.052 -62.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 72.834 2.975 -61.749 1.00 0.00 H new ATOM 531 N VAL A 86 68.656 3.697 -60.591 1.00 0.00 N ATOM 532 CA VAL A 86 67.534 2.886 -61.048 1.00 0.00 C ATOM 533 C VAL A 86 67.879 1.401 -61.016 1.00 0.00 C ATOM 534 O VAL A 86 68.864 0.968 -61.615 1.00 0.00 O ATOM 535 CB VAL A 86 67.108 3.271 -62.478 1.00 0.00 C ATOM 536 CG1 VAL A 86 65.959 2.393 -62.948 1.00 0.00 C ATOM 537 CG2 VAL A 86 66.726 4.743 -62.541 1.00 0.00 C ATOM 0 H VAL A 86 69.199 4.126 -61.340 1.00 0.00 H new ATOM 0 HA VAL A 86 66.706 3.079 -60.365 1.00 0.00 H new ATOM 0 HB VAL A 86 67.953 3.109 -63.147 1.00 0.00 H new ATOM 0 HG11 VAL A 86 65.672 2.680 -63.960 1.00 0.00 H new ATOM 0 HG12 VAL A 86 66.273 1.349 -62.942 1.00 0.00 H new ATOM 0 HG13 VAL A 86 65.107 2.520 -62.280 1.00 0.00 H new ATOM 0 HG21 VAL A 86 66.428 4.998 -63.558 1.00 0.00 H new ATOM 0 HG22 VAL A 86 65.896 4.933 -61.861 1.00 0.00 H new ATOM 0 HG23 VAL A 86 67.581 5.353 -62.250 1.00 0.00 H new ATOM 547 N LEU A 87 67.061 0.625 -60.313 1.00 0.00 N ATOM 548 CA LEU A 87 67.279 -0.813 -60.202 1.00 0.00 C ATOM 549 C LEU A 87 66.986 -1.512 -61.526 1.00 0.00 C ATOM 550 O LEU A 87 67.850 -2.182 -62.092 1.00 0.00 O ATOM 551 CB LEU A 87 66.398 -1.399 -59.097 1.00 0.00 C ATOM 552 CG LEU A 87 66.946 -2.637 -58.387 1.00 0.00 C ATOM 553 CD1 LEU A 87 67.173 -3.765 -59.381 1.00 0.00 C ATOM 554 CD2 LEU A 87 68.236 -2.303 -57.652 1.00 0.00 C ATOM 0 H LEU A 87 66.241 0.967 -59.812 1.00 0.00 H new ATOM 0 HA LEU A 87 68.326 -0.978 -59.949 1.00 0.00 H new ATOM 0 HB2 LEU A 87 66.223 -0.624 -58.350 1.00 0.00 H new ATOM 0 HB3 LEU A 87 65.429 -1.651 -59.528 1.00 0.00 H new ATOM 0 HG LEU A 87 66.210 -2.968 -57.655 1.00 0.00 H new ATOM 0 HD11 LEU A 87 67.563 -4.638 -58.858 1.00 0.00 H new ATOM 0 HD12 LEU A 87 66.229 -4.022 -59.862 1.00 0.00 H new ATOM 0 HD13 LEU A 87 67.890 -3.445 -60.137 1.00 0.00 H new ATOM 0 HD21 LEU A 87 68.612 -3.196 -57.152 1.00 0.00 H new ATOM 0 HD22 LEU A 87 68.979 -1.946 -58.365 1.00 0.00 H new ATOM 0 HD23 LEU A 87 68.042 -1.527 -56.911 1.00 0.00 H new ATOM 566 N LYS A 88 65.762 -1.349 -62.017 1.00 0.00 N ATOM 567 CA LYS A 88 65.354 -1.961 -63.276 1.00 0.00 C ATOM 568 C LYS A 88 64.124 -1.263 -63.847 1.00 0.00 C ATOM 569 O LYS A 88 63.488 -0.453 -63.171 1.00 0.00 O ATOM 570 CB LYS A 88 65.061 -3.449 -63.072 1.00 0.00 C ATOM 571 CG LYS A 88 66.273 -4.342 -63.275 1.00 0.00 C ATOM 572 CD LYS A 88 65.867 -5.785 -63.522 1.00 0.00 C ATOM 573 CE LYS A 88 67.082 -6.683 -63.698 1.00 0.00 C ATOM 574 NZ LYS A 88 66.695 -8.076 -64.054 1.00 0.00 N ATOM 0 H LYS A 88 65.035 -0.798 -61.562 1.00 0.00 H new ATOM 0 HA LYS A 88 66.174 -1.853 -63.986 1.00 0.00 H new ATOM 0 HB2 LYS A 88 64.674 -3.600 -62.064 1.00 0.00 H new ATOM 0 HB3 LYS A 88 64.276 -3.754 -63.764 1.00 0.00 H new ATOM 0 HG2 LYS A 88 66.857 -3.978 -64.120 1.00 0.00 H new ATOM 0 HG3 LYS A 88 66.916 -4.289 -62.397 1.00 0.00 H new ATOM 0 HD2 LYS A 88 65.266 -6.143 -62.686 1.00 0.00 H new ATOM 0 HD3 LYS A 88 65.240 -5.841 -64.412 1.00 0.00 H new ATOM 0 HE2 LYS A 88 67.726 -6.275 -64.477 1.00 0.00 H new ATOM 0 HE3 LYS A 88 67.664 -6.692 -62.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 67.551 -8.656 -64.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 66.102 -8.475 -63.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 66.162 -8.071 -64.947 1.00 0.00 H new ATOM 588 N HIS A 89 63.794 -1.582 -65.094 1.00 0.00 N ATOM 589 CA HIS A 89 62.638 -0.986 -65.755 1.00 0.00 C ATOM 590 C HIS A 89 61.613 -2.054 -66.125 1.00 0.00 C ATOM 591 O HIS A 89 61.928 -3.244 -66.160 1.00 0.00 O ATOM 592 CB HIS A 89 63.076 -0.227 -67.008 1.00 0.00 C ATOM 593 CG HIS A 89 63.454 -1.121 -68.149 1.00 0.00 C ATOM 594 ND1 HIS A 89 62.527 -1.736 -68.963 1.00 0.00 N ATOM 595 CD2 HIS A 89 64.669 -1.503 -68.609 1.00 0.00 C ATOM 596 CE1 HIS A 89 63.154 -2.457 -69.875 1.00 0.00 C ATOM 597 NE2 HIS A 89 64.455 -2.333 -69.682 1.00 0.00 N ATOM 0 H HIS A 89 64.310 -2.249 -65.667 1.00 0.00 H new ATOM 0 HA HIS A 89 62.173 -0.287 -65.060 1.00 0.00 H new ATOM 0 HB2 HIS A 89 62.267 0.431 -67.325 1.00 0.00 H new ATOM 0 HB3 HIS A 89 63.925 0.409 -66.759 1.00 0.00 H new ATOM 0 HD2 HIS A 89 65.628 -1.210 -68.207 1.00 0.00 H new ATOM 0 HE1 HIS A 89 62.683 -3.047 -70.647 1.00 0.00 H new ATOM 0 HE2 HIS A 89 65.182 -2.781 -70.239 1.00 0.00 H new ATOM 605 N ARG A 90 60.387 -1.621 -66.399 1.00 0.00 N ATOM 606 CA ARG A 90 59.316 -2.540 -66.764 1.00 0.00 C ATOM 607 C ARG A 90 58.280 -1.846 -67.643 1.00 0.00 C ATOM 608 O ARG A 90 58.286 -0.623 -67.779 1.00 0.00 O ATOM 609 CB ARG A 90 58.643 -3.097 -65.508 1.00 0.00 C ATOM 610 CG ARG A 90 59.232 -4.416 -65.035 1.00 0.00 C ATOM 611 CD ARG A 90 58.947 -5.539 -66.021 1.00 0.00 C ATOM 612 NE ARG A 90 60.009 -6.542 -66.030 1.00 0.00 N ATOM 613 CZ ARG A 90 60.116 -7.507 -65.124 1.00 0.00 C ATOM 614 NH1 ARG A 90 59.231 -7.600 -64.142 1.00 0.00 N ATOM 615 NH2 ARG A 90 61.110 -8.383 -65.200 1.00 0.00 N ATOM 0 H ARG A 90 60.111 -0.639 -66.375 1.00 0.00 H new ATOM 0 HA ARG A 90 59.754 -3.363 -67.329 1.00 0.00 H new ATOM 0 HB2 ARG A 90 58.726 -2.363 -64.706 1.00 0.00 H new ATOM 0 HB3 ARG A 90 57.580 -3.234 -65.706 1.00 0.00 H new ATOM 0 HG2 ARG A 90 60.309 -4.309 -64.905 1.00 0.00 