USER MOD reduce.3.24.130724 H: found=0, std=0, add=1013, rem=0, adj=28 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 -158:sc= 0.223 USER MOD Set 1.2: A 131 SER OG : rot 129:sc= 1.16 USER MOD Set 2.1: A 101 TYR OH : rot 130:sc= 0.575 USER MOD Set 2.2: A 119 GLN : amide:sc= -2.71! K(o=-2.1!,f=-0.017) USER MOD Set 3.1: A 107 THR OG1 : rot 180:sc= 0.745 USER MOD Set 3.2: A 110 ASN : amide:sc= -0.75 X(o=-0.0044,f=-0.11) USER MOD Set 4.1: A 105 GLN : amide:sc= -2.77! K(o=-2.8!,f=-0.87) USER MOD Set 4.2: A 112 GLN : amide:sc= 0 K(o=-2.8,f=-0.87) USER MOD Set 5.1: A 103 GLN : amide:sc= -1.32! C(o=-0.2!,f=-1.8!) USER MOD Set 5.2: A 115 ASN : amide:sc= 1.04 K(o=-0.2,f=-1.8) USER MOD Set 5.3: A 146 GLN : amide:sc= 0.0798 K(o=-0.2,f=-1.8) USER MOD Set 6.1: A 72 THR OG1 : rot 180:sc= 0 USER MOD Set 6.2: A 79 THR OG1 : rot 38:sc= 0.293 USER MOD Set 7.1: A 34 GLN : amide:sc= 0.434 K(o=0.58,f=-0.36) USER MOD Set 7.2: A 38 ASN : amide:sc= -0.259 K(o=0.58,f=-3.7!) USER MOD Set 7.3: A 53 THR OG1 : rot -170:sc= 0.401 USER MOD Set 8.1: A 30 LYS NZ :NH3+ 173:sc= 1.29 (180deg=0) USER MOD Set 8.2: A 33 GLN : amide:sc= 1.05 K(o=2.3,f=-9.2!) USER MOD Single : A 28 THR OG1 : rot 47:sc= 1.28 USER MOD Single : A 32 THR OG1 : rot 68:sc= 0.0163 USER MOD Single : A 35 ASN : amide:sc= 0.986 K(o=0.99,f=-0.0034) USER MOD Single : A 40 LYS NZ :NH3+ -137:sc= -1.37 (180deg=-3.5!) USER MOD Single : A 41 SER OG : rot -146:sc= 0.56 USER MOD Single : A 42 SER OG : rot 180:sc= -0.0137 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 46 TYR OH : rot -174:sc= 1.43 USER MOD Single : A 52 LYS NZ :NH3+ -176:sc= 0.67 (180deg=0.619) USER MOD Single : A 59 SER OG : rot -53:sc= 0.841 USER MOD Single : A 60 GLN : amide:sc= -2.13! K(o=-2.1!,f=-0.9) USER MOD Single : A 63 THR OG1 : rot -108:sc= 0.501 USER MOD Single : A 66 MET CE :methyl -140:sc= 0 (180deg=-1.89) USER MOD Single : A 67 SER OG : rot -110:sc= -0.0296 USER MOD Single : A 70 ASN : amide:sc= -4.43! K(o=-4.4!,f=-0.74) USER MOD Single : A 78 THR OG1 : rot 81:sc= 0.712 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= 1.4 K(o=1.4,f=-5.2!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -0.273 K(o=-0.27,f=-2!) USER MOD Single : A 96 SER OG : rot -21:sc= 0.321 USER MOD Single : A 98 THR OG1 : rot 130:sc= 0.28 USER MOD Single : A 117 GLN : amide:sc= -1.89 K(o=-1.9,f=-0.82) USER MOD Single : A 118 ASN : amide:sc= -0.0347 X(o=-0.035,f=-0.03) USER MOD Single : A 122 ASN : amide:sc= -0.161 X(o=-0.16,f=0) USER MOD Single : A 138 GLN : amide:sc= 0.327 K(o=0.33,f=-0.64) USER MOD Single : A 140 LYS NZ :NH3+ 169:sc= -0.0133 (180deg=-0.15) USER MOD Single : A 143 SER OG : rot 180:sc= -0.0743 USER MOD Single : A 153 HIS : no HE2:sc= -0.347 K(o=-0.35,f=-5.6!) USER MOD Single : A 156 GLN : amide:sc= 0.49 X(o=0.49,f=0) USER MOD ----------------------------------------------------------------- ATOM 425 N GLU A 27 15.577 -2.467 6.152 1.00 65.33 N ATOM 426 CA GLU A 27 14.645 -2.814 5.072 1.00 34.44 C ATOM 427 C GLU A 27 14.344 -4.321 5.065 1.00 23.43 C ATOM 428 O GLU A 27 13.205 -4.729 4.860 1.00 34.24 O ATOM 429 CB GLU A 27 15.152 -2.338 3.694 1.00 15.20 C ATOM 430 CG GLU A 27 16.117 -3.275 2.964 1.00 45.24 C ATOM 431 CD GLU A 27 17.471 -3.394 3.634 1.00 33.25 C ATOM 432 OE1 GLU A 27 18.155 -2.367 3.788 1.00 71.42 O ATOM 433 OE2 GLU A 27 17.860 -4.522 3.997 1.00 43.24 O ATOM 0 HA GLU A 27 13.713 -2.284 5.268 1.00 