USER MOD reduce.3.24.130724 H: found=0, std=0, add=585, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 586 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 63 THR OG1 : rot 180:sc= 0.875 USER MOD Set 1.2: A 66 THR OG1 : rot 88:sc= 1.03 USER MOD Set 2.1: A 58 THR OG1 : rot -60:sc= 1.27 USER MOD Set 2.2: A 60 MET CE :methyl -160:sc= -0.235 (180deg=-0.96) USER MOD Set 3.1: A 56 GLN : amide:sc=-0.000928 K(o=-0.013,f=-2.4!) USER MOD Set 3.2: A 97 SER OG : rot 180:sc= -0.0121 USER MOD Set 4.1: A 55 TYR OH : rot 50:sc= 1.16 USER MOD Set 4.2: A 75 SER OG : rot 78:sc= 1.83 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 MET CE :methyl -131:sc= -0.758 (180deg=-1.51) USER MOD Single : A 76 ASN : amide:sc= -0.235 K(o=-0.23,f=-0.92) USER MOD Single : A 77 MET CE :methyl 128:sc= -1.25 (180deg=-2.15!) USER MOD Single : A 78 GLN : amide:sc= -0.266 X(o=-0.27,f=-0.21) USER MOD Single : A 80 SER OG : rot 180:sc= -1.31 USER MOD Single : A 81 TYR OH : rot -146:sc= -1.1! USER MOD Single : A 82 ASN : amide:sc= 0.443 X(o=0.44,f=0) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.137 USER MOD Single : A 94 SER OG : rot 180:sc= 0.00854 USER MOD Single : A 98 THR OG1 : rot 130:sc= 0.0656 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.152 USER MOD Single : A 100 SER OG : rot 180:sc= 0.655 USER MOD Single : A 102 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 103 GLN : amide:sc= -0.0222 K(o=-0.022,f=-1) USER MOD Single : A 106 THR OG1 : rot 74:sc= 1.27 USER MOD Single : A 109 SER OG : rot 79:sc= 1.76 USER MOD Single : A 112 TYR OH : rot 180:sc= -0.309 USER MOD Single : A 115 GLN : amide:sc= -0.0785 X(o=-0.079,f=-0.45) USER MOD Single : A 118 SER OG : rot 18:sc= 0.00713 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -1.84! C(o=-1.8!,f=-4.8!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 510 N TYR A 53 0.430 -11.064 -1.363 1.00 10.00 N ATOM 511 CA TYR A 53 0.289 -9.937 -2.279 1.00 10.00 C ATOM 512 C TYR A 53 1.639 -9.589 -2.906 1.00 10.00 C ATOM 513 O TYR A 53 2.647 -9.476 -2.204 1.00 10.00 O ATOM 514 CB TYR A 53 -0.290 -8.728 -1.531 1.00 10.00 C ATOM 515 CG TYR A 53 -0.201 -7.416 -2.280 1.00 10.00 C ATOM 516 CD1 TYR A 53 -0.687 -7.287 -3.575 1.00 10.00 C ATOM 517 CD2 TYR A 53 0.367 -6.299 -1.680 1.00 10.00 C ATOM 518 CE1 TYR A 53 -0.606 -6.085 -4.251 1.00 10.00 C ATOM 519 CE2 TYR A 53 0.448 -5.095 -2.347 1.00 10.00 C ATOM 520 CZ TYR A 53 -0.039 -4.991 -3.633 1.00 10.00 C ATOM 521 OH TYR A 53 0.032 -3.787 -4.301 1.00 10.00 O ATOM 0 HA TYR A 53 -0.396 -10.213 -3.080 1.00 10.00 H new ATOM 0 HB2 TYR A 53 -1.336 -8.928 -1.300 1.00 10.00 H new ATOM 0 HB3 TYR A 53 0.232 -8.623 -0.580 1.00 10.00 H new ATOM 0 HD1 TYR A 53 -1.136 -8.141 -4.061 1.00 10.00 H new ATOM 0 HD2 TYR A 53 0.752 -6.375 -0.674 1.00 10.00 H new ATOM 0 HE1 TYR A 53 -0.985 -6.003 -5.259 1.00 10.00 H new ATOM 0 HE2 TYR A 53 0.891 -4.237 -1.864 1.00 10.00 H new ATOM 0 HH TYR A 53 0.458 -3.118 -3.725 1.00 10.00 H new ATOM 531 N THR A 54 1.651 -9.435 -4.222 1.00 10.00 N ATOM 532 CA THR A 54 2.871 -9.107 -4.940 1.00 10.00 C ATOM 533 C THR A 54 3.194 -7.620 -4.823 1.00 10.00 C ATOM 534 O THR A 54 2.420 -6.762 -5.249 1.00 10.00 O ATOM 535 CB THR A 54 2.762 -9.491 -6.428 1.00 10.00 C ATOM 536 OG1 THR A 54 2.088 -10.754 -6.558 1.00 10.00 O ATOM 537 CG2 THR A 54 4.140 -9.580 -7.066 1.00 10.00 C ATOM 0 H THR A 54 0.826 -9.533 -4.814 1.00 10.00 H new ATOM 0 HA THR A 54 3.677 -9.683 -4.484 1.00 10.00 H new ATOM 0 HB THR A 54 2.191 -8.717 -6.941 1.00 10.00 H new ATOM 0 HG1 THR A 54 2.020 -10.992 -7.506 1.00 10.00 H new ATOM 0 HG21 THR A 54 4.038 -9.852 -8.116 1.00 10.00 H new ATOM 0 HG22 THR A 54 4.640 -8.614 -6.989 1.00 10.00 H new ATOM 0 HG23 THR A 54 4.731 -10.337 -6.551 1.00 10.00 H new ATOM 545 N TYR A 55 4.339 -7.326 -4.233 1.00 10.00 N ATOM 546 CA TYR A 55 4.781 -5.957 -4.054 1.00 10.00 C ATOM 547 C TYR A 55 5.465 -5.458 -5.315 1.00 10.00 C ATOM 548 O TYR A 55 6.559 -5.904 -5.661 1.00 10.00 O ATOM 549 CB TYR A 55 5.736 -5.858 -2.864 1.00 10.00 C ATOM 550 CG TYR A 55 5.130 -6.331 -1.563 1.00 10.00 C ATOM 551 CD1 TYR A 55 4.181 -5.564 -0.900 1.00 10.00 C ATOM 552 CD2 TYR A 55 5.506 -7.541 -0.999 1.00 10.00 C ATOM 553 CE1 TYR A 55 3.626 -5.991 0.288 1.00 10.00 C ATOM 554 CE2 TYR A 55 4.953 -7.975 0.190 1.00 10.00 C ATOM 555 CZ TYR A 55 4.015 -7.197 0.827 1.00 10.00 C ATOM 556 OH TYR A 55 3.466 -7.627 2.011 1.00 10.00 O ATOM 0 H TYR A 55 4.984 -8.026 -3.867 1.00 10.00 H new ATOM 0 HA TYR A 55 3.909 -5.333 -3.855 1.00 10.00 H new ATOM 0 HB2 TYR A 55 6.629 -6.447 -3.075 1.00 10.00 H new ATOM 0 HB3 TYR A 55 6.057 -4.822 -2.751 1.00 10.00 H new ATOM 0 HD1 TYR A 55 3.873 -4.618 -1.321 1.00 10.00 H new ATOM 0 HD2 TYR A 55 6.243 -8.154 -1.497 1.00 10.00 H new ATOM 0 HE1 TYR A 55 2.890 -5.383 0.793 1.00 10.00 H new ATOM 0 HE2 TYR A 55 5.256 -8.920 0.617 1.00 10.00 H new ATOM 0 HH TYR A 55 2.490 -7.556 1.964 1.00 10.00 H new ATOM 566 N GLN A 56 4.800 -4.551 -6.010 1.00 10.00 N ATOM 567 CA GLN A 56 5.329 -3.976 -7.234 1.00 10.00 C ATOM 568 C GLN A 56 4.864 -2.537 -7.370 1.00 10.00 C ATOM 569 O GLN A 56 3.834 -2.159 -6.804 1.00 10.00 O ATOM 570 CB GLN A 56 4.861 -4.787 -8.446 1.00 10.00 C ATOM 571 CG GLN A 56 3.353 -4.997 -8.491 1.00 10.00 C ATOM 572 CD GLN A 56 2.921 -5.898 -9.632 1.00 10.00 C ATOM 573 OE1 GLN A 56 3.668 -6.779 -10.061 1.00 10.00 O ATOM 574 NE2 GLN A 56 1.712 -5.687 -10.130 1.00 10.00 N ATOM 0 H GLN A 56 3.883 -4.194 -5.743 1.00 10.00 H new ATOM 0 HA GLN A 56 6.418 -4.001 -7.192 1.00 10.00 H new ATOM 0 HB2 GLN A 56 5.176 -4.279 -9.357 1.00 10.00 H new ATOM 0 HB3 GLN A 56 5.355 -5.759 -8.436 1.00 10.00 H new ATOM 0 HG2 GLN A 56 3.022 -5.430 -7.547 1.00 10.00 H new ATOM 0 HG3 GLN A 56 2.859 -4.031 -8.589 1.00 10.00 H new ATOM 0 HE21 GLN A 56 1.124 -4.947 -9.746 1.00 10.00 H new ATOM 0 HE22 GLN A 56 1.369 -6.265 -10.897 1.00 10.00 H new ATOM 583 N ALA A 57 5.625 -1.735 -8.099 1.00 10.00 N ATOM 584 CA ALA A 57 5.266 -0.342 -8.312 1.00 10.00 C ATOM 585 C ALA A 57 4.313 -0.225 -9.491 1.00 10.00 C ATOM 586 O ALA A 57 4.606 -0.692 -10.595 1.00 10.00 O ATOM 587 CB ALA A 57 6.506 0.505 -8.535 1.00 10.00 C ATOM 0 H ALA A 57 6.492 -2.024 -8.552 1.00 10.00 H new ATOM 0 HA ALA A 57 4.763 0.030 -7.419 1.00 10.00 H new ATOM 0 HB1 ALA A 57 6.214 1.543 -8.692 1.00 10.00 H new ATOM 0 HB2 ALA A 57 7.154 0.439 -7.661 1.00 10.00 H new ATOM 0 HB3 ALA A 57 7.042 0.142 -9.412 1.00 10.00 H new ATOM 593 N THR A 58 3.170 0.383 -9.247 1.00 10.00 N ATOM 594 CA THR A 58 2.159 0.559 -10.267 1.00 10.00 C ATOM 595 C THR A 58 1.934 2.041 -10.535 1.00 10.00 C ATOM 596 O THR A 58 2.247 2.882 -9.691 1.00 10.00 O ATOM 597 CB THR A 58 0.824 -0.091 -9.832 1.00 10.00 C ATOM 598 OG1 THR A 58 0.316 0.567 -8.662 1.00 10.00 O ATOM 599 CG2 THR A 58 1.006 -1.576 -9.540 1.00 10.00 C ATOM 0 H THR A 58 2.917 0.768 -8.337 1.00 10.00 H new ATOM 0 HA THR A 58 2.510 0.074 -11.178 1.00 10.00 H new ATOM 0 HB THR A 58 0.114 0.017 -10.652 1.00 10.00 H new ATOM 0 HG1 THR A 58 0.967 0.489 -7.934 1.00 10.00 H new ATOM 0 HG21 THR A 58 0.052 -2.007 -9.237 1.00 10.00 H new ATOM 0 HG22 THR A 58 1.364 -2.082 -10.437 1.00 10.00 H new ATOM 0 HG23 THR A 58 1.733 -1.703 -8.738 1.00 10.00 H new ATOM 607 N PRO A 59 1.380 2.394 -11.705 1.00 10.00 N ATOM 608 CA PRO A 59 1.107 3.790 -12.043 1.00 10.00 C ATOM 609 C PRO A 59 -0.003 4.366 -11.168 1.00 10.00 C ATOM 610 O PRO A 59 -0.278 5.566 -11.195 1.00 10.00 O ATOM 611 CB PRO A 59 0.678 3.728 -13.508 1.00 10.00 C ATOM 612 CG PRO A 59 0.164 2.342 -13.694 1.00 10.00 C ATOM 613 CD PRO A 59 0.992 1.474 -12.792 1.00 10.00 C ATOM 0 HA PRO A 59 1.968 4.438 -11.881 1.00 10.00 H new ATOM 0 HB2 PRO A 59 -0.092 4.468 -13.727 1.00 10.00 H new ATOM 0 HB3 PRO A 59 1.516 3.932 -14.175 1.00 10.00 H new ATOM 0 HG2 PRO A 59 -0.893 2.279 -13.435 1.00 10.00 H new ATOM 0 HG3 PRO A 59 0.257 2.027 -14.733 1.00 10.00 H new ATOM 0 HD2 PRO A 59 0.422 0.624 -12.416 1.00 10.00 H new ATOM 0 HD3 PRO A 59 1.863 1.071 -13.309 1.00 10.00 H new ATOM 621 N MET A 60 -0.632 3.488 -10.390 1.00 10.00 N ATOM 622 CA MET A 60 -1.701 3.881 -9.484 1.00 10.00 C ATOM 623 C MET A 60 -1.108 4.417 -8.187 1.00 10.00 C ATOM 624 O MET A 60 -1.766 5.137 -7.434 1.00 10.00 O ATOM 625 CB MET A 60 -2.619 2.692 -9.183 1.00 10.00 C ATOM 626 CG MET A 60 -3.246 2.074 -10.421 1.00 10.00 C ATOM 627 SD MET A 60 -4.254 0.625 -10.047 1.00 10.00 S ATOM 628 CE MET A 60 -3.053 -0.438 -9.248 1.00 10.00 C ATOM 0 H MET A 60 -0.415 2.492 -10.372 1.00 10.00 H new ATOM 0 HA MET A 60 -2.291 4.662 -9.963 1.00 10.00 H new ATOM 0 HB2 MET A 60 -2.048 1.928 -8.656 1.00 10.00 H new ATOM 0 HB3 MET A 60 -3.412 3.018 -8.510 1.00 10.00 H new ATOM 0 HG2 MET A 60 -3.863 2.821 -10.921 1.00 10.00 H new ATOM 0 HG3 MET A 60 -2.458 1.792 -11.119 1.00 10.00 H new ATOM 0 HE1 MET A 60 -3.403 -1.470 -9.279 1.00 10.00 H new ATOM 0 HE2 MET A 60 -2.098 -0.363 -9.768 1.00 10.00 H new ATOM 0 HE3 MET A 60 -2.926 -0.129 -8.211 1.00 10.00 H new ATOM 638 N ASP A 61 0.146 4.058 -7.931 1.00 10.00 N ATOM 639 CA ASP A 61 0.838 4.506 -6.731 1.00 10.00 C ATOM 640 C ASP A 61 1.248 5.959 -6.896 1.00 10.00 C ATOM 641 O ASP A 61 0.844 6.825 -6.125 1.00 10.00 O ATOM 642 CB ASP A 61 2.076 3.646 -6.454 1.00 10.00 C ATOM 643 CG ASP A 61 1.745 2.184 -6.214 1.00 10.00 C ATOM 644 OD1 ASP A 61 1.059 1.876 -5.221 1.00 10.00 O ATOM 645 OD2 ASP A 61 2.167 1.332 -7.020 1.00 10.00 O ATOM 0 H ASP A 61 0.703 3.458 -8.540 1.00 10.00 H new ATOM 0 HA ASP A 61 0.159 4.407 -5.884 1.00 10.00 H new ATOM 0 HB2 ASP A 61 2.761 3.723 -7.298 1.00 10.00 H new ATOM 0 HB3 ASP A 61 2.598 4.042 -5.583 1.00 10.00 H new ATOM 650 N GLY A 62 2.050 6.223 -7.916 1.00 10.00 N ATOM 651 CA GLY A 62 2.495 7.577 -8.179 1.00 10.00 C ATOM 652 C GLY A 62 3.805 7.911 -7.496 1.00 10.00 C ATOM 653 O GLY A 62 4.800 8.199 -8.160 1.00 10.00 O ATOM 0 H GLY A 62 2.402 5.522 -8.568 1.00 10.00 H new ATOM 0 HA2 GLY A 62 2.607 7.715 -9.254 1.00 10.00 H new ATOM 0 HA3 GLY A 62 1.729 8.277 -7.846 1.00 10.00 H new ATOM 657 N THR A 63 3.818 7.866 -6.170 1.00 10.00 N ATOM 658 CA THR A 63 5.019 8.186 -5.420 1.00 10.00 C ATOM 659 C THR A 63 5.415 7.050 -4.487 1.00 10.00 C ATOM 660 O THR A 63 4.630 6.133 -4.236 1.00 10.00 O ATOM 661 CB THR A 63 4.849 9.483 -4.597 1.00 10.00 C ATOM 662 OG1 THR A 63 3.864 9.297 -3.570 1.00 10.00 O ATOM 663 CG2 THR A 63 4.439 10.646 -5.487 1.00 10.00 C ATOM 0 H THR A 63 3.013 7.612 -5.597 1.00 10.00 H new ATOM 0 HA THR A 63 5.810 8.335 -6.155 1.00 10.00 H new ATOM 0 HB THR A 63 5.811 9.715 -4.140 1.00 10.00 H new ATOM 0 HG1 THR A 63 3.767 10.125 -3.055 1.00 10.00 H new ATOM 0 HG21 THR A 63 4.327 11.545 -4.882 1.00 10.00 H new ATOM 0 HG22 THR A 63 5.205 10.812 -6.245 1.00 10.00 H new ATOM 0 HG23 THR A 63 3.491 10.415 -5.974 1.00 10.00 H new ATOM 671 N LEU A 64 6.641 7.129 -3.977 1.00 10.00 N ATOM 672 CA LEU A 64 7.183 6.126 -3.066 1.00 10.00 C ATOM 673 C LEU A 64 6.297 5.961 -1.837 1.00 10.00 C ATOM 674 O LEU A 64 6.005 4.838 -1.423 1.00 10.00 O ATOM 675 CB LEU A 64 8.600 6.525 -2.641 1.00 10.00 C ATOM 676 CG LEU A 64 9.232 5.653 -1.550 1.00 10.00 C ATOM 677 CD1 LEU A 64 9.516 4.251 -2.075 1.00 10.00 C ATOM 678 CD2 LEU A 64 10.505 6.300 -1.025 1.00 10.00 C ATOM 0 H LEU A 64 7.287 7.891 -4.184 1.00 10.00 H new ATOM 0 HA LEU A 64 7.215 5.170 -3.589 1.00 10.00 H new ATOM 0 HB2 LEU A 64 9.244 6.501 -3.520 1.00 10.00 H new ATOM 0 HB3 LEU A 64 8.578 7.557 -2.290 1.00 10.00 H new ATOM 0 HG LEU A 64 8.524 5.567 -0.726 1.00 10.00 H new ATOM 0 HD11 LEU A 64 9.964 3.650 -1.284 1.00 10.00 H new ATOM 0 HD12 LEU A 64 8.584 3.788 -2.399 1.00 10.00 H new ATOM 0 HD13 LEU A 64 10.203 4.311 -2.919 1.00 10.00 H new ATOM 0 HD21 LEU A 64 10.942 5.669 -0.251 1.00 10.00 H new ATOM 0 HD22 LEU A 64 11.217 6.418 -1.842 1.00 10.00 H new ATOM 0 HD23 LEU A 64 10.270 7.278 -0.605 1.00 10.00 H new ATOM 690 N LYS A 65 5.861 7.081 -1.264 1.00 10.00 N ATOM 691 CA LYS A 65 5.011 7.041 -0.082 1.00 10.00 C ATOM 692 C LYS A 65 3.724 6.291 -0.381 1.00 10.00 C ATOM 693 O LYS A 65 3.388 5.334 0.309 1.00 10.00 O ATOM 694 CB LYS A 65 4.687 8.450 0.414 1.00 10.00 C ATOM 695 CG LYS A 65 3.879 8.457 1.706 1.00 10.00 C ATOM 696 CD LYS A 65 3.276 9.823 2.002 1.00 10.00 C ATOM 697 CE LYS A 65 4.331 10.821 2.448 1.00 10.00 C ATOM 698 NZ LYS A 65 3.719 12.061 2.991 1.00 10.00 N ATOM 0 H LYS A 65 6.082 8.019 -1.598 1.00 10.00 H new ATOM 0 HA LYS A 65 5.557 6.518 0.703 1.00 10.00 H new ATOM 0 HB2 LYS A 65 5.617 8.996 0.571 1.00 10.00 H new ATOM 0 HB3 LYS A 65 4.131 8.982 -0.358 1.00 10.00 H new ATOM 0 HG2 LYS A 65 3.081 7.717 1.637 1.00 10.00 H new ATOM 0 HG3 LYS A 65 4.521 8.158 2.535 1.00 10.00 H new ATOM 0 HD2 LYS A 65 2.773 10.199 1.111 1.00 10.00 H new ATOM 0 HD3 LYS A 65 2.517 9.725 2.778 1.00 10.00 H new ATOM 0 HE2 LYS A 65 4.965 10.365 3.208 1.00 10.00 H new ATOM 0 HE3 LYS A 65 4.974 11.072 1.605 1.00 10.00 H new ATOM 0 HZ1 LYS A 65 4.469 12.718 3.285 1.00 10.00 H new ATOM 0 HZ2 LYS A 65 3.134 12.509 2.257 1.00 10.00 H new ATOM 0 HZ3 LYS A 65 3.125 11.825 3.811 1.00 10.00 H new ATOM 712 N THR A 66 3.026 6.710 -1.430 1.00 10.00 N ATOM 713 CA THR A 66 1.777 6.078 -1.815 1.00 10.00 C ATOM 714 C THR A 66 1.975 4.589 -2.081 1.00 10.00 C ATOM 715 O THR A 66 1.184 3.764 -1.630 1.00 10.00 O ATOM 716 CB THR A 66 1.183 6.751 -3.062 1.00 10.00 C ATOM 717 OG1 THR A 66 1.400 8.168 -2.993 1.00 10.00 O ATOM 718 CG2 THR A 66 -0.307 6.472 -3.171 1.00 10.00 C ATOM 0 H THR A 66 3.307 7.487 -2.028 1.00 10.00 H new ATOM 0 HA THR A 66 1.081 6.196 -0.984 1.00 10.00 H new ATOM 0 HB THR A 66 1.678 6.342 -3.943 1.00 10.00 H new ATOM 0 HG1 THR A 66 2.274 8.384 -3.380 1.00 10.00 H new ATOM 0 HG21 THR A 66 -0.704 6.959 -4.062 1.00 10.00 H new ATOM 0 HG22 THR A 66 -0.472 5.397 -3.241 1.00 10.00 H new ATOM 0 HG23 THR A 66 -0.815 6.860 -2.288 1.00 10.00 H new ATOM 726 N MET A 67 3.049 4.258 -2.789 1.00 10.00 N ATOM 727 CA MET A 67 3.364 2.871 -3.109 1.00 10.00 C ATOM 728 C MET A 67 3.496 2.050 -1.836 1.00 10.00 C ATOM 729 O MET A 67 2.856 1.013 -1.680 1.00 10.00 O ATOM 730 CB MET A 67 4.665 2.795 -3.911 1.00 10.00 C ATOM 731 CG MET A 67 4.969 1.411 -4.456 1.00 10.00 C ATOM 732 SD MET A 67 6.627 1.291 -5.158 1.00 10.00 S ATOM 733 CE MET A 67 7.634 1.416 -3.682 1.00 10.00 C ATOM 0 H MET A 67 3.719 4.935 -3.154 1.00 10.00 H new ATOM 0 HA MET A 67 2.551 2.463 -3.710 1.00 10.00 H new ATOM 0 HB2 MET A 67 4.610 3.498 -4.742 1.00 10.00 H new ATOM 0 HB3 MET A 67 5.491 3.115 -3.276 1.00 10.00 H new ATOM 0 HG2 MET A 67 4.863 0.678 -3.656 1.00 10.00 H new ATOM 0 HG3 MET A 67 4.235 1.156 -5.221 1.00 10.00 H new ATOM 0 HE1 MET A 67 8.417 2.158 -3.838 1.00 10.00 H new ATOM 0 HE2 MET A 67 7.010 1.718 -2.841 1.00 10.00 H new ATOM 0 HE3 MET A 67 8.088 0.448 -3.468 1.00 10.00 H new ATOM 743 N LEU A 68 4.310 2.541 -0.914 1.00 10.00 N ATOM 744 CA LEU A 68 4.533 1.856 0.350 1.00 10.00 C ATOM 745 C LEU A 68 3.255 1.807 1.182 1.00 10.00 C ATOM 746 O LEU A 68 2.994 0.814 1.863 1.00 10.00 O ATOM 747 CB LEU A 68 5.646 2.538 1.136 1.00 10.00 C ATOM 748 CG LEU A 68 7.021 2.496 0.468 1.00 10.00 C ATOM 749 CD1 LEU A 68 7.981 3.434 1.175 1.00 10.00 C ATOM 750 CD2 LEU A 68 7.572 1.076 0.456 1.00 10.00 C ATOM 0 H LEU A 68 4.828 3.413 -1.018 1.00 10.00 H new ATOM 0 HA LEU A 68 4.834 0.832 0.128 1.00 10.00 H new ATOM 0 HB2 LEU A 68 5.370 3.579 1.301 1.00 10.00 H new ATOM 0 HB3 LEU A 68 5.720 2.068 2.117 1.00 10.00 H new ATOM 0 HG LEU A 68 6.911 2.827 -0.565 1.00 10.00 H new ATOM 0 HD11 LEU A 68 8.955 3.393 0.688 1.00 10.00 H new ATOM 0 HD12 LEU A 68 7.595 4.452 1.129 1.00 10.00 H new ATOM 0 HD13 LEU A 68 8.084 3.132 2.217 1.00 10.00 H new ATOM 0 HD21 LEU A 68 8.551 1.070 -0.024 1.00 10.00 H new ATOM 0 HD22 LEU A 68 7.667 0.714 1.480 1.00 10.00 H new ATOM 0 HD23 LEU A 68 6.893 0.427 -0.097 1.00 10.00 H new ATOM 762 N GLU A 69 2.465 2.878 1.127 1.00 10.00 N ATOM 763 CA GLU A 69 1.208 2.933 1.864 1.00 10.00 C ATOM 764 C GLU A 69 0.248 1.872 1.348 1.00 10.00 C ATOM 765 O GLU A 69 -0.432 1.210 2.133 1.00 10.00 O ATOM 766 CB GLU A 69 0.564 4.318 1.759 1.00 10.00 C ATOM 767 CG GLU A 69 1.294 5.385 2.556 1.00 10.00 C ATOM 768 CD GLU A 69 0.421 6.571 2.902 1.00 10.00 C ATOM 769 OE1 GLU A 69 0.083 7.356 1.989 1.00 10.00 O ATOM 770 OE2 GLU A 69 0.074 6.727 4.095 1.00 10.00 O ATOM 0 H GLU A 69 2.673 3.715 0.582 1.00 10.00 H new ATOM 0 HA GLU A 69 1.426 2.738 2.914 1.00 10.00 H new ATOM 0 HB2 GLU A 69 0.531 4.617 0.711 1.00 10.00 H new ATOM 0 HB3 GLU A 69 -0.468 4.258 2.106 1.00 10.00 H new ATOM 0 HG2 GLU A 69 1.678 4.944 3.476 1.00 10.00 H new ATOM 0 HG3 GLU A 69 2.156 5.730 1.985 1.00 10.00 H new ATOM 777 N ARG A 70 0.208 1.701 0.032 1.00 10.00 N ATOM 778 CA ARG A 70 -0.657 0.701 -0.576 1.00 10.00 C ATOM 779 C ARG A 70 -0.141 -0.692 -0.243 1.00 10.00 C ATOM 780 O ARG A 70 -0.922 -1.604 0.027 1.00 10.00 O ATOM 781 CB ARG A 70 -0.737 0.882 -2.097 1.00 10.00 C ATOM 782 CG ARG A 70 -1.270 2.239 -2.538 1.00 10.00 C ATOM 783 CD ARG A 70 -2.655 2.520 -1.973 1.00 10.00 C ATOM 784 NE ARG A 70 -3.188 3.798 -2.444 1.00 10.00 N ATOM 785 CZ ARG A 70 -4.077 4.534 -1.773 1.00 10.00 C ATOM 786 NH1 ARG A 70 -4.580 4.097 -0.623 1.00 10.00 N ATOM 787 NH2 ARG A 70 -4.483 5.697 -2.268 1.00 10.00 N ATOM 0 H ARG A 70 0.763 2.241 -0.632 1.00 10.00 H new ATOM 0 HA ARG A 70 -1.661 0.826 -0.171 1.00 10.00 H new ATOM 0 HB2 ARG A 70 0.257 0.739 -2.521 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -1.375 0.102 -2.511 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -0.582 3.021 -2.216 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -1.308 2.277 -3.627 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -3.334 1.716 -2.259 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -2.608 2.525 -0.884 1.00 10.00 H new ATOM 0 HE ARG A 70 -2.859 4.150 -3.343 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -4.287 3.195 -0.248 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -5.259 4.664 -0.115 1.00 10.00 H new ATOM 0 HH21 ARG A 70 -4.116 6.028 -3.160 1.00 10.00 H new ATOM 0 HH22 ARG A 70 -5.162 6.260 -1.756 1.00 10.00 H new ATOM 801 N TRP A 71 1.179 -0.845 -0.256 1.00 10.00 N ATOM 802 CA TRP A 71 1.811 -2.123 0.061 1.00 10.00 C ATOM 803 C TRP A 71 1.490 -2.544 1.491 1.00 10.00 C ATOM 804 O TRP A 71 0.983 -3.644 1.730 1.00 10.00 O ATOM 805 CB TRP A 71 3.329 -2.030 -0.104 1.00 10.00 C ATOM 806 CG TRP A 71 3.801 -2.055 -1.528 1.00 10.00 C ATOM 807 CD1 TRP A 71 3.037 -1.975 -2.657 1.00 10.00 C ATOM 808 CD2 TRP A 71 5.158 -2.169 -1.971 1.00 10.00 C ATOM 809 NE1 TRP A 71 3.839 -2.027 -3.771 1.00 10.00 N ATOM 810 CE2 TRP A 71 5.143 -2.149 -3.375 1.00 10.00 C ATOM 811 CE3 TRP A 71 6.385 -2.287 -1.312 1.00 10.00 C ATOM 812 CZ2 TRP A 71 6.307 -2.238 -4.134 1.00 10.00 C ATOM 813 CZ3 TRP A 71 7.539 -2.378 -2.066 1.00 10.00 C ATOM 814 CH2 TRP A 71 7.495 -2.354 -3.465 1.00 10.00 C ATOM 0 H TRP A 71 1.835 -0.098 -0.483 1.00 10.00 H new ATOM 0 HA TRP A 71 1.417 -2.868 -0.631 1.00 10.00 H new ATOM 0 HB2 TRP A 71 3.677 -1.110 0.365 1.00 10.00 H new ATOM 0 HB3 TRP A 71 3.792 -2.857 0.434 1.00 10.00 H new ATOM 0 HD1 TRP A 71 1.961 -1.884 -2.672 1.00 10.00 H new ATOM 0 HE1 TRP A 71 3.515 -1.982 -4.737 1.00 10.00 H new ATOM 0 HE3 TRP A 71 6.430 -2.307 -0.233 1.00 10.00 H new ATOM 0 HZ2 TRP A 71 6.273 -2.216 -5.213 1.00 10.00 H new ATOM 0 HZ3 TRP A 71 8.492 -2.469 -1.567 1.00 10.00 H new ATOM 0 HH2 TRP A 71 8.415 -2.428 -4.026 1.00 10.00 H new ATOM 825 N ALA A 72 1.790 -1.656 2.433 1.00 10.00 N ATOM 826 CA ALA A 72 1.543 -1.917 3.842 1.00 10.00 C ATOM 827 C ALA A 72 0.063 -2.167 4.114 1.00 10.00 C ATOM 828 O ALA A 72 -0.289 -3.101 4.828 1.00 10.00 O ATOM 829 CB ALA A 72 2.050 -0.759 4.692 1.00 10.00 C ATOM 0 H ALA A 72 2.207 -0.745 2.242 1.00 10.00 H new ATOM 0 HA ALA A 72 2.088 -2.821 4.113 1.00 10.00 H new ATOM 0 HB1 ALA A 72 1.858 -0.969 5.744 1.00 10.00 H new ATOM 0 HB2 ALA A 72 3.122 -0.635 4.536 1.00 10.00 H new ATOM 0 HB3 ALA A 72 1.533 0.157 4.405 1.00 10.00 H new ATOM 835 N ALA A 73 -0.801 -1.349 3.524 1.00 10.00 N ATOM 836 CA ALA A 73 -2.239 -1.493 3.724 1.00 10.00 C ATOM 837 C ALA A 73 -2.755 -2.811 3.153 1.00 10.00 C ATOM 838 O ALA A 73 -3.639 -3.441 3.728 1.00 10.00 O ATOM 839 CB ALA A 73 -2.988 -0.331 3.093 1.00 10.00 C ATOM 0 H ALA A 73 -0.533 -0.583 2.906 1.00 10.00 H new ATOM 0 HA ALA A 73 -2.419 -1.493 4.799 1.00 10.00 H new ATOM 0 HB1 ALA A 73 -4.059 -0.458 3.254 1.00 10.00 H new ATOM 0 HB2 ALA A 73 -2.661 0.603 3.549 1.00 10.00 H new ATOM 0 HB3 ALA A 73 -2.782 -0.304 2.023 1.00 10.00 H new ATOM 845 N ASP A 74 -2.186 -3.234 2.032 1.00 10.00 N ATOM 846 CA ASP A 74 -2.606 -4.476 1.381 1.00 10.00 C ATOM 847 C ASP A 74 -2.126 -5.699 2.153 1.00 10.00 C ATOM 848 O ASP A 74 -2.569 -6.819 1.901 1.00 10.00 O ATOM 849 CB ASP A 74 -2.073 -4.535 -0.048 1.00 10.00 C ATOM 850 CG ASP A 74 -3.146 -4.886 -1.064 1.00 10.00 C ATOM 851 OD1 ASP A 74 -3.842 -5.909 -0.885 1.00 10.00 O ATOM 852 OD2 ASP A 74 -3.292 -4.138 -2.056 1.00 10.00 O ATOM 0 H ASP A 74 -1.434 -2.739 1.552 1.00 10.00 H new ATOM 0 HA ASP A 74 -3.696 -4.484 1.364 1.00 10.00 H new ATOM 0 HB2 ASP A 74 -1.635 -3.571 -0.307 1.00 10.00 H new ATOM 0 HB3 ASP A 74 -1.273 -5.273 -0.102 1.00 10.00 H new ATOM 857 N SER A 75 -1.217 -5.484 3.093 1.00 10.00 N ATOM 858 CA SER A 75 -0.678 -6.578 3.888 1.00 10.00 C ATOM 859 C SER A 75 -0.945 -6.367 5.374 1.00 10.00 C ATOM 860 O SER A 75 -0.368 -7.057 6.220 1.00 10.00 O ATOM 861 CB SER A 75 0.820 -6.704 3.634 1.00 10.00 C ATOM 862 OG SER A 75 1.120 -6.463 2.266 1.00 10.00 O ATOM 0 H SER A 75 -0.838 -4.565 3.323 1.00 10.00 H new ATOM 0 HA SER A 75 -1.177 -7.500 3.589 1.00 10.00 H new ATOM 0 HB2 SER A 75 1.361 -5.995 4.260 1.00 10.00 H new ATOM 0 HB3 SER A 75 1.159 -7.701 3.916 1.00 10.00 H new ATOM 0 HG SER A 75 1.103 -5.499 2.092 1.00 10.00 H new ATOM 868 N ASN A 76 -1.815 -5.402 5.684 1.00 10.00 N ATOM 869 CA ASN A 76 -2.178 -5.098 7.070 1.00 10.00 C ATOM 870 C ASN A 76 -0.928 -4.780 7.898 1.00 10.00 C ATOM 871 O ASN A 76 -0.703 -5.353 8.965 1.00 10.00 O ATOM 872 CB ASN A 76 -2.945 -6.286 7.675 1.00 10.00 C ATOM 873 CG ASN A 76 -3.517 -5.999 9.051 1.00 10.00 C ATOM 874 OD1 ASN A 76 -3.855 -4.857 9.373 1.00 10.00 O ATOM 875 ND2 ASN A 76 -3.630 -7.034 9.868 1.00 10.00 N ATOM 0 H ASN A 76 -2.282 -4.817 4.991 1.00 10.00 H new ATOM 0 HA ASN A 76 -2.821 -4.218 7.085 1.00 10.00 H new ATOM 0 HB2 ASN A 76 -3.757 -6.564 7.003 1.00 10.00 H new ATOM 0 HB3 ASN A 76 -2.277 -7.145 7.740 1.00 10.00 H new ATOM 0 HD21 ASN A 76 -4.009 -6.904 10.806 1.00 10.00 H new ATOM 0 HD22 ASN A 76 -3.338 -7.961 9.560 1.00 10.00 H new ATOM 882 N MET A 77 -0.117 -3.862 7.395 1.00 10.00 N ATOM 883 CA MET A 77 1.118 -3.474 8.065 1.00 10.00 C ATOM 884 C MET A 77 1.155 -1.973 8.316 1.00 10.00 C ATOM 885 O MET A 77 0.302 -1.226 7.828 1.00 10.00 O ATOM 886 CB MET A 77 2.327 -3.883 7.218 1.00 10.00 C ATOM 887 CG MET A 77 2.471 -5.384 7.051 1.00 10.00 C ATOM 888 SD MET A 77 3.523 -5.838 5.663 1.00 10.00 S ATOM 889 CE MET A 77 5.073 -5.086 6.146 1.00 10.00 C ATOM 0 H MET A 77 -0.292 -3.368 6.520 1.00 10.00 H new ATOM 0 HA MET A 77 1.156 -3.987 9.026 1.00 10.00 H new ATOM 0 HB2 MET A 77 2.243 -3.423 6.234 1.00 10.00 H new ATOM 0 HB3 MET A 77 3.233 -3.488 7.678 1.00 10.00 H new ATOM 0 HG2 MET A 77 2.883 -5.808 7.967 1.00 10.00 H new ATOM 0 HG3 MET A 77 1.484 -5.825 6.912 1.00 10.00 H new ATOM 0 HE1 MET A 77 5.869 -5.829 6.097 1.00 10.00 H new ATOM 0 HE2 MET A 77 5.304 -4.262 5.471 1.00 10.00 H new ATOM 0 HE3 MET A 77 4.992 -4.708 7.165 1.00 10.00 H new ATOM 899 N GLN A 78 2.147 -1.541 9.079 1.00 10.00 N ATOM 900 CA GLN A 78 2.319 -0.131 9.401 1.00 10.00 C ATOM 901 C GLN A 78 3.423 0.474 8.534 1.00 10.00 C ATOM 902 O GLN A 78 4.202 -0.258 7.922 1.00 10.00 O ATOM 903 CB GLN A 78 2.653 0.032 10.884 1.00 10.00 C ATOM 904 CG GLN A 78 1.506 -0.325 11.816 1.00 10.00 C ATOM 905 CD GLN A 78 0.257 0.483 11.539 1.00 10.00 C ATOM 906 OE1 GLN A 78 0.106 1.601 12.027 1.00 10.00 O ATOM 907 NE2 GLN A 78 -0.651 -0.081 10.761 1.00 10.00 N ATOM 0 H GLN A 78 2.852 -2.153 9.491 1.00 10.00 H new ATOM 0 HA GLN A 78 1.387 0.396 9.195 1.00 10.00 H new ATOM 0 HB2 GLN A 78 3.512 -0.595 11.124 1.00 10.00 H new ATOM 0 HB3 GLN A 78 2.950 1.064 11.068 1.00 10.00 H new ATOM 0 HG2 GLN A 78 1.278 -1.386 11.715 1.00 10.00 H new ATOM 0 HG3 GLN A 78 1.818 -0.163 12.848 1.00 10.00 H new ATOM 0 HE21 GLN A 78 -0.486 -1.011 10.376 1.00 10.00 H new ATOM 0 HE22 GLN A 78 -1.516 0.414 10.546 1.00 10.00 H new ATOM 916 N LEU A 79 3.490 1.801 8.484 1.00 10.00 N ATOM 917 CA LEU A 79 4.496 2.486 7.682 1.00 10.00 C ATOM 918 C LEU A 79 5.025 3.725 8.391 1.00 10.00 C ATOM 919 O LEU A 79 4.284 4.444 9.064 1.00 10.00 O ATOM 920 CB LEU A 79 3.922 2.882 6.317 1.00 10.00 C ATOM 921 CG LEU A 79 4.832 3.779 5.465 1.00 10.00 C ATOM 922 CD1 LEU A 79 5.943 2.966 4.820 1.00 10.00 C ATOM 923 CD2 LEU A 79 4.024 4.510 4.407 1.00 10.00 C ATOM 0 H LEU A 79 2.859 2.423 8.990 1.00 10.00 H new ATOM 0 HA LEU A 79 5.323 1.791 7.537 1.00 10.00 H new ATOM 0 HB2 LEU A 79 3.703 1.974 5.755 1.00 10.00 H new ATOM 0 HB3 LEU A 79 2.974 3.397 6.474 1.00 10.00 H new ATOM 0 HG LEU A 79 5.289 4.519 6.122 1.00 10.00 H new ATOM 0 HD11 LEU A 79 6.574 3.623 4.222 1.00 10.00 H new ATOM 0 HD12 LEU A 79 6.545 2.492 5.596 1.00 10.00 H new ATOM 0 HD13 LEU A 79 5.508 2.199 4.179 1.00 10.00 H new ATOM 0 HD21 LEU A 79 4.687 5.140 3.814 1.00 10.00 H new ATOM 0 HD22 LEU A 79 3.535 3.785 3.757 1.00 10.00 H new ATOM 0 HD23 LEU A 79 3.269 5.131 4.890 1.00 10.00 H new ATOM 935 N SER A 80 6.312 3.955 8.230 1.00 10.00 N ATOM 936 CA SER A 80 6.982 5.092 8.823 1.00 10.00 C ATOM 937 