H new ATOM 0 HG3 ARG A 90 58.817 -4.672 -64.060 1.00 0.00 H new ATOM 0 HD2 ARG A 90 58.001 -6.015 -65.764 1.00 0.00 H new ATOM 0 HD3 ARG A 90 58.833 -5.123 -67.022 1.00 0.00 H new ATOM 0 HE ARG A 90 60.707 -6.499 -66.773 1.00 0.00 H new ATOM 0 HH11 ARG A 90 58.465 -6.929 -64.081 1.00 0.00 H new ATOM 0 HH12 ARG A 90 59.316 -8.342 -63.448 1.00 0.00 H new ATOM 0 HH21 ARG A 90 61.793 -8.315 -65.955 1.00 0.00 H new ATOM 0 HH22 ARG A 90 61.191 -9.124 -64.504 1.00 0.00 H new ATOM 629 N MET A 91 57.393 -2.636 -68.240 1.00 0.00 N ATOM 630 CA MET A 91 56.351 -2.098 -69.106 1.00 0.00 C ATOM 631 C MET A 91 54.967 -2.378 -68.530 1.00 0.00 C ATOM 632 O MET A 91 54.591 -3.532 -68.327 1.00 0.00 O ATOM 633 CB MET A 91 56.463 -2.698 -70.509 1.00 0.00 C ATOM 634 CG MET A 91 56.345 -4.213 -70.533 1.00 0.00 C ATOM 635 SD MET A 91 56.761 -4.917 -72.140 1.00 0.00 S ATOM 636 CE MET A 91 55.881 -3.805 -73.234 1.00 0.00 C ATOM 0 H MET A 91 57.375 -3.651 -68.140 1.00 0.00 H new ATOM 0 HA MET A 91 56.488 -1.018 -69.169 1.00 0.00 H new ATOM 0 HB2 MET A 91 55.684 -2.271 -71.141 1.00 0.00 H new ATOM 0 HB3 MET A 91 57.420 -2.409 -70.943 1.00 0.00 H new ATOM 0 HG2 MET A 91 57.003 -4.637 -69.774 1.00 0.00 H new ATOM 0 HG3 MET A 91 55.327 -4.498 -70.268 1.00 0.00 H new ATOM 0 HE1 MET A 91 55.815 -4.249 -74.227 1.00 0.00 H new ATOM 0 HE2 MET A 91 54.877 -3.632 -72.846 1.00 0.00 H new ATOM 0 HE3 MET A 91 56.415 -2.857 -73.295 1.00 0.00 H new ATOM 646 N ALA A 92 54.213 -1.315 -68.268 1.00 0.00 N ATOM 647 CA ALA A 92 52.870 -1.447 -67.717 1.00 0.00 C ATOM 648 C ALA A 92 51.990 -2.307 -68.617 1.00 0.00 C ATOM 649 O ALA A 92 51.725 -1.951 -69.766 1.00 0.00 O ATOM 650 CB ALA A 92 52.244 -0.075 -67.519 1.00 0.00 C ATOM 0 H ALA A 92 54.510 -0.352 -68.429 1.00 0.00 H new ATOM 0 HA ALA A 92 52.948 -1.942 -66.749 1.00 0.00 H new ATOM 0 HB1 ALA A 92 51.241 -0.189 -67.107 1.00 0.00 H new ATOM 0 HB2 ALA A 92 52.855 0.508 -66.830 1.00 0.00 H new ATOM 0 HB3 ALA A 92 52.186 0.440 -68.478 1.00 0.00 H new ATOM 716 N GLY A 97 52.177 2.692 -70.084 1.00 0.00 N ATOM 717 CA GLY A 97 53.477 3.118 -70.569 1.00 0.00 C ATOM 718 C GLY A 97 54.607 2.267 -70.025 1.00 0.00 C ATOM 719 O GLY A 97 54.786 1.122 -70.441 1.00 0.00 O ATOM 0 HA2 GLY A 97 53.487 3.076 -71.658 1.00 0.00 H new ATOM 0 HA3 GLY A 97 53.643 4.158 -70.289 1.00 0.00 H new ATOM 723 N TYR A 98 55.371 2.826 -69.094 1.00 0.00 N ATOM 724 CA TYR A 98 56.492 2.111 -68.495 1.00 0.00 C ATOM 725 C TYR A 98 56.716 2.558 -67.054 1.00 0.00 C ATOM 726 O TYR A 98 56.110 3.524 -66.591 1.00 0.00 O ATOM 727 CB TYR A 98 57.765 2.338 -69.314 1.00 0.00 C ATOM 728 CG TYR A 98 57.691 1.776 -70.715 1.00 0.00 C ATOM 729 CD1 TYR A 98 57.875 0.419 -70.951 1.00 0.00 C ATOM 730 CD2 TYR A 98 57.439 2.602 -71.804 1.00 0.00 C ATOM 731 CE1 TYR A 98 57.809 -0.099 -72.230 1.00 0.00 C ATOM 732 CE2 TYR A 98 57.370 2.092 -73.086 1.00 0.00 C ATOM 733 CZ TYR A 98 57.556 0.741 -73.294 1.00 0.00 C ATOM 734 OH TYR A 98 57.490 0.230 -74.570 1.00 0.00 O ATOM 0 H TYR A 98 55.235 3.772 -68.737 1.00 0.00 H new ATOM 0 HA TYR A 98 56.252 1.048 -68.494 1.00 0.00 H new ATOM 0 HB2 TYR A 98 57.965 3.408 -69.371 1.00 0.00 H new ATOM 0 HB3 TYR A 98 58.608 1.884 -68.793 1.00 0.00 H new ATOM 0 HD1 TYR A 98 58.073 -0.242 -70.120 1.00 0.00 H new ATOM 0 HD2 TYR A 98 57.295 3.660 -71.645 1.00 0.00 H new ATOM 0 HE1 TYR A 98 57.955 -1.156 -72.396 1.00 0.00 H new ATOM 0 HE2 TYR A 98 57.171 2.748 -73.921 1.00 0.00 H new ATOM 0 HH TYR A 98 57.303 0.954 -75.203 1.00 0.00 H new ATOM 744 N GLU A 99 57.590 1.847 -66.349 1.00 0.00 N ATOM 745 CA GLU A 99 57.894 2.169 -64.960 1.00 0.00 C ATOM 746 C GLU A 99 59.379 1.976 -64.668 1.00 0.00 C ATOM 747 O GLU A 99 60.112 1.405 -65.476 1.00 0.00 O ATOM 748 CB GLU A 99 57.060 1.299 -64.017 1.00 0.00 C ATOM 749 CG GLU A 99 57.014 -0.165 -64.422 1.00 0.00 C ATOM 750 CD GLU A 99 56.353 -1.040 -63.374 1.00 0.00 C ATOM 751 OE1 GLU A 99 55.808 -0.485 -62.397 1.00 0.00 O ATOM 752 OE2 GLU A 99 56.381 -2.278 -63.531 1.00 0.00 O ATOM 0 H GLU A 99 58.100 1.044 -66.717 1.00 0.00 H new ATOM 0 HA GLU A 99 57.643 3.217 -64.794 1.00 0.00 H new ATOM 0 HB2 GLU A 99 57.468 1.376 -63.009 1.00 0.00 H new ATOM 0 HB3 GLU A 99 56.043 1.689 -63.980 1.00 0.00 H new ATOM 0 HG2 GLU A 99 56.473 -0.261 -65.364 1.00 0.00 H new ATOM 0 HG3 GLU A 99 58.029 -0.521 -64.600 1.00 0.00 H new ATOM 759 N TYR A 100 59.816 2.457 -63.510 1.00 0.00 N ATOM 760 CA TYR A 100 61.214 2.341 -63.112 1.00 0.00 C ATOM 761 C TYR A 100 61.335 2.114 -61.608 1.00 0.00 C ATOM 762 O TYR A 100 60.769 2.859 -60.808 1.00 0.00 O ATOM 763 CB TYR A 100 61.986 3.598 -63.513 1.00 0.00 C ATOM 764 CG TYR A 100 61.728 4.040 -64.936 1.00 0.00 C ATOM 765 CD1 TYR A 100 62.380 3.432 -66.002 1.00 0.00 C ATOM 766 CD2 TYR A 100 60.833 5.065 -65.215 1.00 0.00 C ATOM 767 CE1 TYR A 100 62.148 3.832 -67.304 1.00 0.00 C ATOM 768 CE2 TYR A 100 60.593 5.471 -66.514 1.00 0.00 C ATOM 769 CZ TYR A 100 61.253 4.851 -67.554 1.00 0.00 C ATOM 770 OH TYR A 100 61.018 5.254 -68.849 1.00 0.00 O ATOM 0 H TYR A 100 59.222 2.931 -62.830 1.00 0.00 H new ATOM 0 HA TYR A 100 61.642 1.481 -63.627 1.00 0.00 H new ATOM 0 HB2 TYR A 100 61.719 4.409 -62.836 1.00 0.00 H new ATOM 0 HB3 TYR A 100 63.053 3.415 -63.386 1.00 0.00 