USER MOD reduce.3.24.130724 H: found=0, std=0, add=1013, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1014 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 126 SER OG : rot 150:sc= 0 USER MOD Set 1.2: A 131 SER OG : rot 90:sc= 0.613 USER MOD Set 2.1: A 107 THR OG1 : rot -120:sc= 2.08 USER MOD Set 2.2: A 110 ASN : amide:sc= 0.684 K(o=2.8,f=-6.7!) USER MOD Set 3.1: A 103 GLN : amide:sc= 1.21 K(o=2,f=-1.9) USER MOD Set 3.2: A 115 ASN : amide:sc= 0.742 K(o=2,f=-0.4) USER MOD Set 4.1: A 70 ASN : amide:sc= -0.192 X(o=-0.032,f=-0.022) USER MOD Set 4.2: A 81 THR OG1 : rot -140:sc= 0.16 USER MOD Set 5.1: A 72 THR OG1 : rot -69:sc= 0.0502 USER MOD Set 5.2: A 79 THR OG1 : rot 37:sc= 0.0094 USER MOD Set 6.1: A 34 GLN : amide:sc= 2 K(o=2,f=-5.4!) USER MOD Set 6.2: A 53 THR OG1 : rot 150:sc= 0.00885 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 171:sc= -0.0211 (180deg=-0.136) USER MOD Single : A 32 THR OG1 : rot 73:sc= 1.06 USER MOD Single : A 33 GLN : amide:sc= -0.389 X(o=-0.39,f=-0.52) USER MOD Single : A 35 ASN : amide:sc= 0.989 K(o=0.99,f=-0.14) USER MOD Single : A 38 ASN :FLIP amide:sc= -0.702 F(o=-1.8!,f=-0.7) USER MOD Single : A 40 LYS NZ :NH3+ -128:sc= 1.27 (180deg=-0.153) USER MOD Single : A 41 SER OG : rot -124:sc= 0.995 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 44:sc= 0.422 USER MOD Single : A 46 TYR OH : rot -148:sc= 0.651 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot -46:sc= 0.323 USER MOD Single : A 60 GLN :FLIP amide:sc= -0.271 F(o=-0.96,f=-0.27) USER MOD Single : A 63 THR OG1 : rot 137:sc= 0.0183 USER MOD Single : A 66 MET CE :methyl -128:sc= -0.279 (180deg=-1.35) USER MOD Single : A 67 SER OG : rot 180:sc= -0.105 USER MOD Single : A 78 THR OG1 : rot 77:sc= 0.241 USER MOD Single : A 85 GLN : amide:sc= -1.02! C(o=-1!,f=-9.3!) USER MOD Single : A 88 SER OG : rot -127:sc= 0.403 USER MOD Single : A 89 ASN :FLIP amide:sc= 0 F(o=-0.68,f=0) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 123:sc= 0.552 USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 GLN :FLIP amide:sc= -0.417 F(o=-1.2,f=-0.42) USER MOD Single : A 112 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 GLN :FLIP amide:sc= -0.769 F(o=-1.6,f=-0.77) USER MOD Single : A 118 ASN : amide:sc= -0.157 X(o=-0.16,f=-0.22) USER MOD Single : A 119 GLN :FLIP amide:sc= -0.815 F(o=-1.8,f=-0.82) USER MOD Single : A 122 ASN : amide:sc= -0.349 K(o=-0.35,f=-4.5!) USER MOD Single : A 138 GLN : amide:sc= 0.101 K(o=0.1,f=-0.46) USER MOD Single : A 140 LYS NZ :NH3+ 162:sc= -0.0348 (180deg=-0.288) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 146 GLN : amide:sc= 0.293 X(o=0.29,f=-0.05) USER MOD Single : A 153 HIS : +bothHN:sc= 0.644 K(o=0.64,f=-6.5!) USER MOD Single : A 156 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 425 N GLU A 27 16.734 -2.400 5.309 1.00 70.34 N ATOM 426 CA GLU A 27 15.729 -2.651 4.274 1.00 42.23 C ATOM 427 C GLU A 27 15.129 -4.056 4.429 1.00 24.13 C ATOM 428 O GLU A 27 13.911 -4.236 4.374 1.00 65.31 O ATOM 429 CB GLU A 27 16.354 -2.494 2.881 1.00 73.33 C ATOM 430 CG GLU A 27 15.405 -2.840 1.739 1.00 25.45 C ATOM 431 CD GLU A 27 16.023 -2.595 0.374 1.00 54.51 C ATOM 432 OE1 GLU A 27 16.841 -3.423 -0.074 1.00 24.45 O ATOM 433 OE2 GLU A 27 15.696 -1.565 -0.255 1.00 34.13 O ATOM 0 HA GLU A 27 14.928 -1.920 4.388 1.00 42.23 H new ATOM 0 HB2 GLU A 27 16.694 -1.466 2.759 1.00 73.33 H new ATOM 0 HB3 GLU A 27 17.236 -3.132 2.814 1.00 73.33 H new ATOM 0 HG2 GLU A 27 15.112 -3.887 1.819 1.00 25.45 H new ATOM 0 HG3 GLU A 27 14.496 -2.247 1.834 1.00 25.45 H new ATOM 440 N THR A 28 15.998 -5.044 4.645 1.00 13.44 N ATOM 441 CA THR A 28 15.565 -6.429 4.863 1.00 72.24 C ATOM 442 C THR A 28 14.650 -6.533 6.098 1.00 42.11 C ATOM 443 O THR A 28 13.753 -7.375 6.149 1.00 12.45 O ATOM 444 CB THR A 28 16.774 -7.380 5.051 1.00 71.00 C ATOM 445 OG1 THR A 28 17.792 -7.096 4.076 1.00 13.31 O ATOM 446 CG2 THR A 28 16.349 -8.843 4.924 1.00 10.33 C ATOM 0 H THR A 28 17.009 -4.913 4.674 1.00 13.44 H new ATOM 0 HA THR A 28 15.012 -6.731 3.973 1.00 72.24 H new ATOM 0 HB THR A 28 17.171 -7.215 6.052 1.00 71.00 H new ATOM 0 HG1 THR A 28 18.550 -7.703 4.208 1.00 13.31 H new ATOM 0 HG21 THR A 28 17.218 -9.487 5.060 1.00 10.33 H new ATOM 0 HG22 THR A 28 15.604 -9.073 5.685 1.00 10.33 H new ATOM 0 HG23 THR A 28 15.922 -9.013 3.936 1.00 10.33 H new ATOM 454 N VAL A 29 14.888 -5.676 7.096 1.00 54.14 N ATOM 455 CA VAL A 29 14.022 -5.607 8.282 1.00 42.14 C ATOM 456 C VAL A 29 12.608 -5.139 7.903 1.00 71.51 C ATOM 457 O VAL A 29 11.620 -5.769 8.277 1.00 20.43 O ATOM 458 CB VAL A 29 14.600 -4.660 9.367 1.00 30.13 C ATOM 459 CG1 VAL A 29 13.651 -4.550 10.563 1.00 11.32 C ATOM 460 CG2 VAL A 29 15.984 -5.130 9.819 1.00 74.14 C ATOM 0 H VAL A 29 15.670 -5.021 7.108 1.00 54.14 H new ATOM 0 HA VAL A 29 13.974 -6.615 8.693 1.00 42.14 H new ATOM 0 HB VAL A 29 14.703 -3.669 8.925 1.00 30.13 H new ATOM 0 HG11 VAL A 29 14.081 -3.880 11.308 1.00 11.32 H new ATOM 0 HG12 VAL A 29 12.691 -4.155 10.231 1.00 11.32 H new ATOM 0 HG13 VAL A 29 13.505 -5.536 11.003 1.00 11.32 H new ATOM 0 HG21 VAL A 29 16.369 -4.451 10.580 1.00 74.14 H new ATOM 0 HG22 VAL A 29 15.909 -6.135 10.235 1.00 74.14 H new ATOM 0 HG23 VAL A 29 16.662 -5.140 8.965 1.00 74.14 H new ATOM 470 N LYS A 30 12.522 -4.032 7.159 1.00 62.30 N ATOM 471 CA LYS A 30 11.231 -3.530 6.656 1.00 42.25 C ATOM 472 C LYS A 30 10.498 -4.616 5.848 1.00 53.54 C ATOM 473 O LYS A 30 9.307 -4.862 6.049 1.00 21.14 O ATOM 474 CB LYS A 30 11.434 -2.272 5.784 1.00 15.31 C ATOM 475 CG LYS A 30 11.573 -0.960 6.564 1.00 1.24 C ATOM 476 CD LYS A 30 12.711 -0.995 7.582 1.00 15.31 C ATOM 477 CE LYS A 30 12.951 0.374 8.211 1.00 52.02 C ATOM 478 NZ LYS A 30 11.712 0.946 8.802 1.00 32.30 N ATOM 0 H LYS A 30 13.326 -3.465 6.890 1.00 62.30 H new ATOM 0 HA LYS A 30 10.619 -3.263 7.518 1.00 42.25 H new ATOM 0 HB2 LYS A 30 12.327 -2.411 5.174 1.00 15.31 H new ATOM 0 HB3 LYS A 30 10.591 -2.183 5.099 1.00 15.31 H new ATOM 0 HG2 LYS A 30 11.743 -0.142 5.864 1.00 1.24 H new ATOM 0 HG3 LYS A 30 10.636 -0.748 7.080 1.00 1.24 H new ATOM 0 HD2 LYS A 30 12.477 -1.718 8.363 1.00 15.31 H new ATOM 0 HD3 LYS A 30 13.624 -1.336 7.095 1.00 15.31 H new ATOM 0 HE2 LYS A 30 13.714 0.288 8.985 1.00 52.02 H new ATOM 0 HE3 LYS A 30 13.339 1.056 7.455 1.00 52.02 H new ATOM 0 HZ1 LYS A 30 11.949 1.799 9.348 1.00 32.30 H new ATOM 0 HZ2 LYS A 30 11.048 1.195 8.042 1.00 32.30 H new ATOM 0 HZ3 LYS A 30 11.271 0.244 9.430 1.00 32.30 H new ATOM 492 N ILE A 31 11.226 -5.264 4.942 1.00 31.11 N ATOM 493 CA ILE A 31 10.686 -6.379 4.157 1.00 12.32 C ATOM 494 C ILE A 31 10.117 -7.483 5.069 1.00 74.53 C ATOM 495 O ILE A 31 8.960 -7.887 4.932 1.00 54.10 O ATOM 496 CB ILE A 31 11.780 -6.975 3.233 1.00 33.34 C ATOM 497 CG1 ILE A 31 12.220 -5.934 2.186 1.00 75.45 C ATOM 498 CG2 ILE A 31 11.289 -8.257 2.561 1.00 31.23 C ATOM 499 CD1 ILE A 31 13.328 -6.410 1.266 1.00 31.03 C ATOM 0 H ILE A 31 12.198 -5.037 4.730 1.00 31.11 H new ATOM 0 HA ILE A 31 9.874 -5.987 3.544 1.00 12.32 H new ATOM 0 HB ILE A 31 12.645 -7.233 3.844 1.00 33.34 H new ATOM 0 HG12 ILE A 31 11.356 -5.654 1.582 1.00 75.45 H new ATOM 0 HG13 ILE A 31 12.553 -5.034 2.702 1.00 75.45 H new ATOM 0 HG21 ILE A 31 12.075 -8.655 1.919 1.00 31.23 H new ATOM 0 HG22 ILE A 31 11.036 -8.994 3.324 1.00 31.23 H new ATOM 0 HG23 ILE A 31 10.406 -8.038 1.961 1.00 31.23 H new ATOM 0 HD11 ILE A 31 13.579 -5.619 0.559 1.00 31.03 H new ATOM 0 HD12 ILE A 31 14.209 -6.662 1.857 1.00 31.03 H new ATOM 0 HD13 ILE A 31 12.994 -7.292 0.720 1.00 31.03 H new ATOM 511 N THR A 32 10.937 -7.954 6.005 1.00 4.34 N ATOM 512 CA THR A 32 10.519 -8.993 6.957 1.00 41.22 C ATOM 513 C THR A 32 9.272 -8.570 7.744 1.00 3.50 C ATOM 514 O THR A 32 8.304 -9.328 7.857 1.00 72.55 O ATOM 515 CB THR A 32 11.652 -9.330 7.956 1.00 11.10 C ATOM 516 OG1 THR A 32 12.818 -9.771 7.244 1.00 41.53 O ATOM 517 CG2 THR A 32 11.219 -10.413 8.940 1.00 73.33 C ATOM 0 H THR A 32 11.898 -7.635 6.129 1.00 4.34 H new ATOM 0 HA THR A 32 10.283 -9.878 6.366 1.00 41.22 H new ATOM 0 HB THR A 32 11.883 -8.425 8.518 1.00 11.10 H new ATOM 0 HG1 THR A 32 13.243 -9.004 6.806 1.00 41.53 H new ATOM 0 HG21 THR A 32 12.037 -10.627 9.628 1.00 73.33 H new ATOM 0 HG22 THR A 32 10.352 -10.068 9.503 1.00 73.33 H new ATOM 0 HG23 THR A 32 10.959 -11.319 8.393 1.00 73.33 H new ATOM 525 N GLN A 33 9.301 -7.349 8.269 1.00 45.13 N ATOM 526 CA GLN A 33 8.177 -6.795 9.029 1.00 31.23 C ATOM 527 C GLN A 33 6.894 -6.756 8.183 1.00 63.24 C ATOM 528 O GLN A 33 5.805 -7.050 8.678 1.00 24.02 O ATOM 529 CB GLN A 33 8.526 -5.384 9.528 1.00 44.03 C ATOM 530 CG GLN A 33 7.443 -4.742 10.392 1.00 35.55 C ATOM 531 CD GLN A 33 7.823 -3.351 10.878 1.00 70.20 C ATOM 532 OE1 GLN A 33 8.558 -2.625 10.217 1.00 55.52 O ATOM 533 NE2 GLN A 33 7.325 -2.972 12.038 1.00 65.13 N ATOM 0 H GLN A 33 10.097 -6.717 8.183 1.00 45.13 H new ATOM 0 HA GLN A 33 7.994 -7.445 9.884 1.00 31.23 H new ATOM 0 HB2 GLN A 33 9.452 -5.432 10.101 1.00 44.03 H new ATOM 0 HB3 GLN A 33 8.717 -4.743 8.667 1.00 44.03 H new ATOM 0 HG2 GLN A 33 6.517 -4.682 9.820 1.00 35.55 H new ATOM 0 HG3 GLN A 33 7.245 -5.381 11.253 1.00 35.55 H new ATOM 0 HE21 GLN A 33 6.717 -3.601 12.562 1.00 65.13 H new ATOM 0 HE22 GLN A 33 7.548 -2.050 12.412 1.00 65.13 H new ATOM 542 N GLN A 34 7.029 -6.401 6.905 1.00 51.11 N ATOM 543 CA GLN A 34 5.885 -6.376 5.988 1.00 44.31 C ATOM 544 C GLN A 34 5.255 -7.769 5.849 1.00 74.31 C ATOM 545 O GLN A 34 4.038 -7.920 5.940 1.00 14.23 O ATOM 546 CB GLN A 34 6.308 -5.853 4.608 1.00 32.32 C ATOM 547 CG GLN A 34 5.137 -5.643 3.653 1.00 73.43 C ATOM 548 CD GLN A 34 5.553 -5.062 2.313 1.00 64.44 C ATOM 549 OE1 GLN A 34 5.631 -3.852 2.144 1.00 25.44 O ATOM 550 NE2 GLN A 34 5.813 -5.918 1.345 1.00 72.14 N ATOM 0 H GLN A 34 7.915 -6.127 6.481 1.00 51.11 H new ATOM 0 HA GLN A 34 5.139 -5.701 6.409 1.00 44.31 H new ATOM 0 HB2 GLN A 34 6.839 -4.909 4.733 1.00 32.32 H new ATOM 0 HB3 GLN A 34 7.010 -6.557 4.161 1.00 32.32 H new ATOM 0 HG2 GLN A 34 4.636 -6.597 3.488 1.00 73.43 H new ATOM 0 HG3 GLN A 34 4.411 -4.978 4.120 1.00 73.43 H new ATOM 0 HE21 GLN A 34 5.739 -6.921 1.517 1.00 72.14 H new ATOM 0 HE22 GLN A 34 6.088 -5.578 0.424 1.00 72.14 H new ATOM 559 N ASN A 35 6.091 -8.788 5.629 1.00 70.41 N ATOM 560 CA ASN A 35 5.617 -10.179 5.564 1.00 33.14 C ATOM 561 C ASN A 35 4.898 -10.582 6.864 1.00 4.32 C ATOM 562 O ASN A 35 3.857 -11.240 6.834 1.00 21.14 O ATOM 563 CB ASN A 35 6.786 -11.138 5.289 1.00 14.45 C ATOM 564 CG ASN A 35 7.327 -11.014 3.871 1.00 10.03 C ATOM 565 OD1 ASN A 35 6.858 -11.677 2.956 1.00 24.13 O ATOM 566 ND2 ASN A 35 8.321 -10.174 3.678 1.00 3.42 N ATOM 0 H ASN A 35 7.096 -8.680 5.493 1.00 70.41 H new ATOM 0 HA ASN A 35 4.904 -10.248 4.742 1.00 33.14 H new ATOM 0 HB2 ASN A 35 7.589 -10.938 5.999 1.00 14.45 H new ATOM 0 HB3 ASN A 35 6.457 -12.163 5.460 1.00 14.45 H new ATOM 0 HD21 ASN A 35 8.721 -10.062 2.746 1.00 3.42 H new ATOM 0 HD22 ASN A 35 8.692 -9.634 4.460 1.00 3.42 H new ATOM 573 N ARG A 36 5.456 -10.174 8.004 1.00 10.41 N ATOM 574 CA ARG A 36 4.843 -10.449 9.311 1.00 64.13 C ATOM 575 C ARG A 36 3.441 -9.819 9.423 1.00 11.22 C ATOM 576 O ARG A 36 2.460 -10.504 9.720 1.00 63.33 O ATOM 577 CB ARG A 36 5.740 -9.923 10.443 1.00 62.14 C ATOM 578 CG ARG A 36 7.082 -10.651 10.587 1.00 13.20 C ATOM 579 CD ARG A 36 6.922 -12.063 11.156 1.00 74.33 C ATOM 580 NE ARG A 36 6.234 -12.970 10.233 1.00 30.13 N ATOM 581 CZ ARG A 36 5.229 -13.740 10.561 1.00 42.42 C ATOM 582 NH1 ARG A 36 4.769 -13.753 11.768 1.00 11.14 N ATOM 583 NH2 ARG A 36 4.688 -14.503 9.671 1.00 5.42 N ATOM 0 H ARG A 36 6.331 -9.652 8.053 1.00 10.41 H new ATOM 0 HA ARG A 36 4.738 -11.530 9.403 1.00 64.13 H new ATOM 0 HB2 ARG A 36 5.933 -8.864 10.273 1.00 62.14 H new ATOM 0 HB3 ARG A 36 5.197 -10.001 11.385 1.00 62.14 H new ATOM 0 HG2 ARG A 36 7.568 -10.708 9.613 1.00 13.20 H new ATOM 0 HG3 ARG A 36 7.738 -10.072 11.237 1.00 13.20 H new ATOM 0 HD2 ARG A 36 7.906 -12.469 11.392 1.00 74.33 H new ATOM 0 HD3 ARG A 36 6.365 -12.012 12.092 1.00 74.33 H new ATOM 0 HE ARG A 36 6.562 -13.003 9.268 1.00 30.13 H new ATOM 0 HH11 ARG A 36 5.190 -13.157 12.481 1.00 11.14 H new ATOM 0 HH12 ARG A 36 3.985 -14.359 12.008 1.00 11.14 H new ATOM 0 HH21 ARG A 36 5.045 -14.504 8.715 1.00 5.42 H new ATOM 0 HH22 ARG A 36 3.904 -15.105 9.924 1.00 5.42 H new ATOM 597 N LEU A 37 3.355 -8.513 9.181 1.00 41.35 N ATOM 598 CA LEU A 37 2.082 -7.786 9.272 1.00 45.44 C ATOM 599 C LEU A 37 1.076 -8.266 8.211 1.00 70.50 C ATOM 600 O LEU A 37 -0.126 -8.340 8.465 1.00 3.34 O ATOM 601 CB LEU A 37 2.326 -6.275 9.124 1.00 61.25 C ATOM 602 CG LEU A 37 3.240 -5.644 10.191 1.00 43.24 C ATOM 603 CD1 LEU A 37 3.433 -4.152 9.923 1.00 52.13 C ATOM 604 CD2 LEU A 37 2.676 -5.875 11.593 1.00 73.24 C ATOM 0 H LEU A 37 4.151 -7.932 8.920 1.00 41.35 H new ATOM 0 HA LEU A 37 1.652 -7.989 10.253 1.00 45.44 H new ATOM 0 HB2 LEU A 37 2.761 -6.089 8.142 1.00 61.25 H new ATOM 0 HB3 LEU A 37 1.363 -5.765 9.148 1.00 61.25 H new ATOM 0 HG LEU A 37 4.215 -6.128 10.134 1.00 43.24 H new ATOM 0 HD11 LEU A 37 4.082 -3.726 10.688 1.00 52.13 H new ATOM 0 HD12 LEU A 37 3.889 -4.014 8.943 1.00 52.13 H new ATOM 0 HD13 LEU A 37 2.466 -3.650 9.947 1.00 52.13 H new ATOM 0 HD21 LEU A 37 3.338 -5.421 12.331 1.00 73.24 H new ATOM 0 HD22 LEU A 37 1.687 -5.423 11.666 1.00 73.24 H new ATOM 0 HD23 LEU A 37 2.601 -6.946 11.783 1.00 73.24 H new ATOM 616 N ASN A 38 1.577 -8.603 7.024 1.00 73.44 N ATOM 617 CA ASN A 38 0.726 -9.103 5.937 1.00 72.22 C ATOM 618 C ASN A 38 0.074 -10.448 6.318 1.00 32.30 C ATOM 619 O ASN A 38 -1.071 -10.722 5.951 1.00 40.11 O ATOM 620 CB ASN A 38 1.546 -9.246 4.646 1.00 72.44 C ATOM 621 CG ASN A 38 0.683 -9.541 3.432 1.00 50.53 C ATOM 622 OD1 ASN A 38 0.226 -8.503 2.759 1.00 61.14 O flip ATOM 623 ND2 ASN A 38 0.431 -10.690 3.094 1.00 23.43 N flip ATOM 0 H ASN A 38 2.567 -8.540 6.787 1.00 73.44 H new ATOM 0 HA ASN A 38 -0.073 -8.381 5.767 1.00 72.22 H new ATOM 0 HB2 ASN A 38 2.107 -8.327 4.473 1.00 72.44 H new ATOM 0 HB3 ASN A 38 2.276 -10.046 4.771 1.00 72.44 H new ATOM 0 HD21 ASN A 38 0.799 -11.473 3.635 1.00 23.43 H new ATOM 0 HD22 ASN A 38 -0.147 -10.865 2.272 1.00 23.43 H new ATOM 630 N ALA A 39 0.808 -11.273 7.065 1.00 5.23 N ATOM 631 CA ALA A 39 0.277 -12.542 7.572 1.00 1.25 C ATOM 632 C ALA A 39 -0.706 -12.314 8.735 1.00 24.04 C ATOM 633 O ALA A 39 -1.595 -13.131 8.983 1.00 71.23 O ATOM 634 CB ALA A 39 1.422 -13.449 8.015 1.00 13.21 C ATOM 0 H ALA A 39 1.774 -11.086 7.334 1.00 5.23 H new ATOM 0 HA ALA A 39 -0.271 -13.027 6.764 1.00 1.25 H new ATOM 0 HB1 ALA A 39 1.017 -14.389 8.390 1.00 13.21 H new ATOM 0 HB2 ALA A 39 2.077 -13.649 7.167 