USER MOD reduce.3.24.130724 H: found=0, std=0, add=585, rem=0, adj=27 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 109 SER OG : rot 84:sc= 1.26 USER MOD Set 1.2: A 118 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 98 THR OG1 : rot -140:sc= 0.0291 USER MOD Set 2.2: A 103 GLN : amide:sc= 1.18 K(o=1.2,f=-0.54) USER MOD Set 3.1: A 67 MET CE :methyl 157:sc= -0.0939 (180deg=-0.569) USER MOD Set 3.2: A 112 TYR OH : rot -60:sc= -0.177 USER MOD Set 4.1: A 63 THR OG1 : rot 180:sc= 0.685 USER MOD Set 4.2: A 66 THR OG1 : rot 88:sc= 0.758 USER MOD Set 5.1: A 56 GLN : amide:sc= 0.956 X(o=1.9,f=2.2) USER MOD Set 5.2: A 97 SER OG : rot 148:sc= 0.977 USER MOD Set 6.1: A 55 TYR OH : rot 180:sc= 1.07 USER MOD Set 6.2: A 75 SER OG : rot 163:sc= 1.23 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 58 THR OG1 : rot -64:sc= 0.578 USER MOD Single : A 60 MET CE :methyl 170:sc= -0.012 (180deg=-0.211) USER MOD Single : A 65 LYS NZ :NH3+ -107:sc= 0.244 (180deg=0.0436) USER MOD Single : A 76 ASN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 77 MET CE :methyl -131:sc= -4.41! (180deg=-7.62!) USER MOD Single : A 78 GLN : amide:sc= -0.17 X(o=-0.17,f=-0.18) USER MOD Single : A 80 SER OG : rot 78:sc= -0.42 USER MOD Single : A 81 TYR OH : rot 72:sc= -1.09 USER MOD Single : A 82 ASN : amide:sc= -0.0452 K(o=-0.045,f=-2.3) USER MOD Single : A 85 SER OG : rot 180:sc= -0.0159 USER MOD Single : A 87 TYR OH : rot 30:sc= -0.611 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0.134 USER MOD Single : A 94 SER OG : rot 180:sc= 0.0439 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.0351 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 106 THR OG1 : rot 79:sc= 1.25 USER MOD Single : A 115 GLN : amide:sc= -0.184 K(o=-0.18,f=-0.76) USER MOD Single : A 120 SER OG : rot 180:sc= -0.12 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -1.5 K(o=-1.5,f=-3.5!) 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 0.637 -11.460 -1.757 1.00 10.00 N ATOM 511 CA TYR A 53 0.458 -10.211 -2.470 1.00 10.00 C ATOM 512 C TYR A 53 1.763 -9.783 -3.130 1.00 10.00 C ATOM 513 O TYR A 53 2.784 -9.627 -2.462 1.00 10.00 O ATOM 514 CB TYR A 53 -0.030 -9.130 -1.505 1.00 10.00 C ATOM 515 CG TYR A 53 -0.181 -7.759 -2.128 1.00 10.00 C ATOM 516 CD1 TYR A 53 -0.850 -7.588 -3.335 1.00 10.00 C ATOM 517 CD2 TYR A 53 0.340 -6.634 -1.503 1.00 10.00 C ATOM 518 CE1 TYR A 53 -0.992 -6.335 -3.900 1.00 10.00 C ATOM 519 CE2 TYR A 53 0.197 -5.380 -2.061 1.00 10.00 C ATOM 520 CZ TYR A 53 -0.469 -5.235 -3.257 1.00 10.00 C ATOM 521 OH TYR A 53 -0.618 -3.981 -3.808 1.00 10.00 O ATOM 0 HA TYR A 53 -0.289 -10.354 -3.250 1.00 10.00 H new ATOM 0 HB2 TYR A 53 -0.991 -9.436 -1.092 1.00 10.00 H new ATOM 0 HB3 TYR A 53 0.669 -9.062 -0.671 1.00 10.00 H new ATOM 0 HD1 TYR A 53 -1.265 -8.448 -3.839 1.00 10.00 H new ATOM 0 HD2 TYR A 53 0.865 -6.742 -0.566 1.00 10.00 H new ATOM 0 HE1 TYR A 53 -1.510 -6.219 -4.840 1.00 10.00 H new ATOM 0 HE2 TYR A 53 0.606 -4.515 -1.561 1.00 10.00 H new ATOM 0 HH TYR A 53 -0.192 -3.316 -3.228 1.00 10.00 H new ATOM 531 N THR A 54 1.734 -9.626 -4.445 1.00 10.00 N ATOM 532 CA THR A 54 2.912 -9.204 -5.178 1.00 10.00 C ATOM 533 C THR A 54 3.179 -7.728 -4.944 1.00 10.00 C ATOM 534 O THR A 54 2.373 -6.870 -5.309 1.00 10.00 O ATOM 535 CB THR A 54 2.757 -9.448 -6.688 1.00 10.00 C ATOM 536 OG1 THR A 54 2.336 -10.800 -6.925 1.00 10.00 O ATOM 537 CG2 THR A 54 4.064 -9.171 -7.426 1.00 10.00 C ATOM 0 H THR A 54 0.908 -9.785 -5.023 1.00 10.00 H new ATOM 0 HA THR A 54 3.750 -9.798 -4.812 1.00 10.00 H new ATOM 0 HB THR A 54 2.000 -8.762 -7.068 1.00 10.00 H new ATOM 0 HG1 THR A 54 2.238 -10.948 -7.889 1.00 10.00 H new ATOM 0 HG21 THR A 54 3.925 -9.352 -8.492 1.00 10.00 H new ATOM 0 HG22 THR A 54 4.358 -8.133 -7.269 1.00 10.00 H new ATOM 0 HG23 THR A 54 4.844 -9.830 -7.045 1.00 10.00 H new ATOM 545 N TYR A 55 4.298 -7.441 -4.321 1.00 10.00 N ATOM 546 CA TYR A 55 4.685 -6.076 -4.046 1.00 10.00 C ATOM 547 C TYR A 55 5.379 -5.499 -5.267 1.00 10.00 C ATOM 548 O TYR A 55 6.519 -5.856 -5.565 1.00 10.00 O ATOM 549 CB TYR A 55 5.613 -6.010 -2.833 1.00 10.00 C ATOM 550 CG TYR A 55 4.951 -6.425 -1.539 1.00 10.00 C ATOM 551 CD1 TYR A 55 4.095 -5.562 -0.869 1.00 10.00 C ATOM 552 CD2 TYR A 55 5.184 -7.678 -0.988 1.00 10.00 C ATOM 553 CE1 TYR A 55 3.488 -5.933 0.314 1.00 10.00 C ATOM 554 CE2 TYR A 55 4.581 -8.058 0.196 1.00 10.00 C ATOM 555 CZ TYR A 55 3.734 -7.181 0.843 1.00 10.00 C ATOM 556 OH TYR A 55 3.132 -7.553 2.024 1.00 10.00 O ATOM 0 H TYR A 55 4.962 -8.142 -3.992 1.00 10.00 H new ATOM 0 HA TYR A 55 3.793 -5.492 -3.821 1.00 10.00 H new ATOM 0 HB2 TYR A 55 6.476 -6.651 -3.011 1.00 10.00 H new ATOM 0 HB3 TYR A 55 5.989 -4.992 -2.729 1.00 10.00 H new ATOM 0 HD1 TYR A 55 3.900 -4.583 -1.281 1.00 10.00 H new ATOM 0 HD2 TYR A 55 5.846 -8.366 -1.492 1.00 10.00 H new ATOM 0 HE1 TYR A 55 2.824 -5.249 0.822 1.00 10.00 H new ATOM 0 HE2 TYR A 55 4.771 -9.036 0.613 1.00 10.00 H new ATOM 0 HH TYR A 55 3.409 -8.463 2.260 1.00 10.00 H new ATOM 566 N GLN A 56 4.677 -4.639 -5.987 1.00 10.00 N ATOM 567 CA GLN A 56 5.224 -4.023 -7.183 1.00 10.00 C ATOM 568 C GLN A 56 4.795 -2.565 -7.270 1.00 10.00 C ATOM 569 O GLN A 56 3.709 -2.203 -6.813 1.00 10.00 O ATOM 570 CB GLN A 56 4.747 -4.777 -8.427 1.00 10.00 C ATOM 571 CG GLN A 56 5.462 -4.363 -9.702 1.00 10.00 C ATOM 572 CD GLN A 56 4.735 -4.806 -10.956 1.00 10.00 C ATOM 573 OE1 GLN A 56 3.839 -4.120 -11.448 1.00 10.00 O ATOM 574 NE2 GLN A 56 5.127 -5.947 -11.496 1.00 10.00 N ATOM 0 H GLN A 56 3.724 -4.352 -5.762 1.00 10.00 H new ATOM 0 HA GLN A 56 6.312 -4.069 -7.131 1.00 10.00 H new ATOM 0 HB2 GLN A 56 4.891 -5.846 -8.271 1.00 10.00 H new ATOM 0 HB3 GLN A 56 3.676 -4.614 -8.552 1.00 10.00 H new ATOM 0 HG2 GLN A 56 5.572 -3.279 -9.715 1.00 10.00 H new ATOM 0 HG3 GLN A 56 6.467 -4.785 -9.702 1.00 10.00 H new ATOM 0 HE21 GLN A 56 5.873 -6.488 -11.059 1.00 10.00 H new ATOM 0 HE22 GLN A 56 4.683 -6.286 -12.349 1.00 10.00 H new ATOM 583 N ALA A 57 5.659 -1.732 -7.831 1.00 10.00 N ATOM 584 CA ALA A 57 5.354 -0.322 -7.998 1.00 10.00 C ATOM 585 C ALA A 57 4.377 -0.150 -9.148 1.00 10.00 C ATOM 586 O ALA A 57 4.686 -0.485 -10.292 1.00 10.00 O ATOM 587 CB ALA A 57 6.621 0.474 -8.257 1.00 10.00 C ATOM 0 H ALA A 57 6.577 -2.010 -8.178 1.00 10.00 H new ATOM 0 HA ALA A 57 4.901 0.054 -7.081 1.00 10.00 H new ATOM 0 HB1 ALA A 57 6.370 1.528 -8.379 1.00 10.00 H new ATOM 0 HB2 ALA A 57 7.302 0.359 -7.414 1.00 10.00 H new ATOM 0 HB3 ALA A 57 7.102 0.108 -9.164 1.00 10.00 H new ATOM 593 N THR A 58 3.199 0.358 -8.843 1.00 10.00 N ATOM 594 CA THR A 58 2.181 0.545 -9.858 1.00 10.00 C ATOM 595 C THR A 58 2.104 2.004 -10.296 1.00 10.00 C ATOM 596 O THR A 58 2.422 2.911 -9.522 1.00 10.00 O ATOM 597 CB THR A 58 0.798 0.080 -9.355 1.00 10.00 C ATOM 598 OG1 THR A 58 0.362 0.901 -8.267 1.00 10.00 O ATOM 599 CG2 THR A 58 0.841 -1.372 -8.905 1.00 10.00 C ATOM 0 H THR A 58 2.924 0.648 -7.904 1.00 10.00 H new ATOM 0 HA THR A 58 2.464 -0.066 -10.715 1.00 10.00 H new ATOM 0 HB THR A 58 0.095 0.170 -10.183 1.00 10.00 H new ATOM 0 HG1 THR A 58 0.968 0.785 -7.506 1.00 10.00 H new ATOM 0 HG21 THR A 58 -0.146 -1.674 -8.555 1.00 10.00 H new ATOM 0 HG22 THR A 58 1.138 -2.004 -9.742 1.00 10.00 H new ATOM 0 HG23 THR A 58 1.562 -1.481 -8.095 1.00 10.00 H new ATOM 607 N PRO A 59 1.671 2.252 -11.542 1.00 10.00 N ATOM 608 CA PRO A 59 1.550 3.610 -12.082 1.00 10.00 C ATOM 609 C PRO A 59 0.496 4.437 -11.348 1.00 10.00 C ATOM 610 O PRO A 59 0.444 5.659 -11.488 1.00 10.00 O ATOM 611 CB PRO A 59 1.144 3.383 -13.543 1.00 10.00 C ATOM 612 CG PRO A 59 0.540 2.023 -13.570 1.00 10.00 C ATOM 613 CD PRO A 59 1.279 1.230 -12.532 1.00 10.00 C ATOM 0 HA PRO A 59 2.475 4.175 -11.972 1.00 10.00 H new ATOM 0 HB2 PRO A 59 0.431 4.138 -13.876 1.00 10.00 H new ATOM 0 HB3 PRO A 59 2.007 3.445 -14.206 1.00 10.00 H new ATOM 0 HG2 PRO A 59 -0.526 2.063 -13.346 1.00 10.00 H new ATOM 0 HG3 PRO A 59 0.642 1.569 -14.556 1.00 10.00 H new ATOM 0 HD2 PRO A 59 0.647 0.461 -12.088 1.00 10.00 H new ATOM 0 HD3 PRO A 59 2.148 0.725 -12.954 1.00 10.00 H new ATOM 621 N MET A 60 -0.340 3.768 -10.555 1.00 10.00 N ATOM 622 CA MET A 60 -1.382 4.455 -9.800 1.00 10.00 C ATOM 623 C MET A 60 -0.835 4.945 -8.459 1.00 10.00 C ATOM 624 O MET A 60 -1.522 5.643 -7.712 1.00 10.00 O ATOM 625 CB MET A 60 -2.602 3.547 -9.584 1.00 10.00 C ATOM 626 CG MET A 60 -2.388 2.447 -8.557 1.00 10.00 C ATOM 627 SD MET A 60 -3.932 1.681 -8.019 1.00 10.00 S ATOM 628 CE MET A 60 -4.602 1.114 -9.582 1.00 10.00 C ATOM 