H new ATOM 0 HD1 TYR A 100 63.080 2.633 -65.809 1.00 0.00 H new ATOM 0 HD2 TYR A 100 60.316 5.553 -64.402 1.00 0.00 H new ATOM 0 HE1 TYR A 100 62.664 3.350 -68.121 1.00 0.00 H new ATOM 0 HE2 TYR A 100 59.893 6.269 -66.713 1.00 0.00 H new ATOM 0 HH TYR A 100 60.361 5.981 -68.851 1.00 0.00 H new ATOM 780 N LEU A 101 62.079 1.079 -61.231 1.00 0.00 N ATOM 781 CA LEU A 101 62.277 0.753 -59.824 1.00 0.00 C ATOM 782 C LEU A 101 63.375 1.618 -59.213 1.00 0.00 C ATOM 783 O LEU A 101 64.444 1.790 -59.800 1.00 0.00 O ATOM 784 CB LEU A 101 62.634 -0.727 -59.669 1.00 0.00 C ATOM 785 CG LEU A 101 62.461 -1.316 -58.268 1.00 0.00 C ATOM 786 CD1 LEU A 101 61.036 -1.811 -58.070 1.00 0.00 C ATOM 787 CD2 LEU A 101 63.456 -2.443 -58.037 1.00 0.00 C ATOM 0 H LEU A 101 62.554 0.452 -61.880 1.00 0.00 H new ATOM 0 HA LEU A 101 61.345 0.954 -59.296 1.00 0.00 H new ATOM 0 HB2 LEU A 101 62.020 -1.303 -60.362 1.00 0.00 H new ATOM 0 HB3 LEU A 101 63.672 -0.864 -59.973 1.00 0.00 H new ATOM 0 HG LEU A 101 62.656 -0.531 -57.537 1.00 0.00 H new ATOM 0 HD11 LEU A 101 60.931 -2.227 -57.068 1.00 0.00 H new ATOM 0 HD12 LEU A 101 60.342 -0.980 -58.192 1.00 0.00 H new ATOM 0 HD13 LEU A 101 60.813 -2.582 -58.808 1.00 0.00 H new ATOM 0 HD21 LEU A 101 63.318 -2.850 -57.035 1.00 0.00 H new ATOM 0 HD22 LEU A 101 63.293 -3.229 -58.774 1.00 0.00 H new ATOM 0 HD23 LEU A 101 64.471 -2.058 -58.136 1.00 0.00 H new ATOM 799 N LEU A 102 63.104 2.160 -58.030 1.00 0.00 N ATOM 800 CA LEU A 102 64.069 3.006 -57.338 1.00 0.00 C ATOM 801 C LEU A 102 64.930 2.183 -56.385 1.00 0.00 C ATOM 802 O LEU A 102 64.444 1.260 -55.731 1.00 0.00 O ATOM 803 CB LEU A 102 63.347 4.111 -56.566 1.00 0.00 C ATOM 804 CG LEU A 102 62.643 5.172 -57.413 1.00 0.00 C ATOM 805 CD1 LEU A 102 61.833 6.109 -56.530 1.00 0.00 C ATOM 806 CD2 LEU A 102 63.656 5.955 -58.236 1.00 0.00 C ATOM 0 H LEU A 102 62.224 2.028 -57.531 1.00 0.00 H new ATOM 0 HA LEU A 102 64.719 3.460 -58.086 1.00 0.00 H new ATOM 0 HB2 LEU A 102 62.608 3.647 -55.913 1.00 0.00 H new ATOM 0 HB3 LEU A 102 64.072 4.610 -55.923 1.00 0.00 H new ATOM 0 HG LEU A 102 61.959 4.669 -58.097 1.00 0.00 H new ATOM 0 HD11 LEU A 102 61.339 6.857 -57.150 1.00 0.00 H new ATOM 0 HD12 LEU A 102 61.082 5.537 -55.985 1.00 0.00 H new ATOM 0 HD13 LEU A 102 62.496 6.605 -55.822 1.00 0.00 H new ATOM 0 HD21 LEU A 102 63.138 6.706 -58.833 1.00 0.00 H new ATOM 0 HD22 LEU A 102 64.364 6.447 -57.569 1.00 0.00 H new ATOM 0 HD23 LEU A 102 64.193 5.274 -58.896 1.00 0.00 H new ATOM 818 N LYS A 103 66.212 2.526 -56.308 1.00 0.00 N ATOM 819 CA LYS A 103 67.141 1.822 -55.432 1.00 0.00 C ATOM 820 C LYS A 103 67.683 2.753 -54.352 1.00 0.00 C ATOM 821 O LYS A 103 67.971 3.921 -54.615 1.00 0.00 O ATOM 822 CB LYS A 103 68.299 1.239 -56.246 1.00 0.00 C ATOM 823 CG LYS A 103 69.135 0.230 -55.478 1.00 0.00 C ATOM 824 CD LYS A 103 70.473 -0.016 -56.154 1.00 0.00 C ATOM 825 CE LYS A 103 71.458 -0.690 -55.211 1.00 0.00 C ATOM 826 NZ LYS A 103 72.810 -0.822 -55.823 1.00 0.00 N ATOM 0 H LYS A 103 66.631 3.287 -56.842 1.00 0.00 H new ATOM 0 HA LYS A 103 66.600 1.009 -54.948 1.00 0.00 H new ATOM 0 HB2 LYS A 103 67.899 0.761 -57.140 1.00 0.00 H new ATOM 0 HB3 LYS A 103 68.943 2.053 -56.580 1.00 0.00 H new ATOM 0 HG2 LYS A 103 69.300 0.591 -54.463 1.00 0.00 H new ATOM 0 HG3 LYS A 103 68.589 -0.710 -55.397 1.00 0.00 H new ATOM 0 HD2 LYS A 103 70.327 -0.640 -57.036 1.00 0.00 H new ATOM 0 HD3 LYS A 103 70.888 0.931 -56.499 1.00 0.00 H new ATOM 0 HE2 LYS A 103 71.531 -0.113 -54.289 1.00 0.00 H new ATOM 0 HE3 LYS A 103 71.084 -1.677 -54.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 73.452 -1.286 -55.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 72.745 -1.394 -56.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 73.178 0.122 -56.058 1.00 0.00 H new ATOM 840 N TRP A 104 67.820 2.229 -53.140 1.00 0.00 N ATOM 841 CA TRP A 104 68.329 3.014 -52.021 1.00 0.00 C ATOM 842 C TRP A 104 69.837 2.842 -51.876 1.00 0.00 C ATOM 843 O TRP A 104 70.359 1.737 -52.015 1.00 0.00 O ATOM 844 CB TRP A 104 67.629 2.605 -50.724 1.00 0.00 C ATOM 845 CG TRP A 104 66.144 2.806 -50.761 1.00 0.00 C ATOM 846 CD1 TRP A 104 65.191 1.842 -50.926 1.00 0.00 C ATOM 847 CD2 TRP A 104 65.444 4.048 -50.632 1.00 0.00 C ATOM 848 NE1 TRP A 104 63.940 2.410 -50.908 1.00 0.00 N ATOM 849 CE2 TRP A 104 64.068 3.762 -50.728 1.00 0.00 C ATOM 850 CE3 TRP A 104 65.845 5.373 -50.443 1.00 0.00 C ATOM 851 CZ2 TRP A 104 63.094 4.754 -50.642 1.00 0.00 C ATOM 852 CZ3 TRP A 104 64.878 6.356 -50.358 1.00 0.00 C ATOM 853 CH2 TRP A 104 63.516 6.042 -50.456 1.00 0.00 C ATOM 0 H TRP A 104 67.586 1.264 -52.906 1.00 0.00 H new ATOM 0 HA TRP A 104 68.120 4.065 -52.222 1.00 0.00 H new ATOM 0 HB2 TRP A 104 67.841 1.555 -50.520 1.00 0.00 H new ATOM 0 HB3 TRP A 104 68.046 3.181 -49.898 1.00 0.00 H new ATOM 0 HD1 TRP A 104 65.391 0.788 -51.052 1.00 0.00 H new ATOM 0 HE1 TRP A 104 63.059 1.907 -51.012 1.00 0.00 H new ATOM 0 HE3 TRP A 104 66.892 5.624 -50.365 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 62.044 4.515 -50.719 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 65.177 7.384 -50.214 1.00 0.00 H new ATOM 0 HH2 TRP A 104 62.784 6.833 -50.383 1.00 0.00 H new ATOM 864 N GLU A 105 70.530 3.941 -51.597 1.00 