1.00 13.21 H new ATOM 0 HB3 ALA A 39 1.990 -12.958 8.805 1.00 13.21 H new ATOM 640 N LYS A 40 -0.525 -11.206 9.456 1.00 1.44 N ATOM 641 CA LYS A 40 -1.429 -10.824 10.556 1.00 4.44 C ATOM 642 C LYS A 40 -2.581 -9.929 10.058 1.00 52.23 C ATOM 643 O LYS A 40 -3.476 -9.563 10.825 1.00 24.31 O ATOM 644 CB LYS A 40 -0.638 -10.093 11.653 1.00 10.41 C ATOM 645 CG LYS A 40 0.403 -10.965 12.359 1.00 11.11 C ATOM 646 CD LYS A 40 1.310 -10.130 13.262 1.00 35.54 C ATOM 647 CE LYS A 40 2.292 -10.985 14.062 1.00 53.00 C ATOM 648 NZ LYS A 40 1.618 -11.756 15.140 1.00 73.03 N ATOM 0 H LYS A 40 0.242 -10.551 9.301 1.00 1.44 H new ATOM 0 HA LYS A 40 -1.865 -11.736 10.963 1.00 4.44 H new ATOM 0 HB2 LYS A 40 -0.136 -9.232 11.212 1.00 10.41 H new ATOM 0 HB3 LYS A 40 -1.337 -9.708 12.395 1.00 10.41 H new ATOM 0 HG2 LYS A 40 -0.101 -11.728 12.952 1.00 11.11 H new ATOM 0 HG3 LYS A 40 1.007 -11.487 11.616 1.00 11.11 H new ATOM 0 HD2 LYS A 40 1.867 -9.418 12.653 1.00 35.54 H new ATOM 0 HD3 LYS A 40 0.696 -9.549 13.950 1.00 35.54 H new ATOM 0 HE2 LYS A 40 2.802 -11.674 13.389 1.00 53.00 H new ATOM 0 HE3 LYS A 40 3.056 -10.343 14.500 1.00 53.00 H new ATOM 0 HZ1 LYS A 40 2.103 -11.586 16.044 1.00 73.03 H new ATOM 0 HZ2 LYS A 40 0.627 -11.451 15.217 1.00 73.03 H new ATOM 0 HZ3 LYS A 40 1.652 -12.771 14.914 1.00 73.03 H new ATOM 662 N SER A 41 -2.549 -9.575 8.773 1.00 11.43 N ATOM 663 CA SER A 41 -3.574 -8.707 8.177 1.00 51.34 C ATOM 664 C SER A 41 -4.933 -9.413 8.064 1.00 55.41 C ATOM 665 O SER A 41 -5.121 -10.306 7.234 1.00 54.30 O ATOM 666 CB SER A 41 -3.134 -8.227 6.789 1.00 4.54 C ATOM 667 OG SER A 41 -4.087 -7.337 6.231 1.00 31.55 O ATOM 0 H SER A 41 -1.824 -9.875 8.121 1.00 11.43 H new ATOM 0 HA SER A 41 -3.690 -7.851 8.842 1.00 51.34 H new ATOM 0 HB2 SER A 41 -2.167 -7.730 6.862 1.00 4.54 H new ATOM 0 HB3 SER A 41 -3.002 -9.084 6.129 1.00 4.54 H new ATOM 0 HG SER A 41 -4.376 -7.673 5.357 1.00 31.55 H new ATOM 673 N SER A 42 -5.883 -8.993 8.895 1.00 73.22 N ATOM 674 CA SER A 42 -7.233 -9.578 8.903 1.00 42.45 C ATOM 675 C SER A 42 -8.189 -8.813 7.975 1.00 3.11 C ATOM 676 O SER A 42 -9.354 -9.179 7.831 1.00 61.12 O ATOM 677 CB SER A 42 -7.794 -9.596 10.334 1.00 44.11 C ATOM 678 OG SER A 42 -7.806 -8.290 10.904 1.00 52.13 O ATOM 0 H SER A 42 -5.748 -8.247 9.577 1.00 73.22 H new ATOM 0 HA SER A 42 -7.152 -10.600 8.531 1.00 42.45 H new ATOM 0 HB2 SER A 42 -8.806 -10.000 10.325 1.00 44.11 H new ATOM 0 HB3 SER A 42 -7.192 -10.260 10.954 1.00 44.11 H new ATOM 0 HG SER A 42 -8.169 -8.333 11.813 1.00 52.13 H new ATOM 684 N SER A 43 -7.688 -7.754 7.342 1.00 51.34 N ATOM 685 CA SER A 43 -8.497 -6.942 6.420 1.00 64.13 C ATOM 686 C SER A 43 -7.617 -6.247 5.374 1.00 41.54 C ATOM 687 O SER A 43 -6.960 -5.245 5.667 1.00 61.34 O ATOM 688 CB SER A 43 -9.311 -5.892 7.196 1.00 75.32 C ATOM 689 OG SER A 43 -8.467 -5.043 7.965 1.00 15.04 O ATOM 0 H SER A 43 -6.725 -7.434 7.447 1.00 51.34 H new ATOM 0 HA SER A 43 -9.182 -7.614 5.903 1.00 64.13 H new ATOM 0 HB2 SER A 43 -9.893 -5.292 6.497 1.00 75.32 H new ATOM 0 HB3 SER A 43 -10.021 -6.394 7.854 1.00 75.32 H new ATOM 0 HG SER A 43 -7.696 -4.771 7.424 1.00 15.04 H new ATOM 695 N GLY A 44 -7.606 -6.781 4.154 1.00 54.25 N ATOM 696 CA GLY A 44 -6.756 -6.230 3.100 1.00 64.34 C ATOM 697 C GLY A 44 -5.301 -6.678 3.222 1.00 45.12 C ATOM 698 O GLY A 44 -5.026 -7.805 3.637 1.00 11.44 O ATOM 0 H GLY A 44 -8.168 -7.584 3.873 1.00 54.25 H new ATOM 0 HA2 GLY A 44 -7.145 -6.534 2.129 1.00 64.34 H new ATOM 0 HA3 GLY A 44 -6.801 -5.141 3.135 1.00 64.34 H new ATOM 702 N VAL A 45 -4.362 -5.802 2.860 1.00 31.22 N ATOM 703 CA VAL A 45 -2.926 -6.118 2.967 1.00 25.14 C ATOM 704 C VAL A 45 -2.121 -4.970 3.593 1.00 13.51 C ATOM 705 O VAL A 45 -2.359 -3.796 3.308 1.00 22.25 O ATOM 706 CB VAL A 45 -2.308 -6.471 1.588 1.00 34.34 C ATOM 707 CG1 VAL A 45 -2.855 -7.798 1.069 1.00 44.12 C ATOM 708 CG2 VAL A 45 -2.553 -5.350 0.577 1.00 72.31 C ATOM 0 H VAL A 45 -4.562 -4.872 2.492 1.00 31.22 H new ATOM 0 HA VAL A 45 -2.865 -6.987 3.622 1.00 25.14 H new ATOM 0 HB VAL A 45 -1.231 -6.578 1.720 1.00 34.34 H new ATOM 0 HG11 VAL A 45 -2.406 -8.023 0.101 1.00 44.12 H new ATOM 0 HG12 VAL A 45 -2.613 -8.592 1.775 1.00 44.12 H new ATOM 0 HG13 VAL A 45 -3.937 -7.728 0.960 1.00 44.12 H new ATOM 0 HG21 VAL A 45 -2.110 -5.621 -0.381 1.00 72.31 H new ATOM 0 HG22 VAL A 45 -3.625 -5.201 0.452 1.00 72.31 H new ATOM 0 HG23 VAL A 45 -2.098 -4.428 0.939 1.00 72.31 H new ATOM 718 N TYR A 46 -1.169 -5.328 4.455 1.00 5.24 N ATOM 719 CA TYR A 46 -0.249 -4.358 5.058 1.00 11.11 C ATOM 720 C TYR A 46 1.022 -4.186 4.210 1.00 51.45 C ATOM 721 O TYR A 46 1.870 -5.076 4.163 1.00 43.34 O ATOM 722 CB TYR A 46 0.142 -4.799 6.481 1.00 21.43 C ATOM 723 CG TYR A 46 -0.873 -4.451 7.558 1.00 20.14 C ATOM 724 CD1 TYR A 46 -2.189 -4.897 7.486 1.00 54.31 C ATOM 725 CD2 TYR A 46 -0.502 -3.684 8.658 1.00 15.01 C ATOM 726 CE1 TYR A 46 -3.101 -4.590 8.479 1.00 61.05 C ATOM 727 CE2 TYR A 46 -1.409 -3.372 9.651 1.00 1.25 C ATOM 728 CZ TYR A 46 -2.706 -3.826 9.558 1.00 11.33 C ATOM 729 OH TYR A 46 -3.609 -3.523 10.552 1.00 71.43 O ATOM 0 H TYR A 46 -1.013 -6.290 4.754 1.00 5.24 H new ATOM 0 HA TYR A 46 -0.768 -3.401 5.102 1.00 11.11 H new ATOM 0 HB2 TYR A 46 0.296 -5.878 6.482 1.00 21.43 H new ATOM 0 HB3 TYR A 46 1.096 -4.340 6.739 1.00 21.43 H new ATOM 0 HD1 TYR A 46 -2.503 -5.492 6.641 1.00 54.31 H new ATOM 0 HD2 TYR A 46 0.514 -3.326 8.736 1.00 15.01 H new ATOM 0 HE1 TYR A 46 -4.118 -4.947 8.410 1.00 61.05 H new ATOM 0 HE2 TYR A 46 -1.103 -2.775 10.497 1.00 1.25 H new ATOM 0 HH TYR A 46 -3.397 -2.644 10.929 1.00 71.43 H new ATOM 739 N LEU A 47 1.133 -3.053 3.528 1.00 24.32 N ATOM 740 CA LEU A 47 2.371 -2.672 2.836 1.00 41.41 C ATOM 741 C LEU A 47 3.163 -1.670 3.690 1.00 2.41 C ATOM 742 O LEU A 47 2.574 -0.885 4.436 1.00 31.33 O ATOM 743 CB LEU A 47 2.055 -2.050 1.465 1.00 20.40 C ATOM 744 CG LEU A 47 1.497 -3.021 0.408 1.00 1.43 C ATOM 745 CD1 LEU A 47 1.002 -2.259 -0.820 1.00 34.14 C ATOM 746 CD2 LEU A 47 2.555 -4.049 0.004 1.00 63.10 C ATOM 0 H LEU A 47 0.378 -2.373 3.435 1.00 24.32 H new ATOM 0 HA LEU A 47 2.971 -3.569 2.683 1.00 41.41 H new ATOM 0 HB2 LEU A 47 1.335 -1.244 1.609 1.00 20.40 H new ATOM 0 HB3 LEU A 47 2.966 -1.598 1.072 1.00 20.40 H new ATOM 0 HG LEU A 47 0.652 -3.550 0.849 1.00 1.43 H new ATOM 0 HD11 LEU A 47 0.612 -2.965 -1.553 1.00 34.14 H new ATOM 0 HD12 LEU A 47 0.212 -1.568 -0.526 1.00 34.14 H new ATOM 0 HD13 LEU A 47 1.828 -1.699 -1.258 1.00 34.14 H new ATOM 0 HD21 LEU A 47 2.139 -4.725 -0.743 1.00 63.10 H new ATOM 0 HD22 LEU A 47 3.421 -3.535 -0.413 1.00 63.10 H new ATOM 0 HD23 LEU A 47 2.860 -4.621 0.880 1.00 63.10 H new ATOM 758 N LEU A 48 4.488 -1.697 3.589 1.00 42.13 N ATOM 759 CA LEU A 48 5.338 -0.772 4.351 1.00 5.31 C ATOM 760 C LEU A 48 6.075 0.206 3.425 1.00 13.33 C ATOM 761 O LEU A 48 6.720 -0.203 2.458 1.00 30.34 O ATOM 762 CB LEU A 48 6.352 -1.544 5.208 1.00 44.21 C ATOM 763 CG LEU A 48 5.742 -2.424 6.312 1.00 63.41 C ATOM 764 CD1 LEU A 48 6.840 -3.048 7.164 1.00 53.10 C ATOM 765 CD2 LEU A 48 4.778 -1.617 7.181 1.00 43.33 C ATOM 0 H LEU A 48 5.001 -2.345 2.991 1.00 42.13 H new ATOM 0 HA LEU A 48 4.685 -0.196 5.007 1.00 5.31 H new ATOM 0 HB2 LEU A 48 6.951 -2.175 4.552 1.00 44.21 H new ATOM 0 HB3 LEU A 48 7.032 -0.828 5.670 1.00 44.21 H new ATOM 0 HG LEU A 48 5.177 -3.226 5.836 1.00 63.41 H new ATOM 0 HD11 LEU A 48 6.391 -3.667 7.940 1.00 53.10 H new ATOM 0 HD12 LEU A 48 7.483 -3.664 6.535 1.00 53.10 H new ATOM 0 HD13 LEU A 48 7.433 -2.260 7.627 1.00 53.10 H new ATOM 0 HD21 LEU A 48 4.359 -2.261 7.954 1.00 43.33 H new ATOM 0 HD22 LEU A 48 5.314 -0.790 7.648 1.00 43.33 H new ATOM 0 HD23 LEU A 48 3.972 -1.223 6.561 1.00 43.33 H new ATOM 777 N PRO A 49 6.024 1.519 3.731 1.00 25.42 N ATOM 778 CA PRO A 49 6.651 2.571 2.898 1.00 52.12 C ATOM 779 C PRO A 49 8.193 2.592 2.977 1.00 50.34 C ATOM 780 O PRO A 49 8.822 3.635 2.785 1.00 21.24 O ATOM 781 CB PRO A 49 6.054 3.861 3.472 1.00 54.44 C ATOM 782 CG PRO A 49 5.751 3.536 4.896 1.00 24.42 C ATOM 783 CD PRO A 49 5.348 2.086 4.916 1.00 14.02 C ATOM 0 HA PRO A 49 6.452 2.416 1.838 1.00 52.12 H new ATOM 0 HB2 PRO A 49 6.757 4.691 3.396 1.00 54.44 H new ATOM 0 HB3 PRO A 49 5.154 4.155 2.933 1.00 54.44 H new ATOM 0 HG2 PRO A 49 6.622 3.707 5.529 1.00 24.42 H new ATOM 0 HG3 PRO A 49 4.950 4.169 5.278 1.00 24.42 H new ATOM 0 HD2 PRO A 49 5.669 1.594 5.834 1.00 14.02 H new ATOM 0 HD3 PRO A 49 4.266 1.970 4.854 1.00 14.02 H new ATOM 791 N GLY A 50 8.791 1.434 3.240 1.00 70.33 N ATOM 792 CA GLY A 50 10.247 1.312 3.251 1.00 35.34 C ATOM 793 C GLY A 50 10.719 -0.036 2.715 1.00 32.41 C ATOM 794 O GLY A 50 11.889 -0.402 2.861 1.00 44.51 O ATOM 0 H GLY A 50 8.293 0.569 3.448 1.00 70.33 H new ATOM 0 HA2 GLY A 50 10.681 2.111 2.650 1.00 35.34 H new ATOM 0 HA3 GLY A 50 10.613 1.444 4.269 1.00 35.34 H new ATOM 798 N ALA A 51 9.807 -0.774 2.083 1.00 73.14 N ATOM 799 CA ALA A 51 10.105 -2.114 1.568 1.00 62.40 C ATOM 800 C ALA A 51 9.687 -2.259 0.095 1.00 44.32 C ATOM 801 O ALA A 51 8.506 -2.206 -0.235 1.00 42.11 O ATOM 802 CB ALA A 51 9.408 -3.167 2.424 1.00 64.21 C ATOM 0 H ALA A 51 8.850 -0.466 1.914 1.00 73.14 H new ATOM 0 HA ALA A 51 11.183 -2.264 1.621 1.00 62.40 H new ATOM 0 HB1 ALA A 51 9.634 -4.160 2.035 1.00 64.21 H new ATOM 0 HB2 ALA A 51 9.760 -3.091 3.453 1.00 64.21 H new ATOM 0 HB3 ALA A 51 8.331 -3.003 2.397 1.00 64.21 H new ATOM 808 N LYS A 52 10.668 -2.469 -0.780 1.00 40.41 N ATOM 809 CA LYS A 52 10.425 -2.647 -2.223 1.00 33.12 C ATOM 810 C LYS A 52 9.707 -3.978 -2.547 1.00 42.11 C ATOM 811 O LYS A 52 9.565 -4.354 -3.715 1.00 14.44 O ATOM 812 CB LYS A 52 11.765 -2.591 -2.971 1.00 3.43 C ATOM 813 CG LYS A 52 12.745 -3.682 -2.539 1.00 50.33 C ATOM 814 CD LYS A 52 14.085 -3.573 -3.262 1.00 72.12 C ATOM 815 CE LYS A 52 15.044 -4.671 -2.820 1.00 21.11 C ATOM 816 NZ LYS A 52 16.379 -4.540 -3.458 1.00 4.24 N ATOM 0 H LYS A 52 11.652 -2.522 -0.517 1.00 40.41 H new ATOM 0 HA LYS A 52 9.768 -1.840 -2.547 1.00 33.12 H new ATOM 0 HB2 LYS A 52 11.580 -2.682 -4.041 1.00 3.43 H new ATOM 0 HB3 LYS A 52 12.223 -1.616 -2.808 1.00 3.43 H new ATOM 0 HG2 LYS A 52 12.908 -3.616 -1.463 1.00 50.33 H new ATOM 0 HG3 LYS A 52 12.307 -4.660 -2.736 1.00 50.33 H new ATOM 0 HD2 LYS A 52 13.926 -3.638 -4.338 1.00 72.12 H new ATOM 0 HD3 LYS A 52 14.529 -2.598 -3.064 1.00 72.12 H new ATOM 0 HE2 LYS A 52 15.156 -4.638 -1.736 1.00 21.11 H new ATOM 0 HE3 LYS A 52 14.619 -5.644 -3.067 1.00 21.11 H new ATOM 0 HZ1 LYS A 52 16.998 -5.308 -3.128 1.00 4.24 H new ATOM 0 HZ2 LYS A 52 16.277 -4.597 -4.491 1.00 4.24 H new ATOM 0 HZ3 LYS A 52 16.798 -3.623 -3.202 1.00 4.24 H new ATOM 830 N THR A 53 9.250 -4.686 -1.519 1.00 54.04 N ATOM 831 CA THR A 53 8.596 -5.988 -1.698 1.00 4.14 C ATOM 832 C THR A 53 7.077 -5.866 -1.863 1.00 60.34 C ATOM 833 O THR A 53 6.437 -5.010 -1.256 1.00 20.04 O ATOM 834 CB THR A 53 8.895 -6.945 -0.517 1.00 32.31 C ATOM 835 OG1 THR A 53 8.939 -6.215 0.720 1.00 64.44 O ATOM 836 CG2 THR A 53 10.210 -7.687 -0.741 1.00 72.14 C ATOM 0 H THR A 53 9.319 -4.383 -0.548 1.00 54.04 H new ATOM 0 HA THR A 53 9.013 -6.401 -2.617 1.00 4.14 H new ATOM 0 HB THR A 53 8.092 -7.680 -0.462 1.00 32.31 H new ATOM 0 HG1 THR A 53 8.650 -6.797 1.454 1.00 64.44 H new ATOM 0 HG21 THR A 53 10.400 -8.353 0.101 1.00 72.14 H new ATOM 0 HG22 THR A 53 10.146 -8.271 -1.659 1.00 72.14 H new ATOM 0 HG23 THR A 53 11.024 -6.967 -0.825 1.00 72.14 H new ATOM 844 N PRO A 54 6.485 -6.744 -2.692 1.00 41.21 N ATOM 845 CA PRO A 54 5.032 -6.772 -2.932 1.00 45.42 C ATOM 846 C PRO A 54 4.232 -7.526 -1.852 1.00 14.14 C ATOM 847 O PRO A 54 4.788 -8.027 -0.869 1.00 30.34 O ATOM 848 CB PRO A 54 4.949 -7.518 -4.264 1.00 15.24 C ATOM 849 CG PRO A 54 6.083 -8.486 -4.210 1.00 44.53 C ATOM 850 CD PRO A 54 7.192 -7.774 -3.485 1.00 20.01 C ATOM 0 HA PRO A 54 4.601 -5.771 -2.924 1.00 45.42 H new ATOM 0 HB2 PRO A 54 3.993 -8.030 -4.375 1.00 15.24 H new ATOM 0 HB3 PRO A 54 5.046 -6.837 -5.109 1.00 15.24 H new ATOM 0 HG2 PRO A 54 5.795 -9.398 -3.686 1.00 44.53 H new ATOM 0 HG3 PRO A 54 6.395 -8.779 -5.212 1.00 44.53 H new ATOM 0 HD2 PRO A 54 7.755 -8.455 -2.847 1.00 20.01 H new ATOM 0 HD3 PRO A 54 7.903 -7.327 -4.180 1.00 20.01 H new ATOM 858 N ALA A 55 2.914 -7.604 -2.053 1.00 40.30 N ATOM 859 CA ALA A 55 2.025 -8.369 -1.172 1.00 50.52 C ATOM 860 C ALA A 55 0.845 -8.971 -1.952 1.00 35.02 C ATOM 861 O ALA A 55 0.344 -8.365 -2.904 1.00 72.52 O ATOM 862 CB ALA A 55 1.511 -7.483 -0.043 1.00 64.45 C ATOM 0 H ALA A 55 2.434 -7.142 -2.826 1.00 40.30 H new ATOM 0 HA ALA A 55 2.601 -9.191 -0.747 1.00 50.52 H new ATOM 0 HB1 ALA A 55 0.852 -8.063 0.604 1.00 64.45 H new ATOM 0 HB2 ALA A 55 2.354 -7.109 0.539 1.00 64.45 H new ATOM 0 HB3 ALA A 55 0.959 -6.642 -0.463 1.00 64.45 H new ATOM 868 N ARG A 56 0.406 -10.161 -1.539 1.00 4.15 N ATOM 869 CA ARG A 56 -0.717 -10.855 -2.186 1.00 12.33 C ATOM 870 C ARG A 56 -2.064 -10.306 -1.697 1.00 71.45 C ATOM 871 O ARG A 56 -2.430 -10.493 -0.536 1.00 21.33 O ATOM 872 CB ARG A 56 -0.657 -12.365 -1.894 1.00 53.44 C ATOM 873 CG ARG A 56 -1.685 -13.187 -2.674 1.00 53.41 C ATOM 874 CD ARG A 56 -1.859 -14.592 -2.099 1.00 40.22 C ATOM 875 NE ARG A 56 -2.651 -14.588 -0.864 1.00 35.13 N ATOM 876 CZ ARG A 56 -2.591 -15.514 0.059 1.00 10.12 C ATOM 877 NH1 ARG A 56 -1.722 -16.470 -0.016 1.00 30.23 N ATOM 878 NH2 ARG A 56 -3.390 -15.461 1.075 1.00 14.35 N ATOM 0 H ARG A 56 0.812 -10.670 -0.754 1.00 4.15 H new ATOM 0 HA ARG A 56 -0.632 -10.684 -3.259 1.00 12.33 H new ATOM 0 HB2 ARG A 56 0.342 -12.732 -2.130 1.00 53.44 H new ATOM 0 HB3 ARG A 56 -0.812 -12.526 -0.827 1.00 53.44 H new ATOM 0 HG2 ARG A 56 -2.645 -12.670 -2.662 1.00 53.41 H new ATOM 0 HG3 ARG A 56 -1.374 -13.259 -3.716 1.00 53.41 H new ATOM 0 HD2 ARG A 56 -2.345 -15.228 -2.839 1.00 40.22 H new ATOM 0 HD3 ARG A 56 -0.879 -15.026 -1.899 1.00 40.22 H new ATOM 0 HE ARG A 56 -3.293 -13.810 -0.714 1.00 35.13 H new ATOM 0 HH11 ARG A 56 -1.073 -16.508 -0.802 1.00 30.23 H new ATOM 0 HH12 ARG A 56 -1.686 -17.185 0.711 1.00 30.23 H new ATOM 0 HH21 ARG A 56 -4.064 -14.699 1.155 1.00 14.35 H new ATOM 0 HH22 ARG A 56 -3.346 -16.181 1.796 1.00 14.35 H new ATOM 892 N LEU A 57 -2.803 -9.638 -2.579 1.00 4.15 N ATOM 893 CA LEU A 57 -4.128 -9.114 -2.227 1.00 51.22 C ATOM 894 C LEU A 57 -5.231 -9.747 -3.087 1.00 72.40 C ATOM 895 O LEU A 57 -5.216 -9.656 -4.317 1.00 54.31 O ATOM 896 CB LEU A 57 -4.155 -7.586 -2.364 1.00 73.20 C ATOM 897 CG LEU A 57 -5.519 -6.919 -2.082 1.00 64.34 C ATOM 898 CD1 LEU A 57 -6.020 -7.257 -0.678 1.00 41.00 C ATOM 899 CD2 LEU A 57 -5.429 -5.406 -2.271 1.00 2.23 C ATOM 0 H LEU A 57 -2.513 -9.445 -3.538 1.00 4.15 H new ATOM 0 HA LEU A 57 -4.323 -9.379 -1.188 1.00 51.22 H new ATOM 0 HB2 LEU A 57 -3.416 -7.164 -1.683 1.00 73.20 H new ATOM 0 HB3 LEU A 57 -3.843 -7.323 -3.375 1.00 73.20 H new ATOM 0 HG LEU A 57 -6.239 -7.314 -2.799 1.00 64.34 H new ATOM 0 HD11 LEU A 57 -6.982 -6.773 -0.509 1.00 41.00 H new ATOM 0 HD12 LEU A 57 -6.135 -8.337 -0.583 1.00 41.00 H new ATOM 0 HD13 LEU A 57 -5.301 -6.902 0.060 1.00 41.00 H new ATOM 0 HD21 LEU A 57 -6.400 -4.955 -2.068 1.00 2.23 H new ATOM 0 HD22 LEU A 57 -4.688 -4.997 -1.584 1.00 2.23 H new ATOM 0 HD23 LEU A 57 -5.134 -5.184 -3.297 1.00 2.23 H new ATOM 911 N GLU A 58 -6.178 -10.403 -2.424 1.00 72.34 N ATOM 912 CA GLU A 58 -7.342 -10.986 -3.096 1.00 62.32 C ATOM 913 C GLU A 58 -8.439 -9.929 -3.297 1.00 24.14 C ATOM 914 O GLU A 58 -9.007 -9.414 -2.331 1.00 3.34 O ATOM 915 CB GLU A 58 -7.888 -12.156 -2.271 1.00 1.42 C ATOM 916 CG GLU A 58 -9.104 -12.841 -2.889 1.00 1.31 C ATOM 917 CD GLU A 58 -9.675 -13.929 -1.994 1.00 31.24 C ATOM 918 OE1 GLU A 58 -9.199 -15.080 -2.068 1.00 41.52 O ATOM 919 OE2 GLU A 58 -10.601 -13.637 -1.206 1.00 72.14 O ATOM 0 H GLU A 58 -6.164 -10.547 -1.414 1.00 72.34 H new ATOM 0 HA GLU A 58 -7.030 -11.350 -4.075 1.00 62.32 H new ATOM 0 HB2 GLU A 58 -7.097 -12.894 -2.139 1.00 1.42 H new ATOM 0 HB3 GLU A 58 -8.154 -11.793 -1.278 1.00 1.42 H new ATOM 0 HG2 GLU A 58 -9.875 -12.096 -3.088 1.00 1.31 H new ATOM 0 HG3 GLU A 58 -8.824 -13.274 -3.849 1.00 1.31 H new ATOM 926 N SER A 59 -8.735 -9.606 -4.550 1.00 34.22 N ATOM 927 CA SER A 59 -9.738 -8.581 -4.867 1.00 54.42 C ATOM 928 C SER A 59 -10.956 -9.186 -5.572 1.00 64.35 C ATOM 929 O SER A 59 -11.004 -10.387 -5.842 1.00 41.22 O ATOM 930 CB SER A 59 -9.129 -7.496 -5.759 1.00 22.51 C ATOM 931 OG SER A 59 -8.910 -7.978 -7.075 1.00 12.54 O ATOM 0 H SER A 59 -8.299 -10.035 -5.366 1.00 34.22 H new ATOM 0 HA SER A 59 -10.064 -8.143 -3.924 1.00 54.42 H new ATOM 0 HB2 SER A 59 -9.793 -6.632 -5.791 1.00 22.51 H new ATOM 0 HB3 SER A 59 -8.186 -7.157 -5.331 1.00 22.51 H new ATOM 0 HG SER A 59 -8.489 -8.862 -7.034 1.00 12.54 H new ATOM 937 N GLN A 60 -11.935 -8.340 -5.888 1.00 5.02 N ATOM 938 CA GLN A 60 -13.155 -8.792 -6.568 1.00 65.51 C ATOM 939 C GLN A 60 -12.940 -8.986 -8.082 1.00 73.40 C ATOM 940 O GLN A 60 -13.862 -9.365 -8.804 1.00 73.53 O ATOM 941 CB GLN A 60 -14.306 -7.812 -6.289 1.00 15.44 C ATOM 942 CG GLN A 60 -14.735 -7.795 -4.823 1.00 45.51 C ATOM 943 CD GLN A 60 -15.913 -6.878 -4.551 1.00 45.42 C ATOM 944 OE1 GLN A 60 -15.638 -5.644 -4.179 1.00 3.20 O flip ATOM 945 NE2 GLN A 60 -17.068 -7.282 -4.654 1.00 73.42 N flip ATOM 0 H GLN A 60 -11.911 -7.340 -5.686 1.00 5.02 H new ATOM 0 HA GLN A 60 -13.420 -9.770 -6.165 1.00 65.51 H new ATOM 0 HB2 GLN A 60 -14.000 -6.808 -6.584 1.00 15.44 H new ATOM 0 HB3 GLN A 60 -15.162 -8.080 -6.909 1.00 15.44 H new ATOM 0 HG2 GLN A 60 -14.994 -8.808 -4.516 1.00 45.51 H new ATOM 0 HG3 GLN A 60 -13.891 -7.482 -4.209 1.00 45.51 H new ATOM 0 HE21 GLN A 60 -17.248 -8.243 -4.944 1.00 73.42 H new ATOM 0 HE22 GLN A 60 -17.847 -6.657 -4.449 1.00 73.42 H new ATOM 954 N ILE A 61 -11.719 -8.730 -8.558 1.00 4.34 N ATOM 955 CA ILE A 61 -11.346 -9.053 -9.946 1.00 3.43 C ATOM 956 C ILE A 61 -10.351 -10.229 -9.979 1.00 62.24 C ATOM 957 O ILE A 61 -9.845 -10.610 -11.039 1.00 41.22 O ATOM 958 CB ILE A 61 -10.730 -7.832 -10.683 1.00 14.43 C ATOM 959 CG1 ILE A 61 -9.428 -7.380 -10.000 1.00 50.45 C ATOM 960 CG2 ILE A 61 -11.734 -6.681 -10.753 1.00 61.43 C ATOM 961 CD1 ILE A 61 -8.733 -6.229 -10.699 1.00 31.11 C ATOM 0 H ILE A 61 -10.972 -8.303 -8.010 1.00 4.34 H new ATOM 0 HA ILE A 61 -12.263 -9.334 -10.465 1.00 3.43 H new ATOM 0 HB ILE A 61 -10.489 -8.136 -11.701 1.00 14.43 H new ATOM 0 HG12 ILE A 61 -9.651 -7.087 -8.974 1.00 50.45 H new ATOM 0 HG13 ILE A 61 -8.744 -8.227 -9.949 1.00 50.45 H new ATOM 0 HG21 ILE A 61 -11.283 -5.836 -11.273 1.00 61.43 H new ATOM 0 HG22 ILE A 61 -12.623 -7.006 -11.293 1.00 61.43 H new ATOM 0 HG23 ILE A 61 -12.012 -6.379 -9.743 1.00 61.43 H new ATOM 0 HD11 ILE A 61 -7.824 -5.969 -10.157 1.00 31.11 H new ATOM 0 HD12 ILE A 61 -8.477 -6.523 -11.717 1.00 31.11 H new ATOM 0 HD13 ILE A 61 -9.398 -5.366 -10.727 1.00 31.11 H new ATOM 973 N GLY A 62 -10.091 -10.809 -8.804 1.00 62.22 N ATOM 974 CA GLY A 62 -9.134 -11.906 -8.683 1.00 3.55 C ATOM 975 C GLY A 62 -7.930 -11.545 -7.820 1.00 20.30 C ATOM 976 O GLY A 62 -7.909 -10.497 -7.172 1.00 21.33 O ATOM 0 H GLY A 62 -10.531 -10.536 -7.925 1.00 62.22 H new ATOM 0 HA2 GLY A 62 -9.635 -12.774 -8.255 1.00 3.55 H new ATOM 0 HA3 GLY A 62 -8.790 -12.194 -9.677 1.00 3.55 H new ATOM 980 N THR A 63 -6.928 -12.416 -7.800 1.00 33.41 N ATOM 981 CA THR A 63 -5.701 -12.161 -7.037 1.00 40.35 C ATOM 982 C THR A 63 -4.784 -11.178 -7.772 1.00 30.12 C ATOM 983 O THR A 63 -4.560 -11.305 -8.977 1.00 33.12 O ATOM 984 CB THR A 63 -4.907 -13.465 -6.778 1.00 35.21 C ATOM 985 OG1 THR A 63 -5.756 -14.453 -6.175 1.00 41.53 O ATOM 986 CG2 THR A 63 -3.701 -13.214 -5.875 1.00 43.45 C ATOM 0 H THR A 63 -6.936 -13.305 -8.301 1.00 33.41 H new ATOM 0 HA THR A 63 -6.015 -11.733 -6.085 1.00 40.35 H new ATOM 0 HB THR A 63 -4.548 -13.828 -7.741 1.00 35.21 H new ATOM 0 HG1 THR A 63 -5.589 -15.325 -6.590 1.00 41.53 H new ATOM 0 HG21 THR A 63 -3.166 -14.150 -5.714 1.00 43.45 H new ATOM 0 HG22 THR A 63 -3.035 -12.493 -6.349 1.00 43.45 H new ATOM 0 HG23 THR A 63 -4.040 -12.820 -4.917 1.00 43.45 H new ATOM 994 N LEU A 64 -4.257 -10.200 -7.046 1.00 1.22 N ATOM 995 CA LEU A 64 -3.313 -9.241 -7.621 1.00 30.04 C ATOM 996 C LEU A 64 -2.155 -8.945 -6.655 1.00 22.23 C ATOM 997 O LEU A 64 -2.291 -9.065 -5.434 1.00 33.04 O ATOM 998 CB LEU A 64 -4.044 -7.952 -8.058 1.00 23.23 C ATOM 999 CG LEU A 64 -5.059 -7.359 -7.053 1.00 5.13 C ATOM 1000 CD1 LEU A 64 -4.361 -6.726 -5.854 1.00 65.31 C ATOM 1001 CD2 LEU A 64 -5.965 -6.343 -7.749 1.00 51.13 C ATOM 0 H LEU A 64 -4.465 -10.047 -6.059 1.00 1.22 H new ATOM 0 HA LEU A 64 -2.873 -9.689 -8.512 1.00 30.04 H new ATOM 0 HB2 LEU A 64 -3.294 -7.191 -8.274 1.00 23.23 H new ATOM 0 HB3 LEU A 64 -4.568 -8.157 -8.991 1.00 23.23 H new ATOM 0 HG LEU A 64 -5.673 -8.178 -6.678 1.00 5.13 H new ATOM 0 HD11 LEU A 64 -5.107 -6.321 -5.171 1.00 65.31 H new ATOM 0 HD12 LEU A 64 -3.768 -7.481 -5.338 1.00 65.31 H new ATOM 0 HD13 LEU A 64 -3.708 -5.923 -6.195 1.00 65.31 H new ATOM 0 HD21 LEU A 64 -6.674 -5.934 -7.029 1.00 51.13 H new ATOM 0 HD22 LEU A 64 -5.358 -5.536 -8.159 1.00 51.13 H new ATOM 0 HD23 LEU A 64 -6.509 -6.834 -8.556 1.00 51.13 H new ATOM 1013 N ARG A 65 -1.011 -8.574 -7.216 1.00 21.11 N ATOM 1014 CA ARG A 65 0.206 -8.340 -6.434 1.00 24.35 C ATOM 1015 C ARG A 65 0.562 -6.846 -6.388 1.00 35.33 C ATOM 1016 O ARG A 65 1.017 -6.281 -7.379 1.00 73.32 O ATOM 1017 CB ARG A 65 1.363 -9.135 -7.055 1.00 74.12 C ATOM 1018 CG ARG A 65 2.673 -9.037 -6.285 1.00 44.42 C ATOM 1019 CD ARG A 65 3.826 -9.679 -7.052 1.00 41.10 C ATOM 1020 NE ARG A 65 3.572 -11.082 -7.366 1.00 25.54 N ATOM 1021 CZ ARG A 65 3.788 -11.625 -8.536 1.00 62.42 C ATOM 1022 NH1 ARG A 65 4.235 -10.914 -9.525 1.00 74.13 N ATOM 1023 NH2 ARG A 65 3.549 -12.883 -8.714 1.00 60.43 N ATOM 0 H ARG A 65 -0.896 -8.426 -8.219 1.00 21.11 H new ATOM 0 HA ARG A 65 0.031 -8.672 -5.411 1.00 24.35 H new ATOM 0 HB2 ARG A 65 1.073 -10.183 -7.124 1.00 74.12 H new ATOM 0 HB3 ARG A 65 1.526 -8.782 -8.073 1.00 74.12 H new ATOM 0 HG2 ARG A 65 2.904 -7.990 -6.090 1.00 44.42 H new ATOM 0 HG3 ARG A 65 2.564 -9.525 -5.316 1.00 44.42 H new ATOM 0 HD2 ARG A 65 3.996 -9.127 -7.977 1.00 41.10 H new ATOM 0 HD3 ARG A 65 4.739 -9.601 -6.462 1.00 41.10 H new ATOM 0 HE ARG A 65 3.202 -11.677 -6.625 1.00 25.54 H new ATOM 0 HH11 ARG A 65 4.422 -9.920 -9.395 1.00 74.13 H new ATOM 0 HH12 ARG A 65 4.399 -11.349 -10.433 1.00 74.13 H new ATOM 0 HH21 ARG A 65 3.193 -13.449 -7.943 1.00 60.43 H new ATOM 0 HH22 ARG A 65 3.716 -13.310 -9.625 1.00 60.43 H new ATOM 1037 N MET A 66 0.357 -6.208 -5.238 1.00 2.43 N ATOM 1038 CA MET A 66 0.658 -4.777 -5.089 1.00 33.33 C ATOM 1039 C MET A 66 2.016 -4.548 -4.410 1.00 61.22 C ATOM 1040 O MET A 66 2.362 -5.233 -3.445 1.00 43.45 O ATOM 1041 CB MET A 66 -0.451 -4.074 -4.298 1.00 63.51 C ATOM 1042 CG MET A 66 -1.777 -4.005 -5.039 1.00 33.53 C ATOM 1043 SD MET A 66 -3.040 -3.113 -4.112 1.00 43.14 S ATOM 1044 CE MET A 66 -4.379 -3.081 -5.302 1.00 62.21 C ATOM 0 H MET A 66 -0.014 -6.652 -4.398 1.00 2.43 H new ATOM 0 HA MET A 66 0.709 -4.350 -6.090 1.00 33.33 H new ATOM 0 HB2 MET A 66 -0.599 -4.597 -3.353 1.00 63.51 H new ATOM 0 HB3 MET A 66 -0.127 -3.062 -4.055 1.00 63.51 H new ATOM 0 HG2 MET A 66 -1.626 -3.518 -6.002 1.00 33.53 H new ATOM 0 HG3 MET A 66 -2.128 -5.016 -5.244 1.00 33.53 H new ATOM 0 HE1 MET A 66 -4.732 -2.057 -5.425 1.00 62.21 H new ATOM 0 HE2 MET A 66 -4.023 -3.460 -6.260 1.00 62.21 H new ATOM 0 HE3 MET A 66 -5.198 -3.706 -4.946 1.00 62.21 H new ATOM 1054 N SER A 67 2.778 -3.583 -4.921 1.00 11.50 N ATOM 1055 CA SER A 67 4.098 -3.238 -4.359 1.00 12.40 C ATOM 1056 C SER A 67 4.319 -1.720 -4.326 1.00 51.13 C ATOM 1057 O SER A 67 3.640 -0.966 -5.030 1.00 70.00 O ATOM 1058 CB SER A 67 5.221 -3.899 -5.171 1.00 43.31 C ATOM 1059 OG SER A 67 6.501 -3.535 -4.675 1.00 32.04 O ATOM 0 H SER A 67 2.509 -3.019 -5.727 1.00 11.50 H new ATOM 0 HA SER A 67 4.120 -3.612 -3.336 1.00 12.40 H new ATOM 0 HB2 SER A 67 5.109 -4.983 -5.134 1.00 43.31 H new ATOM 0 HB3 SER A 67 5.137 -3.605 -6.217 1.00 43.31 H new ATOM 0 HG SER A 67 7.196 -3.972 -5.210 1.00 32.04 H new ATOM 1065 N LEU A 68 5.283 -1.278 -3.515 1.00 61.30 N ATOM 1066 CA LEU A 68 5.564 0.151 -3.332 1.00 75.41 C ATOM 1067 C LEU A 68 6.947 0.535 -3.882 1.00 21.12 C ATOM 1068 O LEU A 68 7.978 0.176 -3.311 1.00 42.34 O ATOM 1069 CB LEU A 68 5.487 0.519 -1.841 1.00 0.31 C ATOM 1070 CG LEU A 68 4.121 0.306 -1.168 1.00 41.21 C ATOM 1071 CD1 LEU A 68 4.173 0.703 0.307 1.00 33.13 C ATOM 1072 CD2 LEU A 68 3.031 1.089 -1.895 1.00 23.42 C ATOM 0 H LEU A 68 5.887 -1.893 -2.970 1.00 61.30 H new ATOM 0 HA LEU A 68 4.810 0.706 -3.890 1.00 75.41 H new ATOM 0 HB2 LEU A 68 6.231 -0.068 -1.303 1.00 0.31 H new ATOM 0 HB3 LEU A 68 5.766 1.567 -1.730 1.00 0.31 H new ATOM 0 HG LEU A 68 3.878 -0.755 -1.227 1.00 41.21 H new ATOM 0 HD11 LEU A 68 3.195 0.543 0.761 1.00 33.13 H new ATOM 0 HD12 LEU A 68 4.916 0.094 0.822 1.00 33.13 H new ATOM 0 HD13 LEU A 68 4.445 1.755 0.391 1.00 33.13 H new ATOM 0 HD21 LEU A 68 2.073 0.923 -1.402 1.00 23.42 H new ATOM 0 HD22 LEU A 68 3.271 2.152 -1.874 1.00 23.42 H new ATOM 0 HD23 LEU A 68 2.969 0.752 -2.930 1.00 23.42 H new ATOM 1084 N VAL A 69 6.964 1.269 -4.991 1.00 50.11 N ATOM 1085 CA VAL A 69 8.218 1.758 -5.582 1.00 74.51 C ATOM 1086 C VAL A 69 8.271 3.290 -5.586 1.00 42.00 C ATOM 1087 O VAL A 69 7.244 3.955 -5.446 1.00 34.32 O ATOM 1088 CB VAL A 69 8.405 1.250 -7.037 1.00 25.43 C ATOM 1089 CG1 VAL A 69 8.493 -0.269 -7.082 1.00 64.35 C ATOM 1090 CG2 VAL A 69 7.279 1.745 -7.939 1.00 42.32 C ATOM 0 H VAL A 69 6.125 1.542 -5.503 1.00 50.11 H new ATOM 0 HA VAL A 69 9.024 1.366 -4.961 1.00 74.51 H new ATOM 0 HB VAL A 69 9.346 1.657 -7.409 1.00 25.43 H new ATOM 0 HG11 VAL A 69 8.624 -0.595 -8.114 1.00 64.35 H new ATOM 0 HG12 VAL A 69 9.342 -0.602 -6.486 1.00 64.35 H new ATOM 0 HG13 VAL A 69 7.576 -0.699 -6.679 1.00 64.35 H new ATOM 0 HG21 VAL A 69 7.435 1.375 -8.952 1.00 42.32 H new ATOM 0 HG22 VAL A 69 6.324 1.380 -7.562 1.00 42.32 H new ATOM 0 HG23 VAL A 69 7.273 2.835 -7.948 1.00 42.32 H new ATOM 1100 N ASN A 70 9.479 3.843 -5.734 1.00 63.02 N ATOM 1101 CA ASN A 70 9.662 5.293 -5.905 1.00 25.21 C ATOM 1102 C ASN A 70 9.236 6.092 -4.658 1.00 74.33 C ATOM 1103 O ASN A 70 8.954 7.289 -4.747 1.00 71.31 O ATOM 1104 CB ASN A 70 8.871 5.761 -7.134 1.00 44.44 C ATOM 1105 CG ASN A 70 9.386 5.132 -8.415 1.00 52.43 C ATOM 1106 OD1 ASN A 70 10.588 5.051 -8.639 1.00 2.42 O ATOM 1107 ND2 ASN A 70 8.488 4.627 -9.235 1.00 41.01 N ATOM 0 H ASN A 70 10.348 3.309 -5.739 1.00 63.02 H new ATOM 0 HA ASN A 70 10.726 5.481 -6.050 1.00 25.21 H new ATOM 0 HB2 ASN A 70 7.818 5.510 -7.005 1.00 44.44 H new ATOM 0 HB3 ASN A 70 8.932 6.846 -7.213 1.00 44.44 H new ATOM 0 HD21 ASN A 70 8.786 4.151 -10.087 1.00 41.01 H new ATOM 0 HD22 ASN A 70 7.495 4.712 -9.019 1.00 41.01 H new ATOM 1114 N ILE A 71 9.226 5.429 -3.501 1.00 73.02 N ATOM 1115 CA ILE A 71 8.782 6.047 -2.241 1.00 73.04 C ATOM 1116 C ILE A 71 9.664 7.247 -1.846 1.00 55.22 C ATOM 1117 O ILE A 71 10.850 7.086 -1.545 1.00 31.22 O ATOM 1118 CB ILE A 71 8.788 5.013 -1.087 1.00 43.42 C ATOM 1119 CG1 ILE A 71 7.999 3.757 -1.496 1.00 43.13 C ATOM 1120 CG2 ILE A 71 8.203 5.627 0.188 1.00 54.23 C ATOM 1121 CD1 ILE A 71 8.082 2.626 -0.496 1.00 55.22 C ATOM 0 H ILE A 71 9.522 4.457 -3.406 1.00 73.02 H new ATOM 0 HA ILE A 71 7.766 6.404 -2.409 1.00 73.04 H new ATOM 0 HB ILE A 71 9.819 4.724 -0.883 1.00 43.42 H new ATOM 0 HG12 ILE A 71 6.953 4.028 -1.637 1.00 43.13 H new ATOM 0 HG13 ILE A 71 8.370 3.405 -2.459 1.00 43.13 H new ATOM 0 HG21 ILE A 71 8.215 4.886 0.987 1.00 54.23 H new ATOM 0 HG22 ILE A 71 8.800 6.490 0.483 1.00 54.23 H new ATOM 0 HG23 ILE A 71 7.176 5.943 0.002 1.00 54.23 H new ATOM 0 HD11 ILE A 71 7.500 1.778 -0.857 1.00 55.22 H new ATOM 0 HD12 ILE A 71 9.122 2.326 -0.372 1.00 55.22 H new ATOM 0 HD13 ILE A 71 7.683 2.958 0.463 1.00 55.22 H new ATOM 1133 N THR A 72 9.078 8.446 -1.837 1.00 72.24 N ATOM 1134 CA THR A 72 9.821 9.681 -1.521 1.00 23.35 C ATOM 1135 C THR A 72 8.962 10.699 -0.756 1.00 51.40 C ATOM 1136 O THR A 72 7.735 10.697 -0.863 1.00 74.34 O ATOM 1137 CB THR A 72 10.367 10.360 -2.806 1.00 32.44 C ATOM 1138 OG1 THR A 72 9.353 10.387 -3.830 1.00 62.02 O ATOM 1139 CG2 THR A 72 11.613 9.647 -3.320 1.00 10.33 C ATOM 0 H THR A 72 8.090 8.594 -2.044 1.00 72.24 H new ATOM 0 HA THR A 72 10.652 9.374 -0.886 1.00 23.35 H new ATOM 0 HB THR A 72 10.642 11.384 -2.552 1.00 32.44 H new ATOM 0 HG1 THR A 72 9.188 9.476 -4.151 1.00 62.02 H new ATOM 0 HG21 THR A 72 11.972 10.145 -4.220 1.00 10.33 H new ATOM 0 HG22 THR A 72 12.390 9.675 -2.556 1.00 10.33 H new ATOM 0 HG23 THR A 72 11.369 8.610 -3.552 1.00 10.33 H new ATOM 1147 N PRO A 73 9.603 11.591 0.032 1.00 0.30 N ATOM 1148 CA PRO A 73 8.890 12.643 0.781 1.00 21.12 C ATOM 1149 C PRO A 73 8.300 13.732 -0.139 1.00 72.50 C ATOM 1150 O PRO A 73 8.958 14.200 -1.075 1.00 62.53 O ATOM 1151 CB PRO A 73 9.980 13.229 1.692 1.00 4.43 C ATOM 1152 CG PRO A 73 11.261 12.951 0.976 1.00 20.32 C ATOM 1153 CD PRO A 73 11.062 11.640 0.261 1.00 21.15 C ATOM 0 HA PRO A 73 8.031 12.247 1.323 1.00 21.12 H new ATOM 0 HB2 PRO A 73 9.836 14.299 1.845 1.00 4.43 H new ATOM 0 HB3 PRO A 73 9.967 12.762 2.677 1.00 4.43 H new ATOM 0 HG2 PRO A 73 11.495 13.748 0.271 1.00 20.32 H new ATOM 0 HG3 PRO A 73 12.094 12.891 1.676 1.00 20.32 H new ATOM 0 HD2 PRO A 73 11.617 11.606 -0.677 