0 H MET A 60 -0.315 2.757 -10.420 1.00 10.00 H new ATOM 0 HA MET A 60 -1.705 5.318 -10.382 1.00 10.00 H new ATOM 0 HB2 MET A 60 -3.447 4.161 -9.271 1.00 10.00 H new ATOM 0 HB3 MET A 60 -2.874 3.091 -10.536 1.00 10.00 H new ATOM 0 HG2 MET A 60 -1.737 1.682 -8.981 1.00 10.00 H new ATOM 0 HG3 MET A 60 -1.872 2.861 -7.691 1.00 10.00 H new ATOM 0 HE1 MET A 60 -5.461 0.469 -9.397 1.00 10.00 H new ATOM 0 HE2 MET A 60 -4.914 1.972 -10.177 1.00 10.00 H new ATOM 0 HE3 MET A 60 -3.839 0.556 -10.124 1.00 10.00 H new ATOM 638 N ASP A 61 0.402 4.569 -8.151 1.00 10.00 N ATOM 639 CA ASP A 61 1.034 4.987 -6.906 1.00 10.00 C ATOM 640 C ASP A 61 1.644 6.361 -7.090 1.00 10.00 C ATOM 641 O ASP A 61 1.303 7.310 -6.380 1.00 10.00 O ATOM 642 CB ASP A 61 2.116 3.996 -6.470 1.00 10.00 C ATOM 643 CG ASP A 61 1.547 2.646 -6.091 1.00 10.00 C ATOM 644 OD1 ASP A 61 0.502 2.606 -5.408 1.00 10.00 O ATOM 645 OD2 ASP A 61 2.133 1.614 -6.491 1.00 10.00 O ATOM 0 H ASP A 61 0.984 3.978 -8.744 1.00 10.00 H new ATOM 0 HA ASP A 61 0.272 5.017 -6.127 1.00 10.00 H new ATOM 0 HB2 ASP A 61 2.835 3.869 -7.279 1.00 10.00 H new ATOM 0 HB3 ASP A 61 2.661 4.408 -5.621 1.00 10.00 H new ATOM 650 N GLY A 62 2.549 6.462 -8.050 1.00 10.00 N ATOM 651 CA GLY A 62 3.187 7.726 -8.337 1.00 10.00 C ATOM 652 C GLY A 62 4.403 7.992 -7.477 1.00 10.00 C ATOM 653 O GLY A 62 5.513 8.137 -7.993 1.00 10.00 O ATOM 0 H GLY A 62 2.854 5.686 -8.638 1.00 10.00 H new ATOM 0 HA2 GLY A 62 3.481 7.746 -9.386 1.00 10.00 H new ATOM 0 HA3 GLY A 62 2.466 8.530 -8.193 1.00 10.00 H new ATOM 657 N THR A 63 4.211 8.042 -6.164 1.00 10.00 N ATOM 658 CA THR A 63 5.314 8.328 -5.263 1.00 10.00 C ATOM 659 C THR A 63 5.623 7.168 -4.325 1.00 10.00 C ATOM 660 O THR A 63 4.842 6.223 -4.188 1.00 10.00 O ATOM 661 CB THR A 63 5.034 9.591 -4.416 1.00 10.00 C ATOM 662 OG1 THR A 63 3.986 9.330 -3.476 1.00 10.00 O ATOM 663 CG2 THR A 63 4.632 10.763 -5.295 1.00 10.00 C ATOM 0 H THR A 63 3.312 7.890 -5.706 1.00 10.00 H new ATOM 0 HA THR A 63 6.181 8.494 -5.902 1.00 10.00 H new ATOM 0 HB THR A 63 5.952 9.847 -3.887 1.00 10.00 H new ATOM 0 HG1 THR A 63 3.817 10.135 -2.943 1.00 10.00 H new ATOM 0 HG21 THR A 63 4.441 11.637 -4.672 1.00 10.00 H new ATOM 0 HG22 THR A 63 5.437 10.985 -5.995 1.00 10.00 H new ATOM 0 HG23 THR A 63 3.729 10.509 -5.849 1.00 10.00 H new ATOM 671 N LEU A 64 6.784 7.272 -3.689 1.00 10.00 N ATOM 672 CA LEU A 64 7.276 6.284 -2.743 1.00 10.00 C ATOM 673 C LEU A 64 6.287 6.064 -1.604 1.00 10.00 C ATOM 674 O LEU A 64 5.990 4.926 -1.240 1.00 10.00 O ATOM 675 CB LEU A 64 8.615 6.761 -2.180 1.00 10.00 C ATOM 676 CG LEU A 64 9.760 5.763 -2.296 1.00 10.00 C ATOM 677 CD1 LEU A 64 11.046 6.465 -2.702 1.00 10.00 C ATOM 678 CD2 LEU A 64 9.943 5.027 -0.983 1.00 10.00 C ATOM 0 H LEU A 64 7.419 8.060 -3.820 1.00 10.00 H new ATOM 0 HA LEU A 64 7.401 5.335 -3.264 1.00 10.00 H new ATOM 0 HB2 LEU A 64 8.901 7.679 -2.694 1.00 10.00 H new ATOM 0 HB3 LEU A 64 8.479 7.014 -1.128 1.00 10.00 H new ATOM 0 HG LEU A 64 9.513 5.038 -3.071 1.00 10.00 H new ATOM 0 HD11 LEU A 64 11.851 5.734 -2.779 1.00 10.00 H new ATOM 0 HD12 LEU A 64 10.905 6.953 -3.667 1.00 10.00 H new ATOM 0 HD13 LEU A 64 11.305 7.212 -1.952 1.00 10.00 H new ATOM 0 HD21 LEU A 64 10.764 4.316 -1.076 1.00 10.00 H new ATOM 0 HD22 LEU A 64 10.171 5.743 -0.193 1.00 10.00 H new ATOM 0 HD23 LEU A 64 9.026 4.492 -0.735 1.00 10.00 H new ATOM 690 N LYS A 65 5.783 7.163 -1.051 1.00 10.00 N ATOM 691 CA LYS A 65 4.830 7.102 0.050 1.00 10.00 C ATOM 692 C LYS A 65 3.590 6.311 -0.347 1.00 10.00 C ATOM 693 O LYS A 65 3.253 5.317 0.292 1.00 10.00 O ATOM 694 CB LYS A 65 4.426 8.510 0.484 1.00 10.00 C ATOM 695 CG LYS A 65 3.461 8.525 1.660 1.00 10.00 C ATOM 696 CD LYS A 65 3.003 9.936 1.981 1.00 10.00 C ATOM 697 CE LYS A 65 4.069 10.702 2.740 1.00 10.00 C ATOM 698 NZ LYS A 65 3.849 12.172 2.676 1.00 10.00 N ATOM 0 H LYS A 65 6.020 8.109 -1.349 1.00 10.00 H new ATOM 0 HA LYS A 65 5.314 6.595 0.885 1.00 10.00 H new ATOM 0 HB2 LYS A 65 5.322 9.071 0.751 1.00 10.00 H new ATOM 0 HB3 LYS A 65 3.967 9.025 -0.360 1.00 10.00 H new ATOM 0 HG2 LYS A 65 2.596 7.903 1.431 1.00 10.00 H new ATOM 0 HG3 LYS A 65 3.944 8.089 2.535 1.00 10.00 H new ATOM 0 HD2 LYS A 65 2.763 10.462 1.057 1.00 10.00 H new ATOM 0 HD3 LYS A 65 2.089 9.898 2.573 1.00 10.00 H new ATOM 0 HE2 LYS A 65 4.074 10.381 3.782 1.00 10.00 H new ATOM 0 HE3 LYS A 65 5.050 10.464 2.328 1.00 10.00 H new ATOM 0 HZ1 LYS A 65 4.554 12.601 2.043 1.00 10.00 H new ATOM 0 HZ2 LYS A 65 2.894 12.365 2.312 1.00 10.00 H new ATOM 0 HZ3 LYS A 65 3.945 12.579 3.628 1.00 10.00 H new ATOM 712 N THR A 66 2.940 6.747 -1.421 1.00 10.00 N ATOM 713 CA THR A 66 1.731 6.101 -1.907 1.00 10.00 C ATOM 714 C THR A 66 1.957 4.621 -2.197 1.00 10.00 C ATOM 715 O THR A 66 1.130 3.778 -1.845 1.00 10.00 O ATOM 716 CB THR A 66 1.227 6.802 -3.179 1.00 10.00 C ATOM 717 OG1 THR A 66 1.373 8.221 -3.038 1.00 10.00 O ATOM 718 CG2 THR A 66 -0.228 6.470 -3.442 1.00 10.00 C ATOM 0 H THR A 66 3.235 7.552 -1.974 1.00 10.00 H new ATOM 0 HA THR A 66 0.981 6.182 -1.120 1.00 10.00 H new ATOM 0 HB THR A 66 1.821 6.449 -4.022 1.00 10.00 H new ATOM 0 HG1 THR A 66 2.269 8.489 -3.333 1.00 10.00 H new ATOM 0 HG21 THR A 66 -0.559 6.979 -4.347 1.00 10.00 H new ATOM 0 HG22 THR A 66 -0.338 5.393 -3.570 1.00 10.00 H new ATOM 0 HG23 THR A 66 -0.835 6.799 -2.598 1.00 10.00 H new ATOM 726 N MET A 67 3.088 4.313 -2.818 1.00 10.00 N ATOM 727 CA MET A 67 3.426 2.936 -3.155 1.00 10.00 C ATOM 728 C MET A 67 3.498 2.072 -1.899 1.00 10.00 C ATOM 729 O MET A 67 2.815 1.056 -1.793 1.00 10.00 O ATOM 730 CB MET A 67 4.761 2.886 -3.897 1.00 10.00 C ATOM 731 CG MET A 67 5.104 1.511 -4.444 1.00 10.00 C ATOM 732 SD MET A 67 6.805 1.408 -5.038 1.00 10.00 S ATOM 733 CE MET A 67 7.710 1.525 -3.499 1.00 10.00 C ATOM 0 H MET A 67 3.788 4.999 -3.099 1.00 10.00 H new ATOM 0 HA MET A 67 2.642 2.542 -3.802 1.00 10.00 H new ATOM 0 HB2 MET A 67 4.736 3.599 -4.721 1.00 10.00 H new ATOM 0 HB3 MET A 67 5.554 3.207 -3.222 1.00 10.00 H new ATOM 0 HG2 MET A 67 4.949 0.765 -3.665 1.00 10.00 H new ATOM 0 HG3 MET A 67 4.423 1.267 -5.259 1.00 10.00 H new ATOM 0 HE1 MET A 67 8.698 1.082 -3.623 1.00 10.00 H new ATOM 0 HE2 MET A 67 7.815 2.573 -3.217 1.00 10.00 H new ATOM 0 HE3 MET A 67 7.169 0.991 -2.717 1.00 10.00 H new ATOM 743 N LEU A 68 4.303 2.505 -0.936 1.00 10.00 N ATOM 744 CA LEU A 68 4.472 1.768 0.312 1.00 10.00 C ATOM 745 C LEU A 68 3.171 1.727 1.106 1.00 10.00 C ATOM 746 O LEU A 68 2.862 0.722 1.746 1.00 10.00 O ATOM 747 CB LEU A 68 5.587 2.390 1.149 1.00 10.00 C ATOM 748 CG LEU A 68 6.974 2.352 0.503 1.00 10.00 C ATOM 749 CD1 LEU A 68 7.972 3.120 1.349 1.00 10.00 C ATOM 750 CD2 LEU A 68 7.435 0.917 0.312 1.00 10.00 C ATOM 0 H LEU A 68 4.850 3.364 -0.995 1.00 10.00 H new ATOM 0 HA LEU A 68 4.748 0.743 0.065 1.00 10.00 H new ATOM 0 HB2 LEU A 68 5.328 3.428 1.359 1.00 10.00 H new ATOM 0 HB3 LEU A 68 5.634 1.873 2.107 1.00 10.00 H new ATOM 0 HG LEU A 68 6.911 2.826 -0.476 1.00 10.00 H new ATOM 0 HD11 LEU A 68 8.954 3.084 0.876 1.00 10.00 H new ATOM 0 HD12 LEU A 68 7.651 4.158 1.439 1.00 10.00 H new ATOM 0 HD13 LEU A 68 8.030 2.671 2.341 1.00 10.00 H new ATOM 0 HD21 LEU A 68 8.423 0.910 -0.149 1.00 10.00 H new ATOM 0 HD22 LEU A 68 7.483 0.418 1.280 1.00 10.00 H new ATOM 0 HD23 LEU A 68 6.731 0.391 -0.333 1.00 10.00 H new ATOM 762 N GLU A 69 2.408 2.815 1.057 1.00 10.00 N ATOM 763 CA GLU A 69 1.132 2.886 1.761 1.00 10.00 C ATOM 764 C GLU A 69 0.188 1.800 1.257 1.00 10.00 C ATOM 765 O GLU A 69 -0.458 1.110 2.047 1.00 10.00 O ATOM 766 CB GLU A 69 0.478 4.260 1.581 1.00 10.00 C ATOM 767 CG GLU A 69 0.996 5.319 2.537 1.00 10.00 C ATOM 768 CD GLU A 69 0.086 6.526 2.606 1.00 10.00 C ATOM 769 OE1 GLU A 69 -0.108 7.191 1.570 1.00 10.00 O ATOM 770 OE2 GLU A 69 -0.459 6.806 3.698 1.00 10.00 O ATOM 0 H GLU A 69 2.651 3.659 0.538 1.00 10.00 H new ATOM 0 HA GLU A 69 1.327 2.731 2.822 1.00 10.00 H new ATOM 0 HB2 GLU A 69 0.641 4.598 0.558 1.00 10.00 H new ATOM 0 HB3 GLU A 69 -0.599 4.159 1.715 1.00 10.00 H new ATOM 0 HG2 GLU A 69 1.099 4.887 3.533 1.00 10.00 H new ATOM 0 HG3 GLU A 69 1.991 5.634 2.222 1.00 10.00 H new ATOM 777 N ARG A 70 0.123 1.655 -0.061 1.00 10.00 N ATOM 778 CA ARG A 70 -0.730 0.653 -0.688 1.00 10.00 C ATOM 779 C ARG A 70 -0.243 -0.749 -0.356 1.00 10.00 C ATOM 780 O ARG A 70 -1.046 -1.657 -0.125 1.00 10.00 O ATOM 781 CB ARG A 70 -0.756 0.858 -2.202 1.00 10.00 C ATOM 782 CG ARG A 70 -1.606 2.042 -2.633 1.00 10.00 C ATOM 783 CD ARG A 70 -3.053 1.636 -2.864 1.00 10.00 C ATOM 784 NE