0.00 N ATOM 865 CA GLU A 105 71.978 3.910 -51.434 1.00 0.00 C ATOM 866 C GLU A 105 72.364 3.232 -50.122 1.00 0.00 C ATOM 867 O GLU A 105 71.960 3.667 -49.044 1.00 0.00 O ATOM 868 CB GLU A 105 72.550 5.328 -51.475 1.00 0.00 C ATOM 869 CG GLU A 105 71.998 6.239 -50.391 1.00 0.00 C ATOM 870 CD GLU A 105 72.197 7.709 -50.706 1.00 0.00 C ATOM 871 OE1 GLU A 105 72.539 8.025 -51.865 1.00 0.00 O ATOM 872 OE2 GLU A 105 72.012 8.542 -49.795 1.00 0.00 O ATOM 0 H GLU A 105 70.112 4.864 -51.479 1.00 0.00 H new ATOM 0 HA GLU A 105 72.397 3.333 -52.258 1.00 0.00 H new ATOM 0 HB2 GLU A 105 73.634 5.276 -51.377 1.00 0.00 H new ATOM 0 HB3 GLU A 105 72.339 5.768 -52.450 1.00 0.00 H new ATOM 0 HG2 GLU A 105 70.934 6.040 -50.262 1.00 0.00 H new ATOM 0 HG3 GLU A 105 72.484 6.005 -49.444 1.00 0.00 H new ATOM 879 N GLY A 106 73.148 2.163 -50.222 1.00 0.00 N ATOM 880 CA GLY A 106 73.574 1.442 -49.037 1.00 0.00 C ATOM 881 C GLY A 106 72.657 0.283 -48.703 1.00 0.00 C ATOM 882 O GLY A 106 73.101 -0.737 -48.173 1.00 0.00 O ATOM 0 H GLY A 106 73.496 1.783 -51.103 1.00 0.00 H new ATOM 0 HA2 GLY A 106 74.587 1.068 -49.187 1.00 0.00 H new ATOM 0 HA3 GLY A 106 73.610 2.128 -48.191 1.00 0.00 H new ATOM 886 N TYR A 107 71.374 0.438 -49.010 1.00 0.00 N ATOM 887 CA TYR A 107 70.391 -0.603 -48.735 1.00 0.00 C ATOM 888 C TYR A 107 70.027 -1.360 -50.009 1.00 0.00 C ATOM 889 O TYR A 107 69.615 -0.762 -51.003 1.00 0.00 O ATOM 890 CB TYR A 107 69.132 0.006 -48.114 1.00 0.00 C ATOM 891 CG TYR A 107 69.412 0.874 -46.908 1.00 0.00 C ATOM 892 CD1 TYR A 107 69.683 2.229 -47.051 1.00 0.00 C ATOM 893 CD2 TYR A 107 69.404 0.340 -45.626 1.00 0.00 C ATOM 894 CE1 TYR A 107 69.940 3.026 -45.952 1.00 0.00 C ATOM 895 CE2 TYR A 107 69.658 1.129 -44.521 1.00 0.00 C ATOM 896 CZ TYR A 107 69.926 2.472 -44.690 1.00 0.00 C ATOM 897 OH TYR A 107 70.179 3.263 -43.592 1.00 0.00 O ATOM 0 H TYR A 107 70.990 1.275 -49.449 1.00 0.00 H new ATOM 0 HA TYR A 107 70.833 -1.307 -48.029 1.00 0.00 H new ATOM 0 HB2 TYR A 107 68.616 0.601 -48.868 1.00 0.00 H new ATOM 0 HB3 TYR A 107 68.455 -0.797 -47.824 1.00 0.00 H new ATOM 0 HD1 TYR A 107 69.693 2.667 -48.038 1.00 0.00 H new ATOM 0 HD2 TYR A 107 69.195 -0.711 -45.491 1.00 0.00 H new ATOM 0 HE1 TYR A 107 70.151 4.077 -46.081 1.00 0.00 H new ATOM 0 HE2 TYR A 107 69.647 0.697 -43.531 1.00 0.00 H new ATOM 0 HH TYR A 107 70.130 2.719 -42.778 1.00 0.00 H new ATOM 907 N ASP A 108 70.183 -2.678 -49.971 1.00 0.00 N ATOM 908 CA ASP A 108 69.870 -3.519 -51.121 1.00 0.00 C ATOM 909 C ASP A 108 68.599 -4.326 -50.874 1.00 0.00 C ATOM 910 O ASP A 108 68.633 -5.378 -50.237 1.00 0.00 O ATOM 911 CB ASP A 108 71.036 -4.461 -51.423 1.00 0.00 C ATOM 912 CG ASP A 108 71.060 -4.908 -52.871 1.00 0.00 C ATOM 913 OD1 ASP A 108 70.594 -4.138 -53.737 1.00 0.00 O ATOM 914 OD2 ASP A 108 71.544 -6.027 -53.139 1.00 0.00 O ATOM 0 H ASP A 108 70.524 -3.188 -49.156 1.00 0.00 H new ATOM 0 HA ASP A 108 69.705 -2.870 -51.981 1.00 0.00 H new ATOM 0 HB2 ASP A 108 71.975 -3.960 -51.185 1.00 0.00 H new ATOM 0 HB3 ASP A 108 70.969 -5.336 -50.777 1.00 0.00 H new ATOM 919 N ASP A 109 67.479 -3.824 -51.383 1.00 0.00 N ATOM 920 CA ASP A 109 66.196 -4.498 -51.218 1.00 0.00 C ATOM 921 C ASP A 109 65.967 -5.511 -52.335 1.00 0.00 C ATOM 922 O ASP A 109 66.571 -5.439 -53.406 1.00 0.00 O ATOM 923 CB ASP A 109 65.058 -3.476 -51.199 1.00 0.00 C ATOM 924 CG ASP A 109 64.639 -3.103 -49.790 1.00 0.00 C ATOM 925 OD1 ASP A 109 63.829 -3.845 -49.196 1.00 0.00 O ATOM 926 OD2 ASP A 109 65.122 -2.070 -49.282 1.00 0.00 O ATOM 0 H ASP A 109 67.433 -2.954 -51.913 1.00 0.00 H new ATOM 0 HA ASP A 109 66.213 -5.030 -50.267 1.00 0.00 H new ATOM 0 HB2 ASP A 109 65.371 -2.578 -51.732 1.00 0.00 H new ATOM 0 HB3 ASP A 109 64.200 -3.882 -51.735 1.00 0.00 H new ATOM 931 N PRO A 110 65.074 -6.480 -52.082 1.00 0.00 N ATOM 932 CA PRO A 110 64.745 -7.527 -53.054 1.00 0.00 C ATOM 933 C PRO A 110 63.966 -6.986 -54.248 1.00 0.00 C ATOM 934 O PRO A 110 63.912 -5.776 -54.469 1.00 0.00 O ATOM 935 CB PRO A 110 63.881 -8.500 -52.248 1.00 0.00 C ATOM 936 CG PRO A 110 63.287 -7.670 -51.164 1.00 0.00 C ATOM 937 CD PRO A 110 64.317 -6.627 -50.828 1.00 0.00 C ATOM 0 HA PRO A 110 65.639 -7.982 -53.481 1.00 0.00 H new ATOM 0 HB2 PRO A 110 63.108 -8.951 -52.870 1.00 0.00 H new ATOM 0 HB3 PRO A 110 64.478 -9.315 -51.840 1.00 0.00 H new ATOM 0 HG2 PRO A 110 62.356 -7.207 -51.492 1.00 0.00 H new ATOM 0 HG3 PRO A 110 63.050 -8.279 -50.292 1.00 0.00 H new ATOM 0 HD2 PRO A 110 63.854 -5.688 -50.525 1.00 0.00 H new ATOM 0 HD3 PRO A 110 64.958 -6.945 -50.006 1.00 0.00 H new ATOM 945 N SER A 111 63.364 -7.889 -55.015 1.00 0.00 N ATOM 946 CA SER A 111 62.590 -7.502 -56.188 1.00 0.00 C ATOM 947 C SER A 111 61.331 -6.741 -55.782 1.00 0.00 C ATOM 948 O SER A 111 60.636 -6.174 -56.626 1.00 0.00 O ATOM 949 CB SER A 111 62.210 -8.738 -57.006 1.00 0.00 C ATOM 950 OG SER A 111 63.238 -9.080 -57.920 1.00 0.00 O ATOM 0 H SER A 111 63.398 -8.894 -54.845 1.00 0.00 H new ATOM 0 HA SER A 111 63.209 -6.846 -56.800 1.00 0.00 H new ATOM 0 HB2 SER A 111 62.020 -9.577 -56.336 1.00 0.00 H new ATOM 0 HB3 SER A 111 61.284 -8.548 -57.549 1.00 0.00 H new ATOM 0 HG SER A 111 62.972 -9.874 -58.429 1.00 0.00 H new ATOM 956 N ASP A 112 61.046 -6.732 -54.485 1.00 0.00 N ATOM 957 CA ASP A 112 59.872 -6.040 -53.965 1.00 0.00 C ATOM 958 C ASP A 112 60.187 -4.575 -53.681 1.00 0.00 C ATOM 959 O ASP A 112 59.440 -3.894 -52.979 1.00 0.00 O ATOM 960 CB ASP A 112 59.373 -6.724 -52.691 1.00 0.00 C ATOM 961 CG ASP A 112 57.879 -6.560 -52.494 1.00 0.00 C ATOM 962 OD1 ASP A 112 57.298 -5.634 -53.098 1.00 0.00 O ATOM 963 OD2 ASP A 112 57.290 -7.359 -51.736 1.00 0.00 O ATOM 0 H ASP A 112 61.611 -7.196 -53.774 1.00 0.00 H new ATOM 0 HA ASP A 112 59.089 -6.085 -54.722 1.00 0.00 H new ATOM 0 HB2 ASP A 112 59.617 -7.786 -52.733 1.00 0.00 H new ATOM 0 HB3 ASP A 112 59.898 -6.310 -51.830 1.00 0.00 H new ATOM 968 N ASN A 113 61.299 -4.096 -54.230 1.00 0.00 N ATOM 969 CA ASN A 113 61.714 -2.712 -54.034 1.00 0.00 C ATOM 970 C ASN A 113 60.585 -1.750 -54.392 1.00 0.00 C ATOM 971 O ASN A 113 59.525 -2.165 -54.862 1.00 0.00 O ATOM 972 CB ASN A 113 62.949 -2.403 -54.882 1.00 0.00 C ATOM 973 CG ASN A 113 64.196 -2.215 -54.039 1.00 0.00 C ATOM 974 OD1 ASN A 113 65.099 -3.052 -54.052 1.00 0.00 O ATOM 975 ND2 ASN A 113 64.250 -1.113 -53.300 1.00 0.00 N ATOM 0 H ASN A 113 61.929 -4.646 -54.814 1.00 0.00 H new ATOM 0 HA ASN A 113 61.962 -2.579 -52.981 1.00 0.00 H new ATOM 0 HB2 ASN A 113 63.112 -3.215 -55.591 1.00 0.00 H new ATOM 0 HB3 ASN A 113 62.769 -1.501 -55.466 1.00 0.00 H new ATOM 0 HD21 ASN A 113 65.064 -0.933 -52.712 1.00 0.00 H new ATOM 0 HD22 ASN A 113 63.478 -0.447 -53.321 1.00 0.00 H new ATOM 982 N THR A 114 60.819 -0.461 -54.165 1.00 0.00 N ATOM 983 CA THR A 114 59.823 0.561 -54.462 1.00 0.00 C ATOM 984 C THR A 114 59.810 0.901 -55.948 1.00 0.00 C ATOM 985 O THR A 114 60.850 1.202 -56.534 1.00 0.00 O ATOM 986 CB THR A 114 60.079 1.847 -53.655 1.00 0.00 C ATOM 987 OG1 THR A 114 60.608 1.519 -52.365 1.00 0.00 O ATOM 988 CG2 THR A 114 58.797 2.650 -53.495 1.00 0.00 C ATOM 0 H THR A 114 61.690 -0.100 -53.776 1.00 0.00 H new ATOM 0 HA THR A 114 58.854 0.150 -54.178 1.00 0.00 H new ATOM 0 HB THR A 114 60.802 2.454 -54.200 1.00 0.00 H new ATOM 0 HG1 THR A 114 60.770 2.342 -51.859 1.00 0.00 H new ATOM 0 HG21 THR A 114 59.003 3.554 -52.922 1.00 0.00 H new ATOM 0 HG22 THR A 114 58.414 2.923 -54.478 1.00 0.00 H new ATOM 0 HG23 THR A 114 58.054 2.049 -52.970 1.00 0.00 H new ATOM 996 N TRP A 115 58.628 0.851 -56.552 1.00 0.00 N ATOM 997 CA TRP A 115 58.481 1.154 -57.971 1.00 0.00 C ATOM 998 C TRP A 115 58.090 2.614 -58.177 1.00 0.00 C ATOM 999 O TRP A 115 57.448 3.221 -57.321 1.00 0.00 O ATOM 1000 CB TRP A 115 57.432 0.238 -58.603 1.00 0.00 C ATOM 1001 CG TRP A 115 57.773 -1.217 -58.497 1.00 0.00 C ATOM 1002 CD1 TRP A 115 57.819 -1.967 -57.357 1.00 0.00 C ATOM 1003 CD2 TRP A 115 58.117 -2.097 -59.573 1.00 0.00 C ATOM 1004 NE1 TRP A 115 58.171 -3.261 -57.659 1.00 0.00 N ATOM 1005 CE2 TRP A 115 58.359 -3.366 -59.012 1.00 0.00 C ATOM 1006 CE3 TRP A 115 58.243 -1.937 -60.956 1.00 0.00 C ATOM 1007 CZ2 TRP A 115 58.720 -4.466 -59.786 1.00 0.00 C ATOM 1008 CZ3 TRP A 115 58.601 -3.029 -61.723 1.00 0.00 C ATOM 1009 CH2 TRP A 115 58.835 -4.280 -61.137 1.00 0.00 C ATOM 0 H TRP A 115 57.758 0.604 -56.081 1.00 0.00 H new ATOM 0 HA TRP A 115 59.442 0.982 -58.456 1.00 0.00 H new ATOM 0 HB2 TRP A 115 56.470 0.414 -58.123 1.00 0.00 H new ATOM 0 HB3 TRP A 115 57.316 0.501 -59.654 1.00 0.00 H new ATOM 0 HD1 TRP A 115 57.610 -1.598 -56.364 1.00 0.00 H new ATOM 0 HE1 TRP A 115 58.275 -4.020 -56.985 1.00 0.00 H new ATOM 0 HE3 TRP A 115 58.064 -0.977 -61.417 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 58.903 -5.431 -59.336 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 58.702 -2.916 -62.792 1.00 0.00 H new ATOM 0 HH2 TRP A 115 59.112 -5.115 -61.764 1.00 0.00 H new ATOM 1020 N SER A 116 58.482 3.171 -59.319 1.00 0.00 N ATOM 1021 CA SER A 116 58.176 4.561 -59.635 1.00 0.00 C ATOM 1022 C SER A 116 57.579 4.680 -61.034 1.00 0.00 C ATOM 1023 O SER A 116 57.990 3.978 -61.958 1.00 0.00 O ATOM 1024 CB SER A 116 59.438 5.420 -59.532 1.00 0.00 C ATOM 1025 OG SER A 116 60.069 5.553 -60.794 1.00 0.00 O ATOM 0 H SER A 116 59.012 2.681 -60.040 1.00 0.00 H new ATOM 0 HA SER A 116 57.442 4.919 -58.913 1.00 0.00 H new ATOM 0 HB2 SER A 116 59.180 6.406 -59.145 1.00 0.00 H new ATOM 0 HB3 SER A 116 60.131 4.970 -58.821 1.00 0.00 H new ATOM 0 HG SER A 116 60.452 4.691 -61.061 1.00 0.00 H new ATOM 1031 N SER A 117 56.607 5.575 -61.182 1.00 0.00 N ATOM 1032 CA SER A 117 55.950 5.785 -62.466 1.00 0.00 C ATOM 1033 C SER A 117 56.717 6.798 -63.310 1.00 0.00 C ATOM 1034 O SER A 117 57.737 7.335 -62.879 1.00 0.00 O ATOM 1035 CB SER A 117 54.512 6.263 -62.256 1.00 0.00 C ATOM 1036 OG SER A 117 53.835 5.447 -61.315 1.00 0.00 O ATOM 0 H SER A 117 56.257 6.166 -60.428 1.00 0.00 H new ATOM 0 HA SER A 117 55.934 4.833 -62.997 1.00 0.00 H new ATOM 0 HB2 SER A 117 54.516 7.296 -61.909 1.00 0.00 H new ATOM 0 HB3 SER A 117 53.978 6.248 -63.206 1.00 0.00 H new ATOM 0 HG SER A 117 52.919 5.774 -61.197 1.00 0.00 H new ATOM 1042 N GLU A 118 56.218 7.055 -64.515 1.00 0.00 N ATOM 1043 CA GLU A 118 56.856 8.003 -65.420 1.00 0.00 C ATOM 1044 C GLU A 118 57.080 9.346 -64.731 1.00 0.00 C ATOM 1045 O GLU A 118 58.024 10.069 -65.047 1.00 0.00 O ATOM 1046 CB GLU A 118 56.004 8.198 -66.675 1.00 0.00 C ATOM 1047 CG GLU A 118 56.333 