C SER A 80 7.830 5.821 7.777 1.00 10.00 C ATOM 938 O SER A 80 8.954 5.412 7.471 1.00 10.00 O ATOM 939 CB SER A 80 7.845 4.613 9.987 1.00 10.00 C ATOM 940 OG SER A 80 7.057 4.353 11.136 1.00 10.00 O ATOM 0 H SER A 80 6.926 3.354 7.680 1.00 10.00 H new ATOM 0 HA SER A 80 6.240 5.797 9.197 1.00 10.00 H new ATOM 0 HB2 SER A 80 8.381 3.709 9.698 1.00 10.00 H new ATOM 0 HB3 SER A 80 8.596 5.368 10.221 1.00 10.00 H new ATOM 0 HG SER A 80 7.634 4.046 11.866 1.00 10.00 H new ATOM 946 N TYR A 81 7.268 6.885 7.217 1.00 10.00 N ATOM 947 CA TYR A 81 7.946 7.691 6.209 1.00 10.00 C ATOM 948 C TYR A 81 8.709 8.821 6.896 1.00 10.00 C ATOM 949 O TYR A 81 8.109 9.804 7.331 1.00 10.00 O ATOM 950 CB TYR A 81 6.912 8.263 5.232 1.00 10.00 C ATOM 951 CG TYR A 81 7.459 8.681 3.883 1.00 10.00 C ATOM 952 CD1 TYR A 81 7.812 7.737 2.927 1.00 10.00 C ATOM 953 CD2 TYR A 81 7.593 10.024 3.554 1.00 10.00 C ATOM 954 CE1 TYR A 81 8.288 8.119 1.685 1.00 10.00 C ATOM 955 CE2 TYR A 81 8.062 10.414 2.314 1.00 10.00 C ATOM 956 CZ TYR A 81 8.409 9.460 1.383 1.00 10.00 C ATOM 957 OH TYR A 81 8.879 9.849 0.149 1.00 10.00 O ATOM 0 H TYR A 81 6.330 7.213 7.448 1.00 10.00 H new ATOM 0 HA TYR A 81 8.651 7.073 5.653 1.00 10.00 H new ATOM 0 HB2 TYR A 81 6.133 7.517 5.075 1.00 10.00 H new ATOM 0 HB3 TYR A 81 6.436 9.127 5.696 1.00 10.00 H new ATOM 0 HD1 TYR A 81 7.713 6.686 3.157 1.00 10.00 H new ATOM 0 HD2 TYR A 81 7.326 10.777 4.281 1.00 10.00 H new ATOM 0 HE1 TYR A 81 8.563 7.371 0.956 1.00 10.00 H new ATOM 0 HE2 TYR A 81 8.156 11.463 2.076 1.00 10.00 H new ATOM 0 HH TYR A 81 9.400 10.674 0.243 1.00 10.00 H new ATOM 967 N ASN A 82 10.024 8.680 7.004 1.00 10.00 N ATOM 968 CA ASN A 82 10.843 9.692 7.671 1.00 10.00 C ATOM 969 C ASN A 82 11.399 10.705 6.682 1.00 10.00 C ATOM 970 O ASN A 82 12.131 11.618 7.061 1.00 10.00 O ATOM 971 CB ASN A 82 11.996 9.033 8.433 1.00 10.00 C ATOM 972 CG ASN A 82 11.519 8.198 9.602 1.00 10.00 C ATOM 973 OD1 ASN A 82 11.201 8.724 10.669 1.00 10.00 O ATOM 974 ND2 ASN A 82 11.480 6.888 9.415 1.00 10.00 N ATOM 0 H ASN A 82 10.546 7.882 6.642 1.00 10.00 H new ATOM 0 HA ASN A 82 10.198 10.219 8.374 1.00 10.00 H new ATOM 0 HB2 ASN A 82 12.565 8.403 7.750 1.00 10.00 H new ATOM 0 HB3 ASN A 82 12.675 9.805 8.796 1.00 10.00 H new ATOM 0 HD21 ASN A 82 11.178 6.274 10.171 1.00 10.00 H new ATOM 0 HD22 ASN A 82 11.752 6.493 8.515 1.00 10.00 H new ATOM 981 N LEU A 83 11.056 10.540 5.417 1.00 10.00 N ATOM 982 CA LEU A 83 11.528 11.441 4.382 1.00 10.00 C ATOM 983 C LEU A 83 10.792 12.773 4.464 1.00 10.00 C ATOM 984 O LEU A 83 9.576 12.802 4.653 1.00 10.00 O ATOM 985 CB LEU A 83 11.329 10.826 2.996 1.00 10.00 C ATOM 986 CG LEU A 83 12.017 9.479 2.755 1.00 10.00 C ATOM 987 CD1 LEU A 83 13.457 9.512 3.228 1.00 10.00 C ATOM 988 CD2 LEU A 83 11.268 8.355 3.436 1.00 10.00 C ATOM 0 H LEU A 83 10.452 9.790 5.082 1.00 10.00 H new ATOM 0 HA LEU A 83 12.593 11.610 4.540 1.00 10.00 H new ATOM 0 HB2 LEU A 83 10.260 10.701 2.826 1.00 10.00 H new ATOM 0 HB3 LEU A 83 11.690 11.535 2.250 1.00 10.00 H new ATOM 0 HG LEU A 83 12.011 9.294 1.681 1.00 10.00 H new ATOM 0 HD11 LEU A 83 13.922 8.543 3.045 1.00 10.00 H new ATOM 0 HD12 LEU A 83 14.001 10.284 2.684 1.00 10.00 H new ATOM 0 HD13 LEU A 83 13.484 9.732 4.295 1.00 10.00 H new ATOM 0 HD21 LEU A 83 11.779 7.411 3.248 1.00 10.00 H new ATOM 0 HD22 LEU A 83 11.231 8.540 4.510 1.00 10.00 H new ATOM 0 HD23 LEU A 83 10.253 8.303 3.042 1.00 10.00 H new ATOM 1000 N PRO A 84 11.525 13.889 4.320 1.00 10.00 N ATOM 1001 CA PRO A 84 10.947 15.239 4.381 1.00 10.00 C ATOM 1002 C PRO A 84 9.986 15.517 3.230 1.00 10.00 C ATOM 1003 O PRO A 84 9.071 16.334 3.351 1.00 10.00 O ATOM 1004 CB PRO A 84 12.172 16.157 4.289 1.00 10.00 C ATOM 1005 CG PRO A 84 13.222 15.330 3.631 1.00 10.00 C ATOM 1006 CD PRO A 84 12.982 13.923 4.099 1.00 10.00 C ATOM 0 HA PRO A 84 10.354 15.384 5.284 1.00 10.00 H new ATOM 0 HB2 PRO A 84 11.952 17.052 3.707 1.00 10.00 H new ATOM 0 HB3 PRO A 84 12.492 16.489 5.277 1.00 10.00 H new ATOM 0 HG2 PRO A 84 13.152 15.399 2.545 1.00 10.00 H new ATOM 0 HG3 PRO A 84 14.220 15.670 3.908 1.00 10.00 H new ATOM 0 HD2 PRO A 84 13.294 13.191 3.354 1.00 10.00 H new ATOM 0 HD3 PRO A 84 13.534 13.702 5.013 1.00 10.00 H new ATOM 1014 N SER A 85 10.193 14.837 2.115 1.00 10.00 N ATOM 1015 CA SER A 85 9.344 15.015 0.952 1.00 10.00 C ATOM 1016 C SER A 85 9.085 13.686 0.256 1.00 10.00 C ATOM 1017 O SER A 85 9.803 12.705 0.473 1.00 10.00 O ATOM 1018 CB SER A 85 9.986 16.002 -0.023 1.00 10.00 C ATOM 1019 OG SER A 85 10.166 17.270 0.584 1.00 10.00 O ATOM 0 H SER A 85 10.943 14.156 1.992 1.00 10.00 H new ATOM 0 HA SER A 85 8.388 15.416 1.288 1.00 10.00 H new ATOM 0 HB2 SER A 85 10.949 15.615 -0.357 1.00 10.00 H new ATOM 0 HB3 SER A 85 9.359 16.104 -0.909 1.00 10.00 H new ATOM 0 HG SER A 85 10.580 17.884 -0.058 1.00 10.00 H new ATOM 1025 N ASP A 86 8.051 13.660 -0.571 1.00 10.00 N ATOM 1026 CA ASP A 86 7.691 12.466 -1.318 1.00 10.00 C ATOM 1027 C ASP A 86 8.486 12.404 -2.613 1.00 10.00 C ATOM 1028 O ASP A 86 8.773 13.431 -3.233 1.00 10.00 O ATOM 1029 CB ASP A 86 6.187 12.441 -1.619 1.00 10.00 C ATOM 1030 CG ASP A 86 5.748 13.587 -2.510 1.00 10.00 C ATOM 1031 OD1 ASP A 86 5.548 14.706 -1.988 1.00 10.00 O ATOM 1032 OD2 ASP A 86 5.591 13.379 -3.730 1.00 10.00 O ATOM 0 H ASP A 86 7.442 14.460 -0.742 1.00 10.00 H new ATOM 0 HA ASP A 86 7.931 11.594 -0.709 1.00 10.00 H new ATOM 0 HB2 ASP A 86 5.933 11.496 -2.098 1.00 10.00 H new ATOM 0 HB3 ASP A 86 5.633 12.482 -0.681 1.00 10.00 H new ATOM 1037 N TYR A 87 8.863 11.201 -3.005 1.00 10.00 N ATOM 1038 CA TYR A 87 9.632 11.010 -4.223 1.00 10.00 C ATOM 1039 C TYR A 87 8.885 10.090 -5.178 1.00 10.00 C ATOM 1040 O TYR A 87 8.348 9.062 -4.763 1.00 10.00 O ATOM 1041 CB TYR A 87 11.013 10.421 -3.904 1.00 10.00 C ATOM 1042 CG TYR A 87 11.728 11.101 -2.753 1.00 10.00 C ATOM 1043 CD1 TYR A 87 12.147 12.424 -2.848 1.00 10.00 C ATOM 1044 CD2 TYR A 87 11.991 10.417 -1.573 1.00 10.00 C ATOM 1045 CE1 TYR A 87 12.800 13.044 -1.800 1.00 10.00 C ATOM 1046 CE2 TYR A 87 12.644 11.032 -0.522 1.00 10.00 C ATOM 1047 CZ TYR A 87 13.048 12.342 -0.640 1.00 10.00 C ATOM 1048 OH TYR A 87 13.696 12.954 0.407 1.00 10.00 O ATOM 0 H TYR A 87 8.650 10.341 -2.499 1.00 10.00 H new ATOM 0 HA TYR A 87 9.768 11.982 -4.698 1.00 10.00 H new ATOM 0 HB2 TYR A 87 10.899 9.362 -3.671 1.00 10.00 H new ATOM 0 HB3 TYR A 87 11.638 10.486 -4.795 1.00 10.00 H new ATOM 0 HD1 TYR A 87 11.959 12.976 -3.757 1.00 10.00 H new ATOM 0 HD2 TYR A 87 11.680 9.387 -1.475 1.00 10.00 H new ATOM 0 HE1 TYR A 87 13.114 14.073 -1.889 1.00 10.00 H new ATOM 0 HE2 TYR A 87 12.837 10.486 0.390 1.00 10.00 H new ATOM 0 HH TYR A 87 13.790 12.320 1.149 1.00 10.00 H new ATOM 1058 N THR A 88 8.838 10.465 -6.445 1.00 10.00 N ATOM 1059 CA THR A 88 8.166 9.662 -7.455 1.00 10.00 C ATOM 1060 C THR A 88 9.009 8.443 -7.811 1.00 10.00 C ATOM 1061 O THR A 88 10.207 8.409 -7.520 1.00 10.00 O ATOM 1062 CB THR A 88 7.905 10.485 -8.728 1.00 10.00 C ATOM 1063 OG1 THR A 88 8.818 11.592 -8.787 1.00 10.00 O ATOM 1064 CG2 THR A 88 6.473 10.995 -8.762 1.00 10.00 C ATOM 0 H THR A 88 9.259 11.324 -6.801 1.00 10.00 H new ATOM 0 HA THR A 88 7.211 9.338 -7.041 1.00 10.00 H new ATOM 0 HB THR A 88 8.059 9.839 -9.592 1.00 10.00 H new ATOM 0 HG1 THR A 88 8.649 12.112 -9.600 1.00 10.00 H new ATOM 0 HG21 THR A 88 6.314 11.574 -9.672 1.00 10.00 H new ATOM 0 HG22 THR A 88 5.785 10.150 -8.745 1.00 10.00 H new ATOM 0 HG23 THR A 88 6.291 11.628 -7.893 1.00 10.00 H new ATOM 1072 N LEU A 89 8.390 7.434 -8.413 1.00 10.00 N ATOM 1073 CA LEU A 89 9.119 6.240 -8.808 1.00 10.00 C ATOM 1074 C LEU A 89 10.063 6.587 -9.949 1.00 10.00 C ATOM 1075 O LEU A 89 9.624 6.834 -11.074 1.00 10.00 O ATOM 1076 CB LEU A 89 8.164 5.120 -9.236 1.00 10.00 C ATOM 1077 CG LEU A 89 7.289 4.513 -8.129 1.00 10.00 C ATOM 1078 CD1 LEU A 89 7.841 4.807 -6.741 1.00 10.00 C ATOM 1079 CD2 LEU A 89 5.858 5.002 -8.254 1.00 10.00 C ATOM 0 H LEU A 89 7.395 7.420 -8.636 1.00 10.00 H new ATOM 0 HA LEU A 89 9.689 5.880 -7.951 1.00 10.00 H new ATOM 0 HB2 LEU A 89 7.509 5.508 -10.016 1.00 10.00 H new ATOM 0 HB3 LEU A 89 8.753 4.320 -9.684 1.00 10.00 H new ATOM 0 HG LEU A 89 7.302 3.431 -8.258 1.00 10.00 H new ATOM 0 HD11 LEU A 89 7.191 4.359 -5.989 1.00 10.00 H new ATOM 0 HD12 LEU A 89 8.843 4.387 -6.651 1.00 10.00 H new ATOM 0 HD13 LEU A 89 7.884 5.885 -6.588 1.00 10.00 H new ATOM 0 HD21 LEU A 89 5.253 4.562 -7.462 1.00 10.00 H new ATOM 0 HD22 LEU A 89 5.836 6.088 -8.167 1.00 10.00 H new ATOM 0 HD23 LEU