ARG A 70 -3.184 0.737 -4.005 1.00 10.00 N ATOM 785 CZ ARG A 70 -4.263 0.005 -4.265 1.00 10.00 C ATOM 786 NH1 ARG A 70 -5.326 0.075 -3.475 1.00 10.00 N ATOM 787 NH2 ARG A 70 -4.274 -0.796 -5.324 1.00 10.00 N ATOM 0 H ARG A 70 0.655 2.223 -0.720 1.00 10.00 H new ATOM 0 HA ARG A 70 -1.741 0.767 -0.298 1.00 10.00 H new ATOM 0 HB2 ARG A 70 0.263 1.002 -2.560 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -1.136 -0.046 -2.678 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -1.563 2.819 -1.870 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -1.197 2.471 -3.548 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -3.442 1.149 -1.970 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -3.659 2.527 -3.031 1.00 10.00 H new ATOM 0 HE ARG A 70 -2.395 0.665 -4.647 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -5.318 0.693 -2.663 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -6.151 -0.489 -3.679 1.00 10.00 H new ATOM 0 HH21 ARG A 70 -3.457 -0.847 -5.933 1.00 10.00 H new ATOM 0 HH22 ARG A 70 -5.099 -1.360 -5.528 1.00 10.00 H new ATOM 801 N TRP A 71 1.074 -0.919 -0.333 1.00 10.00 N ATOM 802 CA TRP A 71 1.676 -2.207 -0.012 1.00 10.00 C ATOM 803 C TRP A 71 1.309 -2.612 1.410 1.00 10.00 C ATOM 804 O TRP A 71 0.773 -3.698 1.650 1.00 10.00 O ATOM 805 CB TRP A 71 3.200 -2.138 -0.139 1.00 10.00 C ATOM 806 CG TRP A 71 3.704 -2.097 -1.551 1.00 10.00 C ATOM 807 CD1 TRP A 71 2.975 -1.891 -2.684 1.00 10.00 C ATOM 808 CD2 TRP A 71 5.060 -2.270 -1.973 1.00 10.00 C ATOM 809 NE1 TRP A 71 3.796 -1.921 -3.784 1.00 10.00 N ATOM 810 CE2 TRP A 71 5.082 -2.151 -3.373 1.00 10.00 C ATOM 811 CE3 TRP A 71 6.259 -2.510 -1.300 1.00 10.00 C ATOM 812 CZ2 TRP A 71 6.255 -2.267 -4.112 1.00 10.00 C ATOM 813 CZ3 TRP A 71 7.422 -2.625 -2.033 1.00 10.00 C ATOM 814 CH2 TRP A 71 7.413 -2.502 -3.426 1.00 10.00 C ATOM 0 H TRP A 71 1.746 -0.179 -0.533 1.00 10.00 H new ATOM 0 HA TRP A 71 1.295 -2.947 -0.716 1.00 10.00 H new ATOM 0 HB2 TRP A 71 3.556 -1.252 0.387 1.00 10.00 H new ATOM 0 HB3 TRP A 71 3.634 -3.003 0.363 1.00 10.00 H new ATOM 0 HD1 TRP A 71 1.908 -1.728 -2.712 1.00 10.00 H new ATOM 0 HE1 TRP A 71 3.497 -1.793 -4.751 1.00 10.00 H new ATOM 0 HE3 TRP A 71 6.276 -2.604 -0.224 1.00 10.00 H new ATOM 0 HZ2 TRP A 71 6.250 -2.175 -5.188 1.00 10.00 H new ATOM 0 HZ3 TRP A 71 8.355 -2.813 -1.523 1.00 10.00 H new ATOM 0 HH2 TRP A 71 8.341 -2.595 -3.971 1.00 10.00 H new ATOM 825 N ALA A 72 1.588 -1.711 2.345 1.00 10.00 N ATOM 826 CA ALA A 72 1.303 -1.937 3.753 1.00 10.00 C ATOM 827 C ALA A 72 -0.188 -2.134 4.000 1.00 10.00 C ATOM 828 O ALA A 72 -0.578 -2.990 4.785 1.00 10.00 O ATOM 829 CB ALA A 72 1.817 -0.773 4.584 1.00 10.00 C ATOM 0 H ALA A 72 2.017 -0.807 2.147 1.00 10.00 H new ATOM 0 HA ALA A 72 1.816 -2.851 4.052 1.00 10.00 H new ATOM 0 HB1 ALA A 72 1.598 -0.953 5.637 1.00 10.00 H new ATOM 0 HB2 ALA A 72 2.894 -0.677 4.449 1.00 10.00 H new ATOM 0 HB3 ALA A 72 1.328 0.147 4.264 1.00 10.00 H new ATOM 835 N ALA A 73 -1.012 -1.356 3.310 1.00 10.00 N ATOM 836 CA ALA A 73 -2.463 -1.430 3.470 1.00 10.00 C ATOM 837 C ALA A 73 -3.009 -2.820 3.161 1.00 10.00 C ATOM 838 O ALA A 73 -3.904 -3.308 3.854 1.00 10.00 O ATOM 839 CB ALA A 73 -3.147 -0.402 2.585 1.00 10.00 C ATOM 0 H ALA A 73 -0.701 -0.662 2.630 1.00 10.00 H new ATOM 0 HA ALA A 73 -2.679 -1.215 4.516 1.00 10.00 H new ATOM 0 HB1 ALA A 73 -4.227 -0.470 2.716 1.00 10.00 H new ATOM 0 HB2 ALA A 73 -2.810 0.597 2.861 1.00 10.00 H new ATOM 0 HB3 ALA A 73 -2.895 -0.595 1.542 1.00 10.00 H new ATOM 845 N ASP A 74 -2.470 -3.459 2.127 1.00 10.00 N ATOM 846 CA ASP A 74 -2.937 -4.785 1.728 1.00 10.00 C ATOM 847 C ASP A 74 -2.632 -5.838 2.789 1.00 10.00 C ATOM 848 O ASP A 74 -3.431 -6.746 3.021 1.00 10.00 O ATOM 849 CB ASP A 74 -2.320 -5.207 0.396 1.00 10.00 C ATOM 850 CG ASP A 74 -3.074 -6.361 -0.244 1.00 10.00 C ATOM 851 OD1 ASP A 74 -2.751 -7.529 0.053 1.00 10.00 O ATOM 852 OD2 ASP A 74 -3.993 -6.097 -1.055 1.00 10.00 O ATOM 0 H ASP A 74 -1.715 -3.084 1.553 1.00 10.00 H new ATOM 0 HA ASP A 74 -4.019 -4.716 1.615 1.00 10.00 H new ATOM 0 HB2 ASP A 74 -2.314 -4.356 -0.286 1.00 10.00 H new ATOM 0 HB3 ASP A 74 -1.281 -5.497 0.554 1.00 10.00 H new ATOM 857 N SER A 75 -1.492 -5.705 3.447 1.00 10.00 N ATOM 858 CA SER A 75 -1.093 -6.666 4.465 1.00 10.00 C ATOM 859 C SER A 75 -1.313 -6.122 5.877 1.00 10.00 C ATOM 860 O SER A 75 -0.812 -6.690 6.850 1.00 10.00 O ATOM 861 CB SER A 75 0.369 -7.060 4.260 1.00 10.00 C ATOM 862 OG SER A 75 0.588 -7.518 2.934 1.00 10.00 O ATOM 0 H SER A 75 -0.829 -4.945 3.296 1.00 10.00 H new ATOM 0 HA SER A 75 -1.722 -7.550 4.360 1.00 10.00 H new ATOM 0 HB2 SER A 75 1.013 -6.205 4.465 1.00 10.00 H new ATOM 0 HB3 SER A 75 0.642 -7.841 4.969 1.00 10.00 H new ATOM 0 HG SER A 75 1.548 -7.509 2.739 1.00 10.00 H new ATOM 868 N ASN A 76 -2.066 -5.025 5.980 1.00 10.00 N ATOM 869 CA ASN A 76 -2.375 -4.397 7.272 1.00 10.00 C ATOM 870 C ASN A 76 -1.101 -4.077 8.052 1.00 10.00 C ATOM 871 O ASN A 76 -1.013 -4.305 9.262 1.00 10.00 O ATOM 872 CB ASN A 76 -3.297 -5.293 8.106 1.00 10.00 C ATOM 873 CG ASN A 76 -4.652 -5.500 7.458 1.00 10.00 C ATOM 874 OD1 ASN A 76 -5.119 -4.664 6.681 1.00 10.00 O ATOM 875 ND2 ASN A 76 -5.286 -6.619 7.764 1.00 10.00 N ATOM 0 H ASN A 76 -2.478 -4.548 5.178 1.00 10.00 H new ATOM 0 HA ASN A 76 -2.892 -3.460 7.067 1.00 10.00 H new ATOM 0 HB2 ASN A 76 -2.819 -6.261 8.256 1.00 10.00 H new ATOM 0 HB3 ASN A 76 -3.434 -4.849 9.092 1.00 10.00 H new ATOM 0 HD21 ASN A 76 -6.198 -6.817 7.352 1.00 10.00 H new ATOM 0 HD22 ASN A 76 -4.863 -7.284 8.412 1.00 10.00 H new ATOM 882 N MET A 77 -0.119 -3.547 7.346 1.00 10.00 N ATOM 883 CA MET A 77 1.161 -3.192 7.937 1.00 10.00 C ATOM 884 C MET A 77 1.243 -1.689 8.148 1.00 10.00 C ATOM 885 O MET A 77 0.498 -0.929 7.531 1.00 10.00 O ATOM 886 CB MET A 77 2.307 -3.640 7.028 1.00 10.00 C ATOM 887 CG MET A 77 2.340 -5.136 6.763 1.00 10.00 C ATOM 888 SD MET A 77 3.315 -5.567 5.308 1.00 10.00 S ATOM 889 CE MET A 77 4.925 -4.930 5.763 1.00 10.00 C ATOM 0 H MET A 77 -0.185 -3.350 6.347 1.00 10.00 H new ATOM 0 HA MET A 77 1.247 -3.696 8.899 1.00 10.00 H new ATOM 0 HB2 MET A 77 2.228 -3.115 6.076 1.00 10.00 H new ATOM 0 HB3 MET A 77 3.253 -3.341 7.480 1.00 10.00 H new ATOM 0 HG2 MET A 77 2.751 -5.646 7.634 1.00 10.00 H new ATOM 0 HG3 MET A 77 1.321 -5.500 6.633 1.00 10.00 H new ATOM 0 HE1 MET A 77 5.324 -4.330 4.945 1.00 10.00 H new ATOM 0 HE2 MET A 77 4.832 -4.311 6.655 1.00 10.00 H new ATOM 0 HE3 MET A 77 5.601 -5.761 5.967 1.00 10.00 H new ATOM 899 N GLN A 78 2.144 -1.265 9.017 1.00 10.00 N ATOM 900 CA GLN A 78 2.322 0.153 9.287 1.00 10.00 C ATOM 901 C GLN A 78 3.486 0.693 8.464 1.00 10.00 C ATOM 902 O GLN A 78 4.395 -0.055 8.098 1.00 10.00 O ATOM 903 CB GLN A 78 2.559 0.399 10.781 1.00 10.00 C ATOM 904 CG GLN A 78 1.388 -0.013 11.661 1.00 10.00 C ATOM 905 CD GLN A 78 0.074 0.608 11.231 1.00 10.00 C ATOM 906 OE1 GLN A 78 -0.689 0.016 10.468 1.00 10.00 O ATOM 907 NE2 GLN A 78 -0.200 1.801 11.722 1.00 10.00 N ATOM 0 H GLN A 78 2.762 -1.879 9.547 1.00 10.00 H new ATOM 0 HA GLN A 78 1.411 0.680 9.002 1.00 10.00 H new ATOM 0 HB2 GLN A 78 3.448 -0.149 11.094 1.00 10.00 H new ATOM 0 HB3 GLN A 78 2.765 1.458 10.938 1.00 10.00 H new ATOM 0 HG2 GLN A 78 1.293 -1.099 11.644 1.00 10.00 H new ATOM 0 HG3 GLN A 78 1.598 0.272 12.692 1.00 10.00 H new ATOM 0 HE21 GLN A 78 0.460 2.257 12.352 1.00 10.00 H new ATOM 0 HE22 GLN A 78 -1.072 2.267 11.472 1.00 10.00 H new ATOM 916 N LEU A 79 3.463 1.985 8.178 1.00 10.00 N ATOM 917 CA LEU A 79 4.509 2.607 7.383 1.00 10.00 C ATOM 918 C LEU A 79 5.184 3.740 8.141 1.00 10.00 C ATOM 919 O LEU A 79 4.528 4.586 8.753 1.00 10.00 O ATOM 920 CB LEU A 79 3.933 3.135 6.066 1.00 10.00 C ATOM 921 CG LEU A 79 4.895 3.981 5.232 1.00 10.00 C ATOM 922 CD1 LEU A 79 6.004 3.117 4.662 1.00 10.00 C ATOM 923 CD2 LEU A 79 4.152 4.697 4.119 1.00 10.00 C ATOM 0 H LEU A 79 2.730 2.624 8.485 1.00 10.00 H new ATOM 0 HA LEU A 79 5.259 1.846 7.170 1.00 10.00 H new ATOM 0 HB2 LEU A 79 3.604 2.287 5.465 1.00 10.00 H new ATOM 0 HB3 LEU A 79 3.048 3.731 6.287 1.00 10.00 H new ATOM 0 HG LEU A 79 5.343 4.733 5.882 1.00 10.00 H new ATOM 0 HD11 LEU A 79 6.680 3.735 4.071 1.00 10.00 H new ATOM 0 HD12 LEU A 79 6.558 2.651 5.477 1.00 10.00 H new ATOM 0 HD13 LEU A 79 5.572 2.343 4.028 1.00 10.00 H new ATOM 0 HD21 LEU A 79 4.855 5.294 3.537 1.00 10.00 H new ATOM 0 HD22 LEU A 79 3.675 3.963 3.470 1.00 10.00 H new ATOM 0 HD23 LEU A 79 3.392 5.349 4.550 1.00 10.00 H new ATOM 935 N SER A 80 6.501 3.740 8.092 1.00 10.00 N ATOM 936 