1.00 21.15 H new ATOM 0 HD3 PRO A 73 11.402 10.798 0.864 1.00 21.15 H new ATOM 1161 N ASP A 74 7.062 14.137 0.139 1.00 31.01 N ATOM 1162 CA ASP A 74 6.366 15.145 -0.668 1.00 72.21 C ATOM 1163 C ASP A 74 6.257 16.481 0.087 1.00 51.42 C ATOM 1164 O ASP A 74 6.360 16.523 1.314 1.00 21.33 O ATOM 1165 CB ASP A 74 4.969 14.629 -1.045 1.00 53.11 C ATOM 1166 CG ASP A 74 4.205 15.588 -1.942 1.00 61.44 C ATOM 1167 OD1 ASP A 74 4.562 15.708 -3.128 1.00 32.24 O ATOM 1168 OD2 ASP A 74 3.252 16.235 -1.462 1.00 23.12 O ATOM 0 H ASP A 74 6.515 13.781 0.923 1.00 31.01 H new ATOM 0 HA ASP A 74 6.943 15.321 -1.576 1.00 72.21 H new ATOM 0 HB2 ASP A 74 5.067 13.668 -1.550 1.00 53.11 H new ATOM 0 HB3 ASP A 74 4.394 14.455 -0.135 1.00 53.11 H new ATOM 1173 N ALA A 75 6.051 17.568 -0.657 1.00 12.32 N ATOM 1174 CA ALA A 75 5.888 18.900 -0.063 1.00 32.21 C ATOM 1175 C ALA A 75 4.726 18.934 0.943 1.00 42.42 C ATOM 1176 O ALA A 75 4.791 19.616 1.966 1.00 22.53 O ATOM 1177 CB ALA A 75 5.673 19.939 -1.158 1.00 53.33 C ATOM 0 H ALA A 75 5.993 17.554 -1.675 1.00 12.32 H new ATOM 0 HA ALA A 75 6.802 19.137 0.482 1.00 32.21 H new ATOM 0 HB1 ALA A 75 5.553 20.924 -0.707 1.00 53.33 H new ATOM 0 HB2 ALA A 75 6.535 19.948 -1.825 1.00 53.33 H new ATOM 0 HB3 ALA A 75 4.777 19.689 -1.726 1.00 53.33 H new ATOM 1183 N ASP A 76 3.656 18.204 0.635 1.00 62.25 N ATOM 1184 CA ASP A 76 2.510 18.087 1.538 1.00 61.01 C ATOM 1185 C ASP A 76 2.738 16.937 2.538 1.00 31.12 C ATOM 1186 O ASP A 76 2.682 17.126 3.755 1.00 41.50 O ATOM 1187 CB ASP A 76 1.227 17.849 0.721 1.00 54.23 C ATOM 1188 CG ASP A 76 -0.050 18.119 1.505 1.00 72.12 C ATOM 1189 OD1 ASP A 76 -0.080 17.862 2.725 1.00 40.34 O ATOM 1190 OD2 ASP A 76 -1.031 18.602 0.899 1.00 33.44 O ATOM 0 H ASP A 76 3.557 17.682 -0.236 1.00 62.25 H new ATOM 0 HA ASP A 76 2.400 19.014 2.101 1.00 61.01 H new ATOM 0 HB2 ASP A 76 1.244 18.488 -0.162 1.00 54.23 H new ATOM 0 HB3 ASP A 76 1.216 16.818 0.368 1.00 54.23 H new ATOM 1195 N GLY A 77 3.007 15.742 2.010 1.00 32.45 N ATOM 1196 CA GLY A 77 3.254 14.579 2.860 1.00 54.12 C ATOM 1197 C GLY A 77 4.274 13.605 2.272 1.00 10.33 C ATOM 1198 O GLY A 77 5.480 13.774 2.453 1.00 54.51 O ATOM 0 H GLY A 77 3.059 15.556 1.008 1.00 32.45 H new ATOM 0 HA2 GLY A 77 3.606 14.918 3.834 1.00 54.12 H new ATOM 0 HA3 GLY A 77 2.314 14.053 3.026 1.00 54.12 H new ATOM 1202 N THR A 78 3.794 12.579 1.565 1.00 21.33 N ATOM 1203 CA THR A 78 4.681 11.562 0.966 1.00 25.41 C ATOM 1204 C THR A 78 4.091 10.986 -0.329 1.00 45.55 C ATOM 1205 O THR A 78 2.903 10.682 -0.388 1.00 21.12 O ATOM 1206 CB THR A 78 4.960 10.396 1.949 1.00 42.11 C ATOM 1207 OG1 THR A 78 5.582 10.895 3.140 1.00 32.13 O ATOM 1208 CG2 THR A 78 5.858 9.336 1.311 1.00 51.14 C ATOM 0 H THR A 78 2.801 12.425 1.390 1.00 21.33 H new ATOM 0 HA THR A 78 5.617 12.072 0.738 1.00 25.41 H new ATOM 0 HB THR A 78 4.005 9.934 2.199 1.00 42.11 H new ATOM 0 HG1 THR A 78 4.906 11.318 3.710 1.00 32.13 H new ATOM 0 HG21 THR A 78 6.035 8.532 2.025 1.00 51.14 H new ATOM 0 HG22 THR A 78 5.371 8.932 0.424 1.00 51.14 H new ATOM 0 HG23 THR A 78 6.809 9.787 1.029 1.00 51.14 H new ATOM 1216 N THR A 79 4.920 10.837 -1.360 1.00 62.01 N ATOM 1217 CA THR A 79 4.472 10.270 -2.646 1.00 42.34 C ATOM 1218 C THR A 79 5.177 8.945 -2.965 1.00 44.20 C ATOM 1219 O THR A 79 6.404 8.840 -2.898 1.00 71.32 O ATOM 1220 CB THR A 79 4.703 11.254 -3.821 1.00 71.01 C ATOM 1221 OG1 THR A 79 6.061 11.719 -3.823 1.00 64.54 O ATOM 1222 CG2 THR A 79 3.753 12.445 -3.740 1.00 74.22 C ATOM 0 H THR A 79 5.906 11.098 -1.338 1.00 62.01 H new ATOM 0 HA THR A 79 3.403 10.088 -2.536 1.00 42.34 H new ATOM 0 HB THR A 79 4.503 10.716 -4.748 1.00 71.01 H new ATOM 0 HG1 THR A 79 6.657 10.990 -3.551 1.00 64.54 H new ATOM 0 HG21 THR A 79 3.940 13.117 -4.578 1.00 74.22 H new ATOM 0 HG22 THR A 79 2.723 12.092 -3.781 1.00 74.22 H new ATOM 0 HG23 THR A 79 3.917 12.978 -2.804 1.00 74.22 H new ATOM 1230 N LEU A 80 4.385 7.930 -3.311 1.00 3.40 N ATOM 1231 CA LEU A 80 4.913 6.612 -3.686 1.00 72.53 C ATOM 1232 C LEU A 80 4.095 5.989 -4.831 1.00 32.10 C ATOM 1233 O LEU A 80 2.905 6.265 -4.979 1.00 24.25 O ATOM 1234 CB LEU A 80 4.955 5.684 -2.450 1.00 4.52 C ATOM 1235 CG LEU A 80 3.660 5.594 -1.611 1.00 40.11 C ATOM 1236 CD1 LEU A 80 2.613 4.708 -2.283 1.00 64.01 C ATOM 1237 CD2 LEU A 80 3.963 5.085 -0.203 1.00 24.32 C ATOM 0 H LEU A 80 3.367 7.994 -3.340 1.00 3.40 H new ATOM 0 HA LEU A 80 5.932 6.739 -4.052 1.00 72.53 H new ATOM 0 HB2 LEU A 80 5.214 4.680 -2.786 1.00 4.52 H new ATOM 0 HB3 LEU A 80 5.761 6.020 -1.798 1.00 4.52 H new ATOM 0 HG LEU A 80 3.247 6.600 -1.539 1.00 40.11 H new ATOM 0 HD11 LEU A 80 1.717 4.669 -1.663 1.00 64.01 H new ATOM 0 HD12 LEU A 80 2.361 5.120 -3.260 1.00 64.01 H new ATOM 0 HD13 LEU A 80 3.013 3.701 -2.406 1.00 64.01 H new ATOM 0 HD21 LEU A 80 3.038 5.029 0.371 1.00 24.32 H new ATOM 0 HD22 LEU A 80 4.413 4.094 -0.263 1.00 24.32 H new ATOM 0 HD23 LEU A 80 4.655 5.768 0.290 1.00 24.32 H new ATOM 1249 N THR A 81 4.737 5.164 -5.649 1.00 41.33 N ATOM 1250 CA THR A 81 4.062 4.534 -6.791 1.00 52.04 C ATOM 1251 C THR A 81 3.496 3.154 -6.425 1.00 51.13 C ATOM 1252 O THR A 81 4.248 2.206 -6.177 1.00 51.33 O ATOM 1253 CB THR A 81 5.014 4.368 -7.998 1.00 71.42 C ATOM 1254 OG1 THR A 81 5.638 5.619 -8.333 1.00 40.42 O ATOM 1255 CG2 THR A 81 4.268 3.832 -9.220 1.00 33.15 C ATOM 0 H THR A 81 5.720 4.912 -5.549 1.00 41.33 H new ATOM 0 HA THR A 81 3.244 5.201 -7.063 1.00 52.04 H new ATOM 0 HB THR A 81 5.781 3.650 -7.710 1.00 71.42 H new ATOM 0 HG1 THR A 81 5.683 5.711 -9.308 1.00 40.42 H new ATOM 0 HG21 THR A 81 4.963 3.726 -10.053 1.00 33.15 H new ATOM 0 HG22 THR A 81 3.833 2.861 -8.984 1.00 33.15 H new ATOM 0 HG23 THR A 81 3.475 4.527 -9.496 1.00 33.15 H new ATOM 1263 N LEU A 82 2.171 3.050 -6.401 1.00 50.44 N ATOM 1264 CA LEU A 82 1.489 1.784 -6.120 1.00 14.21 C ATOM 1265 C LEU A 82 1.306 0.990 -7.426 1.00 61.43 C ATOM 1266 O LEU A 82 0.570 1.406 -8.321 1.00 64.51 O ATOM 1267 CB LEU A 82 0.127 2.074 -5.446 1.00 44.14 C ATOM 1268 CG LEU A 82 -0.608 0.878 -4.793 1.00 24.15 C ATOM 1269 CD1 LEU A 82 -1.225 -0.053 -5.835 1.00 50.34 C ATOM 1270 CD2 LEU A 82 0.328 0.101 -3.868 1.00 2.23 C ATOM 0 H LEU A 82 1.540 3.833 -6.574 1.00 50.44 H new ATOM 0 HA LEU A 82 2.090 1.181 -5.439 1.00 14.21 H new ATOM 0 HB2 LEU A 82 0.284 2.833 -4.680 1.00 44.14 H new ATOM 0 HB3 LEU A 82 -0.535 2.509 -6.195 1.00 44.14 H new ATOM 0 HG LEU A 82 -1.423 1.290 -4.198 1.00 24.15 H new ATOM 0 HD11 LEU A 82 -1.730 -0.878 -5.332 1.00 50.34 H new ATOM 0 HD12 LEU A 82 -1.945 0.501 -6.437 1.00 50.34 H new ATOM 0 HD13 LEU A 82 -0.440 -0.448 -6.480 1.00 50.34 H new ATOM 0 HD21 LEU A 82 -0.212 -0.734 -3.422 1.00 2.23 H new ATOM 0 HD22 LEU A 82 1.174 -0.279 -4.442 1.00 2.23 H new ATOM 0 HD23 LEU A 82 0.691 0.761 -3.080 1.00 2.23 H new ATOM 1282 N ARG A 83 1.993 -0.148 -7.542 1.00 21.41 N ATOM 1283 CA ARG A 83 1.933 -0.968 -8.764 1.00 42.02 C ATOM 1284 C ARG A 83 1.193 -2.296 -8.535 1.00 62.33 C ATOM 1285 O ARG A 83 1.442 -2.996 -7.552 1.00 35.34 O ATOM 1286 CB ARG A 83 3.348 -1.230 -9.303 1.00 2.43 C ATOM 1287 CG ARG A 83 4.033 0.031 -9.821 1.00 22.33 C ATOM 1288 CD ARG A 83 5.344 -0.272 -10.540 1.00 51.13 C ATOM 1289 NE ARG A 83 5.807 0.879 -11.316 1.00 71.11 N ATOM 1290 CZ ARG A 83 6.711 0.818 -12.259 1.00 73.03 C ATOM 1291 NH1 ARG A 83 7.342 -0.288 -12.507 1.00 5.52 N ATOM 1292 NH2 ARG A 83 6.996 1.880 -12.940 1.00 3.41 N ATOM 0 H ARG A 83 2.596 -0.526 -6.811 1.00 21.41 H new ATOM 0 HA ARG A 83 1.366 -0.404 -9.505 1.00 42.02 H new ATOM 0 HB2 ARG A 83 3.957 -1.668 -8.512 1.00 2.43 H new ATOM 0 HB3 ARG A 83 3.294 -1.964 -10.107 1.00 2.43 H new ATOM 0 HG2 ARG A 83 3.361 0.553 -10.502 1.00 22.33 H new ATOM 0 HG3 ARG A 83 4.227 0.705 -8.986 1.00 22.33 H new ATOM 0 HD2 ARG A 83 6.105 -0.550 -9.811 1.00 51.13 H new ATOM 0 HD3 ARG A 83 5.208 -1.128 -11.201 1.00 51.13 H new ATOM 0 HE ARG A 83 5.397 1.790 -11.107 1.00 71.11 H new ATOM 0 HH11 ARG A 83 7.136 -1.126 -11.963 1.00 5.52 H new ATOM 0 HH12 ARG A 83 8.044 -0.320 -13.246 1.00 5.52 H new ATOM 0 HH21 ARG A 83 6.517 2.758 -12.740 1.00 3.41 H new ATOM 0 HH22 ARG A 83 7.700 1.840 -13.677 1.00 3.41 H new ATOM 1306 N ILE A 84 0.288 -2.632 -9.461 1.00 4.42 N ATOM 1307 CA ILE A 84 -0.538 -3.842 -9.364 1.00 25.23 C ATOM 1308 C ILE A 84 -0.187 -4.846 -10.478 1.00 3.14 C ATOM 1309 O ILE A 84 -0.483 -4.611 -11.652 1.00 75.50 O ATOM 1310 CB ILE A 84 -2.057 -3.515 -9.467 1.00 42.51 C ATOM 1311 CG1 ILE A 84 -2.466 -2.397 -8.484 1.00 0.33 C ATOM 1312 CG2 ILE A 84 -2.892 -4.774 -9.228 1.00 22.22 C ATOM 1313 CD1 ILE A 84 -2.197 -0.993 -8.993 1.00 43.53 C ATOM 0 H ILE A 84 0.107 -2.075 -10.296 1.00 4.42 H new ATOM 0 HA ILE A 84 -0.327 -4.278 -8.388 1.00 25.23 H new ATOM 0 HB ILE A 84 -2.250 -3.152 -10.476 1.00 42.51 H new ATOM 0 HG12 ILE A 84 -3.529 -2.494 -8.263 1.00 0.33 H new ATOM 0 HG13 ILE A 84 -1.931 -2.540 -7.545 1.00 0.33 H new ATOM 0 HG21 ILE A 84 -3.951 -4.528 -9.304 1.00 22.22 H new ATOM 0 HG22 ILE A 84 -2.640 -5.525 -9.976 1.00 22.22 H new ATOM 0 HG23 ILE A 84 -2.681 -5.167 -8.234 1.00 22.22 H new ATOM 0 HD11 ILE A 84 -2.513 -0.267 -8.243 1.00 43.53 H new ATOM 0 HD12 ILE A 84 -1.131 -0.874 -9.187 1.00 43.53 H new ATOM 0 HD13 ILE A 84 -2.754 -0.827 -9.915 1.00 43.53 H new ATOM 1325 N GLN A 85 0.446 -5.957 -10.105 1.00 55.43 N ATOM 1326 CA GLN A 85 0.774 -7.023 -11.058 1.00 63.01 C ATOM 1327 C GLN A 85 -0.327 -8.098 -11.091 1.00 40.14 C ATOM 1328 O GLN A 85 -0.926 -8.423 -10.064 1.00 4.53 O ATOM 1329 CB GLN A 85 2.132 -7.651 -10.707 1.00 52.01 C ATOM 1330 CG GLN A 85 3.303 -6.678 -10.835 1.00 61.24 C ATOM 1331 CD GLN A 85 4.644 -7.308 -10.495 1.00 10.12 C ATOM 1332 OE1 GLN A 85 4.734 -8.213 -9.669 1.00 60.40 O ATOM 1333 NE2 GLN A 85 5.699 -6.839 -11.129 1.00 51.10 N ATOM 0 H GLN A 85 0.744 -6.145 -9.148 1.00 55.43 H new ATOM 0 HA GLN A 85 0.838 -6.581 -12.052 1.00 63.01 H new ATOM 0 HB2 GLN A 85 2.095 -8.031 -9.686 1.00 52.01 H new ATOM 0 HB3 GLN A 85 2.307 -8.507 -11.359 1.00 52.01 H new ATOM 0 HG2 GLN A 85 3.338 -6.293 -11.854 1.00 61.24 H new ATOM 0 HG3 GLN A 85 3.132 -5.825 -10.178 1.00 61.24 H new ATOM 0 HE21 GLN A 85 5.592 -6.087 -11.810 1.00 51.10 H new ATOM 0 HE22 GLN A 85 6.623 -7.228 -10.939 1.00 51.10 H new ATOM 1342 N GLY A 86 -0.587 -8.644 -12.278 1.00 55.25 N ATOM 1343 CA GLY A 86 -1.658 -9.625 -12.444 1.00 24.24 C ATOM 1344 C GLY A 86 -1.248 -11.059 -12.100 1.00 75.31 C ATOM 1345 O GLY A 86 -0.099 -11.455 -12.309 1.00 43.12 O ATOM 0 H GLY A 86 -0.075 -8.426 -13.133 1.00 55.25 H new ATOM 0 HA2 GLY A 86 -2.500 -9.338 -11.815 1.00 24.24 H new ATOM 0 HA3 GLY A 86 -2.007 -9.596 -13.476 1.00 24.24 H new ATOM 1349 N GLU A 87 -2.198 -11.835 -11.571 1.00 72.04 N ATOM 1350 CA GLU A 87 -1.975 -13.252 -11.244 1.00 41.23 C ATOM 1351 C GLU A 87 -1.874 -14.126 -12.508 1.00 64.55 C ATOM 1352 O GLU A 87 -0.983 -14.973 -12.623 1.00 54.04 O ATOM 1353 CB GLU A 87 -3.124 -13.764 -10.356 1.00 64.23 C ATOM 1354 CG GLU A 87 -3.109 -15.273 -10.104 1.00 3.53 C ATOM 1355 CD GLU A 87 -4.354 -15.761 -9.376 1.00 12.40 C ATOM 1356 OE1 GLU A 87 -5.462 -15.661 -9.954 1.00 72.14 O ATOM 1357 OE2 GLU A 87 -4.239 -16.256 -8.235 1.00 34.01 O ATOM 0 H GLU A 87 -3.139 -11.504 -11.357 1.00 72.04 H new ATOM 0 HA GLU A 87 -1.026 -13.324 -10.712 1.00 41.23 H new ATOM 0 HB2 GLU A 87 -3.082 -13.248 -9.397 1.00 64.23 H new ATOM 0 HB3 GLU A 87 -4.073 -13.496 -10.821 1.00 64.23 H new ATOM 0 HG2 GLU A 87 -3.022 -15.795 -11.057 1.00 3.53 H new ATOM 0 HG3 GLU A 87 -2.227 -15.530 -9.518 1.00 3.53 H new ATOM 1364 N SER A 88 -2.796 -13.923 -13.449 1.00 63.41 N ATOM 1365 CA SER A 88 -2.878 -14.756 -14.660 1.00 71.14 C ATOM 1366 C SER A 88 -2.289 -14.051 -15.891 1.00 42.44 C ATOM 1367 O SER A 88 -1.831 -12.910 -15.817 1.00 54.41 O ATOM 1368 CB SER A 88 -4.341 -15.132 -14.940 1.00 35.02 C ATOM 1369 OG SER A 88 -4.459 -15.943 -16.104 1.00 22.11 O ATOM 0 H SER A 88 -3.501 -13.188 -13.400 1.00 63.41 H new ATOM 0 HA SER A 88 -2.288 -15.653 -14.475 1.00 71.14 H new ATOM 0 HB2 SER A 88 -4.751 -15.664 -14.082 1.00 35.02 H new ATOM 0 HB3 SER A 88 -4.933 -14.225 -15.066 1.00 35.02 H new ATOM 0 HG SER A 88 -5.117 -15.547 -16.713 1.00 22.11 H new ATOM 1375 N ASN A 89 -2.325 -14.745 -17.030 1.00 64.35 N ATOM 1376 CA ASN A 89 -1.840 -14.195 -18.305 1.00 15.21 C ATOM 1377 C ASN A 89 -2.929 -13.361 -19.002 1.00 73.12 C ATOM 1378 O ASN A 89 -2.786 -12.974 -20.164 1.00 3.14 O ATOM 1379 CB ASN A 89 -1.384 -15.330 -19.230 1.00 42.10 C ATOM 1380 CG ASN A 89 -0.305 -16.204 -18.611 1.00 41.03 C ATOM 1381 OD1 ASN A 89 0.546 -15.625 -17.786 1.00 32.43 O flip ATOM 1382 ND2 ASN A 89 -0.230 -17.397 -18.883 1.00 41.25 N flip ATOM 0 H ASN A 89 -2.687 -15.696 -17.099 1.00 64.35 H new ATOM 0 HA ASN A 89 -0.995 -13.542 -18.089 1.00 15.21 H new ATOM 0 HB2 ASN A 89 -2.243 -15.950 -19.486 1.00 42.10 H new ATOM 0 HB3 ASN A 89 -1.009 -14.904 -20.161 1.00 42.10 H new ATOM 0 HD21 ASN A 89 -0.903 -17.817 -19.525 1.00 41.25 H new ATOM 0 HD22 ASN A 89 0.505 -17.970 -18.468 1.00 41.25 H new ATOM 1389 N ASP A 90 -4.015 -13.095 -18.279 1.00 72.33 N ATOM 1390 CA ASP A 90 -5.130 -12.298 -18.793 1.00 55.13 C ATOM 1391 C ASP A 90 -5.108 -10.876 -18.199 1.00 70.12 C ATOM 1392 O ASP A 90 -4.720 -10.688 -17.044 1.00 14.01 O ATOM 1393 CB ASP A 90 -6.457 -12.984 -18.453 1.00 51.34 C ATOM 1394 CG ASP A 90 -6.537 -14.392 -19.011 1.00 74.51 C ATOM 1395 OD1 ASP A 90 -6.840 -14.544 -20.214 1.00 41.11 O ATOM 1396 OD2 ASP A 90 -6.302 -15.358 -18.254 1.00 1.44 O ATOM 0 H ASP A 90 -4.148 -13.424 -17.323 1.00 72.33 H new ATOM 0 HA ASP A 90 -5.028 -12.219 -19.875 1.00 55.13 H new ATOM 0 HB2 ASP A 90 -6.579 -13.017 -17.370 1.00 51.34 H new ATOM 0 HB3 ASP A 90 -7.282 -12.391 -18.849 1.00 51.34 H new ATOM 1401 N PRO A 91 -5.524 -9.858 -18.980 1.00 31.42 N ATOM 1402 CA PRO A 91 -5.572 -8.465 -18.504 1.00 24.42 C ATOM 1403 C PRO A 91 -6.749 -8.200 -17.542 1.00 51.32 C ATOM 1404 O PRO A 91 -7.896 -8.566 -17.823 1.00 72.30 O ATOM 1405 CB PRO A 91 -5.732 -7.664 -19.802 1.00 1.31 C ATOM 1406 CG PRO A 91 -6.445 -8.589 -20.732 1.00 22.14 C ATOM 1407 CD PRO A 91 -5.969 -9.978 -20.385 1.00 3.12 C ATOM 0 HA PRO A 91 -4.688 -8.198 -17.925 1.00 24.42 H new ATOM 0 HB2 PRO A 91 -6.304 -6.751 -19.636 1.00 1.31 H new ATOM 0 HB3 PRO A 91 -4.764 -7.365 -20.205 1.00 1.31 H new ATOM 0 HG2 PRO A 91 -7.525 -8.506 -20.613 1.00 22.14 H new ATOM 0 HG3 PRO A 91 -6.220 -8.348 -21.771 1.00 22.14 H new ATOM 0 HD2 PRO A 91 -6.768 -10.712 -20.490 1.00 3.12 H new ATOM 0 HD3 PRO A 91 -5.155 -10.296 -21.037 1.00 3.12 H new ATOM 1415 N LEU A 92 -6.462 -7.563 -16.408 1.00 62.31 N ATOM 1416 CA LEU A 92 -7.491 -7.238 -15.413 1.00 20.52 C ATOM 1417 C LEU A 92 -8.292 -5.982 -15.816 1.00 2.24 C ATOM 1418 O LEU A 92 -7.758 -5.074 -16.463 1.00 34.40 O ATOM 1419 CB LEU A 92 -6.837 -7.032 -14.037 1.00 13.43 C ATOM 1420 CG LEU A 92 -6.092 -8.255 -13.467 1.00 10.45 C ATOM 1421 CD1 LEU A 92 -5.447 -7.915 -12.123 1.00 52.40 C ATOM 1422 CD2 LEU A 92 -7.036 -9.449 -13.324 1.00 41.32 C ATOM 0 H LEU A 92 -5.523 -7.259 -16.152 1.00 62.31 H new ATOM 0 HA LEU A 92 -8.189 -8.073 -15.362 1.00 20.52 H new ATOM 0 HB2 LEU A 92 -6.135 -6.201 -14.109 1.00 13.43 H new ATOM 0 HB3 LEU A 92 -7.610 -6.736 -13.327 1.00 13.43 H new ATOM 0 HG LEU A 92 -5.303 -8.528 -14.168 1.00 10.45 H new ATOM 0 HD11 LEU A 92 -4.926 -8.791 -11.737 1.00 52.40 H new ATOM 0 HD12 LEU A 92 -4.736 -7.100 -12.257 1.00 52.40 H new ATOM 0 HD13 LEU A 92 -6.219 -7.611 -11.416 1.00 52.40 H new ATOM 0 HD21 LEU A 92 -6.488 -10.300 -12.920 1.00 41.32 H new ATOM 0 HD22 LEU A 92 -7.852 -9.189 -12.649 1.00 41.32 H new ATOM 0 HD23 LEU A 92 -7.443 -9.710 -14.301 1.00 41.32 H new ATOM 1434 N PRO A 93 -9.592 -5.918 -15.456 1.00 10.14 N ATOM 1435 CA PRO A 93 -10.443 -4.739 -15.726 1.00 72.43 C ATOM 1436 C PRO A 93 -10.061 -3.510 -14.875 1.00 52.31 C ATOM 1437 O PRO A 93 -9.109 -3.548 -14.095 1.00 1.10 O ATOM 1438 CB PRO A 93 -11.865 -5.226 -15.364 1.00 24.41 C ATOM 1439 CG PRO A 93 -11.755 -6.714 -15.244 1.00 12.13 C ATOM 1440 CD PRO A 93 -10.349 -6.985 -14.788 1.00 42.02 C ATOM 0 HA PRO A 93 -10.340 -4.403 -16.758 1.00 72.43 H new ATOM 0 HB2 PRO A 93 -12.207 -4.780 -14.430 1.00 24.41 H new ATOM 0 HB3 PRO A 93 -12.584 -4.946 -16.133 1.00 24.41 H new ATOM 0 HG2 PRO A 93 -12.480 -7.103 -14.529 1.00 12.13 H new ATOM 0 HG3 PRO A 93 -11.957 -7.199 -16.199 1.00 12.13 H new ATOM 0 HD2 PRO A 93 -10.256 -6.932 -13.703 1.00 42.02 H new ATOM 0 HD3 PRO A 93 -10.008 -7.975 -15.089 1.00 42.02 H new ATOM 1448 N ALA A 94 -10.810 -2.417 -15.035 1.00 72.11 N ATOM 1449 CA ALA A 94 -10.576 -1.189 -14.259 1.00 63.40 C ATOM 1450 C ALA A 94 -11.143 -1.309 -12.832 1.00 13.42 C ATOM 1451 O ALA A 94 -12.295 -1.714 -12.644 1.00 34.31 O ATOM 1452 CB ALA A 94 -11.189 0.009 -14.979 1.00 20.12 C ATOM 0 H ALA A 94 -11.585 -2.353 -15.695 1.00 72.11 H new ATOM 0 HA ALA A 94 -9.499 -1.041 -14.175 1.00 63.40 H new ATOM 0 HB1 ALA A 94 -11.011 0.913 -14.397 1.00 20.12 H new ATOM 0 HB2 ALA A 94 -10.732 0.115 -15.963 1.00 20.12 H new ATOM 0 HB3 ALA A 94 -12.262 -0.144 -15.092 1.00 20.12 H new ATOM 1458 N PHE A 95 -10.341 -0.935 -11.833 1.00 45.31 N ATOM 1459 CA PHE A 95 -10.724 -1.102 -10.425 1.00 75.24 C ATOM 1460 C PHE A 95 -10.362 0.127 -9.570 1.00 13.41 C ATOM 1461 O PHE A 95 -9.656 1.032 -10.016 1.00 2.45 O ATOM 1462 CB PHE A 95 -10.057 -2.362 -9.846 1.00 54.31 C ATOM 1463 CG PHE A 95 -8.547 -2.358 -9.927 1.00 71.40 C ATOM 1464 CD1 PHE A 95 -7.897 -2.731 -11.098 1.00 65.12 C ATOM 1465 CD2 PHE A 95 -7.778 -1.981 -8.834 1.00 2.14 C ATOM 1466 CE1 PHE A 95 -6.517 -2.736 -11.171 1.00 41.51 C ATOM 1467 CE2 PHE A 95 -6.398 -1.987 -8.905 1.00 62.10 C ATOM 1468 CZ PHE A 95 -5.767 -2.358 -10.076 1.00 22.44 C ATOM 0 H PHE A 95 -9.422 -0.514 -11.970 1.00 45.31 H new ATOM 0 HA PHE A 95 -11.808 -1.210 -10.393 1.00 75.24 H new ATOM 0 HB2 PHE A 95 -10.353 -2.469 -8.803 1.00 54.31 H new ATOM 0 HB3 PHE A 95 -10.436 -3.236 -10.376 1.00 54.31 H new ATOM 0 HD1 PHE A 95 -8.478 -3.020 -11.961 1.00 65.12 H new ATOM 0 HD2 PHE A 95 -8.264 -1.680 -7.918 1.00 2.14 H new ATOM 0 HE1 PHE A 95 -6.026 -3.036 -12.085 1.00 41.51 H new ATOM 0 HE2 PHE A 95 -5.812 -1.701 -8.044 1.00 62.10 H new ATOM 0 HZ PHE A 95 -4.689 -2.352 -10.135 1.00 22.44 H new ATOM 1478 N SER A 96 -10.853 0.143 -8.331 1.00 74.50 N ATOM 1479 CA SER A 96 -10.594 1.244 -7.388 1.00 44.20 C ATOM 1480 C SER A 96 -10.687 0.746 -5.943 1.00 41.14 C ATOM 1481 O SER A 96 -11.343 -0.260 -5.675 1.00 33.22 O ATOM 1482 CB SER A 96 -11.606 2.380 -7.594 1.00 44.33 C ATOM 1483 OG SER A 96 -12.934 1.931 -7.356 1.00 30.01 O ATOM 0 H SER A 96 -11.439 -0.600 -7.949 1.00 74.50 H new ATOM 0 HA SER A 96 -9.588 1.618 -7.578 1.00 44.20 H new ATOM 0 HB2 SER A 96 -11.372 3.206 -6.922 1.00 44.33 H new ATOM 0 HB3 SER A 96 -11.525 2.763 -8.611 1.00 44.33 H new ATOM 0 HG SER A 96 -13.560 2.673 -7.492 1.00 30.01 H new ATOM 1489 N GLY A 97 -10.044 1.449 -5.014 1.00 63.14 N ATOM 1490 CA GLY A 97 -10.084 1.044 -3.611 1.00 22.41 C ATOM 1491 C GLY A 97 -9.693 2.153 -2.639 1.00 55.25 C ATOM 1492 O GLY A 97 -9.490 3.298 -3.035 1.00 75.04 O ATOM 0 H GLY A 97 -9.497 2.289 -5.202 1.00 63.14 H new ATOM 0 HA2 GLY A 97 -11.090 0.700 -3.370 1.00 22.41 H new ATOM 0 HA3 GLY A 97 -9.415 0.196 -3.468 1.00 22.41 H new ATOM 1496 N THR A 98 -9.586 1.803 -1.360 1.00 1.21 N ATOM 1497 CA THR A 98 -9.212 2.758 -0.310 1.00 45.14 C ATOM 1498 C THR A 98 -7.930 2.308 0.405 1.00 51.53 C ATOM 1499 O THR A 98 -7.719 1.113 0.630 1.00 23.23 O ATOM 1500 CB THR A 98 -10.339 2.908 0.742 1.00 52.22 C ATOM 1501 OG1 THR A 98 -11.590 3.184 0.094 1.00 43.14 O ATOM 1502 CG2 THR A 98 -10.027 4.021 1.744 1.00 53.53 C ATOM 0 H THR A 98 -9.754 0.856 -1.019 1.00 1.21 H new ATOM 0 HA THR A 98 -9.045 3.719 -0.797 1.00 45.14 H new ATOM 0 HB THR A 98 -10.408 1.966 1.286 1.00 52.22 H new ATOM 0 HG1 THR A 98 -12.246 2.499 0.343 1.00 43.14 H new ATOM 0 HG21 THR A 98 -10.839 4.098 2.467 1.00 53.53 H new ATOM 0 HG22 THR A 98 -9.098 3.791 2.265 1.00 53.53 H new ATOM 0 HG23 THR A 98 -9.922 4.968 1.215 1.00 53.53 H new ATOM 1510 N VAL A 99 -7.080 3.265 0.768 1.00 54.10 N ATOM 1511 CA VAL A 99 -5.818 2.969 1.457 1.00 5.41 C ATOM 1512 C VAL A 99 -5.752 3.626 2.852 1.00 45.41 C ATOM 1513 O VAL A 99 -6.001 4.822 3.003 1.00 50.44 O ATOM 1514 CB VAL A 99 -4.598 3.424 0.609 1.00 31.33 C ATOM 1515 CG1 VAL A 99 -4.700 4.902 0.236 1.00 43.10 C ATOM 1516 CG2 VAL A 99 -3.292 3.140 1.345 1.00 32.34 C ATOM 0 H VAL A 99 -7.240 4.258 0.597 1.00 54.10 H new ATOM 0 HA VAL A 99 -5.781 1.888 1.588 1.00 5.41 H new ATOM 0 HB VAL A 99 -4.603 2.848 -0.316 1.00 31.33 H new ATOM 0 HG11 VAL A 99 -3.831 5.188 -0.357 1.00 43.10 H new ATOM 0 HG12 VAL A 99 -5.607 5.069 -0.345 1.00 43.10 H new ATOM 0 HG13 VAL A 99 -4.735 5.505 1.144 1.00 43.10 H new ATOM 0 HG21 VAL A 99 -2.451 3.466 0.733 1.00 32.34 H new ATOM 0 HG22 VAL A 99 -3.283 3.680 2.292 1.00 32.34 H new ATOM 0 HG23 VAL A 99 -3.208 2.070 1.537 1.00 32.34 H new ATOM 1526 N GLU A 100 -5.428 2.820 3.863 1.00 24.33 N ATOM 1527 CA GLU A 100 -5.244 3.299 5.240 1.00 65.05 C ATOM 1528 C GLU A 100 -3.752 3.562 5.512 1.00 23.01 C ATOM 1529 O GLU A 100 -2.954 2.625 5.541 1.00 51.32 O ATOM 1530 CB GLU A 100 -5.747 2.242 6.240 1.00 75.24 C ATOM 1531 CG GLU A 100 -7.122 1.658 5.925 1.00 2.53 C ATOM 1532 CD GLU A 100 -8.266 2.640 6.123 1.00 50.45 C ATOM 1533 OE1 GLU A 100 -8.640 2.895 7.287 1.00 42.51 O ATOM 1534 OE2 GLU A 100 -8.823 3.122 5.116 1.00 61.22 O ATOM 0 H GLU A 100 -5.285 1.816 3.754 1.00 24.33 H new ATOM 0 HA GLU A 100 -5.811 4.222 5.361 1.00 65.05 H new ATOM 0 HB2 GLU A 100 -5.023 1.428 6.279 1.00 75.24 H new ATOM 0 HB3 GLU A 100 -5.778 2.689 7.234 1.00 75.24 H new ATOM 0 HG2 GLU A 100 -7.130 1.309 4.893 1.00 2.53 H new ATOM 0 HG3 GLU A 100 -7.290 0.787 6.558 1.00 2.53 H new ATOM 1541 N TYR A 101 -3.367 4.818 5.712 1.00 14.14 N ATOM 1542 CA TYR A 101 -1.957 5.145 5.974 1.00 13.20 C ATOM 1543 C TYR A 101 -1.782 5.924 7.287 1.00 35.33 C ATOM 1544 O TYR A 101 -2.441 6.941 7.512 1.00 43.33 O ATOM 1545 CB TYR A 101 -1.352 5.923 4.794 1.00 42.42 C ATOM 1546 CG TYR A 101 -2.001 7.271 4.508 1.00 20.13 C ATOM 1547 CD1 TYR A 101 -3.170 7.366 3.754 1.00 41.34 C ATOM 1548 CD2 TYR A 101 -1.427 8.453 4.972 1.00 22.20 C ATOM 1549 CE1 TYR A 101 -3.739 8.595 3.468 1.00 23.12 C ATOM 1550 CE2 TYR A 101 -1.996 9.682 4.696 1.00 24.03 C ATOM 1551 CZ TYR A 101 -3.150 9.749 3.945 1.00 53.30 C ATOM 1552 OH TYR A 101 -3.704 10.975 3.657 1.00 24.15 O ATOM 0 H TYR A 101 -3.996 5.621 5.700 1.00 14.14 H new ATOM 0 HA TYR A 101 -1.419 4.203 6.083 1.00 13.20 H new ATOM 0 HB2 TYR A 101 -0.292 6.082 4.989 1.00 42.42 H new ATOM 0 HB3 TYR A 101 -1.422 5.306 3.898 1.00 42.42 H new ATOM 0 HD1 TYR A 101 -3.640 6.465 3.387 1.00 41.34 H new ATOM 0 HD2 TYR A 101 -0.521 8.408 5.558 1.00 22.20 H new ATOM 0 HE1 TYR A 101 -4.640 8.651 2.874 1.00 23.12 H new ATOM 0 HE2 TYR A 101 -1.538 10.587 5.067 1.00 24.03 H new ATOM 0 HH TYR A 101 -3.166 11.682 4.070 1.00 24.15 H new ATOM 1562 N GLY A 102 -0.887 5.437 8.150 1.00 42.33 N ATOM 1563 CA GLY A 102 -0.652 6.084 9.437 1.00 53.42 C ATOM 1564 C GLY A 102 0.556 5.523 10.182 1.00 70.23 C ATOM 1565 O GLY A 102 1.477 4.977 9.568 1.00 70.43 O ATOM 0 H GLY A 102 -0.320 4.606 7.981 1.00 42.33 H new ATOM 0 HA2 GLY A 102 -0.508 7.153 9.278 1.00 53.42 H new ATOM 0 HA3 GLY A 102 -1.539 5.971 10.060 1.00 53.42 H new ATOM 1569 N GLN A 103 0.542 5.645 11.511 1.00 42.22 N ATOM 1570 CA GLN A 103 1.665 5.217 12.361 1.00 35.11 C ATOM 1571 C GLN A 103 1.287 4.025 13.255 1.00 64.24 C ATOM 1572 O GLN A 103 0.124 3.851 13.631 1.00 74.22 O ATOM 1573 CB GLN A 103 2.135 6.381 13.247 1.00 61.34 C ATOM 1574 CG GLN A 103 2.620 7.596 12.467 1.00 24.15 C ATOM 1575 CD GLN A 103 3.141 8.709 13.361 1.00 35.24 C ATOM 1576 OE1 GLN A 103 2.685 8.896 14.485 1.00 1.01 O ATOM 1577 NE2 GLN A 103 4.104 9.458 12.866 1.00 35.43 N ATOM 0 H GLN A 103 -0.242 6.041 12.030 1.00 42.22 H new ATOM 0 HA GLN A 103 2.470 4.904 11.696 1.00 35.11 H new ATOM 0 HB2 GLN A 103 1.314 6.683 13.897 1.00 61.34 H new ATOM 0 HB3 GLN A 103 2.941 6.031 13.892 1.00 61.34 H new ATOM 0 HG2 GLN A 103 3.410 7.289 11.782 1.00 24.15 H new ATOM 0 HG3 GLN A 103 1.801 7.980 11.858 1.00 24.15 H new ATOM 0 HE21 GLN A 103 4.461 9.276 11.928 1.00 35.43 H new ATOM 0 HE22 GLN A 103 4.493 10.220 13.421 1.00 35.43 H new ATOM 1586 N ILE A 104 2.286 3.218 13.605 1.00 31.54 N ATOM 1587 CA ILE A 104 2.089 2.053 14.480 1.00 3.14 C ATOM 1588 C ILE A 104 2.705 2.296 15.872 1.00 72.12 C ATOM 1589 O ILE A 104 3.926 2.278 16.032 1.00 55.34 O ATOM 1590 CB ILE A 104 2.721 0.777 13.862 1.00 41.10 C ATOM 1591 CG1 ILE A 104 2.093 0.477 12.489 1.00 73.33 C ATOM 1592 CG2 ILE A 104 2.564 -0.419 14.804 1.00 43.15 C ATOM 1593 CD1 ILE A 104 2.676 -0.739 11.793 1.00 72.42 C ATOM 0 H ILE A 104 3.249 3.347 13.296 1.00 31.54 H new ATOM 0 HA ILE A 104 1.014 1.907 14.583 1.00 3.14 H new ATOM 0 HB ILE A 104 3.787 0.956 13.721 1.00 41.10 H new ATOM 0 HG12 ILE A 104 1.021 0.330 12.616 1.00 73.33 H new ATOM 0 HG13 ILE A 104 2.221 1.347 11.845 1.00 73.33 H new ATOM 0 HG21 ILE A 104 3.014 -1.302 14.350 1.00 43.15 H new ATOM 0 HG22 ILE A 104 3.061 -0.205 15.750 1.00 43.15 H new ATOM 0 HG23 ILE A 104 1.505 -0.604 14.984 1.00 43.15 H new ATOM 0 HD11 ILE A 104 2.180 -0.881 10.833 1.00 72.42 H new ATOM 0 HD12 ILE A 104 3.743 -0.589 11.631 1.00 72.42 H new ATOM 0 HD13 ILE A 104 2.524 -1.622 12.414 1.00 72.42 H new ATOM 1605 N GLN A 105 1.858 2.516 16.879 1.00 13.32 N ATOM 1606 CA GLN A 105 2.335 2.792 18.248 1.00 34.15 C ATOM 1607 C GLN A 105 2.440 1.506 19.095 1.00 53.43 C ATOM 1608 O GLN A 105 2.434 1.562 20.325 1.00 75.31 O ATOM 1609 CB GLN A 105 1.398 3.793 18.947 1.00 20.01 C ATOM 1610 CG GLN A 105 0.008 3.235 19.244 1.00 73.43 C ATOM 1611 CD GLN A 105 -0.853 4.152 20.105 1.00 73.31 C ATOM 1612 OE1 GLN A 105 -0.233 4.923 20.975 1.00 73.54 O flip ATOM 1613 NE2 GLN A 105 -2.075 4.156 19.994 1.00 54.20 N flip ATOM 0 H GLN A 105 0.843 2.510 16.780 1.00 13.32 H new ATOM 0 HA GLN A 105 3.334 3.220 18.161 1.00 34.15 H new ATOM 0 HB2 GLN A 105 1.857 4.114 19.882 1.00 20.01 H new ATOM 0 HB3 GLN A 105 1.297 4.679 18.321 1.00 20.01 H new ATOM 0 HG2 GLN A 105 -0.507 3.048 18.302 1.00 73.43 H new ATOM 0 HG3 GLN A 105 0.113 2.273 19.746 1.00 73.43 H new ATOM 0 HE21 GLN A 105 -2.527 3.548 19.311 1.00 54.20 H new ATOM 0 HE22 GLN A 105 -2.639 4.768 20.584 1.00 54.20 H new ATOM 1622 N GLY A 106 2.559 0.351 18.440 1.00 63.21 N ATOM 1623 CA GLY A 106 2.610 -0.920 19.162 1.00 31.14 C ATOM 1624 C GLY A 106 3.671 -1.876 18.632 1.00 22.51 C ATOM 1625 O GLY A 106 4.553 -1.480 17.863 1.00 44.42 O ATOM 0 H GLY A 106 2.621 0.269 17.425 1.00 63.21 H new ATOM 0 HA2 GLY A 106 2.804 -0.723 20.216 1.00 31.14 H new ATOM 0 HA3 GLY A 106 1.634 -1.403 19.102 1.00 31.14 H new ATOM 1629 N THR A 107 3.575 -3.144 19.032 1.00 21.45 N ATOM 1630 CA THR A 107 4.546 -4.174 18.625 1.00 24.14 C ATOM 1631 C THR A 107 4.137 -4.822 17.293 1.00 41.44 C ATOM 1632 O THR A 107 3.360 -4.250 16.528 1.00 32.31 O ATOM 1633 CB THR A 107 4.671 -5.285 19.699 1.00 64.01 C ATOM 1634 OG1 THR A 107 3.547 -6.176 19.631 1.00 11.13 O ATOM 1635 CG2 THR A 107 4.760 -4.693 21.104 1.00 71.33 C ATOM 0 H THR A 107 2.833 -3.489 19.641 1.00 21.45 H new ATOM 0 HA THR A 107 5.508 -3.674 18.509 1.00 24.14 H new ATOM 0 HB THR A 107 5.589 -5.836 19.494 1.00 64.01 H new ATOM 0 HG1 THR A 107 3.071 -6.168 20.488 1.00 11.13 H new ATOM 0 HG21 THR A 107 4.847 -5.498 21.833 1.00 71.33 H new ATOM 0 HG22 THR A 107 5.635 -4.046 21.172 1.00 71.33 H new ATOM 0 HG23 THR A 107 3.862 -4.111 21.311 1.00 71.33 H new ATOM 1643 N ILE A 108 4.691 -5.996 16.994 1.00 42.53 N ATOM 1644 CA ILE A 108 4.276 -6.760 15.813 1.00 5.24 C ATOM 1645 C ILE A 108 3.051 -7.641 16.125 1.00 11.22 C ATOM 1646 O ILE A 108 2.239 -7.929 15.245 1.00 64.34 O ATOM 1647 CB ILE A 108 5.431 -7.647 15.274 1.00 10.42 C ATOM 1648 CG1 ILE A 108 6.660 -6.788 14.939 1.00 1.15 C ATOM 1649 CG2 ILE A 108 4.989 -8.443 14.044 1.00 11.44 C ATOM 1650 CD1 ILE A 108 6.395 -5.707 13.910 1.00 22.03 C ATOM 0 H ILE A 108 5.424 -6.439 17.548 1.00 42.53 H new ATOM 0 HA ILE A 108 4.006 -6.036 15.044 1.00 5.24 H new ATOM 0 HB ILE A 108 5.701 -8.355 16.057 1.00 10.42 H new ATOM 0 HG12 ILE A 108 7.025 -6.322 15.854 1.00 1.15 H new ATOM 0 HG13 ILE A 108 7.455 -7.437 14.572 1.00 1.15 H new ATOM 0 HG21 ILE A 108 5.818 -9.055 13.689 1.00 11.44 H new ATOM 0 HG22 ILE A 108 4.151 -9.087 14.309 1.00 11.44 H new ATOM 0 HG23 ILE A 108 4.682 -7.755 13.256 1.00 11.44 H new ATOM 0 HD11 ILE A 108 7.311 -5.145 13.728 1.00 22.03 H new ATOM 0 HD12 ILE A 108 6.060 -6.165 12.979 1.00 22.03 H new ATOM 0 HD13 ILE A 108 5.623 -5.033 14.281 1.00 22.03 H new ATOM 1662 N ASP A 109 2.915 -8.059 17.385 1.00 25.15 N ATOM 1663 CA ASP A 109 1.800 -8.924 17.802 1.00 75.43 C ATOM 1664 C ASP A 109 0.593 -8.110 18.298 1.00 11.44 C ATOM 1665 O ASP A 109 -0.555 -8.447 18.006 1.00 71.23 O ATOM 1666 CB ASP A 109 2.262 -9.902 18.885 1.00 53.43 C ATOM 1667 CG ASP A 109 3.311 -10.868 18.370 1.00 33.52 C ATOM 1668 OD1 ASP A 109 2.968 -11.730 17.529 1.00 41.40 O ATOM 1669 OD2 ASP A 109 4.483 -10.776 18.796 1.00 42.23 O ATOM 0 H ASP A 109 3.560 -7.815 18.136 1.00 25.15 H new ATOM 0 HA ASP A 109 1.477 -9.485 16.925 1.00 75.43 H new ATOM 0 HB2 ASP A 109 2.667 -9.343 19.729 1.00 53.43 H new ATOM 0 HB3 ASP A 109 1.404 -10.463 19.256 1.00 53.43 H new ATOM 1674 N ASN