7.221 -67.792 1.00 0.00 C ATOM 1048 CD GLU A 118 57.659 7.526 -68.461 1.00 0.00 C ATOM 1049 OE1 GLU A 118 58.330 8.490 -68.036 1.00 0.00 O ATOM 1050 OE2 GLU A 118 58.025 6.802 -69.410 1.00 0.00 O ATOM 0 H GLU A 118 55.374 6.620 -64.887 1.00 0.00 H new ATOM 0 HA GLU A 118 57.825 7.595 -65.708 1.00 0.00 H new ATOM 0 HB2 GLU A 118 54.952 8.093 -66.410 1.00 0.00 H new ATOM 0 HB3 GLU A 118 56.140 9.215 -67.042 1.00 0.00 H new ATOM 0 HG2 GLU A 118 56.358 6.209 -67.389 1.00 0.00 H new ATOM 0 HG3 GLU A 118 55.539 7.247 -68.538 1.00 0.00 H new ATOM 1057 N ALA A 119 56.203 9.674 -63.787 1.00 0.00 N ATOM 1058 CA ALA A 119 56.304 10.928 -63.052 1.00 0.00 C ATOM 1059 C ALA A 119 57.687 11.089 -62.428 1.00 0.00 C ATOM 1060 O ALA A 119 58.236 12.190 -62.388 1.00 0.00 O ATOM 1061 CB ALA A 119 55.228 11.000 -61.979 1.00 0.00 C ATOM 0 H ALA A 119 55.414 9.088 -63.514 1.00 0.00 H new ATOM 0 HA ALA A 119 56.154 11.746 -63.757 1.00 0.00 H new ATOM 0 HB1 ALA A 119 55.316 11.942 -61.438 1.00 0.00 H new ATOM 0 HB2 ALA A 119 54.245 10.940 -62.445 1.00 0.00 H new ATOM 0 HB3 ALA A 119 55.351 10.170 -61.284 1.00 0.00 H new ATOM 1067 N ASP A 120 58.244 9.985 -61.943 1.00 0.00 N ATOM 1068 CA ASP A 120 59.563 10.003 -61.321 1.00 0.00 C ATOM 1069 C ASP A 120 60.662 10.010 -62.379 1.00 0.00 C ATOM 1070 O ASP A 120 61.779 10.460 -62.125 1.00 0.00 O ATOM 1071 CB ASP A 120 59.732 8.795 -60.399 1.00 0.00 C ATOM 1072 CG ASP A 120 59.032 8.981 -59.067 1.00 0.00 C ATOM 1073 OD1 ASP A 120 57.815 9.258 -59.070 1.00 0.00 O ATOM 1074 OD2 ASP A 120 59.702 8.848 -58.022 1.00 0.00 O ATOM 0 H ASP A 120 57.803 9.066 -61.969 1.00 0.00 H new ATOM 0 HA ASP A 120 59.647 10.915 -60.730 1.00 0.00 H new ATOM 0 HB2 ASP A 120 59.337 7.907 -60.893 1.00 0.00 H new ATOM 0 HB3 ASP A 120 60.794 8.619 -60.227 1.00 0.00 H new ATOM 1079 N CYS A 121 60.337 9.506 -63.565 1.00 0.00 N ATOM 1080 CA CYS A 121 61.297 9.452 -64.662 1.00 0.00 C ATOM 1081 C CYS A 121 61.931 10.819 -64.898 1.00 0.00 C ATOM 1082 O CYS A 121 63.090 10.916 -65.301 1.00 0.00 O ATOM 1083 CB CYS A 121 60.615 8.964 -65.941 1.00 0.00 C ATOM 1084 SG CYS A 121 61.759 8.589 -67.290 1.00 0.00 S ATOM 0 H CYS A 121 59.417 9.129 -63.791 1.00 0.00 H new ATOM 0 HA CYS A 121 62.084 8.749 -64.389 1.00 0.00 H new ATOM 0 HB2 CYS A 121 60.034 8.070 -65.712 1.00 0.00 H new ATOM 0 HB3 CYS A 121 59.910 9.725 -66.277 1.00 0.00 H new ATOM 0 HG CYS A 121 61.748 7.310 -67.525 1.00 0.00 H new ATOM 1090 N SER A 122 61.162 11.873 -64.644 1.00 0.00 N ATOM 1091 CA SER A 122 61.647 13.235 -64.835 1.00 0.00 C ATOM 1092 C SER A 122 62.495 13.681 -63.647 1.00 0.00 C ATOM 1093 O SER A 122 63.440 14.454 -63.800 1.00 0.00 O ATOM 1094 CB SER A 122 60.471 14.195 -65.025 1.00 0.00 C ATOM 1095 OG SER A 122 60.890 15.399 -65.645 1.00 0.00 O ATOM 0 H SER A 122 60.202 11.810 -64.306 1.00 0.00 H new ATOM 0 HA SER A 122 62.269 13.251 -65.730 1.00 0.00 H new ATOM 0 HB2 SER A 122 59.702 13.718 -65.633 1.00 0.00 H new ATOM 0 HB3 SER A 122 60.020 14.418 -64.058 1.00 0.00 H new ATOM 0 HG SER A 122 60.120 15.995 -65.757 1.00 0.00 H new ATOM 1101 N GLY A 123 62.149 13.187 -62.462 1.00 0.00 N ATOM 1102 CA GLY A 123 62.888 13.545 -61.265 1.00 0.00 C ATOM 1103 C GLY A 123 64.229 12.845 -61.181 1.00 0.00 C ATOM 1104 O GLY A 123 65.224 13.442 -60.768 1.00 0.00 O ATOM 0 H GLY A 123 61.371 12.546 -62.310 1.00 0.00 H new ATOM 0 HA2 GLY A 123 63.043 14.624 -61.246 1.00 0.00 H new ATOM 0 HA3 GLY A 123 62.294 13.293 -60.386 1.00 0.00 H new ATOM 1108 N CYS A 124 64.258 11.575 -61.571 1.00 0.00 N ATOM 1109 CA CYS A 124 65.488 10.792 -61.536 1.00 0.00 C ATOM 1110 C CYS A 124 66.064 10.620 -62.937 1.00 0.00 C ATOM 1111 O CYS A 124 66.613 9.570 -63.270 1.00 0.00 O ATOM 1112 CB CYS A 124 65.226 9.423 -60.907 1.00 0.00 C ATOM 1113 SG CYS A 124 64.643 9.495 -59.197 1.00 0.00 S ATOM 0 H CYS A 124 63.444 11.066 -61.915 1.00 0.00 H new ATOM 0 HA CYS A 124 66.216 11.330 -60.929 1.00 0.00 H new ATOM 0 HB2 CYS A 124 64.488 8.894 -61.509 1.00 0.00 H new ATOM 0 HB3 CYS A 124 66.145 8.837 -60.942 1.00 0.00 H new ATOM 0 HG CYS A 124 63.472 8.937 -59.114 1.00 0.00 H new ATOM 1119 N LYS A 125 65.933 11.658 -63.757 1.00 0.00 N ATOM 1120 CA LYS A 125 66.439 11.623 -65.123 1.00 0.00 C ATOM 1121 C LYS A 125 67.891 11.156 -65.154 1.00 0.00 C ATOM 1122 O LYS A 125 68.269 10.332 -65.985 1.00 0.00 O ATOM 1123 CB LYS A 125 66.323 13.006 -65.768 1.00 0.00 C ATOM 1124 CG LYS A 125 65.028 13.214 -66.533 1.00 0.00 C ATOM 1125 CD LYS A 125 65.059 12.517 -67.882 1.00 0.00 C ATOM 1126 CE LYS A 125 65.580 13.438 -68.974 1.00 0.00 C ATOM 1127 NZ LYS A 125 64.615 14.529 -69.287 1.00 0.00 N ATOM 0 H LYS A 125 65.480 12.534 -63.498 1.00 0.00 H new ATOM 0 HA LYS A 125 65.835 10.913 -65.689 1.00 0.00 H new ATOM 0 HB2 LYS A 125 66.403 13.767 -64.992 1.00 0.00 H new ATOM 0 HB3 LYS A 125 67.163 13.153 -66.446 1.00 0.00 H new ATOM 0 HG2 LYS A 125 64.192 12.834 -65.945 1.00 0.00 H new ATOM 0 HG3 LYS A 125 64.857 14.281 -66.678 1.00 0.00 H new ATOM 0 HD2 LYS A 125 65.691 11.631 -67.820 1.00 0.00 H new ATOM 0 HD3 LYS A 125 64.056 12.176 -68.140 1.00 0.00 H new ATOM 0 HE2 LYS A 125 66.530 13.872 -68.661 1.00 0.00 H new ATOM 0 HE3 LYS A 125 65.777 12.858 -69.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 64.815 14.908 -70.