CA SER A 80 7.299 4.758 8.741 1.00 10.00 C ATOM 937 C SER A 80 8.035 5.564 7.679 1.00 10.00 C ATOM 938 O SER A 80 9.105 5.168 7.224 1.00 10.00 O ATOM 939 CB SER A 80 8.302 4.088 9.680 1.00 10.00 C ATOM 940 OG SER A 80 7.912 2.756 9.960 1.00 10.00 O ATOM 0 H SER A 80 7.048 3.033 7.600 1.00 10.00 H new ATOM 0 HA SER A 80 6.659 5.424 9.319 1.00 10.00 H new ATOM 0 HB2 SER A 80 9.293 4.094 9.226 1.00 10.00 H new ATOM 0 HB3 SER A 80 8.373 4.654 10.609 1.00 10.00 H new ATOM 0 HG SER A 80 8.142 2.181 9.200 1.00 10.00 H new ATOM 946 N TYR A 81 7.461 6.688 7.286 1.00 10.00 N ATOM 947 CA TYR A 81 8.068 7.529 6.270 1.00 10.00 C ATOM 948 C TYR A 81 8.795 8.696 6.926 1.00 10.00 C ATOM 949 O TYR A 81 8.192 9.721 7.242 1.00 10.00 O ATOM 950 CB TYR A 81 6.983 8.038 5.319 1.00 10.00 C ATOM 951 CG TYR A 81 7.473 8.401 3.934 1.00 10.00 C ATOM 952 CD1 TYR A 81 7.704 7.424 2.972 1.00 10.00 C ATOM 953 CD2 TYR A 81 7.681 9.726 3.582 1.00 10.00 C ATOM 954 CE1 TYR A 81 8.135 7.762 1.701 1.00 10.00 C ATOM 955 CE2 TYR A 81 8.107 10.072 2.315 1.00 10.00 C ATOM 956 CZ TYR A 81 8.332 9.090 1.378 1.00 10.00 C ATOM 957 OH TYR A 81 8.759 9.438 0.116 1.00 10.00 O ATOM 0 H TYR A 81 6.577 7.039 7.655 1.00 10.00 H new ATOM 0 HA TYR A 81 8.794 6.948 5.701 1.00 10.00 H new ATOM 0 HB2 TYR A 81 6.212 7.273 5.227 1.00 10.00 H new ATOM 0 HB3 TYR A 81 6.512 8.914 5.764 1.00 10.00 H new ATOM 0 HD1 TYR A 81 7.545 6.385 3.220 1.00 10.00 H new ATOM 0 HD2 TYR A 81 7.507 10.502 4.313 1.00 10.00 H new ATOM 0 HE1 TYR A 81 8.316 6.992 0.966 1.00 10.00 H new ATOM 0 HE2 TYR A 81 8.263 11.110 2.060 1.00 10.00 H new ATOM 0 HH TYR A 81 8.030 9.303 -0.525 1.00 10.00 H new ATOM 967 N ASN A 82 10.094 8.534 7.123 1.00 10.00 N ATOM 968 CA ASN A 82 10.909 9.566 7.750 1.00 10.00 C ATOM 969 C ASN A 82 11.648 10.381 6.700 1.00 10.00 C ATOM 970 O ASN A 82 12.542 11.167 7.019 1.00 10.00 O ATOM 971 CB ASN A 82 11.910 8.931 8.719 1.00 10.00 C ATOM 972 CG ASN A 82 11.239 8.269 9.909 1.00 10.00 C ATOM 973 OD1 ASN A 82 10.016 8.109 9.953 1.00 10.00 O ATOM 974 ND2 ASN A 82 12.036 7.871 10.880 1.00 10.00 N ATOM 0 H ASN A 82 10.609 7.695 6.857 1.00 10.00 H new ATOM 0 HA ASN A 82 10.249 10.233 8.305 1.00 10.00 H new ATOM 0 HB2 ASN A 82 12.505 8.190 8.185 1.00 10.00 H new ATOM 0 HB3 ASN A 82 12.599 9.697 9.076 1.00 10.00 H new ATOM 0 HD21 ASN A 82 11.647 7.413 11.704 1.00 10.00 H new ATOM 0 HD22 ASN A 82 13.042 8.021 10.808 1.00 10.00 H new ATOM 981 N LEU A 83 11.275 10.184 5.441 1.00 10.00 N ATOM 982 CA LEU A 83 11.893 10.907 4.342 1.00 10.00 C ATOM 983 C LEU A 83 11.465 12.366 4.369 1.00 10.00 C ATOM 984 O LEU A 83 10.314 12.671 4.693 1.00 10.00 O ATOM 985 CB LEU A 83 11.520 10.284 2.996 1.00 10.00 C ATOM 986 CG LEU A 83 11.984 8.842 2.786 1.00 10.00 C ATOM 987 CD1 LEU A 83 11.751 8.420 1.348 1.00 10.00 C ATOM 988 CD2 LEU A 83 13.449 8.692 3.153 1.00 10.00 C ATOM 0 H LEU A 83 10.547 9.528 5.158 1.00 10.00 H new ATOM 0 HA LEU A 83 12.974 10.845 4.463 1.00 10.00 H new ATOM 0 HB2 LEU A 83 10.436 10.318 2.888 1.00 10.00 H new ATOM 0 HB3 LEU A 83 11.939 10.901 2.201 1.00 10.00 H new ATOM 0 HG LEU A 83 11.401 8.193 3.439 1.00 10.00 H new ATOM 0 HD11 LEU A 83 12.086 7.392 1.212 1.00 10.00 H new ATOM 0 HD12 LEU A 83 10.688 8.490 1.116 1.00 10.00 H new ATOM 0 HD13 LEU A 83 12.312 9.075 0.681 1.00 10.00 H new ATOM 0 HD21 LEU A 83 13.759 7.659 2.997 1.00 10.00 H new ATOM 0 HD22 LEU A 83 14.050 9.350 2.526 1.00 10.00 H new ATOM 0 HD23 LEU A 83 13.591 8.959 4.200 1.00 10.00 H new ATOM 1000 N PRO A 84 12.384 13.282 4.035 1.00 10.00 N ATOM 1001 CA PRO A 84 12.104 14.720 4.021 1.00 10.00 C ATOM 1002 C PRO A 84 10.925 15.073 3.118 1.00 10.00 C ATOM 1003 O PRO A 84 10.111 15.929 3.459 1.00 10.00 O ATOM 1004 CB PRO A 84 13.399 15.347 3.488 1.00 10.00 C ATOM 1005 CG PRO A 84 14.170 14.221 2.887 1.00 10.00 C ATOM 1006 CD PRO A 84 13.772 12.991 3.649 1.00 10.00 C ATOM 0 HA PRO A 84 11.824 15.083 5.010 1.00 10.00 H new ATOM 0 HB2 PRO A 84 13.186 16.117 2.746 1.00 10.00 H new ATOM 0 HB3 PRO A 84 13.963 15.825 4.290 1.00 10.00 H new ATOM 0 HG2 PRO A 84 13.941 14.114 1.827 1.00 10.00 H new ATOM 0 HG3 PRO A 84 15.243 14.398 2.965 1.00 10.00 H new ATOM 0 HD2 PRO A 84 13.841 12.094 3.034 1.00 10.00 H new ATOM 0 HD3 PRO A 84 14.409 12.831 4.519 1.00 10.00 H new ATOM 1014 N SER A 85 10.829 14.411 1.972 1.00 10.00 N ATOM 1015 CA SER A 85 9.746 14.664 1.032 1.00 10.00 C ATOM 1016 C SER A 85 9.380 13.386 0.277 1.00 10.00 C ATOM 1017 O SER A 85 10.058 12.362 0.406 1.00 10.00 O ATOM 1018 CB SER A 85 10.149 15.768 0.049 1.00 10.00 C ATOM 1019 OG SER A 85 10.513 16.955 0.737 1.00 10.00 O ATOM 0 H SER A 85 11.489 13.694 1.671 1.00 10.00 H new ATOM 0 HA SER A 85 8.870 14.994 1.591 1.00 10.00 H new ATOM 0 HB2 SER A 85 10.984 15.428 -0.563 1.00 10.00 H new ATOM 0 HB3 SER A 85 9.321 15.976 -0.629 1.00 10.00 H new ATOM 0 HG SER A 85 10.768 17.644 0.088 1.00 10.00 H new ATOM 1025 N ASP A 86 8.295 13.444 -0.491 1.00 10.00 N ATOM 1026 CA ASP A 86 7.851 12.297 -1.275 1.00 10.00 C ATOM 1027 C ASP A 86 8.639 12.235 -2.569 1.00 10.00 C ATOM 1028 O ASP A 86 8.841 13.255 -3.228 1.00 10.00 O ATOM 1029 CB ASP A 86 6.355 12.382 -1.600 1.00 10.00 C ATOM 1030 CG ASP A 86 5.475 12.366 -0.372 1.00 10.00 C ATOM 1031 OD1 ASP A 86 5.858 11.741 0.633 1.00 10.00 O ATOM 1032 OD2 ASP A 86 4.388 12.984 -0.406 1.00 10.00 O ATOM 0 H ASP A 86 7.708 14.273 -0.586 1.00 10.00 H new ATOM 0 HA ASP A 86 8.021 11.398 -0.683 1.00 10.00 H new ATOM 0 HB2 ASP A 86 6.164 13.295 -2.164 1.00 10.00 H new ATOM 0 HB3 ASP A 86 6.082 11.547 -2.245 1.00 10.00 H new ATOM 1037 N TYR A 87 9.089 11.050 -2.933 1.00 10.00 N ATOM 1038 CA TYR A 87 9.853 10.884 -4.155 1.00 10.00 C ATOM 1039 C TYR A 87 9.069 10.059 -5.157 1.00 10.00 C ATOM 1040 O TYR A 87 8.558 8.991 -4.821 1.00 10.00 O ATOM 1041 CB TYR A 87 11.198 10.223 -3.850 1.00 10.00 C ATOM 1042 CG TYR A 87 12.050 11.023 -2.893 1.00 10.00 C ATOM 1043 CD1 TYR A 87 12.657 12.205 -3.296 1.00 10.00 C ATOM 1044 CD2 TYR A 87 12.242 10.599 -1.587 1.00 10.00 C ATOM 1045 CE1 TYR A 87 13.430 12.945 -2.424 1.00 10.00 C ATOM 1046 CE2 TYR A 87 13.015 11.333 -0.706 1.00 10.00 C ATOM 1047 CZ TYR A 87 13.608 12.504 -1.132 1.00 10.00 C ATOM 1048 OH TYR A 87 14.380 13.238 -0.261 1.00 10.00 O ATOM 0 H TYR A 87 8.940 10.191 -2.403 1.00 10.00 H new ATOM 0 HA TYR A 87 10.040 11.866 -4.589 1.00 10.00 H new ATOM 0 HB2 TYR A 87 11.022 9.233 -3.429 1.00 10.00 H new ATOM 0 HB3 TYR A 87 11.745 10.081 -4.782 1.00 10.00 H new ATOM 0 HD1 TYR A 87 12.522 12.552 -4.310 1.00 10.00 H new ATOM 0 HD2 TYR A 87 11.781 9.681 -1.253 1.00 10.00 H new ATOM 0 HE1 TYR A 87 13.892 13.864 -2.753 1.00 10.00 H new ATOM 0 HE2 TYR A 87 13.154 10.992 0.309 1.00 10.00 H new ATOM 0 HH TYR A 87 14.327 14.188 -0.498 1.00 10.00 H new ATOM 1058 N THR A 88 8.945 10.573 -6.370 1.00 10.00 N ATOM 1059 CA THR A 88 8.225 9.879 -7.424 1.00 10.00 C ATOM 1060 C THR A 88 9.010 8.657 -7.882 1.00 10.00 C ATOM 1061 O THR A 88 10.242 8.655 -7.829 1.00 10.00 O ATOM 1062 CB THR A 88 7.981 10.810 -8.625 1.00 10.00 C ATOM 1063 OG1 THR A 88 8.671 12.053 -8.426 1.00 10.00 O ATOM 1064 CG2 THR A 88 6.496 11.074 -8.811 1.00 10.00 C ATOM 0 H THR A 88 9.336 11.473 -6.649 1.00 10.00 H new ATOM 0 HA THR A 88 7.262 9.563 -7.022 1.00 10.00 H new ATOM 0 HB THR A 88 8.361 10.321 -9.522 1.00 10.00 H new ATOM 0 HG1 THR A 88 8.514 12.641 -9.194 1.00 10.00 H new ATOM 0 HG21 THR A 88 6.348 11.734 -9.666 1.00 10.00 H new ATOM 0 HG22 THR A 88 5.978 10.131 -8.987 1.00 10.00 H new ATOM 0 HG23 THR A 88 6.095 11.546 -7.914 1.00 10.00 H new ATOM 1072 N LEU A 89 8.304 7.611 -8.303 1.00 10.00 N ATOM 1073 CA LEU A 89 8.955 6.402 -8.778 1.00 10.00 C ATOM 1074 C LEU A 89 9.868 6.740 -9.954 1.00 10.00 C ATOM 1075 O LEU A 89 9.402 7.084 -11.041 1.00 10.00 O ATOM 1076 CB LEU A 89 7.913 5.357 -9.186 1.00 10.00 C ATOM 1077 CG LEU A 89 7.211 4.606 -8.041 1.00 10.00 C ATOM 1078 CD1 LEU A 89 7.741 5.014 -6.671 1.00 10.00 C ATOM 1079 CD2 LEU A 89 5.708 4.804 -8.116 1.00 10.00 C ATOM 0 H LEU A 89 7.285 7.580 -8.323 1.00 10.00 H new ATOM 0 HA LEU A 89 9.557 5.981 -7.973 1.00 10.00 H new ATOM 0 HB2 LEU A 89 7.151 5.852 -9.788 1.00 10.00 H new ATOM 0 HB3 LEU A 89 8.399 4.623 -9.828 1.00 10.00 H new ATOM 0 HG LEU A 89 7.434 3.546 -8.167 1.00 10.00 H new ATOM 0 HD11 LEU A 89 7.214 4.457 -5.896 1.00 10.00 H new ATOM 0 HD12 LEU A 89 8.807 4.796 -6.614 1.00 10.00 H new ATOM 0 HD13 LEU A 89 7.581 6.082 -6.522 1.00 10.00 H new ATOM 0 HD21 LEU A 89 5.229 4.266 -7.298 1.00 10.00 H new ATOM 0 HD22 LEU A 89 5.476 5.866 -8.036 1.00 10.00 H new ATOM 0 HD23 LEU A 89 5.338 4.423 -9.068 1.00 10.00 H new ATOM 1091 N ILE A 90 11.170 6.667 -9.704 1.00 10.00 N ATOM 1092 CA ILE A 90 12.186 6.982 -10.707 1.00 10.00 C ATOM 1093 C ILE A 90 12.028 6.153 -11.979 1.00 10.00 C ATOM 1094 O ILE A 90 12.242 6.656 -13.081 1.00 10.00 O ATOM 1095 CB ILE A 90 13.608 6.789 -10.137 1.00 10.00 C ATOM 1096 CG1 ILE A 90 13.703 5.473 -9.358 1.00 10.00 C ATOM 1097 CG2 ILE A 90 13.980 7.964 -9.244 1.00 10.00 C ATOM 1098 CD1 ILE A 90 15.079 5.193 -8.797 1.00 10.00 C ATOM 0 H ILE A 90 11.553 6.388 -8.801 1.00 10.00 H new ATOM 0 HA ILE A 90 12.041 8.030 -10.970 1.00 10.00 H new ATOM 0 HB ILE A 90 14.312 6.745 -10.968 1.00 10.00 H new ATOM 0 HG12 ILE A 90 12.984 5.494 -8.539 1.00 10.00 H new ATOM 0 HG13 ILE A 90 13.414 4.652 -10.014 1.00 10.00 H new ATOM 0 HG21 ILE A 90 14.985 7.816 -8.848 1.00 10.00 H new ATOM 0 HG22 ILE A 90 13.951 8.886 -9.825 1.00 10.00 H new ATOM 0 HG23 ILE A 90 13.271 8.032 -8.419 1.00 10.00 H new ATOM 0 HD11 ILE A 90 15.067 4.245 -8.259 1.00 10.00 H new ATOM 0 HD12 ILE A 90 15.800 5.138 -9.612 1.00 10.00 H new ATOM 0 HD13 ILE A 90 15.363 5.994 -8.114 1.00 10.00 H new ATOM 1110 N GLY A 91 11.642 4.895 -11.832 1.00 10.00 N ATOM 1111 CA GLY A 91 11.472 4.042 -12.996 1.00 10.00 C ATOM 1112 C GLY A 91 11.699 2.571 -12.692 1.00 10.00 C ATOM 1113 O GLY A 91 10.745 1.793 -12.673 1.00 10.00 O ATOM 0 H GLY A 91 11.444 4.449 -10.936 1.00 10.00 H new ATOM 0 HA2 GLY A 91 10.465 4.174 -13.393 1.00 10.00 H new ATOM 0 HA3 GLY A 91 12.166 4.358 -13.775 1.00 10.00 H new ATOM 1117 N PRO A 92 12.958 2.163 -12.433 1.00 10.00 N ATOM 1118 CA PRO A 92 13.317 0.761 -12.136 1.00 10.00 C ATOM 1119 C PRO A 92 12.531 0.167 -10.967 1.00 10.00 C ATOM 1120 O PRO A 92 12.484 -1.050 -10.794 1.00 10.00 O ATOM 1121 CB PRO A 92 14.810 0.832 -11.785 1.00 10.00 C ATOM 1122 CG PRO A 92 15.093 2.277 -11.545 1.00 10.00 C ATOM 1123 CD PRO A 92 14.146 3.029 -12.428 1.00 10.00 C ATOM 0 HA PRO A 92 13.087 0.113 -12.982 1.00 10.00 H new ATOM 0 HB2 PRO A 92 15.034 0.236 -10.901 1.00 10.00 H new ATOM 0 HB3 PRO A 92 15.423 0.441 -12.597 1.00 10.00 H new ATOM 0 HG2 PRO A 92 14.941 2.537 -10.497 1.00 10.00 H new ATOM 0 HG3 PRO A 92 16.128 2.518 -11.786 1.00 10.00 H new ATOM 0 HD2 PRO A 92 13.924 4.020 -12.033 1.00 10.00 H new ATOM 0 HD3 PRO A 92 14.550 3.169 -13.431 1.00 10.00 H new ATOM 1131 N VAL A 93 11.917 1.033 -10.170 1.00 10.00 N ATOM 1132 CA VAL A 93 11.125 0.606 -9.023 1.00 10.00 C ATOM 1133 C VAL A 93 9.970 -0.291 -9.462 1.00 10.00 C ATOM 1134 O VAL A 93 9.620 -1.251 -8.776 1.00 10.00 O ATOM 1135 CB VAL A 93 10.557 1.818 -8.254 1.00 10.00 C ATOM 1136 CG1 VAL A 93 9.905 1.380 -6.953 1.00 10.00 C ATOM 1137 CG2 VAL A 93 11.645 2.841 -7.982 1.00 10.00 C ATOM 0 H VAL A 93 11.953 2.044 -10.299 1.00 10.00 H new ATOM 0 HA VAL A 93 11.789 0.046 -8.365 1.00 10.00 H new ATOM 0 HB VAL A 93 9.794 2.283 -8.879 1.00 10.00 H new ATOM 0 HG11 VAL A 93 9.513 2.253 -6.431 1.00 10.00 H new ATOM 0 HG12 VAL A 93 9.089 0.690 -7.169 1.00 10.00 H new ATOM 0 HG13 VAL A 93 10.644 0.883 -6.325 1.00 10.00 H new ATOM 0 HG21 VAL A 93 11.222 3.686 -7.439 1.00 10.00 H new ATOM 0 HG22 VAL A 93 12.433 2.384 -7.384 1.00 10.00 H new ATOM 0 HG23 VAL A 93 12.062 3.189 -8.927 1.00 10.00 H new ATOM 1147 N SER A 94 9.404 0.007 -10.625 1.00 10.00 N ATOM 1148 CA SER A 94 8.279 -0.755 -11.155 1.00 10.00 C ATOM 1149 C SER A 94 8.696 -2.152 -11.629 1.00 10.00 C ATOM 1150 O SER A 94 7.845 -2.986 -11.945 1.00 10.00 O ATOM 1151 CB SER A 94 7.635 0.020 -12.304 1.00 10.00 C ATOM 1152 OG SER A 94 7.884 1.412 -12.173 1.00 10.00 O ATOM 0 H SER A 94 9.708 0.776 -11.223 1.00 10.00 H new ATOM 0 HA SER A 94 7.559 -0.892 -10.348 1.00 10.00 H new ATOM 0 HB2 SER A 94 8.029 -0.337 -13.256 1.00 10.00 H new ATOM 0 HB3 SER A 94 6.560 -0.163 -12.315 1.00 10.00 H new ATOM 0 HG SER A 94 7.465 1.891 -12.919 1.00 10.00 H new ATOM 1158 N ALA A 95 9.998 -2.410 -11.667 1.00 10.00 N ATOM 1159 CA ALA A 95 10.507 -3.707 -12.103 1.00 10.00 C ATOM 1160 C ALA A 95 10.672 -4.662 -10.921 1.00 10.00 C ATOM 1161 O ALA A 95 11.049 -5.821 -11.093 1.00 10.00 O ATOM 1162 CB ALA A 95 11.826 -3.540 -12.846 1.00 10.00 C ATOM 0 H ALA A 95 10.720 -1.740 -11.402 1.00 10.00 H new ATOM 0 HA ALA A 95 9.777 -4.143 -12.785 1.00 10.00 H new ATOM 0 HB1 ALA A 95 12.191 -4.517 -13.164 1.00 10.00 H new ATOM 0 HB2 ALA A 95 11.673 -2.908 -13.721 1.00 10.00 H new ATOM 0 HB3 ALA A 95 12.559 -3.076 -12.186 1.00 10.00 H new ATOM 1168 N ILE A 96 10.380 -4.175 -9.720 1.00 10.00 N ATOM 1169 CA ILE A 96 10.489 -4.986 -8.516 1.00 10.00 C ATOM 1170 C ILE A 96 9.139 -5.619 -8.199 1.00 10.00 C ATOM 1171 O ILE A 96 8.201 -4.935 -7.794 1.00 10.00 O ATOM 1172 CB ILE A 96 10.974 -4.135 -7.322 1.00 10.00 C ATOM 1173 CG1 ILE A 96 12.344 -3.530 -7.634 1.00 10.00 C ATOM 1174 CG2 ILE A 96 11.035 -4.967 -6.048 1.00 10.00 C ATOM 1175 CD1 ILE A 96 12.646 -2.279 -6.843 1.00 10.00 C ATOM 0 H ILE A 96 10.065 -3.219 -9.556 1.00 10.00 H new ATOM 0 HA ILE A 96 11.223 -5.773 -8.691 1.00 10.00 H new ATOM 0 HB ILE A 96 10.259 -3.328 -7.160 1.00 10.00 H new ATOM 0 HG12 ILE A 96 13.115 -4.273 -7.431 1.00 10.00 H new ATOM 0 HG13 ILE A 96 12.396 -3.299 -8.698 1.00 10.00 H new ATOM 0 HG21 ILE A 96 11.379 -4.344 -5.223 1.00 10.00 H new ATOM 0 HG22 ILE A 96 10.043 -5.356 -5.820 1.00 10.00 H new ATOM 0 HG23 ILE A 96 11.727 -5.798 -6.189 1.00 10.00 H new ATOM 0 HD11 ILE A 96 13.633 -1.905 -7.116 1.00 10.00 H new ATOM 0 HD12 ILE A 96 11.897 -1.519 -7.064 1.00 10.00 H new ATOM 0 HD13 ILE A 96 12.627 -2.509 -5.778 1.00 10.00 H new ATOM 1187 N SER A 97 9.033 -6.920 -8.430 1.00 10.00 N ATOM 1188 CA SER A 97 7.788 -7.636 -8.182 1.00 10.00 C ATOM 1189 C SER A 97 8.027 -8.948 -7.432 1.00 10.00 C ATOM 1190 O SER A 97 8.265 -9.996 -8.039 1.00 10.00 O ATOM 1191 CB SER A 97 7.075 -7.915 -9.507 1.00 10.00 C ATOM 1192 OG SER A 97 7.469 -6.986 -10.502 1.00 10.00 O ATOM 0 H SER A 97 9.791 -7.501 -8.788 1.00 10.00 H new ATOM 0 HA SER A 97 7.161 -7.004 -7.553 1.00 10.00 H new ATOM 0 HB2 SER A 97 7.302 -8.928 -9.840 1.00 10.00 H new ATOM 0 HB3 SER A 97 5.996 -7.862 -9.362 1.00 10.00 H new ATOM 0 HG SER A 97 7.451 -7.420 -11.380 1.00 10.00 H new ATOM 1198 N THR A 98 7.964 -8.878 -6.111 1.00 10.00 N ATOM 1199 CA THR A 98 8.157 -10.054 -5.271 1.00 10.00 C ATOM 1200 C THR A 98 7.028 -10.162 -4.253 1.00 10.00 C ATOM 1201 O THR A 98 6.393 -9.163 -3.912 1.00 10.00 O ATOM 1202 CB THR A 98 9.505 -10.013 -4.520 1.00 10.00 C ATOM 1203 OG1 THR A 98 9.700 -11.230 -3.786 1.00 10.00 O ATOM 1204 CG2 THR A 98 9.549 -8.836 -3.567 1.00 10.00 C ATOM 0 H THR A 98 7.780 -8.018 -5.595 1.00 10.00 H new ATOM 0 HA THR A 98 8.157 -10.922 -5.930 1.00 10.00 H new ATOM 0 HB THR A 98 10.302 -9.903 -5.256 1.00 10.00 H new ATOM 0 HG1 THR A 98 10.099 -11.026 -2.915 1.00 10.00 H new ATOM 0 HG21 THR A 98 10.507 -8.824 -3.047 1.00 10.00 H new ATOM 0 HG22 THR A 98 9.429 -7.909 -4.128 1.00 10.00 H new ATOM 0 HG23 THR A 98 8.742 -8.927 -2.839 1.00 10.00 H new ATOM 1212 N THR A 99 6.768 -11.371 -3.781 1.00 10.00 N ATOM 1213 CA THR A 99 5.730 -11.584 -2.795 1.00 10.00 C ATOM 1214 C THR A 99 6.284 -11.394 -1.385 1.00 10.00 C ATOM 1215 O THR A 99 5.533 -11.197 -0.430 1.00 10.00 O ATOM 1216 CB THR A 99 5.128 -12.988 -2.928 1.00 10.00 C ATOM 1217 OG1 THR A 99 6.166 -13.940 -3.192 1.00 10.00 O ATOM 1218 CG2 THR A 99 4.099 -13.033 -4.045 1.00 10.00 C ATOM 0 H THR A 99 7.263 -12.216 -4.067 1.00 10.00 H new ATOM 0 HA THR A 99 4.945 -10.849 -2.973 1.00 10.00 H new ATOM 0 HB THR A 99 4.633 -13.238 -1.990 1.00 10.00 H new ATOM 0 HG1 THR A 99 5.776 -14.835 -3.274 1.00 10.00 H new ATOM 0 HG21 THR A 99 3.687 -14.039 -4.119 1.00 10.00 H new ATOM 0 HG22 THR A 99 3.297 -12.327 -3.829 1.00 10.00 H new ATOM 0 HG23 THR A 99 4.574 -12.765 -4.989 1.00 10.00 H new ATOM 1226 N SER A 100 7.604 -11.454 -1.267 1.00 10.00 N ATOM 1227 CA SER A 100 8.259 -11.279 0.012 1.00 10.00 C ATOM 1228 C SER A 100 8.548 -9.799 0.242 1.00 10.00 C ATOM 1229 O SER A 100 9.417 -9.218 -0.412 1.00 10.00 O ATOM 1230 CB SER A 100 9.551 -12.099 0.052 1.00 10.00 C ATOM 1231 OG SER A 100 9.363 -13.376 -0.542 1.00 10.00 O ATOM 0 H SER A 100 8.239 -11.623 -2.047 1.00 10.00 H new ATOM 0 HA SER A 100 7.604 -11.633 0.808 1.00 10.00 H new ATOM 0 HB2 SER A 100 10.342 -11.563 -0.472 1.00 10.00 H new ATOM 0 HB3 SER A 100 9.878 -12.219 1.085 1.00 10.00 H new ATOM 0 HG SER A 100 10.202 -13.880 -0.506 1.00 10.00 H new ATOM 1237 N VAL A 101 7.810 -9.195 1.163 1.00 10.00 N ATOM 1238 CA VAL A 101 7.965 -7.777 