A 110 0.852 -7.049 19.056 1.00 14.01 N ATOM 1675 CA ASN A 110 -0.208 -6.142 19.512 1.00 4.44 C ATOM 1676 C ASN A 110 0.131 -4.685 19.164 1.00 22.34 C ATOM 1677 O ASN A 110 0.879 -4.010 19.877 1.00 21.01 O ATOM 1678 CB ASN A 110 -0.475 -6.300 21.022 1.00 64.45 C ATOM 1679 CG ASN A 110 0.783 -6.233 21.878 1.00 1.52 C ATOM 1680 OD1 ASN A 110 1.840 -6.716 21.497 1.00 73.11 O ATOM 1681 ND2 ASN A 110 0.682 -5.617 23.039 1.00 73.43 N ATOM 0 H ASN A 110 1.788 -6.792 19.371 1.00 14.01 H new ATOM 0 HA ASN A 110 -1.123 -6.413 18.986 1.00 4.44 H new ATOM 0 HB2 ASN A 110 -1.164 -5.519 21.343 1.00 64.45 H new ATOM 0 HB3 ASN A 110 -0.971 -7.255 21.196 1.00 64.45 H new ATOM 0 HD21 ASN A 110 1.498 -5.534 23.645 1.00 73.43 H new ATOM 0 HD22 ASN A 110 -0.212 -5.223 23.331 1.00 73.43 H new ATOM 1688 N PHE A 111 -0.416 -4.212 18.049 1.00 53.41 N ATOM 1689 CA PHE A 111 -0.148 -2.858 17.565 1.00 61.31 C ATOM 1690 C PHE A 111 -1.425 -2.013 17.493 1.00 23.44 C ATOM 1691 O PHE A 111 -2.509 -2.519 17.198 1.00 4.40 O ATOM 1692 CB PHE A 111 0.541 -2.906 16.190 1.00 43.40 C ATOM 1693 CG PHE A 111 -0.153 -3.782 15.168 1.00 72.51 C ATOM 1694 CD1 PHE A 111 -1.127 -3.264 14.324 1.00 71.43 C ATOM 1695 CD2 PHE A 111 0.180 -5.127 15.048 1.00 51.11 C ATOM 1696 CE1 PHE A 111 -1.756 -4.067 13.390 1.00 33.13 C ATOM 1697 CE2 PHE A 111 -0.446 -5.932 14.115 1.00 71.13 C ATOM 1698 CZ PHE A 111 -1.415 -5.401 13.285 1.00 72.00 C ATOM 0 H PHE A 111 -1.052 -4.748 17.459 1.00 53.41 H new ATOM 0 HA PHE A 111 0.520 -2.381 18.282 1.00 61.31 H new ATOM 0 HB2 PHE A 111 0.607 -1.892 15.795 1.00 43.40 H new ATOM 0 HB3 PHE A 111 1.562 -3.263 16.322 1.00 43.40 H new ATOM 0 HD1 PHE A 111 -1.397 -2.221 14.398 1.00 71.43 H new ATOM 0 HD2 PHE A 111 0.938 -5.548 15.692 1.00 51.11 H new ATOM 0 HE1 PHE A 111 -2.514 -3.651 12.743 1.00 33.13 H new ATOM 0 HE2 PHE A 111 -0.178 -6.975 14.035 1.00 71.13 H new ATOM 0 HZ PHE A 111 -1.905 -6.029 12.555 1.00 72.00 H new ATOM 1708 N GLN A 112 -1.285 -0.722 17.781 1.00 33.44 N ATOM 1709 CA GLN A 112 -2.392 0.232 17.674 1.00 55.52 C ATOM 1710 C GLN A 112 -2.094 1.272 16.583 1.00 31.52 C ATOM 1711 O GLN A 112 -1.001 1.844 16.541 1.00 4.34 O ATOM 1712 CB GLN A 112 -2.637 0.914 19.028 1.00 61.31 C ATOM 1713 CG GLN A 112 -3.043 -0.057 20.130 1.00 30.32 C ATOM 1714 CD GLN A 112 -3.118 0.596 21.498 1.00 42.30 C ATOM 1715 OE1 GLN A 112 -2.144 0.621 22.243 1.00 50.31 O ATOM 1716 NE2 GLN A 112 -4.269 1.131 21.843 1.00 3.22 N ATOM 0 H GLN A 112 -0.408 -0.306 18.094 1.00 33.44 H new ATOM 0 HA GLN A 112 -3.297 -0.307 17.394 1.00 55.52 H new ATOM 0 HB2 GLN A 112 -1.731 1.438 19.332 1.00 61.31 H new ATOM 0 HB3 GLN A 112 -3.417 1.667 18.912 1.00 61.31 H new ATOM 0 HG2 GLN A 112 -4.013 -0.489 19.886 1.00 30.32 H new ATOM 0 HG3 GLN A 112 -2.328 -0.879 20.164 1.00 30.32 H new ATOM 0 HE21 GLN A 112 -5.061 1.094 21.201 1.00 3.22 H new ATOM 0 HE22 GLN A 112 -4.369 1.583 22.752 1.00 3.22 H new ATOM 1725 N GLU A 113 -3.059 1.501 15.701 1.00 23.25 N ATOM 1726 CA GLU A 113 -2.865 2.374 14.535 1.00 65.30 C ATOM 1727 C GLU A 113 -3.377 3.803 14.798 1.00 32.30 C ATOM 1728 O GLU A 113 -4.577 4.026 14.965 1.00 23.11 O ATOM 1729 CB GLU A 113 -3.585 1.762 13.324 1.00 63.13 C ATOM 1730 CG GLU A 113 -3.106 0.349 12.983 1.00 22.31 C ATOM 1731 CD GLU A 113 -4.052 -0.385 12.043 1.00 74.34 C ATOM 1732 OE1 GLU A 113 -5.211 -0.627 12.444 1.00 42.44 O ATOM 1733 OE2 GLU A 113 -3.651 -0.726 10.911 1.00 32.02 O ATOM 0 H GLU A 113 -3.992 1.094 15.766 1.00 23.25 H new ATOM 0 HA GLU A 113 -1.796 2.448 14.334 1.00 65.30 H new ATOM 0 HB2 GLU A 113 -4.657 1.737 13.522 1.00 63.13 H new ATOM 0 HB3 GLU A 113 -3.436 2.407 12.458 1.00 63.13 H new ATOM 0 HG2 GLU A 113 -2.118 0.406 12.525 1.00 22.31 H new ATOM 0 HG3 GLU A 113 -2.998 -0.225 13.903 1.00 22.31 H new ATOM 1740 N ILE A 114 -2.455 4.766 14.835 1.00 61.13 N ATOM 1741 CA ILE A 114 -2.803 6.176 15.076 1.00 5.21 C ATOM 1742 C ILE A 114 -2.355 7.069 13.912 1.00 34.33 C ATOM 1743 O ILE A 114 -1.543 6.656 13.083 1.00 51.44 O ATOM 1744 CB ILE A 114 -2.169 6.706 16.388 1.00 64.22 C ATOM 1745 CG1 ILE A 114 -0.639 6.546 16.349 1.00 52.30 C ATOM 1746 CG2 ILE A 114 -2.762 5.988 17.598 1.00 51.11 C ATOM 1747 CD1 ILE A 114 0.072 7.124 17.555 1.00 32.23 C ATOM 0 H ILE A 114 -1.458 4.599 14.701 1.00 61.13 H new ATOM 0 HA ILE A 114 -3.889 6.215 15.164 1.00 5.21 H new ATOM 0 HB ILE A 114 -2.397 7.768 16.480 1.00 64.22 H new ATOM 0 HG12 ILE A 114 -0.397 5.486 16.271 1.00 52.30 H new ATOM 0 HG13 ILE A 114 -0.256 7.028 15.449 1.00 52.30 H new ATOM 0 HG21 ILE A 114 -2.305 6.373 18.510 1.00 51.11 H new ATOM 0 HG22 ILE A 114 -3.838 6.159 17.631 1.00 51.11 H new ATOM 0 HG23 ILE A 114 -2.567 4.919 17.518 1.00 51.11 H new ATOM 0 HD11 ILE A 114 1.146 6.971 17.452 1.00 32.23 H new ATOM 0 HD12 ILE A 114 -0.138 8.191 17.624 1.00 32.23 H new ATOM 0 HD13 ILE A 114 -0.280 6.626 18.458 1.00 32.23 H new ATOM 1759 N ASN A 115 -2.882 8.296 13.858 1.00 51.25 N ATOM 1760 CA ASN A 115 -2.562 9.239 12.772 1.00 0.32 C ATOM 1761 C ASN A 115 -2.848 8.626 11.389 1.00 13.52 C ATOM 1762 O ASN A 115 -2.212 8.981 10.393 1.00 40.22 O ATOM 1763 CB ASN A 115 -1.091 9.682 12.863 1.00 12.42 C ATOM 1764 CG ASN A 115 -0.811 10.529 14.090 1.00 53.13 C ATOM 1765 OD1 ASN A 115 -1.670 11.265 14.558 1.00 70.12 O ATOM 1766 ND2 ASN A 115 0.389 10.440 14.619 1.00 13.45 N ATOM 0 H ASN A 115 -3.533 8.663 14.552 1.00 51.25 H new ATOM 0 HA ASN A 115 -3.205 10.111 12.891 1.00 0.32 H new ATOM 0 HB2 ASN A 115 -0.450 8.800 12.881 1.00 12.42 H new ATOM 0 HB3 ASN A 115 -0.830 10.248 11.969 1.00 12.42 H new ATOM 0 HD21 ASN A 115 0.626 10.993 15.442 1.00 13.45 H new ATOM 0 HD22 ASN A 115 1.083 9.817 14.206 1.00 13.45 H new ATOM 1773 N VAL A 116 -3.818 7.716 11.332 1.00 1.25 N ATOM 1774 CA VAL A 116 -4.155 7.018 10.090 1.00 52.12 C ATOM 1775 C VAL A 116 -5.297 7.708 9.327 1.00 74.42 C ATOM 1776 O VAL A 116 -6.379 7.944 9.870 1.00 71.15 O ATOM 1777 CB VAL A 116 -4.517 5.532 10.355 1.00 41.03 C ATOM 1778 CG1 VAL A 116 -5.618 5.403 11.404 1.00 75.30 C ATOM 1779 CG2 VAL A 116 -4.917 4.828 9.057 1.00 13.13 C ATOM 0 H VAL A 116 -4.387 7.443 12.133 1.00 1.25 H new ATOM 0 HA VAL A 116 -3.263 7.056 9.465 1.00 52.12 H new ATOM 0 HB VAL A 116 -3.627 5.042 10.749 1.00 41.03 H new ATOM 0 HG11 VAL A 116 -5.846 4.349 11.564 1.00 75.30 H new ATOM 0 HG12 VAL A 116 -5.282 5.848 12.341 1.00 75.30 H new ATOM 0 HG13 VAL A 116 -6.513 5.919 11.057 1.00 75.30 H new ATOM 0 HG21 VAL A 116 -5.166 3.788 9.269 1.00 13.13 H new ATOM 0 HG22 VAL A 116 -5.784 5.328 8.624 1.00 13.13 H new ATOM 0 HG23 VAL A 116 -4.087 4.866 8.352 1.00 13.13 H new ATOM 1789 N GLN A 117 -5.034 8.043 8.065 1.00 12.11 N ATOM 1790 CA GLN A 117 -6.048 8.627 7.177 1.00 62.15 C ATOM 1791 C GLN A 117 -6.394 7.661 6.038 1.00 41.04 C ATOM 1792 O GLN A 117 -5.589 6.802 5.670 1.00 52.13 O ATOM 1793 CB GLN A 117 -5.570 9.965 6.579 1.00 32.34 C ATOM 1794 CG GLN A 117 -5.394 11.104 7.587 1.00 34.11 C ATOM 1795 CD GLN A 117 -4.249 10.889 8.569 1.00 45.43 C ATOM 1796 OE1 GLN A 117 -3.201 10.217 8.135 1.00 54.20 O flip ATOM 1797 NE2 GLN A 117 -4.299 11.339 9.710 1.00 4.44 N flip ATOM 0 H GLN A 117 -4.121 7.920 7.628 1.00 12.11 H new ATOM 0 HA GLN A 117 -6.937 8.810 7.781 1.00 62.15 H new ATOM 0 HB2 GLN A 117 -4.619 9.799 6.073 1.00 32.34 H new ATOM 0 HB3 GLN A 117 -6.285 10.281 5.819 1.00 32.34 H new ATOM 0 HG2 GLN A 117 -5.224 12.034 7.044 1.00 34.11 H new ATOM 0 HG3 GLN A 117 -6.321 11.227 8.147 1.00 34.11 H new ATOM 0 HE21 GLN A 117 -5.123 11.855 10.019 1.00 4.44 H new ATOM 0 HE22 GLN A 117 -3.517 11.197 10.349 1.00 4.44 H new ATOM 1806 N ASN A 118 -7.590 7.816 5.482 1.00 62.21 N ATOM 1807 CA ASN A 118 -8.044 7.000 4.351 1.00 34.24 C ATOM 1808 C ASN A 118 -8.004 7.799 3.037 1.00 35.45 C ATOM 1809 O ASN A 118 -8.346 8.982 3.011 1.00 43.34 O ATOM 1810 CB ASN A 118 -9.464 6.485 4.615 1.00 44.34 C ATOM 1811 CG ASN A 118 -10.394 7.584 5.097 1.00 35.44 C ATOM 1812 OD1 ASN A 118 -10.532 7.815 6.294 1.00 13.43 O ATOM 1813 ND2 ASN A 118 -11.023 8.284 4.179 1.00 25.00 N ATOM 0 H ASN A 118 -8.272 8.506 5.797 1.00 62.21 H new ATOM 0 HA ASN A 118 -7.367 6.152 4.249 1.00 34.24 H new ATOM 0 HB2 ASN A 118 -9.865 6.047 3.701 1.00 44.34 H new ATOM 0 HB3 ASN A 118 -9.427 5.690 5.360 1.00 44.34 H new ATOM 0 HD21 ASN A 118 -11.646 9.043 4.454 1.00 25.00 H new ATOM 0 HD22 ASN A 118 -10.888 8.068 3.191 1.00 25.00 H new ATOM 1820 N GLN A 119 -7.580 7.152 1.953 1.00 52.22 N ATOM 1821 CA GLN A 119 -7.486 7.815 0.641 1.00 15.10 C ATOM 1822 C GLN A 119 -7.982 6.895 -0.493 1.00 43.13 C ATOM 1823 O GLN A 119 -7.805 5.678 -0.438 1.00 21.31 O ATOM 1824 CB GLN A 119 -6.035 8.246 0.380 1.00 14.14 C ATOM 1825 CG GLN A 119 -5.844 9.050 -0.902 1.00 41.01 C ATOM 1826 CD GLN A 119 -4.400 9.446 -1.162 1.00 23.13 C ATOM 1827 OE1 GLN A 119 -3.637 9.672 -0.111 1.00 14.04 O flip ATOM 1828 NE2 GLN A 119 -3.976 9.567 -2.309 1.00 25.21 N flip ATOM 0 H GLN A 119 -7.296 6.172 1.950 1.00 52.22 H new ATOM 0 HA GLN A 119 -8.129 8.695 0.658 1.00 15.10 H new ATOM 0 HB2 GLN A 119 -5.687 8.841 1.224 1.00 14.14 H new ATOM 0 HB3 GLN A 119 -5.406 7.357 0.336 1.00 14.14 H new ATOM 0 HG2 GLN A 119 -6.209 8.465 -1.746 1.00 41.01 H new ATOM 0 HG3 GLN A 119 -6.455 9.951 -0.851 1.00 41.01 H new ATOM 0 HE21 GLN A 119 -4.591 9.385 -3.102 1.00 25.21 H new ATOM 0 HE22 GLN A 119 -3.009 9.849 -2.468 1.00 25.21 H new ATOM 1837 N LEU A 120 -8.592 7.484 -1.525 1.00 54.24 N ATOM 1838 CA LEU A 120 -9.140 6.711 -2.651 1.00 21.33 C ATOM 1839 C LEU A 120 -8.094 6.492 -3.757 1.00 32.32 C ATOM 1840 O LEU A 120 -7.612 7.445 -4.374 1.00 54.13 O ATOM 1841 CB LEU A 120 -10.373 7.419 -3.237 1.00 52.12 C ATOM 1842 CG LEU A 120 -11.584 7.529 -2.296 1.00 4.15 C ATOM 1843 CD1 LEU A 120 -12.735 8.261 -2.984 1.00 52.10 C ATOM 1844 CD2 LEU A 120 -12.029 6.143 -1.828 1.00 51.21 C ATOM 0 H LEU A 120 -8.721 8.493 -1.607 1.00 54.24 H new ATOM 0 HA LEU A 120 -9.430 5.735 -2.263 1.00 21.33 H new ATOM 0 HB2 LEU A 120 -10.081 8.423 -3.544 1.00 52.12 H new ATOM 0 HB3 LEU A 120 -10.682 6.887 -4.137 1.00 52.12 H new ATOM 0 HG LEU A 120 -11.287 8.106 -1.421 1.00 4.15 H new ATOM 0 HD11 LEU A 120 -13.583 8.329 -2.302 1.00 52.10 H new ATOM 0 HD12 LEU A 120 -12.413 9.264 -3.263 1.00 52.10 H new ATOM 0 HD13 LEU A 120 -13.032 7.713 -3.878 1.00 52.10 H new ATOM 0 HD21 LEU A 120 -12.887 6.242 -1.163 1.00 51.21 H new ATOM 0 HD22 LEU A 120 -12.307 5.539 -2.692 1.00 51.21 H new ATOM 0 HD23 LEU A 120 -11.211 5.659 -1.295 1.00 51.21 H new ATOM 1856 N ILE A 121 -7.745 5.230 -3.998 1.00 22.14 N ATOM 1857 CA ILE A 121 -6.812 4.865 -5.069 1.00 25.35 C ATOM 1858 C ILE A 121 -7.551 4.204 -6.249 1.00 23.42 C ATOM 1859 O ILE A 121 -7.976 3.049 -6.175 1.00 14.04 O ATOM 1860 CB ILE A 121 -5.686 3.926 -4.553 1.00 71.44 C ATOM 1861 CG1 ILE A 121 -6.270 2.709 -3.808 1.00 21.10 C ATOM 1862 CG2 ILE A 121 -4.727 4.701 -3.653 1.00 62.43 C ATOM 1863 CD1 ILE A 121 -5.231 1.701 -3.357 1.00 71.31 C ATOM 0 H ILE A 121 -8.096 4.436 -3.463 1.00 22.14 H new ATOM 0 HA ILE A 121 -6.351 5.789 -5.419 1.00 25.35 H new ATOM 0 HB ILE A 121 -5.134 3.551 -5.415 1.00 71.44 H new ATOM 0 HG12 ILE A 121 -6.821 3.061 -2.936 1.00 21.10 H new ATOM 0 HG13 ILE A 121 -6.987 2.209 -4.458 1.00 21.10 H new ATOM 0 HG21 ILE A 121 -3.942 4.033 -3.297 1.00 62.43 H new ATOM 0 HG22 ILE A 121 -4.279 5.519 -4.217 1.00 62.43 H new ATOM 0 HG23 ILE A 121 -5.274 5.105 -2.801 1.00 62.43 H new ATOM 0 HD11 ILE A 121 -5.724 0.876 -2.842 1.00 71.31 H new ATOM 0 HD12 ILE A 121 -4.695 1.318 -4.225 1.00 71.31 H new ATOM 0 HD13 ILE A 121 -4.526 2.183 -2.679 1.00 71.31 H new ATOM 1875 N ASN A 122 -7.716 4.954 -7.335 1.00 11.41 N ATOM 1876 CA ASN A 122 -8.429 4.463 -8.519 1.00 14.34 C ATOM 1877 C ASN A 122 -7.447 4.117 -9.652 1.00 24.02 C ATOM 1878 O ASN A 122 -6.552 4.899 -9.974 1.00 10.22 O ATOM 1879 CB ASN A 122 -9.447 5.510 -8.996 1.00 61.54 C ATOM 1880 CG ASN A 122 -10.499 5.834 -7.943 1.00 61.33 C ATOM 1881 OD1 ASN A 122 -10.242 5.779 -6.748 1.00 33.43 O ATOM 1882 ND2 ASN A 122 -11.696 6.171 -8.381 1.00 32.43 N ATOM 0 H ASN A 122 -7.366 5.908 -7.423 1.00 11.41 H new ATOM 0 HA ASN A 122 -8.960 3.552 -8.243 1.00 14.34 H new ATOM 0 HB2 ASN A 122 -8.920 6.424 -9.270 1.00 61.54 H new ATOM 0 HB3 ASN A 122 -9.941 5.145 -9.896 1.00 61.54 H new ATOM 0 HD21 ASN A 122 -12.438 6.395 -7.717 1.00 32.43 H new ATOM 0 HD22 ASN A 122 -11.880 6.208 -9.383 1.00 32.43 H new ATOM 1889 N ALA A 123 -7.624 2.945 -10.255 1.00 54.03 N ATOM 1890 CA ALA A 123 -6.729 2.472 -11.320 1.00 60.31 C ATOM 1891 C ALA A 123 -7.493 2.197 -12.631 1.00 64.12 C ATOM 1892 O ALA A 123 -8.651 1.771 -12.609 1.00 65.42 O ATOM 1893 CB ALA A 123 -5.998 1.218 -10.854 1.00 72.31 C ATOM 0 H ALA A 123 -8.380 2.300 -10.027 1.00 54.03 H new ATOM 0 HA ALA A 123 -6.004 3.259 -11.529 1.00 60.31 H new ATOM 0 HB1 ALA A 123 -5.335 0.868 -11.645 1.00 72.31 H new ATOM 0 HB2 ALA A 123 -5.412 1.448 -9.964 1.00 72.31 H new ATOM 0 HB3 ALA A 123 -6.724 0.440 -10.619 1.00 72.31 H new ATOM 1899 N PRO A 124 -6.852 2.449 -13.795 1.00 54.32 N ATOM 1900 CA PRO A 124 -7.462 2.188 -15.112 1.00 10.12 C ATOM 1901 C PRO A 124 -7.461 0.693 -15.491 1.00 32.34 C ATOM 1902 O PRO A 124 -6.896 -0.142 -14.784 1.00 52.44 O ATOM 1903 CB PRO A 124 -6.570 2.993 -16.065 1.00 64.22 C ATOM 1904 CG PRO A 124 -5.228 2.986 -15.413 1.00 12.41 C ATOM 1905 CD PRO A 124 -5.490 3.016 -13.925 1.00 23.21 C ATOM 0 HA PRO A 124 -8.514 2.471 -15.139 1.00 10.12 H new ATOM 0 HB2 PRO A 124 -6.533 2.537 -17.055 1.00 64.22 H new ATOM 0 HB3 PRO A 124 -6.943 4.009 -16.195 1.00 64.22 H new ATOM 0 HG2 PRO A 124 -4.663 2.097 -15.692 1.00 12.41 H new ATOM 0 HG3 PRO A 124 -4.639 3.849 -15.723 1.00 12.41 H new ATOM 0 HD2 PRO A 124 -4.756 2.424 -13.378 1.00 23.21 H new ATOM 0 HD3 PRO A 124 -5.440 4.031 -13.530 1.00 23.21 H new ATOM 1913 N ALA A 125 -8.092 0.367 -16.619 1.00 63.32 N ATOM 1914 CA ALA A 125 -8.183 -1.021 -17.089 1.00 61.04 C ATOM 1915 C ALA A 125 -6.903 -1.466 -17.808 1.00 25.12 C ATOM 1916 O ALA A 125 -6.353 -0.736 -18.638 1.00 60.14 O ATOM 1917 CB ALA A 125 -9.389 -1.187 -18.009 1.00 53.12 C ATOM 0 H ALA A 125 -8.550 1.045 -17.228 1.00 63.32 H new ATOM 0 HA ALA A 125 -8.307 -1.658 -16.213 1.00 61.04 H new ATOM 0 HB1 ALA A 125 -9.446 -2.220 -18.351 1.00 53.12 H new ATOM 0 HB2 ALA A 125 -10.299 -0.934 -17.465 1.00 53.12 H new ATOM 0 HB3 ALA A 125 -9.284 -0.525 -18.869 1.00 53.12 H new ATOM 1923 N SER A 126 -6.443 -2.674 -17.493 1.00 55.43 N ATOM 1924 CA SER A 126 -5.235 -3.239 -18.112 1.00 74.35 C ATOM 1925 C SER A 126 -5.480 -3.604 -19.586 1.00 4.40 C ATOM 1926 O SER A 126 -6.413 -4.344 -19.906 1.00 24.32 O ATOM 1927 CB SER A 126 -4.778 -4.483 -17.343 1.00 41.20 C ATOM 1928 OG SER A 126 -4.468 -4.175 -15.994 1.00 32.23 O ATOM 0 H SER A 126 -6.887 -3.287 -16.810 1.00 55.43 H new ATOM 0 HA SER A 126 -4.455 -2.479 -18.072 1.00 74.35 H new ATOM 0 HB2 SER A 126 -5.562 -5.239 -17.374 1.00 41.20 H new ATOM 0 HB3 SER A 126 -3.902 -4.912 -17.830 1.00 41.20 H new ATOM 0 HG SER A 126 -4.648 -4.956 -15.430 1.00 32.23 H new ATOM 1934 N VAL A 127 -4.634 -3.093 -20.478 1.00 63.55 N ATOM 1935 CA VAL A 127 -4.809 -3.297 -21.924 1.00 33.42 C ATOM 1936 C VAL A 127 -3.941 -4.443 -22.483 1.00 63.21 C ATOM 1937 O VAL A 127 -4.364 -5.162 -23.387 1.00 24.00 O ATOM 1938 CB VAL A 127 -4.505 -1.995 -22.708 1.00 33.03 C ATOM 1939 CG1 VAL A 127 -5.484 -0.891 -22.318 1.00 20.44 C ATOM 1940 CG2 VAL A 127 -3.060 -1.540 -22.484 1.00 44.53 C ATOM 0 H VAL A 127 -3.818 -2.533 -20.230 1.00 63.55 H new ATOM 0 HA VAL A 127 -5.853 -3.578 -22.061 1.00 33.42 H new ATOM 0 HB VAL A 127 -4.629 -2.206 -23.770 1.00 33.03 H new ATOM 0 HG11 VAL A 127 -5.254 0.015 -22.879 1.00 20.44 H new ATOM 0 HG12 VAL A 127 -6.501 -1.210 -22.545 1.00 20.44 H new ATOM 0 HG13 VAL A 127 -5.397 -0.688 -21.251 1.00 20.44 H new ATOM 0 HG21 VAL A 127 -2.876 -0.625 -23.046 1.00 44.53 H new ATOM 0 HG22 VAL A 127 -2.898 -1.353 -21.422 1.00 44.53 H new ATOM 0 HG23 VAL A 127 -2.377 -2.318 -22.824 1.00 44.53 H new ATOM 1950 N LEU A 128 -2.732 -4.605 -21.950 1.00 44.30 N ATOM 1951 CA LEU A 128 -1.793 -5.629 -22.444 1.00 14.02 C ATOM 1952 C LEU A 128 -1.319 -6.537 -21.299 1.00 41.24 C ATOM 1953 O LEU A 128 -0.730 -6.067 -20.327 1.00 13.22 O ATOM 1954 CB LEU A 128 -0.585 -4.960 -23.122 1.00 53.20 C ATOM 1955 CG LEU A 128 -0.919 -4.072 -24.337 1.00 75.32 C ATOM 1956 CD1 LEU A 128 0.343 -3.420 -24.894 1.00 52.22 C ATOM 1957 CD2 LEU A 128 -1.630 -4.880 -25.421 1.00 22.45 C ATOM 0 H LEU A 128 -2.373 -4.045 -21.177 1.00 44.30 H new ATOM 0 HA LEU A 128 -2.316 -6.245 -23.176 1.00 14.02 H new ATOM 0 HB2 LEU A 128 -0.064 -4.353 -22.382 1.00 53.20 H new ATOM 0 HB3 LEU A 128 0.108 -5.738 -23.441 1.00 53.20 H new ATOM 0 HG LEU A 128 -1.593 -3.283 -24.003 1.00 75.32 H new ATOM 0 HD11 LEU A 128 0.083 -2.798 -25.751 1.00 52.22 H new ATOM 0 HD12 LEU A 128 0.804 -2.802 -24.123 1.00 52.22 H new ATOM 0 HD13 LEU A 128 1.045 -4.193 -25.206 1.00 52.22 H new ATOM 0 HD21 LEU A 128 -1.856 -4.233 -26.268 1.00 22.45 H new ATOM 0 HD22 LEU A 128 -0.985 -5.695 -25.749 1.00 22.45 H new ATOM 0 HD23 LEU A 128 -2.557 -5.290 -25.020 1.00 22.45 H new ATOM 1969 N ALA A 129 -1.580 -7.837 -21.415 1.00 61.24 N ATOM 1970 CA ALA A 129 -1.254 -8.793 -20.347 1.00 63.34 C ATOM 1971 C ALA A 129 0.233 -9.210 -20.360 1.00 53.34 C ATOM 1972 O ALA A 129 0.868 -9.239 -21.417 1.00 21.21 O ATOM 1973 CB ALA A 129 -2.149 -10.018 -20.463 1.00 34.42 C ATOM 0 H ALA A 129 -2.016 -8.257 -22.236 1.00 61.24 H new ATOM 0 HA ALA A 129 -1.433 -8.294 -19.395 1.00 63.34 H new ATOM 0 HB1 ALA A 129 -1.904 -10.724 -19.670 1.00 34.42 H new ATOM 0 HB2 ALA A 129 -3.192 -9.716 -20.371 1.00 34.42 H new ATOM 0 HB3 ALA A 129 -1.993 -10.492 -21.432 1.00 34.42 H new ATOM 1979 N PRO A 130 0.822 -9.542 -19.187 1.00 2.24 N ATOM 1980 CA PRO A 130 0.142 -9.505 -17.875 1.00 25.52 C ATOM 1981 C PRO A 130 -0.090 -8.071 -17.359 1.00 24.15 C ATOM 1982 O PRO A 130 0.465 -7.111 -17.892 1.00 44.31 O ATOM 1983 CB PRO A 130 1.105 -10.264 -16.937 1.00 11.32 C ATOM 1984 CG PRO A 130 2.144 -10.871 -17.830 1.00 74.11 C ATOM 1985 CD PRO A 130 2.210 -9.997 -19.050 1.00 41.42 C ATOM 0 HA PRO A 130 -0.853 -9.946 -17.933 1.00 25.52 H new ATOM 0 HB2 PRO A 130 1.558 -9.589 -16.211 1.00 11.32 H new ATOM 0 HB3 PRO A 130 0.577 -11.032 -16.372 1.00 11.32 H new ATOM 0 HG2 PRO A 130 3.111 -10.914 -17.329 1.00 74.11 H new ATOM 0 HG3 PRO A 130 1.878 -11.894 -18.098 1.00 74.11 H new ATOM 0 HD2 PRO A 130 2.899 -9.163 -18.916 1.00 41.42 H new ATOM 0 HD3 PRO A 130 2.545 -10.549 -19.928 1.00 41.42 H new ATOM 1993 N SER A 131 -0.914 -7.936 -16.323 1.00 75.22 N ATOM 1994 CA SER A 131 -1.257 -6.615 -15.775 1.00 2.01 C ATOM 1995 C SER A 131 -0.111 -6.030 -14.942 1.00 32.44 C ATOM 1996 O SER A 131 0.481 -6.719 -14.110 1.00 23.43 O ATOM 1997 CB SER A 131 -2.538 -6.702 -14.936 1.00 10.31 C ATOM 1998 OG SER A 131 -3.629 -7.165 -15.721 1.00 73.54 O ATOM 0 H SER A 131 -1.358 -8.719 -15.843 1.00 75.22 H new ATOM 0 HA SER A 131 -1.428 -5.943 -16.616 1.00 2.01 H new ATOM 0 HB2 SER A 131 -2.380 -7.375 -14.093 1.00 10.31 H new ATOM 0 HB3 SER A 131 -2.773 -5.722 -14.522 1.00 10.31 H new ATOM 0 HG SER A 131 -3.672 -8.143 -15.677 1.00 73.54 H new ATOM 2004 N ASP A 132 0.193 -4.754 -15.181 1.00 33.30 N ATOM 2005 CA ASP A 132 1.301 -4.063 -14.508 1.00 45.25 C ATOM 2006 C ASP A 132 0.918 -2.614 -14.146 1.00 52.42 C ATOM 2007 O ASP A 132 1.774 -1.727 -14.094 1.00 75.05 O ATOM 2008 CB ASP A 132 2.530 -4.068 -15.429 1.00 3.11 C ATOM 2009 CG ASP A 132 2.268 -3.351 -16.747 1.00 11.15 C ATOM 2010 OD1 ASP A 132 1.500 -3.877 -17.579 1.00 22.25 O ATOM 2011 OD2 ASP A 132 2.820 -2.251 -16.957 1.00 62.35 O ATOM 0 H ASP A 132 -0.317 -4.170 -15.843 1.00 33.30 H new ATOM 0 HA ASP A 132 1.529 -4.588 -13.581 1.00 45.25 H new ATOM 0 HB2 ASP A 132 3.366 -3.590 -14.918 1.00 3.11 H new ATOM 0 HB3 ASP A 132 2.826 -5.098 -15.631 1.00 3.11 H new ATOM 2016 N VAL A 133 -0.367 -2.397 -13.865 1.00 41.23 N ATOM 2017 CA VAL A 133 -0.909 -1.051 -13.619 1.00 31.41 C ATOM 2018 C VAL A 133 -0.115 -0.277 -12.552 1.00 62.12 C ATOM 2019 O VAL A 133 -0.078 -0.664 -11.385 1.00 32.50 O ATOM 2020 CB VAL A 133 -2.394 -1.126 -13.185 1.00 33.23 C ATOM 2021 CG1 VAL A 133 -2.966 0.271 -12.951 1.00 71.42 C ATOM 2022 CG2 VAL A 133 -3.222 -1.883 -14.222 1.00 32.55 C ATOM 0 H VAL A 133 -1.062 -3.141 -13.801 1.00 41.23 H new ATOM 0 HA VAL A 133 -0.822 -0.513 -14.563 1.00 31.41 H new ATOM 0 HB VAL A 133 -2.443 -1.672 -12.243 1.00 33.23 H new ATOM 0 HG11 VAL A 133 -4.010 0.191 -12.647 1.00 71.42 H new ATOM 0 HG12 VAL A 133 -2.397 0.770 -12.167 1.00 71.42 H new ATOM 0 HG13 VAL A 133 -2.900 0.850 -13.872 1.00 71.42 H new ATOM 0 HG21 VAL A 133 -4.262 -1.924 -13.898 1.00 32.55 H new ATOM 0 HG22 VAL A 133 -3.161 -1.369 -15.182 1.00 32.55 H new ATOM 0 HG23 VAL A 133 -2.835 -2.896 -14.328 1.00 32.55 H new ATOM 2032 N ASP A 134 0.518 0.818 -12.962 1.00 72.11 N ATOM 2033 CA ASP A 134 1.291 1.661 -12.050 1.00 13.34 C ATOM 2034 C ASP A 134 0.603 3.018 -11.806 1.00 22.25 C ATOM 2035 O ASP A 134 0.454 3.831 -12.719 1.00 0.14 O ATOM 2036 CB ASP A 134 2.713 1.853 -12.600 1.00 11.52 C ATOM 2037 CG ASP A 134 2.744 2.369 -14.033 1.00 1.12 C ATOM 2038 OD1 ASP A 134 2.196 1.696 -14.932 1.00 23.43 O ATOM 2039 OD2 ASP A 134 3.355 3.432 -14.276 1.00 70.13 O ATOM 0 H ASP A 134 0.511 1.146 -13.928 1.00 72.11 H new ATOM 0 HA ASP A 134 1.349 1.158 -11.085 1.00 13.34 H new ATOM 0 HB2 ASP A 134 3.251 2.551 -11.959 1.00 11.52 H new ATOM 0 HB3 ASP A 134 3.244 0.902 -12.553 1.00 11.52 H new ATOM 2044 N ILE A 135 0.172 3.254 -10.564 1.00 24.13 N ATOM 2045 CA ILE A 135 -0.506 4.507 -10.202 1.00 4.54 C ATOM 2046 C ILE A 135 0.214 5.246 -9.054 1.00 34.52 C ATOM 2047 O ILE A 135 0.641 4.632 -8.073 1.00 21.52 O ATOM 2048 CB ILE A 135 -1.988 4.258 -9.805 1.00 41.34 C ATOM 2049 CG1 ILE A 135 -2.086 3.222 -8.669 1.00 50.22 C ATOM 2050 CG2 ILE A 135 -2.799 3.808 -11.020 1.00 61.32 C ATOM 2051 CD1 ILE A 135 -3.503 2.956 -8.202 1.00 22.15 C ATOM 0 H ILE A 135 0.279 2.597 -9.792 1.00 24.13 H new ATOM 0 HA ILE A 135 -0.476 5.137 -11.091 1.00 4.54 H new ATOM 0 HB ILE A 135 -2.406 5.197 -9.441 1.00 41.34 H new ATOM 0 HG12 ILE A 135 -1.643 2.285 -9.006 1.00 50.22 H new ATOM 0 HG13 ILE A 135 -1.494 3.569 -7.822 1.00 50.22 H new ATOM 0 HG21 ILE A 135 -3.834 3.638 -10.724 1.00 61.32 H new ATOM 0 HG22 ILE A 135 -2.763 4.581 -11.788 1.00 61.32 H new ATOM 0 HG23 ILE A 135 -2.379 2.884 -11.416 1.00 61.32 H new ATOM 0 HD11 ILE A 135 -3.489 2.216 -7.401 1.00 22.15 H new ATOM 0 HD12 ILE A 135 -3.944 3.882 -7.833 1.00 22.15 H new ATOM 0 HD13 ILE A 135 -4.096 2.578 -9.035 1.00 22.15 H new ATOM 2063 N PRO A 136 0.367 6.582 -9.164 1.00 21.12 N ATOM 2064 CA PRO A 136 0.997 7.401 -8.114 1.00 52.14 C ATOM 2065 C PRO A 136 0.054 7.687 -6.928 1.00 44.30 C ATOM 2066 O PRO A 136 -1.117 8.031 -7.112 1.00 3.33 O ATOM 2067 CB PRO A 136 1.346 8.695 -8.855 1.00 50.51 C ATOM 2068 CG PRO A 136 0.292 8.816 -9.907 1.00 74.32 C ATOM 2069 CD PRO A 136 -0.052 7.403 -10.322 1.00 54.44 C ATOM 0 HA PRO A 136 1.853 6.900 -7.663 1.00 52.14 H new ATOM 0 HB2 PRO A 136 1.337 9.553 -8.183 1.00 50.51 H new ATOM 0 HB3 PRO A 136 2.342 8.645 -9.294 1.00 50.51 H new ATOM 0 HG2 PRO A 136 -0.586 9.333 -9.521 1.00 74.32 H new ATOM 0 HG3 PRO A 136 0.654 9.394 -10.757 1.00 74.32 H new ATOM 0 HD2 PRO A 136 -1.117 7.294 -10.525 1.00 54.44 H new ATOM 0 HD3 PRO A 136 0.477 7.113 -11.230 1.00 54.44 H new ATOM 2077 N LEU A 137 0.578 7.556 -5.710 1.00 74.31 N ATOM 2078 CA LEU A 137 -0.218 7.741 -4.489 1.00 44.23 C ATOM 2079 C LEU A 137 0.352 8.897 -3.643 1.00 43.32 C ATOM 2080 O LEU A 137 1.463 8.801 -3.115 1.00 54.21 O ATOM 2081 CB LEU A 137 -0.220 6.422 -3.685 1.00 71.25 C ATOM 2082 CG LEU A 137 -1.480 6.130 -2.845 1.00 20.13 C ATOM 2083 CD1 LEU A 137 -1.355 4.778 -2.143 1.00 45.32 C ATOM 2084 CD2 LEU A 137 -1.746 7.237 -1.829 1.00 51.51 C ATOM 0 H LEU A 137 1.556 7.321 -5.538 1.00 74.31 H new ATOM 0 HA LEU A 137 -1.242 8.000 -4.757 1.00 44.23 H new ATOM 0 HB2 LEU A 137 -0.076 5.597 -4.383 1.00 71.25 H new ATOM 0 HB3 LEU A 137 0.641 6.428 -3.017 1.00 71.25 H new ATOM 0 HG LEU A 137 -2.330 6.094 -3.526 1.00 20.13 H new ATOM 0 HD11 LEU A 137 -2.253 4.589 -1.555 1.00 45.32 H new ATOM 0 HD12 LEU A 137 -1.236 3.991 -2.888 1.00 45.32 H new ATOM 0 HD13 LEU A 137 -0.486 4.789 -1.485 1.00 45.32 H new ATOM 0 HD21 LEU A 137 -2.641 6.997 -1.255 1.00 51.51 H new ATOM 0 HD22 LEU A 137 -0.895 7.323 -1.154 1.00 51.51 H new ATOM 0 HD23 LEU A 137 -1.892 8.183 -2.351 1.00 51.51 H new ATOM 2096 N GLN A 138 -0.406 9.990 -3.523 1.00 44.31 N ATOM 2097 CA GLN A 138 0.043 11.171 -2.769 1.00 21.31 C ATOM 2098 C GLN A 138 -0.626 11.264 -1.385 1.00 60.04 C ATOM 2099 O GLN A 138 -1.844 11.384 -1.273 1.00 31.04 O ATOM 2100 CB GLN A 138 -0.243 12.451 -3.567 1.00 52.23 C ATOM 2101 CG GLN A 138 0.249 13.726 -2.882 1.00 71.23 C ATOM 2102 CD GLN A 138 -0.032 14.981 -3.692 1.00 43.01 C ATOM 2103 OE1 GLN A 138 -1.011 15.058 -4.431 1.00 25.03 O ATOM 2104 NE2 GLN A 138 0.822 15.975 -3.558 1.00 22.33 N ATOM 0 H GLN A 138 -1.333 10.085 -3.937 1.00 44.31 H new ATOM 0 HA GLN A 138 1.117 11.065 -2.614 1.00 21.31 H new ATOM 0 HB2 GLN A 138 0.228 12.371 -4.547 1.00 52.23 H new ATOM 0 HB3 GLN A 138 -1.317 12.531 -3.735 1.00 52.23 H new ATOM 0 HG2 GLN A 138 -0.229 13.815 -1.906 1.00 71.23 H new ATOM 0 HG3 GLN A 138 1.322 13.646 -2.706 1.00 71.23 H new ATOM 0 HE21 GLN A 138 1.624 15.878 -2.936 1.00 22.33 H new ATOM 0 HE22 GLN A 138 0.681 16.842 -4.076 1.00 22.33 H new ATOM 2113 N LEU A 139 0.186 11.225 -0.336 1.00 20.45 N ATOM 2114 CA LEU A 139 -0.293 11.342 1.047 1.00 0.15 C ATOM 2115 C LEU A 139 -0.084 12.773 1.576 1.00 0.43 C ATOM 2116 O LEU A 139 0.925 13.406 1.263 1.00 71.54 O ATOM 2117 CB LEU A 139 0.466 10.345 1.933 1.00 74.33 C ATOM 2118 CG LEU A 139 0.518 8.900 1.398 1.00 31.24 C ATOM 2119 CD1 LEU A 139 1.406 8.024 2.282 1.00 0.40 C ATOM 2120 CD2 LEU A 139 -0.885 8.311 1.289 1.00 74.44 C ATOM 0 H LEU A 139 1.197 11.111 -0.414 1.00 20.45 H new ATOM 0 HA LEU A 139 -1.360 11.119 1.070 1.00 0.15 H new ATOM 0 HB2 LEU A 139 1.487 10.704 2.064 1.00 74.33 H new ATOM 0 HB3 LEU A 139 0.003 10.334 2.920 1.00 74.33 H new ATOM 0 HG LEU A 139 0.954 8.926 0.399 1.00 31.24 H new ATOM 0 HD11 LEU A 139 1.427 7.009 1.885 1.00 0.40 H new ATOM 0 HD12 LEU A 139 2.418 8.429 2.296 1.00 0.40 H new ATOM 0 HD13 LEU A 139 1.007 8.008 3.296 1.00 0.40 H new ATOM 0 HD21 LEU A 139 -0.823 7.291 0.909 1.00 74.44 H new ATOM 0 HD22 LEU A 139 -1.354 8.304 2.273 1.00 74.44 H new ATOM 0 HD23 LEU A 139 -1.482 8.916 0.607 1.00 74.44 H new ATOM 2132 N LYS A 140 -1.025 13.279 2.375 1.00 42.11 N ATOM 2133 CA LYS A 140 -0.923 14.651 2.903 1.00 13.52 C ATOM 2134 C LYS A 140 -0.474 14.686 4.374 1.00 34.42 C ATOM 2135 O LYS A 140 -0.855 13.828 5.174 1.00 64.11 O ATOM 2136 CB LYS A 140 -2.264 15.387 2.791 1.00 74.52 C ATOM 2137 CG LYS A 140 -2.827 15.484 1.378 1.00 42.32 C ATOM 2138 CD LYS A 140 -3.917 16.549 1.294 1.00 13.55 C ATOM 2139 CE LYS A 140 -4.689 16.469 -0.014 1.00 4.40 C ATOM 2140 NZ LYS A 140 -5.478 15.214 -0.115 1.00 42.02 N ATOM 0 H LYS A 140 -1.859 12.771 2.671 1.00 42.11 H new ATOM 0 HA LYS A 140 -0.167 15.148 2.294 1.00 13.52 H new ATOM 0 HB2 LYS A 140 -2.994 14.881 3.423 1.00 74.52 H new ATOM 0 HB3 LYS A 140 -2.143 16.395 3.188 1.00 74.52 H new ATOM 0 HG2 LYS A 140 -2.025 15.723 0.679 1.00 42.32 H new ATOM 0 HG3 LYS A 140 -3.234 14.518 1.078 1.00 42.32 H new ATOM 0 HD2 LYS A 140 -4.606 16.430 2.130 1.00 13.55 H new ATOM 0 HD3 LYS A 140 -3.467 17.537 1.390 1.00 13.55 H new ATOM 0 HE2 LYS A 140 -5.358 17.326 -0.094 1.00 4.40 H new ATOM 0 HE3 LYS A 140 -3.993 16.529 -0.851 1.00 4.40 H new ATOM 0 HZ1 LYS A 140 -6.210 15.322 -0.846 1.00 42.02 H new ATOM 0 HZ2 LYS A 140 -4.847 14.427 -0.369 1.00 42.02 H new ATOM 0 HZ3 LYS A 140 -5.930 15.014 0.800 1.00 42.02 H new ATOM 2154 N GLY A 141 0.325 15.695 4.725 1.00 61.15 N ATOM 2155 CA GLY A 141 0.687 15.940 6.121 1.00 13.24 C ATOM 2156 C GLY A 141 1.749 14.998 6.687 1.00 54.51 C ATOM 2157 O GLY A 141 2.661 15.437 7.392 1.00 61.33 O ATOM 0 H GLY A 141 0.733 16.355 4.062 1.00 61.15 H new ATOM 0 HA2 GLY A 141 1.046 16.965 6.213 1.00 13.24 H new ATOM 0 HA3 GLY A 141 -0.211 15.860 6.733 1.00 13.24 H new ATOM 2161 N ILE A 142 1.634 13.707 6.395 1.00 25.24 N ATOM 2162 CA ILE A 142 2.522 12.700 6.982 1.00 62.00 C ATOM 2163 C ILE A 142 3.794 12.490 6.138 1.00 22.54 C ATOM 2164 O ILE A 142 3.734 12.175 4.949 1.00 32.14 O ATOM 2165 CB ILE A 142 1.775 11.353 7.181 1.00 43.44 C ATOM 2166 CG1 ILE A 142 2.641 10.365 7.980 1.00 71.52 C ATOM 2167 CG2 ILE A 142 1.361 10.756 5.835 1.00 74.12 C ATOM 2168 CD1 ILE A 142 1.899 9.120 8.426 1.00 31.34 C ATOM 0 H ILE A 142 0.935 13.329 5.755 1.00 25.24 H new ATOM 0 HA ILE A 142 2.833 13.076 7.957 1.00 62.00 H new ATOM 0 HB ILE A 142 0.868 11.547 7.754 1.00 43.44 H new ATOM 0 HG12 ILE A 142 3.494 10.069 7.370 1.00 71.52 H new ATOM 0 HG13 ILE A 142 3.039 10.873 8.858 1.00 71.52 H new ATOM 0 HG21 ILE A 142 0.840 9.813 6.000 1.00 74.12 H new ATOM 0 HG22 ILE A 142 0.700 11.450 5.317 1.00 74.12 H new ATOM 0 HG23 ILE A 142 2.248 10.578 5.227 1.00 74.12 H new ATOM 0 HD11 ILE A 142 2.576 8.473 8.983 1.00 31.34 H new ATOM 0 HD12 ILE A 142 1.062 9.404 9.064 1.00 31.34 H new ATOM 0 HD13 ILE A 142 1.525 8.587 7.552 1.00 31.34 H new ATOM 2180 N SER A 143 4.948 12.682 6.767 1.00 13.33 N ATOM 2181 CA SER A 143 6.245 