A 89 5.456 4.708 -9.224 1.00 10.00 H new ATOM 1091 N ILE A 90 11.355 6.618 -9.637 1.00 10.00 N ATOM 1092 CA ILE A 90 12.393 6.958 -10.610 1.00 10.00 C ATOM 1093 C ILE A 90 12.235 6.197 -11.924 1.00 10.00 C ATOM 1094 O ILE A 90 12.312 6.786 -12.999 1.00 10.00 O ATOM 1095 CB ILE A 90 13.807 6.705 -10.040 1.00 10.00 C ATOM 1096 CG1 ILE A 90 13.858 5.370 -9.290 1.00 10.00 C ATOM 1097 CG2 ILE A 90 14.220 7.847 -9.123 1.00 10.00 C ATOM 1098 CD1 ILE A 90 15.253 4.954 -8.871 1.00 10.00 C ATOM 0 H ILE A 90 11.713 6.409 -8.705 1.00 10.00 H new ATOM 0 HA ILE A 90 12.272 8.021 -10.816 1.00 10.00 H new ATOM 0 HB ILE A 90 14.509 6.656 -10.872 1.00 10.00 H new ATOM 0 HG12 ILE A 90 13.228 5.439 -8.403 1.00 10.00 H new ATOM 0 HG13 ILE A 90 13.432 4.592 -9.924 1.00 10.00 H new ATOM 0 HG21 ILE A 90 15.218 7.655 -8.729 1.00 10.00 H new ATOM 0 HG22 ILE A 90 14.225 8.781 -9.685 1.00 10.00 H new ATOM 0 HG23 ILE A 90 13.513 7.924 -8.297 1.00 10.00 H new ATOM 0 HD11 ILE A 90 15.206 4.000 -8.346 1.00 10.00 H new ATOM 0 HD12 ILE A 90 15.883 4.851 -9.755 1.00 10.00 H new ATOM 0 HD13 ILE A 90 15.675 5.711 -8.210 1.00 10.00 H new ATOM 1110 N GLY A 91 11.999 4.896 -11.839 1.00 10.00 N ATOM 1111 CA GLY A 91 11.838 4.107 -13.045 1.00 10.00 C ATOM 1112 C GLY A 91 11.928 2.616 -12.790 1.00 10.00 C ATOM 1113 O GLY A 91 10.921 1.915 -12.876 1.00 10.00 O ATOM 0 H GLY A 91 11.917 4.375 -10.966 1.00 10.00 H new ATOM 0 HA2 GLY A 91 10.873 4.336 -13.497 1.00 10.00 H new ATOM 0 HA3 GLY A 91 12.603 4.394 -13.766 1.00 10.00 H new ATOM 1117 N PRO A 92 13.129 2.110 -12.446 1.00 10.00 N ATOM 1118 CA PRO A 92 13.368 0.676 -12.180 1.00 10.00 C ATOM 1119 C PRO A 92 12.466 0.103 -11.087 1.00 10.00 C ATOM 1120 O PRO A 92 12.369 -1.111 -10.927 1.00 10.00 O ATOM 1121 CB PRO A 92 14.836 0.626 -11.729 1.00 10.00 C ATOM 1122 CG PRO A 92 15.191 2.033 -11.391 1.00 10.00 C ATOM 1123 CD PRO A 92 14.370 2.888 -12.306 1.00 10.00 C ATOM 0 HA PRO A 92 13.151 0.076 -13.064 1.00 10.00 H new ATOM 0 HB2 PRO A 92 14.961 -0.029 -10.867 1.00 10.00 H new ATOM 0 HB3 PRO A 92 15.478 0.237 -12.520 1.00 10.00 H new ATOM 0 HG2 PRO A 92 14.970 2.253 -10.346 1.00 10.00 H new ATOM 0 HG3 PRO A 92 16.256 2.214 -11.536 1.00 10.00 H new ATOM 0 HD2 PRO A 92 14.184 3.874 -11.881 1.00 10.00 H new ATOM 0 HD3 PRO A 92 14.862 3.042 -13.266 1.00 10.00 H new ATOM 1131 N VAL A 93 11.807 0.980 -10.344 1.00 10.00 N ATOM 1132 CA VAL A 93 10.910 0.565 -9.274 1.00 10.00 C ATOM 1133 C VAL A 93 9.778 -0.291 -9.833 1.00 10.00 C ATOM 1134 O VAL A 93 9.340 -1.256 -9.209 1.00 10.00 O ATOM 1135 CB VAL A 93 10.313 1.780 -8.537 1.00 10.00 C ATOM 1136 CG1 VAL A 93 9.872 1.396 -7.134 1.00 10.00 C ATOM 1137 CG2 VAL A 93 11.311 2.923 -8.497 1.00 10.00 C ATOM 0 H VAL A 93 11.877 1.991 -10.463 1.00 10.00 H new ATOM 0 HA VAL A 93 11.496 -0.019 -8.564 1.00 10.00 H new ATOM 0 HB VAL A 93 9.433 2.116 -9.086 1.00 10.00 H new ATOM 0 HG11 VAL A 93 9.454 2.269 -6.632 1.00 10.00 H new ATOM 0 HG12 VAL A 93 9.115 0.614 -7.192 1.00 10.00 H new ATOM 0 HG13 VAL A 93 10.730 1.030 -6.570 1.00 10.00 H new ATOM 0 HG21 VAL A 93 10.871 3.772 -7.973 1.00 10.00 H new ATOM 0 HG22 VAL A 93 12.212 2.601 -7.975 1.00 10.00 H new ATOM 0 HG23 VAL A 93 11.567 3.218 -9.515 1.00 10.00 H new ATOM 1147 N SER A 94 9.330 0.062 -11.031 1.00 10.00 N ATOM 1148 CA SER A 94 8.261 -0.659 -11.701 1.00 10.00 C ATOM 1149 C SER A 94 8.715 -2.055 -12.142 1.00 10.00 C ATOM 1150 O SER A 94 7.895 -2.892 -12.514 1.00 10.00 O ATOM 1151 CB SER A 94 7.792 0.148 -12.910 1.00 10.00 C ATOM 1152 OG SER A 94 7.754 1.539 -12.606 1.00 10.00 O ATOM 0 H SER A 94 9.697 0.852 -11.561 1.00 10.00 H new ATOM 0 HA SER A 94 7.438 -0.788 -10.999 1.00 10.00 H new ATOM 0 HB2 SER A 94 8.462 -0.027 -13.752 1.00 10.00 H new ATOM 0 HB3 SER A 94 6.802 -0.189 -13.216 1.00 10.00 H new ATOM 0 HG SER A 94 7.453 2.038 -13.394 1.00 10.00 H new ATOM 1158 N ALA A 95 10.020 -2.302 -12.086 1.00 10.00 N ATOM 1159 CA ALA A 95 10.572 -3.593 -12.483 1.00 10.00 C ATOM 1160 C ALA A 95 10.734 -4.511 -11.275 1.00 10.00 C ATOM 1161 O ALA A 95 11.166 -5.656 -11.404 1.00 10.00 O ATOM 1162 CB ALA A 95 11.904 -3.407 -13.192 1.00 10.00 C ATOM 0 H ALA A 95 10.715 -1.626 -11.770 1.00 10.00 H new ATOM 0 HA ALA A 95 9.873 -4.063 -13.175 1.00 10.00 H new ATOM 0 HB1 ALA A 95 12.301 -4.380 -13.481 1.00 10.00 H new ATOM 0 HB2 ALA A 95 11.760 -2.795 -14.082 1.00 10.00 H new ATOM 0 HB3 ALA A 95 12.607 -2.913 -12.522 1.00 10.00 H new ATOM 1168 N ILE A 96 10.386 -4.003 -10.100 1.00 10.00 N ATOM 1169 CA ILE A 96 10.486 -4.772 -8.870 1.00 10.00 C ATOM 1170 C ILE A 96 9.126 -5.354 -8.514 1.00 10.00 C ATOM 1171 O ILE A 96 8.177 -4.622 -8.242 1.00 10.00 O ATOM 1172 CB ILE A 96 11.007 -3.901 -7.704 1.00 10.00 C ATOM 1173 CG1 ILE A 96 12.359 -3.285 -8.072 1.00 10.00 C ATOM 1174 CG2 ILE A 96 11.131 -4.722 -6.424 1.00 10.00 C ATOM 1175 CD1 ILE A 96 12.753 -2.120 -7.195 1.00 10.00 C ATOM 0 H ILE A 96 10.030 -3.055 -9.974 1.00 10.00 H new ATOM 0 HA ILE A 96 11.199 -5.581 -9.032 1.00 10.00 H new ATOM 0 HB ILE A 96 10.289 -3.101 -7.526 1.00 10.00 H new ATOM 0 HG12 ILE A 96 13.129 -4.054 -8.007 1.00 10.00 H new ATOM 0 HG13 ILE A 96 12.327 -2.953 -9.110 1.00 10.00 H new ATOM 0 HG21 ILE A 96 11.499 -4.087 -5.619 1.00 10.00 H new ATOM 0 HG22 ILE A 96 10.154 -5.122 -6.153 1.00 10.00 H new ATOM 0 HG23 ILE A 96 11.828 -5.544 -6.585 1.00 10.00 H new ATOM 0 HD11 ILE A 96 13.721 -1.735 -7.515 1.00 10.00 H new ATOM 0 HD12 ILE A 96 12.004 -1.332 -7.278 1.00 10.00 H new ATOM 0 HD13 ILE A 96 12.818 -2.451 -6.158 1.00 10.00 H new ATOM 1187 N SER A 97 9.022 -6.668 -8.564 1.00 10.00 N ATOM 1188 CA SER A 97 7.773 -7.345 -8.254 1.00 10.00 C ATOM 1189 C SER A 97 8.030 -8.648 -7.496 1.00 10.00 C ATOM 1190 O SER A 97 8.311 -9.683 -8.096 1.00 10.00 O ATOM 1191 CB SER A 97 7.008 -7.628 -9.547 1.00 10.00 C ATOM 1192 OG SER A 97 7.063 -6.514 -10.428 1.00 10.00 O ATOM 0 H SER A 97 9.789 -7.291 -8.817 1.00 10.00 H new ATOM 0 HA SER A 97 7.175 -6.696 -7.614 1.00 10.00 H new ATOM 0 HB2 SER A 97 7.429 -8.505 -10.038 1.00 10.00 H new ATOM 0 HB3 SER A 97 5.969 -7.861 -9.315 1.00 10.00 H new ATOM 0 HG SER A 97 6.568 -6.721 -11.248 1.00 10.00 H new ATOM 1198 N THR A 98 7.957 -8.584 -6.177 1.00 10.00 N ATOM 1199 CA THR A 98 8.179 -9.758 -5.344 1.00 10.00 C ATOM 1200 C THR A 98 7.060 -9.905 -4.316 1.00 10.00 C ATOM 1201 O THR A 98 6.426 -8.924 -3.936 1.00 10.00 O ATOM 1202 CB THR A 98 9.540 -9.683 -4.616 1.00 10.00 C ATOM 1203 OG1 THR A 98 9.753 -10.867 -3.833 1.00 10.00 O ATOM 1204 CG2 THR A 98 9.603 -8.467 -3.711 1.00 10.00 C ATOM 0 H THR A 98 7.746 -7.732 -5.658 1.00 10.00 H new ATOM 0 HA THR A 98 8.184 -10.628 -6.001 1.00 10.00 H new ATOM 0 HB THR A 98 10.320 -9.602 -5.373 1.00 10.00 H new ATOM 0 HG1 THR A 98 10.639 -11.235 -4.031 1.00 10.00 H new ATOM 0 HG21 THR A 98 10.570 -8.436 -3.210 1.00 10.00 H new ATOM 0 HG22 THR A 98 9.474 -7.563 -4.306 1.00 10.00 H new ATOM 0 HG23 THR A 98 8.810 -8.527 -2.966 1.00 10.00 H new ATOM 1212 N THR A 99 6.814 -11.128 -3.877 1.00 10.00 N ATOM 1213 CA THR A 99 5.782 -11.388 -2.892 1.00 10.00 C ATOM 1214 C THR A 99 6.306 -11.186 -1.473 1.00 10.00 C ATOM 1215 O THR A 99 5.540 -11.201 -0.507 1.00 10.00 O ATOM 1216 CB THR A 99 5.257 -12.820 -3.039 1.00 10.00 C ATOM 1217 OG1 THR A 99 6.163 -13.584 -3.853 1.00 10.00 O ATOM 1218 CG2 THR A 99 3.877 -12.823 -3.668 1.00 10.00 C ATOM 0 H THR A 99 7.318 -11.958 -4.190 1.00 10.00 H new ATOM 0 HA THR A 99 4.972 -10.680 -3.068 1.00 10.00 H new ATOM 0 HB THR A 99 5.187 -13.269 -2.048 1.00 10.00 H new ATOM 0 HG1 THR A 99 5.827 -14.500 -3.945 1.00 10.00 H new ATOM 0 HG21 THR A 99 3.523 -13.849 -3.763 1.00 10.00 H new ATOM 0 HG22 THR A 99 3.189 -12.259 -3.038 1.00 10.00 H new ATOM 0 HG23 THR A 99 3.926 -12.363 -4.655 1.00 10.00 H new ATOM 1226 N SER A 100 7.611 -10.995 -1.355 1.00 10.00 N ATOM 1227 CA SER A 100 8.235 -10.795 -0.061 1.00 10.00 C ATOM 1228 C SER A 100 8.495 -9.314 0.185 1.00 10.00 C ATOM 1229 O SER A 100 9.220 -8.667 -0.572 1.00 10.00 O ATOM 1230 CB SER A 100 9.543 -11.592 0.019 1.00 10.00 C ATOM 1231 OG SER A 100 10.395 -11.098 1.041 1.00 10.00 O ATOM 0 H SER A 100 8.258 -10.975 -2.143 1.00 10.00 H new ATOM 0 HA SER A 100 7.558 -11.154 0.714 1.00 10.00 H new ATOM 0 HB2 SER A 100 9.319 -12.642 0.207 1.00 10.00 H new ATOM 0 HB3 SER A 100 10.058 -11.543 -0.940 1.00 10.00 H new ATOM 0 HG SER A 100 11.218 -11.629 1.066 1.00 10.00 H new ATOM 1237 N VAL A 101 7.888 -8.773 1.236 1.00 10.00 N ATOM 1238 CA VAL A 101 8.071 -7.370 1.577 1.00 10.00 C ATOM 1239 