1.468 1.00 10.00 C ATOM 1239 C VAL A 101 9.398 -7.444 1.890 1.00 10.00 C ATOM 1240 O VAL A 101 9.913 -6.366 1.578 1.00 10.00 O ATOM 1241 CB VAL A 101 6.958 -7.326 2.553 1.00 10.00 C ATOM 1242 CG1 VAL A 101 7.253 -7.974 3.898 1.00 10.00 C ATOM 1243 CG2 VAL A 101 6.938 -5.810 2.667 1.00 10.00 C ATOM 0 H VAL A 101 7.094 -9.667 1.715 1.00 10.00 H new ATOM 0 HA VAL A 101 7.751 -7.225 0.553 1.00 10.00 H new ATOM 0 HB VAL A 101 5.967 -7.660 2.246 1.00 10.00 H new ATOM 0 HG11 VAL A 101 6.525 -7.633 4.634 1.00 10.00 H new ATOM 0 HG12 VAL A 101 7.190 -9.058 3.801 1.00 10.00 H new ATOM 0 HG13 VAL A 101 8.255 -7.696 4.224 1.00 10.00 H new ATOM 0 HG21 VAL A 101 6.224 -5.512 3.435 1.00 10.00 H new ATOM 0 HG22 VAL A 101 7.932 -5.452 2.937 1.00 10.00 H new ATOM 0 HG23 VAL A 101 6.644 -5.377 1.711 1.00 10.00 H new ATOM 1253 N GLN A 102 10.049 -8.382 2.564 1.00 10.00 N ATOM 1254 CA GLN A 102 11.416 -8.185 3.012 1.00 10.00 C ATOM 1255 C GLN A 102 12.354 -8.127 1.811 1.00 10.00 C ATOM 1256 O GLN A 102 13.281 -7.316 1.772 1.00 10.00 O ATOM 1257 CB GLN A 102 11.821 -9.304 3.967 1.00 10.00 C ATOM 1258 CG GLN A 102 11.064 -9.269 5.287 1.00 10.00 C ATOM 1259 CD GLN A 102 11.139 -10.580 6.042 1.00 10.00 C ATOM 1260 OE1 GLN A 102 12.128 -11.310 5.955 1.00 10.00 O ATOM 1261 NE2 GLN A 102 10.094 -10.886 6.789 1.00 10.00 N ATOM 0 H GLN A 102 9.650 -9.287 2.812 1.00 10.00 H new ATOM 0 HA GLN A 102 11.485 -7.238 3.548 1.00 10.00 H new ATOM 0 HB2 GLN A 102 11.650 -10.266 3.483 1.00 10.00 H new ATOM 0 HB3 GLN A 102 12.890 -9.233 4.167 1.00 10.00 H new ATOM 0 HG2 GLN A 102 11.468 -8.472 5.911 1.00 10.00 H new ATOM 0 HG3 GLN A 102 10.019 -9.025 5.095 1.00 10.00 H new ATOM 0 HE21 GLN A 102 9.295 -10.253 6.833 1.00 10.00 H new ATOM 0 HE22 GLN A 102 10.085 -11.755 7.322 1.00 10.00 H new ATOM 1270 N GLN A 103 12.099 -8.978 0.823 1.00 10.00 N ATOM 1271 CA GLN A 103 12.909 -8.999 -0.384 1.00 10.00 C ATOM 1272 C GLN A 103 12.709 -7.701 -1.150 1.00 10.00 C ATOM 1273 O GLN A 103 13.661 -7.107 -1.650 1.00 10.00 O ATOM 1274 CB GLN A 103 12.539 -10.189 -1.265 1.00 10.00 C ATOM 1275 CG GLN A 103 13.283 -10.203 -2.587 1.00 10.00 C ATOM 1276 CD GLN A 103 12.843 -11.328 -3.499 1.00 10.00 C ATOM 1277 OE1 GLN A 103 12.362 -12.365 -3.042 1.00 10.00 O ATOM 1278 NE2 GLN A 103 13.002 -11.131 -4.796 1.00 10.00 N ATOM 0 H GLN A 103 11.340 -9.659 0.836 1.00 10.00 H new ATOM 0 HA GLN A 103 13.957 -9.099 -0.102 1.00 10.00 H new ATOM 0 HB2 GLN A 103 12.750 -11.112 -0.726 1.00 10.00 H new ATOM 0 HB3 GLN A 103 11.466 -10.171 -1.458 1.00 10.00 H new ATOM 0 HG2 GLN A 103 13.130 -9.250 -3.094 1.00 10.00 H new ATOM 0 HG3 GLN A 103 14.352 -10.294 -2.395 1.00 10.00 H new ATOM 0 HE21 GLN A 103 13.405 -10.257 -5.133 1.00 10.00 H new ATOM 0 HE22 GLN A 103 12.722 -11.853 -5.460 1.00 10.00 H new ATOM 1287 N ALA A 104 11.453 -7.275 -1.229 1.00 10.00 N ATOM 1288 CA ALA A 104 11.093 -6.036 -1.907 1.00 10.00 C ATOM 1289 C ALA A 104 11.898 -4.874 -1.347 1.00 10.00 C ATOM 1290 O ALA A 104 12.530 -4.131 -2.092 1.00 10.00 O ATOM 1291 CB ALA A 104 9.603 -5.765 -1.759 1.00 10.00 C ATOM 0 H ALA A 104 10.660 -7.776 -0.827 1.00 10.00 H new ATOM 0 HA ALA A 104 11.324 -6.141 -2.967 1.00 10.00 H new ATOM 0 HB1 ALA A 104 9.350 -4.836 -2.271 1.00 10.00 H new ATOM 0 HB2 ALA A 104 9.038 -6.587 -2.198 1.00 10.00 H new ATOM 0 HB3 ALA A 104 9.352 -5.677 -0.702 1.00 10.00 H new ATOM 1297 N ALA A 105 11.897 -4.748 -0.023 1.00 10.00 N ATOM 1298 CA ALA A 105 12.632 -3.684 0.650 1.00 10.00 C ATOM 1299 C ALA A 105 14.128 -3.792 0.371 1.00 10.00 C ATOM 1300 O ALA A 105 14.817 -2.784 0.217 1.00 10.00 O ATOM 1301 CB ALA A 105 12.367 -3.734 2.144 1.00 10.00 C ATOM 0 H ALA A 105 11.393 -5.373 0.606 1.00 10.00 H new ATOM 0 HA ALA A 105 12.285 -2.727 0.260 1.00 10.00 H new ATOM 0 HB1 ALA A 105 12.920 -2.936 2.639 1.00 10.00 H new ATOM 0 HB2 ALA A 105 11.301 -3.605 2.329 1.00 10.00 H new ATOM 0 HB3 ALA A 105 12.690 -4.697 2.539 1.00 10.00 H new ATOM 1307 N THR A 106 14.615 -5.024 0.283 1.00 10.00 N ATOM 1308 CA THR A 106 16.022 -5.281 0.017 1.00 10.00 C ATOM 1309 C THR A 106 16.407 -4.775 -1.372 1.00 10.00 C ATOM 1310 O THR A 106 17.432 -4.113 -1.549 1.00 10.00 O ATOM 1311 CB THR A 106 16.332 -6.790 0.132 1.00 10.00 C ATOM 1312 OG1 THR A 106 15.913 -7.279 1.417 1.00 10.00 O ATOM 1313 CG2 THR A 106 17.815 -7.065 -0.054 1.00 10.00 C ATOM 0 H THR A 106 14.050 -5.866 0.393 1.00 10.00 H new ATOM 0 HA THR A 106 16.610 -4.745 0.762 1.00 10.00 H new ATOM 0 HB THR A 106 15.785 -7.306 -0.657 1.00 10.00 H new ATOM 0 HG1 THR A 106 14.944 -7.427 1.411 1.00 10.00 H new ATOM 0 HG21 THR A 106 18.000 -8.136 0.033 1.00 10.00 H new ATOM 0 HG22 THR A 106 18.128 -6.721 -1.040 1.00 10.00 H new ATOM 0 HG23 THR A 106 18.382 -6.536 0.712 1.00 10.00 H new ATOM 1321 N GLU A 107 15.563 -5.072 -2.351 1.00 10.00 N ATOM 1322 CA GLU A 107 15.803 -4.649 -3.722 1.00 10.00 C ATOM 1323 C GLU A 107 15.585 -3.144 -3.866 1.00 10.00 C ATOM 1324 O GLU A 107 16.326 -2.464 -4.579 1.00 10.00 O ATOM 1325 CB GLU A 107 14.893 -5.421 -4.676 1.00 10.00 C ATOM 1326 CG GLU A 107 15.201 -6.913 -4.719 1.00 10.00 C ATOM 1327 CD GLU A 107 14.517 -7.630 -5.865 1.00 10.00 C ATOM 1328 OE1 GLU A 107 14.313 -7.010 -6.930 1.00 10.00 O ATOM 1329 OE2 GLU A 107 14.183 -8.826 -5.708 1.00 10.00 O ATOM 0 H GLU A 107 14.704 -5.606 -2.219 1.00 10.00 H new ATOM 0 HA GLU A 107 16.840 -4.866 -3.979 1.00 10.00 H new ATOM 0 HB2 GLU A 107 13.855 -5.279 -4.374 1.00 10.00 H new ATOM 0 HB3 GLU A 107 14.993 -5.006 -5.679 1.00 10.00 H new ATOM 0 HG2 GLU A 107 16.279 -7.053 -4.803 1.00 10.00 H new ATOM 0 HG3 GLU A 107 14.893 -7.369 -3.778 1.00 10.00 H new ATOM 1336 N LEU A 108 14.578 -2.628 -3.170 1.00 10.00 N ATOM 1337 CA LEU A 108 14.269 -1.204 -3.205 1.00 10.00 C ATOM 1338 C LEU A 108 15.454 -0.384 -2.708 1.00 10.00 C ATOM 1339 O LEU A 108 15.896 0.544 -3.380 1.00 10.00 O ATOM 1340 CB LEU A 108 13.041 -0.893 -2.344 1.00 10.00 C ATOM 1341 CG LEU A 108 11.691 -1.309 -2.926 1.00 10.00 C ATOM 1342 CD1 LEU A 108 10.603 -1.173 -1.875 1.00 10.00 C ATOM 1343 CD2 LEU A 108 11.352 -0.467 -4.143 1.00 10.00 C ATOM 0 H LEU A 108 13.960 -3.177 -2.573 1.00 10.00 H new ATOM 0 HA LEU A 108 14.056 -0.936 -4.240 1.00 10.00 H new ATOM 0 HB2 LEU A 108 13.165 -1.384 -1.379 1.00 10.00 H new ATOM 0 HB3 LEU A 108 13.017 0.180 -2.155 1.00 10.00 H new ATOM 0 HG LEU A 108 11.755 -2.352 -3.235 1.00 10.00 H new ATOM 0 HD11 LEU A 108 9.646 -1.472 -2.302 1.00 10.00 H new ATOM 0 HD12 LEU A 108 10.837 -1.813 -1.024 1.00 10.00 H new ATOM 0 HD13 LEU A 108 10.544 -0.136 -1.544 1.00 10.00 H new ATOM 0 HD21 LEU A 108 10.387 -0.778 -4.543 1.00 10.00 H new ATOM 0 HD22 LEU A 108 11.304 0.584 -3.857 1.00 10.00 H new ATOM 0 HD23 LEU A 108 12.121 -0.601 -4.904 1.00 10.00 H new ATOM 1355 N SER A 109 15.978 -0.752 -1.541 1.00 10.00 N ATOM 1356 CA SER A 109 17.107 -0.051 -0.938 1.00 10.00 C ATOM 1357 C SER A 109 18.331 -0.042 -1.852 1.00 10.00 C ATOM 1358 O SER A 109 19.137 0.886 -1.798 1.00 10.00 O ATOM 1359 CB SER A 109 17.464 -0.687 0.404 1.00 10.00 C ATOM 1360 OG SER A 109 16.423 -0.492 1.341 1.00 10.00 O ATOM 0 H SER A 109 15.634 -1.539 -0.991 1.00 10.00 H new ATOM 0 HA SER A 109 16.803 0.984 -0.784 1.00 10.00 H new ATOM 0 HB2 SER A 109 17.645 -1.754 0.270 1.00 10.00 H new ATOM 0 HB3 SER A 109 18.388 -0.252 0.784 1.00 10.00 H new ATOM 0 HG SER A 109 15.739 -1.183 1.218 1.00 10.00 H new ATOM 1366 N ALA A 110 18.461 -1.065 -2.691 1.00 10.00 N ATOM 1367 CA ALA A 110 19.589 -1.158 -3.609 1.00 10.00 C ATOM 1368 C ALA A 110 19.513 -0.058 -4.664 1.00 10.00 C ATOM 1369 O ALA A 110 20.529 0.511 -5.067 1.00 10.00 O ATOM 1370 CB ALA A 110 19.626 -2.528 -4.272 1.00 10.00 C ATOM 0 H ALA A 110 17.800 -1.839 -2.754 1.00 10.00 H new ATOM 0 HA ALA A 110 20.508 -1.026 -3.038 1.00 10.00 H new ATOM 0 HB1 ALA A 110 20.475 -2.579 -4.954 1.00 10.00 H new ATOM 0 HB2 ALA A 110 19.727 -3.299 -3.508 1.00 10.00 H new ATOM 0 HB3 ALA A 110 18.703 -2.688 -4.829 1.00 10.00 H new ATOM 1376 N VAL A 111 18.299 0.243 -5.098 1.00 10.00 N ATOM 1377 CA VAL A 111 18.071 1.273 -6.104 1.00 10.00 C ATOM 1378 C VAL A 111 17.959 2.644 -5.443 1.00 10.00 C ATOM 1379 O VAL A 111 18.501 3.640 -5.931 1.00 10.00 O ATOM 1380 CB VAL A 111 16.768 1.004 -6.893 1.00 10.00 C ATOM 1381 CG1 VAL A 111 16.683 1.892 -8.123 1.00 10.00 C ATOM 1382 CG2 VAL A 111 16.654 -0.461 -7.279 1.00 10.00 C ATOM 0 H VAL A 111 17.449 -0.214 -4.767 1.00 10.00 H new ATOM 0 HA VAL A 111 18.919 1.253 -6.789 1.00 10.00 H new ATOM 0 HB VAL A 111 15.929 1.247 -6.240 1.00 10.00 H new