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 63.646 14.153 -69.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 64.710 15.289 -68.583 1.00 0.00 H new ATOM 1141 N GLN A 126 68.698 11.688 -64.242 1.00 0.00 N ATOM 1142 CA GLN A 126 70.108 11.325 -64.165 1.00 0.00 C ATOM 1143 C GLN A 126 70.277 9.810 -64.107 1.00 0.00 C ATOM 1144 O GLN A 126 71.166 9.249 -64.749 1.00 0.00 O ATOM 1145 CB GLN A 126 70.757 11.970 -62.939 1.00 0.00 C ATOM 1146 CG GLN A 126 69.971 11.762 -61.655 1.00 0.00 C ATOM 1147 CD GLN A 126 70.638 12.400 -60.452 1.00 0.00 C ATOM 1148 OE1 GLN A 126 71.191 13.497 -60.543 1.00 0.00 O ATOM 1149 NE2 GLN A 126 70.590 11.715 -59.316 1.00 0.00 N ATOM 0 H GLN A 126 68.400 12.372 -63.546 1.00 0.00 H new ATOM 0 HA GLN A 126 70.602 11.694 -65.064 1.00 0.00 H new ATOM 0 HB2 GLN A 126 71.760 11.562 -62.812 1.00 0.00 H new ATOM 0 HB3 GLN A 126 70.869 13.039 -63.118 1.00 0.00 H new ATOM 0 HG2 GLN A 126 68.971 12.178 -61.774 1.00 0.00 H new ATOM 0 HG3 GLN A 126 69.852 10.693 -61.475 1.00 0.00 H new ATOM 0 HE21 GLN A 126 70.121 10.810 -59.286 1.00 0.00 H new ATOM 0 HE22 GLN A 126 71.022 12.094 -58.473 1.00 0.00 H new ATOM 1158 N LEU A 127 69.420 9.154 -63.333 1.00 0.00 N ATOM 1159 CA LEU A 127 69.475 7.703 -63.190 1.00 0.00 C ATOM 1160 C LEU A 127 68.982 7.012 -64.457 1.00 0.00 C ATOM 1161 O LEU A 127 69.593 6.054 -64.931 1.00 0.00 O ATOM 1162 CB LEU A 127 68.635 7.256 -61.992 1.00 0.00 C ATOM 1163 CG LEU A 127 68.786 8.088 -60.718 1.00 0.00 C ATOM 1164 CD1 LEU A 127 67.972 7.483 -59.585 1.00 0.00 C ATOM 1165 CD2 LEU A 127 70.252 8.198 -60.325 1.00 0.00 C ATOM 0 H LEU A 127 68.679 9.603 -62.795 1.00 0.00 H new ATOM 0 HA LEU A 127 70.514 7.418 -63.024 1.00 0.00 H new ATOM 0 HB2 LEU A 127 67.585 7.266 -62.286 1.00 0.00 H new ATOM 0 HB3 LEU A 127 68.891 6.222 -61.759 1.00 0.00 H new ATOM 0 HG LEU A 127 68.406 9.091 -60.914 1.00 0.00 H new ATOM 0 HD11 LEU A 127 68.092 8.089 -58.687 1.00 0.00 H new ATOM 0 HD12 LEU A 127 66.919 7.457 -59.867 1.00 0.00 H new ATOM 0 HD13 LEU A 127 68.320 6.469 -59.388 1.00 0.00 H new ATOM 0 HD21 LEU A 127 70.341 8.793 -59.416 1.00 0.00 H new ATOM 0 HD22 LEU A 127 70.657 7.202 -60.147 1.00 0.00 H new ATOM 0 HD23 LEU A 127 70.809 8.678 -61.129 1.00 0.00 H new ATOM 1177 N ILE A 128 67.875 7.506 -65.002 1.00 0.00 N ATOM 1178 CA ILE A 128 67.303 6.938 -66.216 1.00 0.00 C ATOM 1179 C ILE A 128 68.348 6.836 -67.321 1.00 0.00 C ATOM 1180 O ILE A 128 68.486 5.796 -67.964 1.00 0.00 O ATOM 1181 CB ILE A 128 66.115 7.776 -66.724 1.00 0.00 C ATOM 1182 CG1 ILE A 128 65.026 7.860 -65.652 1.00 0.00 C ATOM 1183 CG2 ILE A 128 65.557 7.181 -68.008 1.00 0.00 C ATOM 1184 CD1 ILE A 128 64.400 6.524 -65.321 1.00 0.00 C ATOM 0 H ILE A 128 67.357 8.298 -64.622 1.00 0.00 H new ATOM 0 HA ILE A 128 66.950 5.939 -65.961 1.00 0.00 H new ATOM 0 HB ILE A 128 66.467 8.785 -66.938 1.00 0.00 H new ATOM 0 HG12 ILE A 128 65.453 8.287 -64.744 1.00 0.00 H new ATOM 0 HG13 ILE A 128 64.247 8.543 -65.990 1.00 0.00 H new ATOM 0 HG21 ILE A 128 64.718 7.785 -68.354 1.00 0.00 H new ATOM 0 HG22 ILE A 128 66.335 7.169 -68.772 1.00 0.00 H new ATOM 0 HG23 ILE A 128 65.218 6.162 -67.820 1.00 0.00 H new ATOM 0 HD11 ILE A 128 63.637 6.660 -64.554 1.00 0.00 H new ATOM 0 HD12 ILE A 128 63.943 6.104 -66.217 1.00 0.00 H new ATOM 0 HD13 ILE A 128 65.168 5.844 -64.953 1.00 0.00 H new ATOM 1196 N GLU A 129 69.083 7.923 -67.535 1.00 0.00 N ATOM 1197 CA GLU A 129 70.118 7.955 -68.562 1.00 0.00 C ATOM 1198 C GLU A 129 71.359 7.191 -68.109 1.00 0.00 C ATOM 1199 O GLU A 129 71.985 6.481 -68.895 1.00 0.00 O ATOM 1200 CB GLU A 129 70.489 9.400 -68.899 1.00 0.00 C ATOM 1201 CG GLU A 129 71.026 10.183 -67.712 1.00 0.00 C ATOM 1202 CD GLU A 129 71.090 11.674 -67.977 1.00 0.00 C ATOM 1203 OE1 GLU A 129 70.027 12.328 -67.953 1.00 0.00 O ATOM 1204 OE2 GLU A 129 72.205 12.187 -68.209 1.00 0.00 O ATOM 0 H GLU A 129 68.981 8.792 -67.011 1.00 0.00 H new ATOM 0 HA GLU A 129 69.722 7.472 -69.455 1.00 0.00 H new ATOM 0 HB2 GLU A 129 71.237 9.399 -69.691 1.00 0.00 H new ATOM 0 HB3 GLU A 129 69.609 9.910 -69.292 1.00 0.00 H new ATOM 0 HG2 GLU A 129 70.393 9.999 -66.844 1.00 0.00 H new ATOM 0 HG3 GLU A 129 72.023 9.819 -67.463 1.00 0.00 H new ATOM 1211 N ALA A 130 71.708 7.344 -66.836 1.00 0.00 N ATOM 1212 CA ALA A 130 72.873 6.669 -66.277 1.00 0.00 C ATOM 1213 C ALA A 130 72.759 5.157 -66.435 1.00 0.00 C ATOM 1214 O ALA A 130 73.743 4.478 -66.728 1.00 0.00 O ATOM 1215 CB ALA A 130 73.042 7.037 -64.810 1.00 0.00 C ATOM 0 H ALA A 130 71.201 7.929 -66.172 1.00 0.00 H new ATOM 0 HA ALA A 130 73.754 7.000 -66.827 1.00 0.00 H new ATOM 0 HB1 ALA A 130 73.916 6.526 -64.405 1.00 0.00 H new ATOM 0 HB2 ALA A 130 73.177 8.115 -64.718 1.00 0.00 H new ATOM 0 HB3 ALA A 130 72.155 6.734 -64.254 1.00 0.00 H new ATOM 1221 N TYR A 131 71.553 4.635 -66.239 1.00 0.00 N ATOM 1222 CA TYR A 131 71.312 3.202 -66.357 1.00 0.00 C ATOM 1223 C TYR A 131 71.738 2.689 -67.729 1.00 0.00 C ATOM 1224 O TYR A 131 72.561 1.780 -67.837 1.00 0.00 O ATOM 1225 CB TYR A 131 69.833 2.891 -66.120 1.00 0.00 C ATOM 1226 CG TYR A 131 69.547 1.419 -65.928 1.00 0.00 C ATOM 1227 CD1 TYR A 131 70.189 0.690 -64.935 1.00 0.00 C ATOM 1228 CD2 TYR A 131 68.634 0.757 -66.740 1.00 0.00 C ATOM 1229 CE1 TYR A 131 69.931 -0.656 -64.757 1.00 0.00 C ATOM 1230 CE2 TYR A 131 68.369 -0.588 -66.568 1.00 0.00 C ATOM 1231 CZ TYR A 131 69.020 -1.290 -65.576 1.00 0.00 C ATOM 1232 OH TYR A 131 68.759 -2.629 -65.401 1.00 0.00 O ATOM 0 H TYR A 131 70.727 5.183 -65.998 1.00 0.00 H new ATOM 0 HA TYR A 131 71.909 2.695 -65.599 1.00 0.00 H new ATOM 0 HB2 TYR A 131 69.492 3.437 -65.240 1.00 0.00 H new ATOM 0 HB3 TYR A 131 69.253 3.258 -66.967 1.00 0.00 H new ATOM 0 HD1 TYR A 131 70.902 1.183 -64.291 1.00 0.00 H new ATOM 0 HD2 TYR A 131 68.123 1.303 -67.519 1.00 0.00 H new ATOM 0 HE1 TYR A 131 70.440 -1.208 -63.981 1.00 0.00 H new ATOM 0 HE2 TYR A 131 67.656 -1.087 -67.207 1.00 0.00 H new ATOM 0 HH TYR A 131 68.093 -2.921 -66.058 1.00 0.00 H new ATOM 1242 N TRP A 132 71.171 3.279 -68.775 1.00 0.00 N ATOM 1243 CA TRP A 132 71.492 2.883 -70.142 1.00 0.00 C ATOM 1244 C TRP A 132 72.917 3.283 -70.505 1.00 0.00 C ATOM 1245 O TRP A 132 73.554 2.651 -71.346 1.00 0.00 O ATOM 1246 CB TRP A 132 70.505 3.519 -71.124 1.00 0.00 C ATOM 1247 CG TRP A 132 69.088 3.084 -70.906 1.00 0.00 C ATOM 1248 CD1 TRP A 132 68.071 3.833 -70.385 1.00 0.00 C ATOM 1249 CD2 TRP A 132 68.531 1.798 -71.201 1.00 0.00 C ATOM 1250 NE1 TRP A 132 66.916 3.090 -70.339 1.00 0.00 N ATOM 1251 CE2 TRP A 132 67.171 1.839 -70.835 1.00 0.00 C ATOM 1252 CE3 TRP A 132 69.047 0.618 -71.742 1.00 0.00 C ATOM 1253 CZ2 TRP A 132 66.325 0.744 -70.991 1.00 0.00 C ATOM 1254 CZ3 TRP A 132 68.206 -0.468 -71.896 1.00 0.00 C ATOM 1255 CH2 TRP A 132 66.858 -0.399 -71.522 1.00 0.00 C ATOM 0 H TRP A 132 70.487 4.033 -68.703 1.00 0.00 H new ATOM 0 HA TRP A 132 71.412 1.798 -70.207 1.00 0.00 H new ATOM 0 HB2 TRP A 132 70.562 4.604 -71.035 1.00 0.00 H new ATOM 0 HB3 TRP A 132 70.803 3.267 -72.142 1.00 0.00 H new ATOM 0 HD1 TRP A 132 68.162 4.858 -70.058 1.00 0.00 H new ATOM 0 HE1 TRP A 132 66.015 3.417 -69.992 1.00 0.00 H new ATOM 0 HE3 TRP A 132 70.085 0.555 -72.035 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 65.285 0.795 -70.703 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 68.595 -1.386 -72.312 1.00 0.00 H new ATOM 0 HH2 TRP A 132 66.227 -1.265 -71.655 1.00 0.00 H new ATOM 1266 N ASN A 133 73.413 4.337 -69.864 1.00 0.00 N ATOM 1267 CA ASN A 133 74.764 4.822 -70.120 1.00 0.00 C ATOM 1268 C ASN A 133 75.803 3.789 -69.691 1.00 0.00 C ATOM 1269 O ASN A 133 76.879 3.696 -70.280 1.00 0.00 O ATOM 1270 CB ASN A 133 75.005 6.140 -69.382 1.00 0.00 C ATOM 1271 CG ASN A 133 76.455 6.580 -69.442 1.00 0.00 C ATOM 1272 OD1 ASN A 133 76.936 7.029 -70.483 1.00 0.00 O ATOM 1273 ND2 ASN A 133 77.158 6.454 -68.323 1.00 0.00 N ATOM 0 H ASN A 133 72.899 4.871 -69.163 1.00 0.00 H new ATOM 0 HA ASN A 133 74.865 4.991 -71.192 1.00 0.00 H new ATOM 0 HB2 ASN A 133 74.374 6.916 -69.815 1.00 0.00 H new ATOM 0 HB3 ASN A 133 74.704 6.030 -68.340 1.00 0.00 H new ATOM 0 HD21 ASN A 133 78.138 6.735 -68.302 1.00 0.00 H new ATOM 0 HD22 ASN A 133 76.718 6.077 -67.484 1.00 0.00 H new ATOM 1280 N GLU A 134 75.470 3.017 -68.662 1.00 0.00 N ATOM 1281 CA GLU A 134 76.374 1.991 -68.154 1.00 0.00 C ATOM 1282 C GLU A 134 76.583 0.889 -69.188 1.00 0.00 C ATOM 1283 O GLU A 134 77.636 0.253 -69.231 1.00 0.00 O ATOM 1284 CB GLU A 134 75.825 1.393 -66.857 1.00 0.00 C ATOM 1285 CG GLU A 134 76.192 2.189 -65.616 1.00 0.00 C ATOM 1286 CD GLU A 134 75.207 1.986 -64.481 1.00 0.00 C ATOM 1287 OE1 GLU A 134 75.008 0.825 -64.067 1.00 0.00 O ATOM 1288 OE2 GLU A 134 74.635 2.990 -64.007 1.00 0.00 O ATOM 0 H GLU A 134 74.582 3.082 -68.164 1.00 0.00 H new ATOM 0 HA GLU A 134 77.337 2.460 -67.950 1.00 0.00 H new ATOM 0 HB2 GLU A 134 74.739 1.327 -66.928 1.00 0.00 H new ATOM 0 HB3 GLU A 134 76.199 0.375 -66.749 1.00 0.00 H new ATOM 0 HG2 GLU A 134 77.189 1.898 -65.284 1.00 0.00 H new ATOM 0 HG3 GLU A 134 76.237 3.248 -65.868 1.00 0.00 H new ATOM 1295 N HIS A 135 75.570 0.667 -70.021 1.00 0.00 N ATOM 1296 CA HIS A 135 75.641 -0.358 -71.055 1.00 0.00 C ATOM 1297 C HIS A 135 76.251 0.204 -72.336 1.00 0.00 C ATOM 1298 O HIS A 135 76.928 -0.508 -73.077 1.00 0.00 O ATOM 1299 CB HIS A 135 74.248 -0.919 -71.343 1.00 0.00 C ATOM 1300 CG HIS A 135 74.253 -2.071 -72.301 1.00 0.00 C ATOM 1301 ND1 HIS A 135 74.259 -3.388 -71.893 1.00 0.00 N ATOM 1302 CD2 HIS A 135 74.250 -2.097 -73.654 1.00 0.00 C ATOM 1303 CE1 HIS A 135 74.261 -4.175 -72.955 1.00 0.00 C ATOM 1304 NE2 HIS A 135 74.256 -3.416 -74.036 1.00 0.00 N ATOM 0 H HIS A 135 74.691 1.184 -69.999 1.00 0.00 H new ATOM 0 HA HIS A 135 76.280 -1.162 -70.691 1.00 0.00 H new ATOM 0 HB2 HIS A 135 73.793 -1.239 -70.406 1.00 0.00 H new ATOM 0 HB3 HIS A 135 73.621 -0.124 -71.747 1.00 0.00 H new ATOM 0 HD2 HIS A 135 74.244 -1.240 -74.311 1.00 0.00 H new ATOM 0 HE1 HIS A 135 74.266 -5.255 -72.941 1.00 0.00 H new ATOM 0 HE2 HIS A 135 74.257 -3.755 -74.998 1.00 0.00 H new ATOM 1312 N GLY A 136 76.004 1.485 -72.591 1.00 0.00 N ATOM 1313 CA GLY A 136 76.535 2.120 -73.783 1.00 0.00 C ATOM 1314 C GLY A 136 75.486 2.297 -74.862 1.00 0.00 C ATOM 1315 O GLY A 136 75.756 2.078 -76.042 1.00 0.00 O ATOM 0 H GLY A 136 75.446 2.094 -71.993 1.00 0.00 H new ATOM 0 HA2 GLY A 136 76.948 3.094 -73.519 1.00 0.00 H new ATOM 0 HA3 GLY A 136 77.357 1.521 -74.175 1.00 0.00 H new