C VAL A 101 9.519 -7.111 1.993 1.00 10.00 C ATOM 1240 O VAL A 101 10.065 -6.028 1.758 1.00 10.00 O ATOM 1241 CB VAL A 101 7.091 -6.909 2.687 1.00 10.00 C ATOM 1242 CG1 VAL A 101 7.321 -7.663 3.986 1.00 10.00 C ATOM 1243 CG2 VAL A 101 7.192 -5.407 2.908 1.00 10.00 C ATOM 0 H VAL A 101 7.267 -9.284 1.864 1.00 10.00 H new ATOM 0 HA VAL A 101 7.847 -6.782 0.687 1.00 10.00 H new ATOM 0 HB VAL A 101 6.081 -7.139 2.349 1.00 10.00 H new ATOM 0 HG11 VAL A 101 6.616 -7.313 4.740 1.00 10.00 H new ATOM 0 HG12 VAL A 101 7.173 -8.730 3.819 1.00 10.00 H new ATOM 0 HG13 VAL A 101 8.339 -7.488 4.333 1.00 10.00 H new ATOM 0 HG21 VAL A 101 6.496 -5.107 3.691 1.00 10.00 H new ATOM 0 HG22 VAL A 101 8.208 -5.151 3.208 1.00 10.00 H new ATOM 0 HG23 VAL A 101 6.945 -4.886 1.983 1.00 10.00 H new ATOM 1253 N GLN A 102 10.147 -8.125 2.581 1.00 10.00 N ATOM 1254 CA GLN A 102 11.534 -8.017 3.002 1.00 10.00 C ATOM 1255 C GLN A 102 12.431 -7.946 1.775 1.00 10.00 C ATOM 1256 O GLN A 102 13.376 -7.154 1.724 1.00 10.00 O ATOM 1257 CB GLN A 102 11.923 -9.206 3.881 1.00 10.00 C ATOM 1258 CG GLN A 102 11.211 -9.217 5.226 1.00 10.00 C ATOM 1259 CD GLN A 102 11.721 -10.301 6.150 1.00 10.00 C ATOM 1260 OE1 GLN A 102 12.893 -10.678 6.100 1.00 10.00 O ATOM 1261 NE2 GLN A 102 10.847 -10.811 6.996 1.00 10.00 N ATOM 0 H GLN A 102 9.715 -9.028 2.775 1.00 10.00 H new ATOM 0 HA GLN A 102 11.659 -7.108 3.590 1.00 10.00 H new ATOM 0 HB2 GLN A 102 11.697 -10.131 3.350 1.00 10.00 H new ATOM 0 HB3 GLN A 102 13.000 -9.189 4.048 1.00 10.00 H new ATOM 0 HG2 GLN A 102 11.337 -8.247 5.707 1.00 10.00 H new ATOM 0 HG3 GLN A 102 10.142 -9.356 5.065 1.00 10.00 H new ATOM 0 HE21 GLN A 102 9.886 -10.470 7.004 1.00 10.00 H new ATOM 0 HE22 GLN A 102 11.132 -11.547 7.642 1.00 10.00 H new ATOM 1270 N GLN A 103 12.120 -8.772 0.779 1.00 10.00 N ATOM 1271 CA GLN A 103 12.874 -8.788 -0.464 1.00 10.00 C ATOM 1272 C GLN A 103 12.673 -7.471 -1.200 1.00 10.00 C ATOM 1273 O GLN A 103 13.615 -6.906 -1.758 1.00 10.00 O ATOM 1274 CB GLN A 103 12.429 -9.951 -1.349 1.00 10.00 C ATOM 1275 CG GLN A 103 13.229 -10.075 -2.633 1.00 10.00 C ATOM 1276 CD GLN A 103 14.628 -10.606 -2.397 1.00 10.00 C ATOM 1277 OE1 GLN A 103 14.865 -11.379 -1.467 1.00 10.00 O ATOM 1278 NE2 GLN A 103 15.567 -10.191 -3.233 1.00 10.00 N ATOM 0 H GLN A 103 11.349 -9.439 0.812 1.00 10.00 H new ATOM 0 HA GLN A 103 13.931 -8.917 -0.231 1.00 10.00 H new ATOM 0 HB2 GLN A 103 12.515 -10.880 -0.785 1.00 10.00 H new ATOM 0 HB3 GLN A 103 11.375 -9.826 -1.597 1.00 10.00 H new ATOM 0 HG2 GLN A 103 12.704 -10.737 -3.322 1.00 10.00 H new ATOM 0 HG3 GLN A 103 13.291 -9.099 -3.114 1.00 10.00 H new ATOM 0 HE21 GLN A 103 15.329 -9.551 -3.990 1.00 10.00 H new ATOM 0 HE22 GLN A 103 16.529 -10.512 -3.120 1.00 10.00 H new ATOM 1287 N ALA A 104 11.434 -6.987 -1.184 1.00 10.00 N ATOM 1288 CA ALA A 104 11.083 -5.727 -1.824 1.00 10.00 C ATOM 1289 C ALA A 104 11.906 -4.590 -1.239 1.00 10.00 C ATOM 1290 O ALA A 104 12.511 -3.810 -1.974 1.00 10.00 O ATOM 1291 CB ALA A 104 9.594 -5.446 -1.663 1.00 10.00 C ATOM 0 H ALA A 104 10.650 -7.456 -0.729 1.00 10.00 H new ATOM 0 HA ALA A 104 11.306 -5.803 -2.888 1.00 10.00 H new ATOM 0 HB1 ALA A 104 9.348 -4.501 -2.147 1.00 10.00 H new ATOM 0 HB2 ALA A 104 9.020 -6.250 -2.124 1.00 10.00 H new ATOM 0 HB3 ALA A 104 9.348 -5.386 -0.603 1.00 10.00 H new ATOM 1297 N ALA A 105 11.946 -4.515 0.090 1.00 10.00 N ATOM 1298 CA ALA A 105 12.707 -3.485 0.775 1.00 10.00 C ATOM 1299 C ALA A 105 14.189 -3.614 0.440 1.00 10.00 C ATOM 1300 O ALA A 105 14.898 -2.620 0.298 1.00 10.00 O ATOM 1301 CB ALA A 105 12.484 -3.580 2.274 1.00 10.00 C ATOM 0 H ALA A 105 11.457 -5.160 0.711 1.00 10.00 H new ATOM 0 HA ALA A 105 12.363 -2.507 0.437 1.00 10.00 H new ATOM 0 HB1 ALA A 105 13.059 -2.803 2.777 1.00 10.00 H new ATOM 0 HB2 ALA A 105 11.425 -3.447 2.493 1.00 10.00 H new ATOM 0 HB3 ALA A 105 12.808 -4.559 2.629 1.00 10.00 H new ATOM 1307 N THR A 106 14.640 -4.851 0.298 1.00 10.00 N ATOM 1308 CA THR A 106 16.025 -5.138 -0.035 1.00 10.00 C ATOM 1309 C THR A 106 16.364 -4.642 -1.444 1.00 10.00 C ATOM 1310 O THR A 106 17.362 -3.941 -1.646 1.00 10.00 O ATOM 1311 CB THR A 106 16.295 -6.652 0.073 1.00 10.00 C ATOM 1312 OG1 THR A 106 16.038 -7.092 1.413 1.00 10.00 O ATOM 1313 CG2 THR A 106 17.726 -6.992 -0.309 1.00 10.00 C ATOM 0 H THR A 106 14.058 -5.681 0.410 1.00 10.00 H new ATOM 0 HA THR A 106 16.662 -4.611 0.675 1.00 10.00 H new ATOM 0 HB THR A 106 15.629 -7.164 -0.622 1.00 10.00 H new ATOM 0 HG1 THR A 106 15.071 -7.126 1.566 1.00 10.00 H new ATOM 0 HG21 THR A 106 17.880 -8.067 -0.221 1.00 10.00 H new ATOM 0 HG22 THR A 106 17.912 -6.682 -1.337 1.00 10.00 H new ATOM 0 HG23 THR A 106 18.414 -6.471 0.357 1.00 10.00 H new ATOM 1321 N GLU A 107 15.515 -4.993 -2.407 1.00 10.00 N ATOM 1322 CA GLU A 107 15.716 -4.594 -3.794 1.00 10.00 C ATOM 1323 C GLU A 107 15.593 -3.080 -3.952 1.00 10.00 C ATOM 1324 O GLU A 107 16.412 -2.451 -4.621 1.00 10.00 O ATOM 1325 CB GLU A 107 14.714 -5.302 -4.704 1.00 10.00 C ATOM 1326 CG GLU A 107 14.984 -6.791 -4.866 1.00 10.00 C ATOM 1327 CD GLU A 107 14.521 -7.328 -6.206 1.00 10.00 C ATOM 1328 OE1 GLU A 107 15.034 -6.860 -7.244 1.00 10.00 O ATOM 1329 OE2 GLU A 107 13.658 -8.229 -6.231 1.00 10.00 O ATOM 0 H GLU A 107 14.679 -5.555 -2.249 1.00 10.00 H new ATOM 0 HA GLU A 107 16.725 -4.887 -4.085 1.00 10.00 H new ATOM 0 HB2 GLU A 107 13.710 -5.165 -4.301 1.00 10.00 H new ATOM 0 HB3 GLU A 107 14.731 -4.829 -5.686 1.00 10.00 H new ATOM 0 HG2 GLU A 107 16.052 -6.976 -4.755 1.00 10.00 H new ATOM 0 HG3 GLU A 107 14.481 -7.336 -4.067 1.00 10.00 H new ATOM 1336 N LEU A 108 14.574 -2.501 -3.328 1.00 10.00 N ATOM 1337 CA LEU A 108 14.356 -1.062 -3.396 1.00 10.00 C ATOM 1338 C LEU A 108 15.554 -0.310 -2.835 1.00 10.00 C ATOM 1339 O LEU A 108 16.069 0.599 -3.470 1.00 10.00 O ATOM 1340 CB LEU A 108 13.103 -0.665 -2.618 1.00 10.00 C ATOM 1341 CG LEU A 108 11.771 -1.012 -3.281 1.00 10.00 C ATOM 1342 CD1 LEU A 108 10.628 -0.795 -2.304 1.00 10.00 C ATOM 1343 CD2 LEU A 108 11.560 -0.174 -4.530 1.00 10.00 C ATOM 0 H LEU A 108 13.886 -3.006 -2.769 1.00 10.00 H new ATOM 0 HA LEU A 108 14.224 -0.797 -4.445 1.00 10.00 H new ATOM 0 HB2 LEU A 108 13.137 -1.147 -1.641 1.00 10.00 H new ATOM 0 HB3 LEU A 108 13.132 0.411 -2.444 1.00 10.00 H new ATOM 0 HG LEU A 108 11.793 -2.062 -3.571 1.00 10.00 H new ATOM 0 HD11 LEU A 108 9.684 -1.045 -2.787 1.00 10.00 H new ATOM 0 HD12 LEU A 108 10.769 -1.433 -1.431 1.00 10.00 H new ATOM 0 HD13 LEU A 108 10.610 0.249 -1.991 1.00 10.00 H new ATOM 0 HD21 LEU A 108 10.606 -0.436 -4.987 1.00 10.00 H new ATOM 0 HD22 LEU A 108 11.556 0.883 -4.263 1.00 10.00 H new ATOM 0 HD23 LEU A 108 12.366 -0.366 -5.238 1.00 10.00 H new ATOM 1355 N SER A 109 16.007 -0.704 -1.652 1.00 10.00 N ATOM 1356 CA SER A 109 17.144 -0.050 -1.017 1.00 10.00 C ATOM 1357 C SER A 109 18.413 -0.195 -1.853 1.00 10.00 C ATOM 1358 O SER A 109 19.325 0.614 -1.741 1.00 10.00 O ATOM 1359 CB SER A 109 17.365 -0.615 0.382 1.00 10.00 C ATOM 1360 OG SER A 109 16.211 -0.423 1.182 1.00 10.00 O ATOM 0 H SER A 109 15.606 -1.472 -1.114 1.00 10.00 H new ATOM 0 HA SER A 109 16.916 1.013 -0.940 1.00 10.00 H new ATOM 0 HB2 SER A 109 17.598 -1.678 0.319 1.00 10.00 H new ATOM 0 HB3 SER A 109 18.222 -0.127 0.846 1.00 10.00 H new ATOM 0 HG SER A 109 15.538 -1.097 0.952 1.00 10.00 H new ATOM 1366 N ALA A 110 18.462 -1.216 -2.699 1.00 10.00 N ATOM 1367 CA ALA A 110 19.624 -1.435 -3.550 1.00 10.00 C ATOM 1368 C ALA A 110 19.730 -0.342 -4.607 1.00 10.00 C ATOM 1369 O ALA A 110 20.821 0.145 -4.904 1.00 10.00 O ATOM 1370 CB ALA A 110 19.557 -2.805 -4.208 1.00 10.00 C ATOM 0 H ALA A 110 17.716 -1.902 -2.814 1.00 10.00 H new ATOM 0 HA ALA A 110 20.516 -1.397 -2.924 1.00 10.00 H new ATOM 0 HB1 ALA A 110 20.434 -2.949 -4.839 1.00 10.00 H new ATOM 0 HB2 ALA A 110 19.533 -3.577 -3.439 1.00 10.00 H new ATOM 0 HB3 ALA A 110 18.656 -2.872 -4.818 1.00 10.00 H new ATOM 1376 N VAL A 111 18.595 0.031 -5.179 1.00 10.00 N ATOM 1377 CA VAL A 111 18.557 1.073 -6.199 1.00 10.00 C ATOM 1378 C VAL A 111 18.379 2.463 -5.571 1.00 10.00 C ATOM 1379 O VAL A 111 18.903 3.460 -6.063 1.00 10.00 O ATOM 1380 CB VAL A 111 17.430 0.804 -7.234 1.00 10.00 C ATOM 1381 CG1 VAL A 111 16.089 0.565 -6.556 1.00 10.00 C ATOM 1382 CG2 VAL A 111 17.326 1.937 -8.245 1.00 10.00 C ATOM 0 H VAL A 111 17.685 -0.372 -4.955 1.00 10.00 H new ATOM 0 HA VAL A 111 19.515 1.052 -6.718 1.00 10.00 H new ATOM 0 HB VAL A 111 17.698 -0.106 -7.770 1.00 10.00 H new ATOM 0 HG11 VAL A 