ATOM 0 HG11 VAL A 111 15.758 1.683 -8.660 1.00 10.00 H new ATOM 0 HG12 VAL A 111 16.697 2.938 -7.818 1.00 10.00 H new ATOM 0 HG13 VAL A 111 17.533 1.693 -8.775 1.00 10.00 H new ATOM 0 HG21 VAL A 111 15.729 -0.621 -7.832 1.00 10.00 H new ATOM 0 HG22 VAL A 111 17.503 -0.740 -7.903 1.00 10.00 H new ATOM 0 HG23 VAL A 111 16.649 -1.075 -6.379 1.00 10.00 H new ATOM 1392 N TYR A 112 17.267 2.663 -4.316 1.00 10.00 N ATOM 1393 CA TYR A 112 17.014 3.879 -3.548 1.00 10.00 C ATOM 1394 C TYR A 112 18.277 4.477 -2.942 1.00 10.00 C ATOM 1395 O TYR A 112 18.335 5.683 -2.696 1.00 10.00 O ATOM 1396 CB TYR A 112 16.008 3.579 -2.440 1.00 10.00 C ATOM 1397 CG TYR A 112 14.588 3.390 -2.922 1.00 10.00 C ATOM 1398 CD1 TYR A 112 14.247 3.582 -4.256 1.00 10.00 C ATOM 1399 CD2 TYR A 112 13.586 3.017 -2.039 1.00 10.00 C ATOM 1400 CE1 TYR A 112 12.952 3.410 -4.691 1.00 10.00 C ATOM 1401 CE2 TYR A 112 12.287 2.843 -2.468 1.00 10.00 C ATOM 1402 CZ TYR A 112 11.975 3.041 -3.794 1.00 10.00 C ATOM 1403 OH TYR A 112 10.680 2.875 -4.225 1.00 10.00 O ATOM 0 H TYR A 112 16.858 1.826 -3.900 1.00 10.00 H new ATOM 0 HA TYR A 112 16.615 4.618 -4.242 1.00 10.00 H new ATOM 0 HB2 TYR A 112 16.323 2.678 -1.914 1.00 10.00 H new ATOM 0 HB3 TYR A 112 16.028 4.394 -1.717 1.00 10.00 H new ATOM 0 HD1 TYR A 112 15.011 3.871 -4.963 1.00 10.00 H new ATOM 0 HD2 TYR A 112 13.827 2.860 -0.998 1.00 10.00 H new ATOM 0 HE1 TYR A 112 12.704 3.564 -5.731 1.00 10.00 H new ATOM 0 HE2 TYR A 112 11.518 2.553 -1.767 1.00 10.00 H new ATOM 0 HH TYR A 112 10.350 3.717 -4.602 1.00 10.00 H new ATOM 1413 N ALA A 113 19.278 3.645 -2.684 1.00 10.00 N ATOM 1414 CA ALA A 113 20.532 4.118 -2.096 1.00 10.00 C ATOM 1415 C ALA A 113 21.177 5.213 -2.942 1.00 10.00 C ATOM 1416 O ALA A 113 21.827 6.109 -2.413 1.00 10.00 O ATOM 1417 CB ALA A 113 21.503 2.967 -1.899 1.00 10.00 C ATOM 0 H ALA A 113 19.250 2.643 -2.870 1.00 10.00 H new ATOM 0 HA ALA A 113 20.291 4.546 -1.123 1.00 10.00 H new ATOM 0 HB1 ALA A 113 22.428 3.342 -1.461 1.00 10.00 H new ATOM 0 HB2 ALA A 113 21.060 2.227 -1.233 1.00 10.00 H new ATOM 0 HB3 ALA A 113 21.719 2.505 -2.862 1.00 10.00 H new ATOM 1423 N ALA A 114 20.972 5.150 -4.253 1.00 10.00 N ATOM 1424 CA ALA A 114 21.537 6.140 -5.165 1.00 10.00 C ATOM 1425 C ALA A 114 20.789 7.468 -5.072 1.00 10.00 C ATOM 1426 O ALA A 114 21.269 8.499 -5.549 1.00 10.00 O ATOM 1427 CB ALA A 114 21.510 5.614 -6.592 1.00 10.00 C ATOM 0 H ALA A 114 20.419 4.424 -4.709 1.00 10.00 H new ATOM 0 HA ALA A 114 22.572 6.318 -4.873 1.00 10.00 H new ATOM 0 HB1 ALA A 114 21.934 6.361 -7.263 1.00 10.00 H new ATOM 0 HB2 ALA A 114 22.096 4.697 -6.653 1.00 10.00 H new ATOM 0 HB3 ALA A 114 20.481 5.406 -6.884 1.00 10.00 H new ATOM 1433 N GLN A 115 19.618 7.439 -4.451 1.00 10.00 N ATOM 1434 CA GLN A 115 18.801 8.634 -4.301 1.00 10.00 C ATOM 1435 C GLN A 115 18.808 9.127 -2.854 1.00 10.00 C ATOM 1436 O GLN A 115 18.337 10.224 -2.561 1.00 10.00 O ATOM 1437 CB GLN A 115 17.368 8.357 -4.753 1.00 10.00 C ATOM 1438 CG GLN A 115 17.255 8.032 -6.235 1.00 10.00 C ATOM 1439 CD GLN A 115 17.776 9.150 -7.118 1.00 10.00 C ATOM 1440 OE1 GLN A 115 17.694 10.327 -6.767 1.00 10.00 O ATOM 1441 NE2 GLN A 115 18.310 8.796 -8.276 1.00 10.00 N ATOM 0 H GLN A 115 19.212 6.598 -4.042 1.00 10.00 H new ATOM 0 HA GLN A 115 19.228 9.415 -4.930 1.00 10.00 H new ATOM 0 HB2 GLN A 115 16.967 7.525 -4.174 1.00 10.00 H new ATOM 0 HB3 GLN A 115 16.750 9.227 -4.531 1.00 10.00 H new ATOM 0 HG2 GLN A 115 17.810 7.118 -6.446 1.00 10.00 H new ATOM 0 HG3 GLN A 115 16.212 7.835 -6.482 1.00 10.00 H new ATOM 0 HE21 GLN A 115 18.361 7.810 -8.534 1.00 10.00 H new ATOM 0 HE22 GLN A 115 18.670 9.509 -8.911 1.00 10.00 H new ATOM 1450 N GLY A 116 19.341 8.308 -1.955 1.00 10.00 N ATOM 1451 CA GLY A 116 19.407 8.687 -0.558 1.00 10.00 C ATOM 1452 C GLY A 116 18.244 8.158 0.259 1.00 10.00 C ATOM 1453 O GLY A 116 17.826 8.787 1.233 1.00 10.00 O ATOM 0 H GLY A 116 19.728 7.389 -2.169 1.00 10.00 H new ATOM 0 HA2 GLY A 116 20.340 8.318 -0.132 1.00 10.00 H new ATOM 0 HA3 GLY A 116 19.430 9.774 -0.484 1.00 10.00 H new ATOM 1457 N VAL A 117 17.728 6.993 -0.117 1.00 10.00 N ATOM 1458 CA VAL A 117 16.603 6.391 0.589 1.00 10.00 C ATOM 1459 C VAL A 117 16.883 4.921 0.915 1.00 10.00 C ATOM 1460 O VAL A 117 17.521 4.212 0.137 1.00 10.00 O ATOM 1461 CB VAL A 117 15.301 6.499 -0.250 1.00 10.00 C ATOM 1462 CG1 VAL A 117 14.153 5.737 0.401 1.00 10.00 C ATOM 1463 CG2 VAL A 117 14.913 7.955 -0.461 1.00 10.00 C ATOM 0 H VAL A 117 18.071 6.447 -0.907 1.00 10.00 H new ATOM 0 HA VAL A 117 16.470 6.940 1.521 1.00 10.00 H new ATOM 0 HB VAL A 117 15.500 6.045 -1.221 1.00 10.00 H new ATOM 0 HG11 VAL A 117 13.258 5.834 -0.213 1.00 10.00 H new ATOM 0 HG12 VAL A 117 14.420 4.684 0.490 1.00 10.00 H new ATOM 0 HG13 VAL A 117 13.960 6.147 1.392 1.00 10.00 H new ATOM 0 HG21 VAL A 117 13.998 8.006 -1.051 1.00 10.00 H new ATOM 0 HG22 VAL A 117 14.748 8.431 0.505 1.00 10.00 H new ATOM 0 HG23 VAL A 117 15.714 8.472 -0.989 1.00 10.00 H new ATOM 1473 N SER A 118 16.439 4.483 2.084 1.00 10.00 N ATOM 1474 CA SER A 118 16.609 3.103 2.504 1.00 10.00 C ATOM 1475 C SER A 118 15.302 2.598 3.106 1.00 10.00 C ATOM 1476 O SER A 118 14.637 3.321 3.852 1.00 10.00 O ATOM 1477 CB SER A 118 17.743 2.981 3.525 1.00 10.00 C ATOM 1478 OG SER A 118 18.419 1.739 3.390 1.00 10.00 O ATOM 0 H SER A 118 15.954 5.071 2.763 1.00 10.00 H new ATOM 0 HA SER A 118 16.871 2.497 1.636 1.00 10.00 H new ATOM 0 HB2 SER A 118 18.449 3.800 3.389 1.00 10.00 H new ATOM 0 HB3 SER A 118 17.340 3.072 4.534 1.00 10.00 H new ATOM 0 HG SER A 118 19.140 1.685 4.052 1.00 10.00 H new ATOM 1484 N VAL A 119 14.927 1.369 2.775 1.00 10.00 N ATOM 1485 CA VAL A 119 13.691 0.787 3.280 1.00 10.00 C ATOM 1486 C VAL A 119 13.931 -0.608 3.847 1.00 10.00 C ATOM 1487 O VAL A 119 14.759 -1.367 3.342 1.00 10.00 O ATOM 1488 CB VAL A 119 12.605 0.700 2.184 1.00 10.00 C ATOM 1489 CG1 VAL A 119 12.081 2.081 1.829 1.00 10.00 C ATOM 1490 CG2 VAL A 119 13.139 0.009 0.942 1.00 10.00 C ATOM 0 H VAL A 119 15.461 0.756 2.159 1.00 10.00 H new ATOM 0 HA VAL A 119 13.340 1.449 4.072 1.00 10.00 H new ATOM 0 HB VAL A 119 11.781 0.107 2.582 1.00 10.00 H new ATOM 0 HG11 VAL A 119 11.318 1.993 1.056 1.00 10.00 H new ATOM 0 HG12 VAL A 119 11.648 2.545 2.715 1.00 10.00 H new ATOM 0 HG13 VAL A 119 12.901 2.698 1.461 1.00 10.00 H new ATOM 0 HG21 VAL A 119 12.355 -0.039 0.187 1.00 10.00 H new ATOM 0 HG22 VAL A 119 13.987 0.570 0.550 1.00 10.00 H new ATOM 0 HG23 VAL A 119 13.459 -1.001 1.197 1.00 10.00 H new ATOM 1500 N SER A 120 13.221 -0.933 4.913 1.00 10.00 N ATOM 1501 CA SER A 120 13.339 -2.236 5.548 1.00 10.00 C ATOM 1502 C SER A 120 12.036 -2.590 6.247 1.00 10.00 C ATOM 1503 O SER A 120 11.275 -1.705 6.633 1.00 10.00 O ATOM 1504 CB SER A 120 14.493 -2.233 6.553 1.00 10.00 C ATOM 1505 OG SER A 120 15.700 -1.804 5.942 1.00 10.00 O ATOM 0 H SER A 120 12.551 -0.308 5.361 1.00 10.00 H new ATOM 0 HA SER A 120 13.546 -2.984 4.783 1.00 10.00 H new ATOM 0 HB2 SER A 120 14.251 -1.576 7.388 1.00 10.00 H new ATOM 0 HB3 SER A 120 14.625 -3.234 6.963 1.00 10.00 H new ATOM 0 HG SER A 120 16.422 -1.809 6.605 1.00 10.00 H new ATOM 1511 N VAL A 121 11.771 -3.876 6.392 1.00 10.00 N ATOM 1512 CA VAL A 121 10.559 -4.333 7.051 1.00 10.00 C ATOM 1513 C VAL A 121 10.909 -4.867 8.429 1.00 10.00 C ATOM 1514 O VAL A 121 11.682 -5.817 8.558 1.00 10.00 O ATOM 1515 CB VAL A 121 9.847 -5.437 6.247 1.00 10.00 C ATOM 1516 CG1 VAL A 121 8.432 -5.648 6.760 1.00 10.00 C ATOM 1517 CG2 VAL A 121 9.856 -5.117 4.760 1.00 10.00 C ATOM 0 H VAL A 121 12.380 -4.625 6.062 1.00 10.00 H new ATOM 0 HA VAL A 121 9.880 -3.483 7.128 1.00 10.00 H new ATOM 0 HB VAL A 121 10.394 -6.369 6.387 1.00 10.00 H new ATOM 0 HG11 VAL A 121 7.947 -6.432 6.178 1.00 10.00 H new ATOM 0 HG12 VAL A 121 8.465 -5.943 7.809 1.00 10.00 H new ATOM 0 HG13 VAL A 121 7.867 -4.721 6.661 1.00 10.00 H new ATOM 0 HG21 VAL A 121 9.347 -5.911 4.214 1.00 10.00 H new ATOM 0 HG22 VAL A 121 9.342 -4.172 4.588 1.00 10.00 H new ATOM 0 HG23 VAL A 121 10.886 -5.038 4.411 1.00 10.00 H new ATOM 1527 N SER A 122 10.369 -4.242 9.459 1.00 10.00 N ATOM 1528 CA SER A 122 10.644 -4.659 10.819 1.00 10.00 C ATOM 1529 C SER A 122 9.388 -4.582 11.680 1.00 10.00 C ATOM 1530 O SER A 122 8.802 -3.510 11.841 1.00 10.00 O ATOM 1531 CB SER A 122 11.760 -3.793 11.407 1.00 10.00 C ATOM 1532 OG SER A 122 12.963 -3.954 10.669 1.00 10.00 O ATOM 0 H SER A 122 9.738 -3.445 9.379 1.00 10.00 H new ATOM 0 HA SER A 122 10.971 -5.699 10.807 1.00 10.00 H new ATOM 