12.528 6.092 1.00 61.43 C ATOM 2182 C SER A 143 6.670 11.053 6.035 1.00 74.21 C ATOM 2183 O SER A 143 6.254 10.252 6.871 1.00 54.32 O ATOM 2184 CB SER A 143 7.317 13.347 6.824 1.00 2.25 C ATOM 2185 OG SER A 143 6.909 14.697 6.996 1.00 52.42 O ATOM 0 H SER A 143 5.018 12.946 7.750 1.00 13.33 H new ATOM 0 HA SER A 143 6.139 12.894 5.071 1.00 61.43 H new ATOM 0 HB2 SER A 143 7.518 12.899 7.797 1.00 2.25 H new ATOM 0 HB3 SER A 143 8.249 13.316 6.260 1.00 2.25 H new ATOM 0 HG SER A 143 7.611 15.193 7.466 1.00 52.42 H new ATOM 2191 N VAL A 144 7.506 10.702 5.055 1.00 42.33 N ATOM 2192 CA VAL A 144 7.969 9.313 4.889 1.00 41.42 C ATOM 2193 C VAL A 144 8.667 8.788 6.160 1.00 31.41 C ATOM 2194 O VAL A 144 8.518 7.620 6.528 1.00 15.23 O ATOM 2195 CB VAL A 144 8.914 9.163 3.662 1.00 30.34 C ATOM 2196 CG1 VAL A 144 10.155 10.036 3.811 1.00 1.00 C ATOM 2197 CG2 VAL A 144 9.298 7.696 3.440 1.00 61.50 C ATOM 0 H VAL A 144 7.878 11.354 4.364 1.00 42.33 H new ATOM 0 HA VAL A 144 7.079 8.709 4.712 1.00 41.42 H new ATOM 0 HB VAL A 144 8.371 9.505 2.781 1.00 30.34 H new ATOM 0 HG11 VAL A 144 10.796 9.910 2.938 1.00 1.00 H new ATOM 0 HG12 VAL A 144 9.857 11.081 3.894 1.00 1.00 H new ATOM 0 HG13 VAL A 144 10.701 9.742 4.708 1.00 1.00 H new ATOM 0 HG21 VAL A 144 9.959 7.620 2.576 1.00 61.50 H new ATOM 0 HG22 VAL A 144 9.811 7.316 4.324 1.00 61.50 H new ATOM 0 HG23 VAL A 144 8.398 7.107 3.262 1.00 61.50 H new ATOM 2207 N ASP A 145 9.412 9.661 6.837 1.00 22.54 N ATOM 2208 CA ASP A 145 10.033 9.325 8.124 1.00 52.01 C ATOM 2209 C ASP A 145 8.967 9.078 9.210 1.00 14.20 C ATOM 2210 O ASP A 145 9.188 8.330 10.163 1.00 34.24 O ATOM 2211 CB ASP A 145 10.978 10.459 8.545 1.00 30.32 C ATOM 2212 CG ASP A 145 11.584 10.239 9.922 1.00 12.21 C ATOM 2213 OD1 ASP A 145 12.570 9.481 10.035 1.00 12.01 O ATOM 2214 OD2 ASP A 145 11.073 10.824 10.901 1.00 2.05 O ATOM 0 H ASP A 145 9.602 10.610 6.517 1.00 22.54 H new ATOM 0 HA ASP A 145 10.603 8.403 8.008 1.00 52.01 H new ATOM 0 HB2 ASP A 145 11.779 10.550 7.811 1.00 30.32 H new ATOM 0 HB3 ASP A 145 10.432 11.402 8.540 1.00 30.32 H new ATOM 2219 N GLN A 146 7.806 9.713 9.057 1.00 51.54 N ATOM 2220 CA GLN A 146 6.709 9.585 10.028 1.00 3.12 C ATOM 2221 C GLN A 146 5.702 8.490 9.629 1.00 52.11 C ATOM 2222 O GLN A 146 4.720 8.264 10.332 1.00 64.11 O ATOM 2223 CB GLN A 146 5.976 10.928 10.178 1.00 45.45 C ATOM 2224 CG GLN A 146 6.853 12.066 10.695 1.00 24.33 C ATOM 2225 CD GLN A 146 7.413 11.797 12.084 1.00 30.52 C ATOM 2226 OE1 GLN A 146 6.791 12.118 13.092 1.00 31.44 O ATOM 2227 NE2 GLN A 146 8.590 11.213 12.149 1.00 54.40 N ATOM 0 H GLN A 146 7.596 10.325 8.268 1.00 51.54 H new ATOM 0 HA GLN A 146 7.155 9.296 10.980 1.00 3.12 H new ATOM 0 HB2 GLN A 146 5.563 11.214 9.211 1.00 45.45 H new ATOM 0 HB3 GLN A 146 5.134 10.796 10.858 1.00 45.45 H new ATOM 0 HG2 GLN A 146 7.678 12.227 10.001 1.00 24.33 H new ATOM 0 HG3 GLN A 146 6.270 12.987 10.716 1.00 24.33 H new ATOM 0 HE21 GLN A 146 9.081 10.959 11.292 1.00 54.40 H new ATOM 0 HE22 GLN A 146 9.011 11.014 13.056 1.00 54.40 H new ATOM 2236 N LEU A 147 5.945 7.824 8.503 1.00 22.31 N ATOM 2237 CA LEU A 147 5.061 6.750 8.023 1.00 11.44 C ATOM 2238 C LEU A 147 5.296 5.426 8.770 1.00 55.31 C ATOM 2239 O LEU A 147 6.431 5.067 9.087 1.00 24.24 O ATOM 2240 CB LEU A 147 5.259 6.532 6.513 1.00 75.12 C ATOM 2241 CG LEU A 147 4.474 7.482 5.591 1.00 43.10 C ATOM 2242 CD1 LEU A 147 4.920 7.320 4.141 1.00 61.22 C ATOM 2243 CD2 LEU A 147 2.975 7.223 5.715 1.00 15.22 C ATOM 0 H LEU A 147 6.748 8.005 7.900 1.00 22.31 H new ATOM 0 HA LEU A 147 4.037 7.066 8.220 1.00 11.44 H new ATOM 0 HB2 LEU A 147 6.321 6.631 6.287 1.00 75.12 H new ATOM 0 HB3 LEU A 147 4.976 5.507 6.273 1.00 75.12 H new ATOM 0 HG LEU A 147 4.680 8.506 5.901 1.00 43.10 H new ATOM 0 HD11 LEU A 147 4.352 8.001 3.507 1.00 61.22 H new ATOM 0 HD12 LEU A 147 5.982 7.549 4.059 1.00 61.22 H new ATOM 0 HD13 LEU A 147 4.745 6.294 3.819 1.00 61.22 H new ATOM 0 HD21 LEU A 147 2.433 7.902 5.057 1.00 15.22 H new ATOM 0 HD22 LEU A 147 2.759 6.193 5.431 1.00 15.22 H new ATOM 0 HD23 LEU A 147 2.661 7.388 6.746 1.00 15.22 H new ATOM 2255 N GLY A 148 4.207 4.702 9.033 1.00 22.44 N ATOM 2256 CA GLY A 148 4.298 3.405 9.699 1.00 4.13 C ATOM 2257 C GLY A 148 3.787 2.250 8.837 1.00 44.13 C ATOM 2258 O GLY A 148 4.515 1.293 8.575 1.00 54.04 O ATOM 0 H GLY A 148 3.258 4.991 8.796 1.00 22.44 H new ATOM 0 HA2 GLY A 148 5.336 3.215 9.971 1.00 4.13 H new ATOM 0 HA3 GLY A 148 3.726 3.439 10.626 1.00 4.13 H new ATOM 2262 N PHE A 149 2.534 2.339 8.384 1.00 3.40 N ATOM 2263 CA PHE A 149 1.921 1.256 7.593 1.00 71.51 C ATOM 2264 C PHE A 149 1.076 1.798 6.426 1.00 20.41 C ATOM 2265 O PHE A 149 0.645 2.955 6.433 1.00 24.33 O ATOM 2266 CB PHE A 149 1.040 0.375 8.495 1.00 15.34 C ATOM 2267 CG PHE A 149 -0.211 1.066 8.984 1.00 40.43 C ATOM 2268 CD1 PHE A 149 -0.174 1.905 10.088 1.00 3.51 C ATOM 2269 CD2 PHE A 149 -1.425 0.880 8.332 1.00 21.23 C ATOM 2270 CE1 PHE A 149 -1.316 2.541 10.531 1.00 23.44 C ATOM 2271 CE2 PHE A 149 -2.568 1.515 8.774 1.00 12.44 C ATOM 2272 CZ PHE A 149 -2.515 2.347 9.873 1.00 3.20 C ATOM 0 H PHE A 149 1.924 3.140 8.547 1.00 3.40 H new ATOM 0 HA PHE A 149 2.734 0.664 7.173 1.00 71.51 H new ATOM 0 HB2 PHE A 149 0.757 -0.523 7.946 1.00 15.34 H new ATOM 0 HB3 PHE A 149 1.626 0.051 9.355 1.00 15.34 H new ATOM 0 HD1 PHE A 149 0.760 2.062 10.607 1.00 3.51 H new ATOM 0 HD2 PHE A 149 -1.474 0.231 7.470 1.00 21.23 H new ATOM 0 HE1 PHE A 149 -1.272 3.191 11.393 1.00 23.44 H new ATOM 0 HE2 PHE A 149 -3.505 1.360 8.259 1.00 12.44 H new ATOM 0 HZ PHE A 149 -3.409 2.846 10.218 1.00 3.20 H new ATOM 2282 N VAL A 150 0.844 0.943 5.428 1.00 52.34 N ATOM 2283 CA VAL A 150 -0.027 1.259 4.285 1.00 65.32 C ATOM 2284 C VAL A 150 -0.982 0.080 3.993 1.00 22.13 C ATOM 2285 O VAL A 150 -0.607 -0.885 3.328 1.00 60.44 O ATOM 2286 CB VAL A 150 0.809 1.573 3.009 1.00 14.01 C ATOM 2287 CG1 VAL A 150 -0.096 1.890 1.821 1.00 45.03 C ATOM 2288 CG2 VAL A 150 1.788 2.722 3.262 1.00 53.55 C ATOM 0 H VAL A 150 1.253 0.010 5.386 1.00 52.34 H new ATOM 0 HA VAL A 150 -0.608 2.143 4.548 1.00 65.32 H new ATOM 0 HB VAL A 150 1.386 0.681 2.766 1.00 14.01 H new ATOM 0 HG11 VAL A 150 0.516 2.105 0.945 1.00 45.03 H new ATOM 0 HG12 VAL A 150 -0.738 1.034 1.614 1.00 45.03 H new ATOM 0 HG13 VAL A 150 -0.713 2.758 2.055 1.00 45.03 H new ATOM 0 HG21 VAL A 150 2.359 2.920 2.355 1.00 53.55 H new ATOM 0 HG22 VAL A 150 1.234 3.617 3.545 1.00 53.55 H new ATOM 0 HG23 VAL A 150 2.470 2.448 4.067 1.00 53.55 H new ATOM 2298 N ARG A 151 -2.210 0.149 4.515 1.00 72.34 N ATOM 2299 CA ARG A 151 -3.186 -0.947 4.362 1.00 72.51 C ATOM 2300 C ARG A 151 -4.104 -0.736 3.140 1.00 60.51 C ATOM 2301 O ARG A 151 -4.931 0.174 3.126 1.00 63.41 O ATOM 2302 CB ARG A 151 -4.054 -1.072 5.627 1.00 72.20 C ATOM 2303 CG ARG A 151 -5.002 -2.271 5.597 1.00 44.31 C ATOM 2304 CD ARG A 151 -6.141 -2.145 6.607 1.00 62.20 C ATOM 2305 NE ARG A 151 -5.679 -2.062 7.992 1.00 21.22 N ATOM 2306 CZ ARG A 151 -6.463 -2.224 9.027 1.00 11.55 C ATOM 2307 NH1 ARG A 151 -7.724 -2.480 8.869 1.00 15.32 N ATOM 2308 NH2 ARG A 151 -5.991 -2.109 10.223 1.00 31.44 N ATOM 0 H ARG A 151 -2.556 0.948 5.047 1.00 72.34 H new ATOM 0 HA ARG A 151 -2.615 -1.863 4.209 1.00 72.51 H new ATOM 0 HB2 ARG A 151 -3.404 -1.154 6.498 1.00 72.20 H new ATOM 0 HB3 ARG A 151 -4.638 -0.160 5.750 1.00 72.20 H new ATOM 0 HG2 ARG A 151 -5.419 -2.374 4.595 1.00 44.31 H new ATOM 0 HG3 ARG A 151 -4.438 -3.181 5.803 1.00 44.31 H new ATOM 0 HD2 ARG A 151 -6.728 -1.257 6.373 1.00 62.20 H new ATOM 0 HD3 ARG A 151 -6.806 -3.003 6.504 1.00 62.20 H new ATOM 0 HE ARG A 151 -4.692 -1.867 8.160 1.00 21.22 H new ATOM 0 HH11 ARG A 151 -8.115 -2.557 7.930 1.00 15.32 H new ATOM 0 HH12 ARG A 151 -8.325 -2.604 9.684 1.00 15.32 H new ATOM 0 HH21 ARG A 151 -5.004 -1.891 10.363 1.00 31.44 H new ATOM 0 HH22 ARG A 151 -6.605 -2.236 11.028 1.00 31.44 H new ATOM 2322 N ILE A 152 -3.972 -1.590 2.128 1.00 63.43 N ATOM 2323 CA ILE A 152 -4.817 -1.504 0.925 1.00 71.50 C ATOM 2324 C ILE A 152 -6.103 -2.340 1.083 1.00 53.11 C ATOM 2325 O ILE A 152 -6.063 -3.455 1.606 1.00 74.15 O ATOM 2326 CB ILE A 152 -4.057 -1.994 -0.336 1.00 53.25 C ATOM 2327 CG1 ILE A 152 -2.710 -1.261 -0.489 1.00 14.12 C ATOM 2328 CG2 ILE A 152 -4.917 -1.806 -1.587 1.00 51.44 C ATOM 2329 CD1 ILE A 152 -2.840 0.232 -0.711 1.00 35.22 C ATOM 0 H ILE A 152 -3.292 -2.350 2.110 1.00 63.43 H new ATOM 0 HA ILE A 152 -5.080 -0.453 0.803 1.00 71.50 H new ATOM 0 HB ILE A 152 -3.850 -3.057 -0.215 1.00 53.25 H new ATOM 0 HG12 ILE A 152 -2.111 -1.434 0.405 1.00 14.12 H new ATOM 0 HG13 ILE A 152 -2.165 -1.696 -1.327 1.00 14.12 H new ATOM 0 HG21 ILE A 152 -4.368 -2.155 -2.462 1.00 51.44 H new ATOM 0 HG22 ILE A 152 -5.839 -2.379 -1.484 1.00 51.44 H new ATOM 0 HG23 ILE A 152 -5.158 -0.750 -1.707 1.00 51.44 H new ATOM 0 HD11 ILE A 152 -1.848 0.673 -0.809 1.00 35.22 H new ATOM 0 HD12 ILE A 152 -3.410 0.416 -1.621 1.00 35.22 H new ATOM 0 HD13 ILE A 152 -3.355 0.682 0.137 1.00 35.22 H new ATOM 2341 N HIS A 153 -7.245 -1.795 0.639 1.00 41.42 N ATOM 2342 CA HIS A 153 -8.527 -2.523 0.688 1.00 32.33 C ATOM 2343 C HIS A 153 -9.591 -1.877 -0.227 1.00 33.12 C ATOM 2344 O HIS A 153 -9.305 -0.915 -0.939 1.00 15.11 O ATOM 2345 CB HIS A 153 -9.046 -2.603 2.137 1.00 62.23 C ATOM 2346 CG HIS A 153 -9.375 -1.270 2.756 1.00 54.13 C ATOM 2347 ND1 HIS A 153 -10.662 -0.883 3.062 1.00 23.51 N ATOM 2348 CD2 HIS A 153 -8.581 -0.238 3.140 1.00 21.01 C ATOM 2349 CE1 HIS A 153 -10.648 0.318 3.605 1.00 5.05 C ATOM 2350 NE2 HIS A 153 -9.401 0.731 3.661 1.00 12.53 N ATOM 0 H HIS A 153 -7.310 -0.857 0.243 1.00 41.42 H new ATOM 0 HA HIS A 153 -8.343 -3.532 0.319 1.00 32.33 H new ATOM 0 HB2 HIS A 153 -9.938 -3.229 2.156 1.00 62.23 H new ATOM 0 HB3 HIS A 153 -8.295 -3.100 2.752 1.00 62.23 H new ATOM 0 HD1 HIS A 153 -11.499 -1.442 2.894 1.00 23.51 H new ATOM 0 HD2 HIS A 153 -7.506 -0.189 3.052 1.00 21.01 H new ATOM 0 HE1 HIS A 153 -11.513 0.868 3.946 1.00 5.05 H new ATOM 0 HE2 HIS A 153 -9.092 1.629 4.033 1.00 12.53 H new ATOM 2359 N ASP A 154 -10.811 -2.433 -0.208 1.00 44.34 N ATOM 2360 CA ASP A 154 -11.956 -1.912 -0.987 1.00 14.13 C ATOM 2361 C ASP A 154 -11.746 -2.023 -2.511 1.00 61.41 C ATOM 2362 O ASP A 154 -12.418 -1.338 -3.286 1.00 4.34 O ATOM 2363 CB ASP A 154 -12.259 -0.450 -0.608 1.00 22.40 C ATOM 2364 CG ASP A 154 -12.732 -0.287 0.827 1.00 74.00 C ATOM 2365 OD1 ASP A 154 -12.903 -1.305 1.529 1.00 51.34 O ATOM 2366 OD2 ASP A 154 -12.931 0.869 1.260 1.00 20.10 O ATOM 0 H ASP A 154 -11.037 -3.258 0.347 1.00 44.34 H new ATOM 0 HA ASP A 154 -12.809 -2.540 -0.729 1.00 14.13 H new ATOM 0 HB2 ASP A 154 -11.362 0.150 -0.758 1.00 22.40 H new ATOM 0 HB3 ASP A 154 -13.021 -0.058 -1.281 1.00 22.40 H new ATOM 2371 N ILE A 155 -10.842 -2.904 -2.941 1.00 13.33 N ATOM 2372 CA ILE A 155 -10.536 -3.055 -4.370 1.00 21.05 C ATOM 2373 C ILE A 155 -11.704 -3.697 -5.144 1.00 23.42 C ATOM 2374 O ILE A 155 -11.928 -4.910 -5.081 1.00 51.40 O ATOM 2375 CB ILE A 155 -9.247 -3.882 -4.592 1.00 12.21 C ATOM 2376 CG1 ILE A 155 -8.073 -3.249 -3.828 1.00 3.31 C ATOM 2377 CG2 ILE A 155 -8.921 -3.991 -6.082 1.00 40.01 C ATOM 2378 CD1 ILE A 155 -7.759 -1.824 -4.249 1.00 53.13 C ATOM 0 H ILE A 155 -10.310 -3.522 -2.328 1.00 13.33 H new ATOM 0 HA ILE A 155 -10.378 -2.049 -4.758 1.00 21.05 H new ATOM 0 HB ILE A 155 -9.413 -4.889 -4.208 1.00 12.21 H new ATOM 0 HG12 ILE A 155 -8.298 -3.261 -2.762 1.00 3.31 H new ATOM 0 HG13 ILE A 155 -7.185 -3.864 -3.973 1.00 3.31 H new ATOM 0 HG21 ILE A 155 -8.011 -4.577 -6.213 1.00 40.01 H new ATOM 0 HG22 ILE A 155 -9.746 -4.481 -6.600 1.00 40.01 H new ATOM 0 HG23 ILE A 155 -8.774 -2.994 -6.496 1.00 40.01 H new ATOM 0 HD11 ILE A 155 -6.919 -1.448 -3.664 1.00 53.13 H new ATOM 0 HD12 ILE A 155 -7.501 -1.806 -5.308 1.00 53.13 H new ATOM 0 HD13 ILE A 155 -8.631 -1.193 -4.078 1.00 53.13 H new ATOM 2390 N GLN A 156 -12.445 -2.864 -5.872 1.00 43.15 N ATOM 2391 CA GLN A 156 -13.613 -3.300 -6.648 1.00 42.04 C ATOM 2392 C GLN A 156 -13.624 -2.653 -8.048 1.00 23.33 C ATOM 2393 O GLN A 156 -13.068 -1.567 -8.235 1.00 12.50 O ATOM 2394 CB GLN A 156 -14.896 -2.921 -5.892 1.00 75.42 C ATOM 2395 CG GLN A 156 -14.998 -1.433 -5.575 1.00 64.40 C ATOM 2396 CD GLN A 156 -16.307 -1.066 -4.906 1.00 72.22 C ATOM 2397 OE1 GLN A 156 -17.286 -0.745 -5.572 1.00 52.25 O ATOM 2398 NE2 GLN A 156 -16.337 -1.105 -3.591 1.00 1.15 N ATOM 0 H GLN A 156 -12.255 -1.864 -5.943 1.00 43.15 H new ATOM 0 HA GLN A 156 -13.561 -4.381 -6.775 1.00 42.04 H new ATOM 0 HB2 GLN A 156 -15.760 -3.218 -6.487 1.00 75.42 H new ATOM 0 HB3 GLN A 156 -14.940 -3.487 -4.961 1.00 75.42 H new ATOM 0 HG2 GLN A 156 -14.170 -1.146 -4.926 1.00 64.40 H new ATOM 0 HG3 GLN A 156 -14.893 -0.861 -6.497 1.00 64.40 H new ATOM 0 HE21 GLN A 156 -15.503 -1.377 -3.070 1.00 1.15 H new ATOM 0 HE22 GLN A 156 -17.194 -0.864 -3.093 1.00 1.15 H new ATOM 2407 N PRO A 157 -14.263 -3.301 -9.050 1.00 42.24 N ATOM 2408 CA PRO A 157 -14.339 -2.764 -10.427 1.00 12.22 C ATOM 2409 C PRO A 157 -15.097 -1.423 -10.519 1.00 52.44 C ATOM 2410 O PRO A 157 -15.964 -1.128 -9.691 1.00 60.03 O ATOM 2411 CB PRO A 157 -15.097 -3.858 -11.203 1.00 34.50 C ATOM 2412 CG PRO A 157 -15.001 -5.084 -10.354 1.00 64.24 C ATOM 2413 CD PRO A 157 -14.954 -4.599 -8.934 1.00 44.13 C ATOM 0 HA PRO A 157 -13.345 -2.547 -10.819 1.00 12.22 H new ATOM 0 HB2 PRO A 157 -16.136 -3.574 -11.368 1.00 34.50 H new ATOM 0 HB3 PRO A 157 -14.652 -4.024 -12.184 1.00 34.50 H new ATOM 0 HG2 PRO A 157 -15.858 -5.739 -10.515 1.00 64.24 H new ATOM 0 HG3 PRO A 157 -14.109 -5.660 -10.600 1.00 64.24 H new ATOM 0 HD2 PRO A 157 -15.953 -4.488 -8.512 1.00 44.13 H new ATOM 0 HD3 PRO A 157 -14.410 -5.290 -8.289 1.00 44.13 H new ATOM 2421 N VAL A 158 -14.775 -0.619 -11.534 1.00 2.15 N ATOM 2422 CA VAL A 158 -15.438 0.680 -11.741 1.00 14.45 C ATOM 2423 C VAL A 158 -16.294 0.690 -13.022 1.00 40.10 C ATOM 2424 O VAL A 158 -16.507 -0.350 -13.652 1.00 5.22 O ATOM 2425 CB VAL A 158 -14.407 1.837 -11.811 1.00 42.11 C ATOM 2426 CG1 VAL A 158 -13.575 1.901 -10.533 1.00 34.41 C ATOM 2427 CG2 VAL A 158 -13.508 1.698 -13.040 1.00 50.42 C ATOM 0 H VAL A 158 -14.060 -0.840 -12.228 1.00 2.15 H new ATOM 0 HA VAL A 158 -16.091 0.831 -10.881 1.00 14.45 H new ATOM 0 HB VAL A 158 -14.958 2.773 -11.904 1.00 42.11 H new ATOM 0 HG11 VAL A 158 -12.859 2.720 -10.605 1.00 34.41 H new ATOM 0 HG12 VAL A 158 -14.232 2.068 -9.679 1.00 34.41 H new ATOM 0 HG13 VAL A 158 -13.039 0.961 -10.400 1.00 34.41 H new ATOM 0 HG21 VAL A 158 -12.795 2.522 -13.064 1.00 50.42 H new ATOM 0 HG22 VAL A 158 -12.968 0.752 -12.991 1.00 50.42 H new ATOM 0 HG23 VAL A 158 -14.119 1.720 -13.942 1.00 50.42 H new