111 15.326 0.381 -7.313 1.00 10.00 H new ATOM 0 HG12 VAL A 111 16.163 -0.300 -5.897 1.00 10.00 H new ATOM 0 HG13 VAL A 111 15.815 1.443 -5.971 1.00 10.00 H new ATOM 0 HG21 VAL A 111 16.529 1.719 -8.955 1.00 10.00 H new ATOM 0 HG22 VAL A 111 17.104 2.869 -7.725 1.00 10.00 H new ATOM 0 HG23 VAL A 111 18.271 2.036 -8.779 1.00 10.00 H new ATOM 1392 N TYR A 112 17.658 2.505 -4.465 1.00 10.00 N ATOM 1393 CA TYR A 112 17.368 3.753 -3.771 1.00 10.00 C ATOM 1394 C TYR A 112 18.540 4.268 -2.944 1.00 10.00 C ATOM 1395 O TYR A 112 18.598 5.459 -2.637 1.00 10.00 O ATOM 1396 CB TYR A 112 16.125 3.594 -2.900 1.00 10.00 C ATOM 1397 CG TYR A 112 14.842 3.835 -3.661 1.00 10.00 C ATOM 1398 CD1 TYR A 112 14.744 3.521 -5.012 1.00 10.00 C ATOM 1399 CD2 TYR A 112 13.736 4.384 -3.037 1.00 10.00 C ATOM 1400 CE1 TYR A 112 13.580 3.743 -5.714 1.00 10.00 C ATOM 1401 CE2 TYR A 112 12.567 4.614 -3.732 1.00 10.00 C ATOM 1402 CZ TYR A 112 12.493 4.292 -5.069 1.00 10.00 C ATOM 1403 OH TYR A 112 11.331 4.531 -5.765 1.00 10.00 O ATOM 0 H TYR A 112 17.257 1.679 -4.021 1.00 10.00 H new ATOM 0 HA TYR A 112 17.183 4.504 -4.539 1.00 10.00 H new ATOM 0 HB2 TYR A 112 16.109 2.589 -2.478 1.00 10.00 H new ATOM 0 HB3 TYR A 112 16.182 4.290 -2.063 1.00 10.00 H new ATOM 0 HD1 TYR A 112 15.596 3.095 -5.520 1.00 10.00 H new ATOM 0 HD2 TYR A 112 13.789 4.637 -1.988 1.00 10.00 H new ATOM 0 HE1 TYR A 112 13.520 3.489 -6.762 1.00 10.00 H new ATOM 0 HE2 TYR A 112 11.713 5.045 -3.230 1.00 10.00 H new ATOM 0 HH TYR A 112 10.663 4.919 -5.162 1.00 10.00 H new ATOM 1413 N ALA A 113 19.444 3.378 -2.553 1.00 10.00 N ATOM 1414 CA ALA A 113 20.611 3.759 -1.754 1.00 10.00 C ATOM 1415 C ALA A 113 21.336 4.962 -2.349 1.00 10.00 C ATOM 1416 O ALA A 113 21.603 5.926 -1.644 1.00 10.00 O ATOM 1417 CB ALA A 113 21.577 2.594 -1.621 1.00 10.00 C ATOM 0 H ALA A 113 19.394 2.384 -2.775 1.00 10.00 H new ATOM 0 HA ALA A 113 20.245 4.037 -0.766 1.00 10.00 H new ATOM 0 HB1 ALA A 113 22.436 2.900 -1.024 1.00 10.00 H new ATOM 0 HB2 ALA A 113 21.075 1.759 -1.133 1.00 10.00 H new ATOM 0 HB3 ALA A 113 21.914 2.286 -2.611 1.00 10.00 H new ATOM 1423 N ALA A 114 21.624 4.918 -3.649 1.00 10.00 N ATOM 1424 CA ALA A 114 22.314 6.022 -4.319 1.00 10.00 C ATOM 1425 C ALA A 114 21.463 7.294 -4.322 1.00 10.00 C ATOM 1426 O ALA A 114 21.981 8.406 -4.432 1.00 10.00 O ATOM 1427 CB ALA A 114 22.671 5.628 -5.742 1.00 10.00 C ATOM 0 H ALA A 114 21.392 4.134 -4.258 1.00 10.00 H new ATOM 0 HA ALA A 114 23.228 6.232 -3.764 1.00 10.00 H new ATOM 0 HB1 ALA A 114 23.184 6.456 -6.231 1.00 10.00 H new ATOM 0 HB2 ALA A 114 23.325 4.756 -5.725 1.00 10.00 H new ATOM 0 HB3 ALA A 114 21.761 5.389 -6.292 1.00 10.00 H new ATOM 1433 N GLN A 115 20.156 7.125 -4.188 1.00 10.00 N ATOM 1434 CA GLN A 115 19.236 8.256 -4.178 1.00 10.00 C ATOM 1435 C GLN A 115 19.133 8.841 -2.776 1.00 10.00 C ATOM 1436 O GLN A 115 18.647 9.954 -2.583 1.00 10.00 O ATOM 1437 CB GLN A 115 17.855 7.824 -4.674 1.00 10.00 C ATOM 1438 CG GLN A 115 17.888 7.160 -6.042 1.00 10.00 C ATOM 1439 CD GLN A 115 18.461 8.066 -7.110 1.00 10.00 C ATOM 1440 OE1 GLN A 115 18.262 9.281 -7.086 1.00 10.00 O ATOM 1441 NE2 GLN A 115 19.182 7.483 -8.052 1.00 10.00 N ATOM 0 H GLN A 115 19.707 6.215 -4.084 1.00 10.00 H new ATOM 0 HA GLN A 115 19.622 9.023 -4.849 1.00 10.00 H new ATOM 0 HB2 GLN A 115 17.417 7.134 -3.953 1.00 10.00 H new ATOM 0 HB3 GLN A 115 17.203 8.696 -4.717 1.00 10.00 H new ATOM 0 HG2 GLN A 115 18.482 6.248 -5.986 1.00 10.00 H new ATOM 0 HG3 GLN A 115 16.877 6.865 -6.324 1.00 10.00 H new ATOM 0 HE21 GLN A 115 19.323 6.473 -8.035 1.00 10.00 H new ATOM 0 HE22 GLN A 115 19.598 8.043 -8.796 1.00 10.00 H new ATOM 1450 N GLY A 116 19.605 8.084 -1.797 1.00 10.00 N ATOM 1451 CA GLY A 116 19.557 8.536 -0.424 1.00 10.00 C ATOM 1452 C GLY A 116 18.332 8.029 0.304 1.00 10.00 C ATOM 1453 O GLY A 116 17.869 8.651 1.259 1.00 10.00 O ATOM 0 H GLY A 116 20.021 7.162 -1.930 1.00 10.00 H new ATOM 0 HA2 GLY A 116 20.453 8.200 0.098 1.00 10.00 H new ATOM 0 HA3 GLY A 116 19.565 9.626 -0.402 1.00 10.00 H new ATOM 1457 N VAL A 117 17.799 6.901 -0.145 1.00 10.00 N ATOM 1458 CA VAL A 117 16.618 6.313 0.475 1.00 10.00 C ATOM 1459 C VAL A 117 16.846 4.837 0.788 1.00 10.00 C ATOM 1460 O VAL A 117 17.442 4.107 -0.004 1.00 10.00 O ATOM 1461 CB VAL A 117 15.374 6.449 -0.435 1.00 10.00 C ATOM 1462 CG1 VAL A 117 14.165 5.763 0.185 1.00 10.00 C ATOM 1463 CG2 VAL A 117 15.060 7.910 -0.711 1.00 10.00 C ATOM 0 H VAL A 117 18.166 6.374 -0.937 1.00 10.00 H new ATOM 0 HA VAL A 117 16.440 6.859 1.402 1.00 10.00 H new ATOM 0 HB VAL A 117 15.603 5.958 -1.381 1.00 10.00 H new ATOM 0 HG11 VAL A 117 13.305 5.874 -0.476 1.00 10.00 H new ATOM 0 HG12 VAL A 117 14.380 4.704 0.326 1.00 10.00 H new ATOM 0 HG13 VAL A 117 13.943 6.219 1.150 1.00 10.00 H new ATOM 0 HG21 VAL A 117 14.182 7.978 -1.353 1.00 10.00 H new ATOM 0 HG22 VAL A 117 14.863 8.424 0.230 1.00 10.00 H new ATOM 0 HG23 VAL A 117 15.910 8.377 -1.208 1.00 10.00 H new ATOM 1473 N SER A 118 16.391 4.410 1.953 1.00 10.00 N ATOM 1474 CA SER A 118 16.518 3.027 2.364 1.00 10.00 C ATOM 1475 C SER A 118 15.233 2.554 3.035 1.00 10.00 C ATOM 1476 O SER A 118 14.786 3.129 4.029 1.00 10.00 O ATOM 1477 CB SER A 118 17.718 2.863 3.298 1.00 10.00 C ATOM 1478 OG SER A 118 18.916 2.749 2.552 1.00 10.00 O ATOM 0 H SER A 118 15.926 5.009 2.635 1.00 10.00 H new ATOM 0 HA SER A 118 16.686 2.409 1.482 1.00 10.00 H new ATOM 0 HB2 SER A 118 17.782 3.718 3.971 1.00 10.00 H new ATOM 0 HB3 SER A 118 17.584 1.978 3.919 1.00 10.00 H new ATOM 0 HG SER A 118 18.767 3.078 1.641 1.00 10.00 H new ATOM 1484 N VAL A 119 14.637 1.519 2.466 1.00 10.00 N ATOM 1485 CA VAL A 119 13.404 0.957 2.988 1.00 10.00 C ATOM 1486 C VAL A 119 13.688 -0.353 3.708 1.00 10.00 C ATOM 1487 O VAL A 119 14.474 -1.175 3.239 1.00 10.00 O ATOM 1488 CB VAL A 119 12.363 0.706 1.873 1.00 10.00 C ATOM 1489 CG1 VAL A 119 11.710 2.004 1.435 1.00 10.00 C ATOM 1490 CG2 VAL A 119 12.996 0.018 0.678 1.00 10.00 C ATOM 0 H VAL A 119 14.992 1.048 1.634 1.00 10.00 H new ATOM 0 HA VAL A 119 12.989 1.686 3.684 1.00 10.00 H new ATOM 0 HB VAL A 119 11.596 0.051 2.285 1.00 10.00 H new ATOM 0 HG11 VAL A 119 10.982 1.798 0.650 1.00 10.00 H new ATOM 0 HG12 VAL A 119 11.206 2.463 2.286 1.00 10.00 H new ATOM 0 HG13 VAL A 119 12.472 2.684 1.054 1.00 10.00 H new ATOM 0 HG21 VAL A 119 12.240 -0.146 -0.090 1.00 10.00 H new ATOM 0 HG22 VAL A 119 13.792 0.645 0.276 1.00 10.00 H new ATOM 0 HG23 VAL A 119 13.412 -0.941 0.988 1.00 10.00 H new ATOM 1500 N SER A 120 13.059 -0.542 4.849 1.00 10.00 N ATOM 1501 CA SER A 120 13.250 -1.755 5.622 1.00 10.00 C ATOM 1502 C SER A 120 11.980 -2.096 6.386 1.00 10.00 C ATOM 1503 O SER A 120 11.299 -1.209 6.891 1.00 10.00 O ATOM 1504 CB SER A 120 14.428 -1.575 6.585 1.00 10.00 C ATOM 1505 OG SER A 120 14.643 -0.199 6.866 1.00 10.00 O ATOM 0 H SER A 120 12.411 0.128 5.263 1.00 10.00 H new ATOM 0 HA SER A 120 13.474 -2.580 4.945 1.00 10.00 H new ATOM 0 HB2 SER A 120 14.232 -2.114 7.512 1.00 10.00 H new ATOM 0 HB3 SER A 120 15.329 -2.007 6.150 1.00 10.00 H new ATOM 0 HG SER A 120 15.398 -0.105 7.484 1.00 10.00 H new ATOM 1511 N VAL A 121 11.655 -3.373 6.448 1.00 10.00 N ATOM 1512 CA VAL A 121 10.471 -3.820 7.152 1.00 10.00 C ATOM 1513 C VAL A 121 10.875 -4.526 8.437 1.00 10.00 C ATOM 1514 O VAL A 121 11.664 -5.474 8.424 1.00 10.00 O ATOM 1515 CB VAL A 121 9.608 -4.743 6.266 1.00 10.00 C ATOM 1516 CG1 VAL A 121 10.471 -5.757 5.541 1.00 10.00 C ATOM 1517 CG2 VAL A 121 8.528 -5.437 7.082 1.00 10.00 C ATOM 0 H VAL A 121 12.198 -4.121 6.017 1.00 10.00 H new ATOM 0 HA VAL A 121 9.865 -2.949 7.401 1.00 10.00 H new ATOM 0 HB VAL A 121 9.114 -4.121 5.520 1.00 10.00 H new ATOM 0 HG11 VAL A 121 9.840 -6.396 4.923 1.00 10.00 H new ATOM 0 HG12 VAL A 121 11.190 -5.237 4.909 1.00 10.00 H new ATOM 0 HG13 VAL A 121 11.004 -6.368 6.269 1.00 10.00 H new ATOM 0 HG21 VAL A 121 7.937 -6.080 6.430 1.00 10.00 H new ATOM 0 HG22 VAL A 121 8.993 -6.040 7.862 1.00 10.00 H new ATOM 0 HG23 VAL A 121 7.880 -4.689 7.539 1.00 10.00 H new ATOM 1527 N SER A 122 10.365 -4.034 9.550 1.00 10.00 N ATOM 1528 CA SER A 122 10.676 -4.599 10.847 1.00 10.00 C ATOM 1529 C SER A 122 9.457 -4.549 11.759 1.00 10.00 C ATOM 1530 O SER A 122 8.775 -3.527 11.831 1.00 10.00 O ATOM 1531 CB SER A 122 11.846 -3.837 11.467 1.00 10.00 C ATOM 1532 OG SER A 122 13.000 -3.933 10.646 1.00 10.00 O ATOM 0 H SER A 122 9.728 -3.238 9.580 1.00 10.00 H new ATOM 0 HA SER A 122 10.959 -5.644 10.723 1.00 10.00 H new ATOM 0 HB2 SER