0 HB2 SER A 122 11.458 -2.746 11.396 1.00 10.00 H new ATOM 0 HB3 SER A 122 11.928 -4.065 12.449 1.00 10.00 H new ATOM 0 HG SER A 122 13.664 -3.391 11.059 1.00 10.00 H new ATOM 1538 N ALA A 123 8.974 -5.737 12.199 1.00 10.00 N ATOM 1539 CA ALA A 123 7.796 -5.846 13.059 1.00 10.00 C ATOM 1540 C ALA A 123 6.521 -5.403 12.343 1.00 10.00 C ATOM 1541 O ALA A 123 5.762 -4.578 12.854 1.00 10.00 O ATOM 1542 CB ALA A 123 7.997 -5.052 14.344 1.00 10.00 C ATOM 0 H ALA A 123 9.447 -6.626 12.035 1.00 10.00 H new ATOM 0 HA ALA A 123 7.674 -6.899 13.313 1.00 10.00 H new ATOM 0 HB1 ALA A 123 7.111 -5.145 14.971 1.00 10.00 H new ATOM 0 HB2 ALA A 123 8.863 -5.440 14.880 1.00 10.00 H new ATOM 0 HB3 ALA A 123 8.161 -4.002 14.101 1.00 10.00 H new ATOM 1548 N ASN A 124 6.301 -5.959 11.153 1.00 10.00 N ATOM 1549 CA ASN A 124 5.112 -5.655 10.347 1.00 10.00 C ATOM 1550 C ASN A 124 5.021 -4.162 10.035 1.00 10.00 C ATOM 1551 O ASN A 124 3.931 -3.615 9.848 1.00 10.00 O ATOM 1552 CB ASN A 124 3.841 -6.111 11.079 1.00 10.00 C ATOM 1553 CG ASN A 124 2.753 -6.579 10.130 1.00 10.00 C ATOM 1554 OD1 ASN A 124 3.029 -7.218 9.114 1.00 10.00 O ATOM 1555 ND2 ASN A 124 1.508 -6.260 10.447 1.00 10.00 N ATOM 0 H ASN A 124 6.936 -6.629 10.719 1.00 10.00 H new ATOM 0 HA ASN A 124 5.201 -6.197 9.406 1.00 10.00 H new ATOM 0 HB2 ASN A 124 4.092 -6.921 11.764 1.00 10.00 H new ATOM 0 HB3 ASN A 124 3.460 -5.288 11.684 1.00 10.00 H new ATOM 0 HD21 ASN A 124 0.739 -6.545 9.841 1.00 10.00 H new ATOM 0 HD22 ASN A 124 1.318 -5.730 11.297 1.00 10.00 H new ATOM 1562 N LYS A 125 6.165 -3.504 9.982 1.00 10.00 N ATOM 1563 CA LYS A 125 6.213 -2.086 9.698 1.00 10.00 C ATOM 1564 C LYS A 125 7.325 -1.784 8.705 1.00 10.00 C ATOM 1565 O LYS A 125 8.426 -2.321 8.819 1.00 10.00 O ATOM 1566 CB LYS A 125 6.446 -1.301 10.992 1.00 10.00 C ATOM 1567 CG LYS A 125 6.219 0.193 10.847 1.00 10.00 C ATOM 1568 CD LYS A 125 6.359 0.918 12.176 1.00 10.00 C ATOM 1569 CE LYS A 125 5.740 2.310 12.118 1.00 10.00 C ATOM 1570 NZ LYS A 125 5.886 3.042 13.405 1.00 10.00 N ATOM 0 H LYS A 125 7.077 -3.935 10.133 1.00 10.00 H new ATOM 0 HA LYS A 125 5.260 -1.785 9.263 1.00 10.00 H new ATOM 0 HB2 LYS A 125 5.782 -1.687 11.766 1.00 10.00 H new ATOM 0 HB3 LYS A 125 7.467 -1.473 11.333 1.00 10.00 H new ATOM 0 HG2 LYS A 125 6.934 0.602 10.133 1.00 10.00 H new ATOM 0 HG3 LYS A 125 5.224 0.371 10.439 1.00 10.00 H new ATOM 0 HD2 LYS A 125 5.877 0.336 12.962 1.00 10.00 H new ATOM 0 HD3 LYS A 125 7.414 0.998 12.439 1.00 10.00 H new ATOM 0 HE2 LYS A 125 6.212 2.883 11.320 1.00 10.00 H new ATOM 0 HE3 LYS A 125 4.683 2.226 11.867 1.00 10.00 H new ATOM 0 HZ1 LYS A 125 5.451 3.983 13.320 1.00 10.00 H new ATOM 0 HZ2 LYS A 125 5.414 2.509 14.163 1.00 10.00 H new ATOM 0 HZ3 LYS A 125 6.895 3.146 13.633 1.00 10.00 H new ATOM 1584 N LEU A 126 7.028 -0.951 7.720 1.00 10.00 N ATOM 1585 CA LEU A 126 8.013 -0.565 6.720 1.00 10.00 C ATOM 1586 C LEU A 126 8.762 0.658 7.214 1.00 10.00 C ATOM 1587 O LEU A 126 8.155 1.688 7.496 1.00 10.00 O ATOM 1588 CB LEU A 126 7.337 -0.258 5.373 1.00 10.00 C ATOM 1589 CG LEU A 126 6.599 -1.430 4.709 1.00 10.00 C ATOM 1590 CD1 LEU A 126 7.426 -2.702 4.780 1.00 10.00 C ATOM 1591 CD2 LEU A 126 5.226 -1.625 5.336 1.00 10.00 C ATOM 0 H LEU A 126 6.109 -0.527 7.591 1.00 10.00 H new ATOM 0 HA LEU A 126 8.707 -1.391 6.567 1.00 10.00 H new ATOM 0 HB2 LEU A 126 6.627 0.555 5.522 1.00 10.00 H new ATOM 0 HB3 LEU A 126 8.097 0.106 4.682 1.00 10.00 H new ATOM 0 HG LEU A 126 6.454 -1.191 3.656 1.00 10.00 H new ATOM 0 HD11 LEU A 126 6.882 -3.517 4.303 1.00 10.00 H new ATOM 0 HD12 LEU A 126 8.374 -2.549 4.265 1.00 10.00 H new ATOM 0 HD13 LEU A 126 7.616 -2.954 5.823 1.00 10.00 H new ATOM 0 HD21 LEU A 126 4.720 -2.460 4.851 1.00 10.00 H new ATOM 0 HD22 LEU A 126 5.338 -1.837 6.399 1.00 10.00 H new ATOM 0 HD23 LEU A 126 4.635 -0.718 5.207 1.00 10.00 H new ATOM 1603 N LEU A 127 10.070 0.544 7.327 1.00 10.00 N ATOM 1604 CA LEU A 127 10.888 1.645 7.800 1.00 10.00 C ATOM 1605 C LEU A 127 11.583 2.324 6.638 1.00 10.00 C ATOM 1606 O LEU A 127 12.406 1.717 5.949 1.00 10.00 O ATOM 1607 CB LEU A 127 11.938 1.161 8.803 1.00 10.00 C ATOM 1608 CG LEU A 127 11.504 1.106 10.270 1.00 10.00 C ATOM 1609 CD1 LEU A 127 11.199 2.497 10.794 1.00 10.00 C ATOM 1610 CD2 LEU A 127 10.305 0.190 10.451 1.00 10.00 C ATOM 0 H LEU A 127 10.591 -0.302 7.097 1.00 10.00 H new ATOM 0 HA LEU A 127 10.228 2.356 8.297 1.00 10.00 H new ATOM 0 HB2 LEU A 127 12.261 0.164 8.505 1.00 10.00 H new ATOM 0 HB3 LEU A 127 12.808 1.813 8.728 1.00 10.00 H new ATOM 0 HG LEU A 127 12.332 0.696 10.849 1.00 10.00 H new ATOM 0 HD11 LEU A 127 10.893 2.433 11.838 1.00 10.00 H new ATOM 0 HD12 LEU A 127 12.090 3.119 10.715 1.00 10.00 H new ATOM 0 HD13 LEU A 127 10.394 2.939 10.206 1.00 10.00 H new ATOM 0 HD21 LEU A 127 10.018 0.170 11.502 1.00 10.00 H new ATOM 0 HD22 LEU A 127 9.471 0.560 9.854 1.00 10.00 H new ATOM 0 HD23 LEU A 127 10.565 -0.818 10.126 1.00 10.00 H new ATOM 1622 N VAL A 128 11.239 3.574 6.415 1.00 10.00 N ATOM 1623 CA VAL A 128 11.842 4.348 5.350 1.00 10.00 C ATOM 1624 C VAL A 128 12.690 5.440 5.970 1.00 10.00 C ATOM 1625 O VAL A 128 12.168 6.317 6.664 1.00 10.00 O ATOM 1626 CB VAL A 128 10.778 4.995 4.441 1.00 10.00 C ATOM 1627 CG1 VAL A 128 11.379 5.382 3.104 1.00 10.00 C ATOM 1628 CG2 VAL A 128 9.585 4.071 4.253 1.00 10.00 C ATOM 0 H VAL A 128 10.541 4.079 6.960 1.00 10.00 H new ATOM 0 HA VAL A 128 12.446 3.679 4.737 1.00 10.00 H new ATOM 0 HB VAL A 128 10.423 5.902 4.930 1.00 10.00 H new ATOM 0 HG11 VAL A 128 10.611 5.837 2.478 1.00 10.00 H new ATOM 0 HG12 VAL A 128 12.188 6.095 3.262 1.00 10.00 H new ATOM 0 HG13 VAL A 128 11.770 4.493 2.610 1.00 10.00 H new ATOM 0 HG21 VAL A 128 8.850 4.552 3.608 1.00 10.00 H new ATOM 0 HG22 VAL A 128 9.915 3.139 3.794 1.00 10.00 H new ATOM 0 HG23 VAL A 128 9.133 3.858 5.222 1.00 10.00 H new ATOM 1638 N GLN A 129 13.985 5.409 5.700 1.00 10.00 N ATOM 1639 CA GLN A 129 14.895 6.388 6.267 1.00 10.00 C ATOM 1640 C GLN A 129 15.874 6.897 5.220 1.00 10.00 C ATOM 1641 O GLN A 129 16.285 6.155 4.327 1.00 10.00 O ATOM 1642 CB GLN A 129 15.669 5.773 7.438 1.00 10.00 C ATOM 1643 CG GLN A 129 14.786 5.311 8.585 1.00 10.00 C ATOM 1644 CD GLN A 129 15.587 4.747 9.740 1.00 10.00 C ATOM 1645 OE1 GLN A 129 15.988 5.481 10.645 1.00 10.00 O ATOM 1646 NE2 GLN A 129 15.819 3.445 9.718 1.00 10.00 N ATOM 0 H GLN A 129 14.428 4.718 5.094 1.00 10.00 H new ATOM 0 HA GLN A 129 14.302 7.230 6.625 1.00 10.00 H new ATOM 0 HB2 GLN A 129 16.247 4.924 7.073 1.00 10.00 H new ATOM 0 HB3 GLN A 129 16.382 6.506 7.814 1.00 10.00 H new ATOM 0 HG2 GLN A 129 14.186 6.149 8.938 1.00 10.00 H new ATOM 0 HG3 GLN A 129 14.092 4.552 8.223 1.00 10.00 H new ATOM 0 HE21 GLN A 129 15.467 2.877 8.947 1.00 10.00 H new ATOM 0 HE22 GLN A 129 16.350 3.009 10.472 1.00 10.00 H new ATOM 1655 N PRO A 130 16.237 8.181 5.302 1.00 10.00 N ATOM 1656 CA PRO A 130 17.193 8.780 4.378 1.00 10.00 C ATOM 1657 C PRO A 130 18.620 8.355 4.708 1.00 10.00 C ATOM 1658 O PRO A 130 18.980 8.220 5.878 1.00 10.00 O ATOM 1659 CB PRO A 130 17.014 10.280 4.605 1.00 10.00 C ATOM 1660 CG PRO A 130 16.529 10.398 6.010 1.00 10.00 C ATOM 1661 CD PRO A 130 15.726 9.155 6.286 1.00 10.00 C ATOM 0 HA PRO A 130 17.024 8.477 3.345 1.00 10.00 H new ATOM 0 HB2 PRO A 130 17.953 10.816 4.464 1.00 10.00 H new ATOM 0 HB3 PRO A 130 16.297 10.704 3.902 1.00 10.00 H new ATOM 0 HG2 PRO A 130 17.365 10.483 6.704 1.00 10.00 H new ATOM 0 HG3 PRO A 130 15.918 11.292 6.137 1.00 10.00 H new ATOM 0 HD2 PRO A 130 15.870 8.804 7.308 1.00 10.00 H new ATOM 0 HD3 PRO A 130 14.658 9.332 6.157 1.00 10.00 H new ATOM 1669 N VAL A 131 19.421 8.120 3.682 1.00 10.00 N ATOM 1670 CA VAL A 131 20.805 7.719 3.885 1.00 10.00 C ATOM 1671 C VAL A 131 21.753 8.802 3.386 1.00 10.00 C ATOM 1672 O VAL A 131 21.463 9.483 2.399 1.00 10.00 O ATOM 1673 CB VAL A 131 21.143 6.380 3.192 1.00 10.00 C ATOM 1674 CG1 VAL A 131 20.518 5.216 3.939 1.00 10.00 C ATOM 1675 CG2 VAL A 131 20.698 6.384 1.740 1.00 10.00 C ATOM 0 H VAL A 131 19.140 8.199 2.705 1.00 10.00 H new ATOM 0 HA VAL A 131 20.934 7.578 4.958 1.00 10.00 H new ATOM 0 HB VAL A 131 22.226 6.260 3.210 1.00 10.00 H new ATOM 0 HG11 VAL A 131 20.768 4.283 3.434 1.00 10.00 H new ATOM 0 HG12 VAL A 131 20.901 5.191 4.959 1.00 10.00 H new ATOM 0 HG13 VAL A 131 19.435 5.337 3.961 1.00 10.00 H new ATOM 0 HG21 VAL A 131 20.950 5.429 1.280 1.00 10.00 H new ATOM 0 HG22 VAL A 131 19.620 6.538 1.690 1.00 10.00 H new ATOM 0 HG23 VAL A 131 21.204 7.188 1.206 1.00 10.00 H new