A 122 11.575 -2.790 11.600 1.00 10.00 H new ATOM 0 HB3 SER A 122 12.064 -4.238 12.457 1.00 10.00 H new ATOM 0 HG SER A 122 13.738 -3.437 11.059 1.00 10.00 H new ATOM 1538 N ALA A 123 9.174 -5.670 12.422 1.00 10.00 N ATOM 1539 CA ALA A 123 8.038 -5.778 13.341 1.00 10.00 C ATOM 1540 C ALA A 123 6.719 -5.490 12.629 1.00 10.00 C ATOM 1541 O ALA A 123 5.834 -4.824 13.177 1.00 10.00 O ATOM 1542 CB ALA A 123 8.217 -4.846 14.532 1.00 10.00 C ATOM 0 H ALA A 123 9.722 -6.526 12.339 1.00 10.00 H new ATOM 0 HA ALA A 123 8.004 -6.804 13.707 1.00 10.00 H new ATOM 0 HB1 ALA A 123 7.362 -4.943 15.201 1.00 10.00 H new ATOM 0 HB2 ALA A 123 9.129 -5.111 15.067 1.00 10.00 H new ATOM 0 HB3 ALA A 123 8.288 -3.817 14.181 1.00 10.00 H new ATOM 1548 N ASN A 124 6.611 -5.989 11.397 1.00 10.00 N ATOM 1549 CA ASN A 124 5.412 -5.816 10.570 1.00 10.00 C ATOM 1550 C ASN A 124 5.179 -4.342 10.243 1.00 10.00 C ATOM 1551 O ASN A 124 4.057 -3.917 9.949 1.00 10.00 O ATOM 1552 CB ASN A 124 4.186 -6.412 11.274 1.00 10.00 C ATOM 1553 CG ASN A 124 3.185 -7.005 10.302 1.00 10.00 C ATOM 1554 OD1 ASN A 124 3.543 -7.432 9.205 1.00 10.00 O ATOM 1555 ND2 ASN A 124 1.925 -7.045 10.702 1.00 10.00 N ATOM 0 H ASN A 124 7.351 -6.525 10.943 1.00 10.00 H new ATOM 0 HA ASN A 124 5.568 -6.348 9.632 1.00 10.00 H new ATOM 0 HB2 ASN A 124 4.512 -7.185 11.970 1.00 10.00 H new ATOM 0 HB3 ASN A 124 3.698 -5.636 11.864 1.00 10.00 H new ATOM 0 HD21 ASN A 124 1.209 -7.441 10.093 1.00 10.00 H new ATOM 0 HD22 ASN A 124 1.669 -6.680 11.620 1.00 10.00 H new ATOM 1562 N LYS A 125 6.253 -3.571 10.285 1.00 10.00 N ATOM 1563 CA LYS A 125 6.194 -2.150 10.008 1.00 10.00 C ATOM 1564 C LYS A 125 7.228 -1.775 8.957 1.00 10.00 C ATOM 1565 O LYS A 125 8.383 -2.194 9.037 1.00 10.00 O ATOM 1566 CB LYS A 125 6.463 -1.360 11.290 1.00 10.00 C ATOM 1567 CG LYS A 125 6.225 0.134 11.160 1.00 10.00 C ATOM 1568 CD LYS A 125 6.580 0.855 12.451 1.00 10.00 C ATOM 1569 CE LYS A 125 5.692 2.065 12.679 1.00 10.00 C ATOM 1570 NZ LYS A 125 6.058 2.806 13.918 1.00 10.00 N ATOM 0 H LYS A 125 7.187 -3.914 10.512 1.00 10.00 H new ATOM 0 HA LYS A 125 5.200 -1.908 9.633 1.00 10.00 H new ATOM 0 HB2 LYS A 125 5.827 -1.750 12.085 1.00 10.00 H new ATOM 0 HB3 LYS A 125 7.495 -1.527 11.597 1.00 10.00 H new ATOM 0 HG2 LYS A 125 6.824 0.532 10.340 1.00 10.00 H new ATOM 0 HG3 LYS A 125 5.180 0.319 10.911 1.00 10.00 H new ATOM 0 HD2 LYS A 125 6.481 0.167 13.291 1.00 10.00 H new ATOM 0 HD3 LYS A 125 7.623 1.170 12.417 1.00 10.00 H new ATOM 0 HE2 LYS A 125 5.766 2.735 11.822 1.00 10.00 H new ATOM 0 HE3 LYS A 125 4.652 1.744 12.744 1.00 10.00 H new ATOM 0 HZ1 LYS A 125 5.426 3.624 14.033 1.00 10.00 H new ATOM 0 HZ2 LYS A 125 5.963 2.176 14.740 1.00 10.00 H new ATOM 0 HZ3 LYS A 125 7.042 3.136 13.847 1.00 10.00 H new ATOM 1584 N LEU A 126 6.809 -1.005 7.972 1.00 10.00 N ATOM 1585 CA LEU A 126 7.703 -0.548 6.924 1.00 10.00 C ATOM 1586 C LEU A 126 8.336 0.762 7.364 1.00 10.00 C ATOM 1587 O LEU A 126 7.636 1.732 7.640 1.00 10.00 O ATOM 1588 CB LEU A 126 6.941 -0.348 5.608 1.00 10.00 C ATOM 1589 CG LEU A 126 6.752 -1.607 4.758 1.00 10.00 C ATOM 1590 CD1 LEU A 126 5.693 -1.377 3.691 1.00 10.00 C ATOM 1591 CD2 LEU A 126 8.067 -2.016 4.111 1.00 10.00 C ATOM 0 H LEU A 126 5.847 -0.680 7.875 1.00 10.00 H new ATOM 0 HA LEU A 126 8.475 -1.299 6.754 1.00 10.00 H new ATOM 0 HB2 LEU A 126 5.959 0.066 5.836 1.00 10.00 H new ATOM 0 HB3 LEU A 126 7.470 0.396 5.012 1.00 10.00 H new ATOM 0 HG LEU A 126 6.419 -2.413 5.412 1.00 10.00 H new ATOM 0 HD11 LEU A 126 5.573 -2.283 3.097 1.00 10.00 H new ATOM 0 HD12 LEU A 126 4.745 -1.127 4.167 1.00 10.00 H new ATOM 0 HD13 LEU A 126 6.001 -0.556 3.043 1.00 10.00 H new ATOM 0 HD21 LEU A 126 7.914 -2.913 3.511 1.00 10.00 H new ATOM 0 HD22 LEU A 126 8.425 -1.208 3.472 1.00 10.00 H new ATOM 0 HD23 LEU A 126 8.806 -2.220 4.886 1.00 10.00 H new ATOM 1603 N LEU A 127 9.647 0.793 7.432 1.00 10.00 N ATOM 1604 CA LEU A 127 10.353 1.986 7.853 1.00 10.00 C ATOM 1605 C LEU A 127 11.234 2.511 6.742 1.00 10.00 C ATOM 1606 O LEU A 127 12.093 1.797 6.216 1.00 10.00 O ATOM 1607 CB LEU A 127 11.188 1.708 9.102 1.00 10.00 C ATOM 1608 CG LEU A 127 10.527 2.127 10.412 1.00 10.00 C ATOM 1609 CD1 LEU A 127 10.685 1.047 11.462 1.00 10.00 C ATOM 1610 CD2 LEU A 127 11.113 3.440 10.908 1.00 10.00 C ATOM 0 H LEU A 127 10.250 0.004 7.201 1.00 10.00 H new ATOM 0 HA LEU A 127 9.611 2.747 8.093 1.00 10.00 H new ATOM 0 HB2 LEU A 127 11.409 0.641 9.146 1.00 10.00 H new ATOM 0 HB3 LEU A 127 12.142 2.227 9.009 1.00 10.00 H new ATOM 0 HG LEU A 127 9.463 2.271 10.226 1.00 10.00 H new ATOM 0 HD11 LEU A 127 10.206 1.367 12.388 1.00 10.00 H new ATOM 0 HD12 LEU A 127 10.218 0.127 11.111 1.00 10.00 H new ATOM 0 HD13 LEU A 127 11.745 0.869 11.644 1.00 10.00 H new ATOM 0 HD21 LEU A 127 10.630 3.724 11.843 1.00 10.00 H new ATOM 0 HD22 LEU A 127 12.184 3.321 11.074 1.00 10.00 H new ATOM 0 HD23 LEU A 127 10.946 4.218 10.163 1.00 10.00 H new ATOM 1622 N VAL A 128 11.005 3.756 6.375 1.00 10.00 N ATOM 1623 CA VAL A 128 11.776 4.392 5.330 1.00 10.00 C ATOM 1624 C VAL A 128 12.647 5.478 5.929 1.00 10.00 C ATOM 1625 O VAL A 128 12.141 6.414 6.551 1.00 10.00 O ATOM 1626 CB VAL A 128 10.872 5.019 4.257 1.00 10.00 C ATOM 1627 CG1 VAL A 128 11.609 5.106 2.931 1.00 10.00 C ATOM 1628 CG2 VAL A 128 9.579 4.235 4.112 1.00 10.00 C ATOM 0 H VAL A 128 10.286 4.349 6.789 1.00 10.00 H new ATOM 0 HA VAL A 128 12.389 3.624 4.859 1.00 10.00 H new ATOM 0 HB VAL A 128 10.613 6.030 4.572 1.00 10.00 H new ATOM 0 HG11 VAL A 128 10.956 5.552 2.181 1.00 10.00 H new ATOM 0 HG12 VAL A 128 12.500 5.723 3.050 1.00 10.00 H new ATOM 0 HG13 VAL A 128 11.900 4.106 2.610 1.00 10.00 H new ATOM 0 HG21 VAL A 128 8.956 4.699 3.347 1.00 10.00 H new ATOM 0 HG22 VAL A 128 9.806 3.209 3.823 1.00 10.00 H new ATOM 0 HG23 VAL A 128 9.045 4.234 5.062 1.00 10.00 H new ATOM 1638 N GLN A 129 13.945 5.351 5.745 1.00 10.00 N ATOM 1639 CA GLN A 129 14.886 6.322 6.272 1.00 10.00 C ATOM 1640 C GLN A 129 15.922 6.675 5.212 1.00 10.00 C ATOM 1641 O GLN A 129 16.283 5.832 4.389 1.00 10.00 O ATOM 1642 CB GLN A 129 15.572 5.780 7.533 1.00 10.00 C ATOM 1643 CG GLN A 129 16.059 4.348 7.401 1.00 10.00 C ATOM 1644 CD GLN A 129 17.058 3.978 8.476 1.00 10.00 C ATOM 1645 OE1 GLN A 129 18.260 4.202 8.325 1.00 10.00 O ATOM 1646 NE2 GLN A 129 16.575 3.404 9.565 1.00 10.00 N ATOM 0 H GLN A 129 14.375 4.582 5.232 1.00 10.00 H new ATOM 0 HA GLN A 129 14.339 7.225 6.543 1.00 10.00 H new ATOM 0 HB2 GLN A 129 16.419 6.421 7.778 1.00 10.00 H new ATOM 0 HB3 GLN A 129 14.875 5.841 8.369 1.00 10.00 H new ATOM 0 HG2 GLN A 129 15.206 3.671 7.452 1.00 10.00 H new ATOM 0 HG3 GLN A 129 16.516 4.211 6.421 1.00 10.00 H new ATOM 0 HE21 GLN A 129 15.573 3.236 9.651 1.00 10.00 H new ATOM 0 HE22 GLN A 129 17.205 3.129 10.319 1.00 10.00 H new ATOM 1655 N PRO A 130 16.390 7.928 5.197 1.00 10.00 N ATOM 1656 CA PRO A 130 17.392 8.375 4.235 1.00 10.00 C ATOM 1657 C PRO A 130 18.788 7.882 4.605 1.00 10.00 C ATOM 1658 O PRO A 130 19.093 7.673 5.781 1.00 10.00 O ATOM 1659 CB PRO A 130 17.317 9.899 4.324 1.00 10.00 C ATOM 1660 CG PRO A 130 16.834 10.180 5.705 1.00 10.00 C ATOM 1661 CD PRO A 130 15.981 9.008 6.116 1.00 10.00 C ATOM 0 HA PRO A 130 17.205 7.991 3.232 1.00 10.00 H new ATOM 0 HB2 PRO A 130 18.292 10.353 4.146 1.00 10.00 H new ATOM 0 HB3 PRO A 130 16.635 10.305 3.577 1.00 10.00 H new ATOM 0 HG2 PRO A 130 17.673 10.306 6.389 1.00 10.00 H new ATOM 0 HG3 PRO A 130 16.258 11.105 5.732 1.00 10.00 H new ATOM 0 HD2 PRO A 130 16.155 8.734 7.157 1.00 10.00 H new ATOM 0 HD3 PRO A 130 14.919 9.234 6.019 1.00 10.00 H new ATOM 1669 N VAL A 131 19.629 7.686 3.603 1.00 10.00 N ATOM 1670 CA VAL A 131 20.989 7.224 3.834 1.00 10.00 C ATOM 1671 C VAL A 131 21.998 8.239 3.310 1.00 10.00 C ATOM 1672 O VAL A 131 21.742 8.923 2.318 1.00 10.00 O ATOM 1673 CB VAL A 131 21.267 5.849 3.192 1.00 10.00 C ATOM 1674 CG1 VAL A 131 20.792 4.735 4.112 1.00 10.00 C ATOM 1675 CG2 VAL A 131 20.616 5.734 1.821 1.00 10.00 C ATOM 0 H VAL A 131 19.395 7.839 2.622 1.00 10.00 H new ATOM 0 HA VAL A 131 21.098 7.116 4.913 1.00 10.00 H new ATOM 0 HB VAL A 131 22.343 5.752 3.051 1.00 10.00 H new ATOM 0 HG11 VAL A 131 20.993 3.769 3.648 1.00 10.00 H new ATOM 0 HG12 VAL A 131 21.321 4.798 5.063 1.00 10.00 H new ATOM 0 HG13 VAL A 131 19.721 4.838 4.285 1.00 10.00 H new ATOM 0 HG21 VAL A 131 20.832 4.753 1.397 1.00 10.00 H new ATOM 0 HG22 VAL A 131 19.537 5.858 1.919 1.00 10.00 H new ATOM 0 HG23 VAL A 131 21.012 6.508 1.164 1.00 10.00 H new