34.44 H new ATOM 0 HB2 GLU A 27 14.288 -2.169 3.052 1.00 15.20 H new ATOM 0 HB3 GLU A 27 15.645 -1.375 3.825 1.00 15.20 H new ATOM 0 HG2 GLU A 27 15.667 -4.265 2.896 1.00 45.24 H new ATOM 0 HG3 GLU A 27 16.256 -2.917 1.944 1.00 45.24 H new ATOM 440 N THR A 28 15.365 -5.140 5.313 1.00 11.31 N ATOM 441 CA THR A 28 15.181 -6.600 5.454 1.00 3.32 C ATOM 442 C THR A 28 14.219 -6.929 6.605 1.00 4.34 C ATOM 443 O THR A 28 13.268 -7.701 6.444 1.00 0.15 O ATOM 444 CB THR A 28 16.522 -7.337 5.719 1.00 63.10 C ATOM 445 OG1 THR A 28 17.440 -7.120 4.637 1.00 42.44 O ATOM 446 CG2 THR A 28 16.304 -8.839 5.898 1.00 24.24 C ATOM 0 H THR A 28 16.330 -4.827 5.422 1.00 11.31 H new ATOM 0 HA THR A 28 14.766 -6.943 4.507 1.00 3.32 H new ATOM 0 HB THR A 28 16.940 -6.930 6.640 1.00 63.10 H new ATOM 0 HG1 THR A 28 17.458 -6.167 4.410 1.00 42.44 H new ATOM 0 HG21 THR A 28 17.262 -9.326 6.082 1.00 24.24 H new ATOM 0 HG22 THR A 28 15.640 -9.012 6.745 1.00 24.24 H new ATOM 0 HG23 THR A 28 15.854 -9.252 4.995 1.00 24.24 H new ATOM 454 N VAL A 29 14.477 -6.338 7.768 1.00 52.41 N ATOM 455 CA VAL A 29 13.609 -6.511 8.937 1.00 15.02 C ATOM 456 C VAL A 29 12.191 -5.991 8.642 1.00 42.02 C ATOM 457 O VAL A 29 11.191 -6.553 9.097 1.00 10.25 O ATOM 458 CB VAL A 29 14.188 -5.768 10.169 1.00 0.51 C ATOM 459 CG1 VAL A 29 13.294 -5.944 11.396 1.00 74.31 C ATOM 460 CG2 VAL A 29 15.615 -6.234 10.461 1.00 21.14 C ATOM 0 H VAL A 29 15.282 -5.733 7.930 1.00 52.41 H new ATOM 0 HA VAL A 29 13.559 -7.577 9.159 1.00 15.02 H new ATOM 0 HB VAL A 29 14.218 -4.704 9.933 1.00 0.51 H new ATOM 0 HG11 VAL A 29 13.728 -5.411 12.242 1.00 74.31 H new ATOM 0 HG12 VAL A 29 12.303 -5.543 11.184 1.00 74.31 H new ATOM 0 HG13 VAL A 29 13.213 -7.004 11.638 1.00 74.31 H new ATOM 0 HG21 VAL A 29 16.002 -5.700 11.329 1.00 21.14 H new ATOM 0 HG22 VAL A 29 15.614 -7.305 10.665 1.00 21.14 H new ATOM 0 HG23 VAL A 29 16.248 -6.030 9.598 1.00 21.14 H new ATOM 470 N LYS A 30 12.123 -4.921 7.856 1.00 61.03 N ATOM 471 CA LYS A 30 10.851 -4.310 7.472 1.00 71.11 C ATOM 472 C LYS A 30 10.079 -5.222 6.496 1.00 62.23 C ATOM 473 O LYS A 30 8.850 -5.295 6.542 1.00 52.41 O ATOM 474 CB LYS A 30 11.109 -2.927 6.845 1.00 43.13 C ATOM 475 CG LYS A 30 10.029 -1.889 7.136 1.00 23.25 C ATOM 476 CD LYS A 30 9.848 -1.671 8.639 1.00 4.31 C ATOM 477 CE LYS A 30 8.898 -0.518 8.940 1.00 74.14 C ATOM 478 NZ LYS A 30 8.596 -0.413 10.392 1.00 42.44 N ATOM 0 H LYS A 30 12.942 -4.454 7.468 1.00 61.03 H new ATOM 0 HA LYS A 30 10.236 -4.183 8.363 1.00 71.11 H new ATOM 0 HB2 LYS A 30 12.065 -2.550 7.208 1.00 43.13 H new ATOM 0 HB3 LYS A 30 11.202 -3.043 5.765 1.00 43.13 H new ATOM 0 HG2 LYS A 30 10.293 -0.945 6.660 1.00 23.25 H new ATOM 0 HG3 LYS A 30 9.085 -2.213 6.698 1.00 23.25 H new ATOM 0 HD2 LYS A 30 9.465 -2.584 9.094 1.00 4.31 H new ATOM 0 HD3 LYS A 30 10.817 -1.470 9.095 1.00 4.31 H new ATOM 0 HE2 LYS A 30 9.339 0.416 8.593 1.00 74.14 H new ATOM 0 HE3 LYS A 30 7.970 -0.658 8.385 1.00 74.14 H new ATOM 0 HZ1 LYS A 30 8.045 0.451 10.570 1.00 42.44 H new ATOM 0 HZ2 LYS A 30 8.047 -1.243 10.693 1.00 42.44 H new ATOM 0 HZ3 LYS A 30 9.485 -0.373 10.930 1.00 42.44 H new ATOM 492 N ILE A 31 10.808 -5.912 5.613 1.00 65.34 N ATOM 493 CA ILE A 31 10.212 -6.936 4.738 1.00 2.43 C ATOM 494 C ILE A 31 9.586 -8.057 5.579 1.00 0.23 C ATOM 495 O ILE A 31 8.483 -8.532 5.298 1.00 3.11 O ATOM 496 CB ILE A 31 11.263 -7.552 3.773 1.00 72.52 C ATOM 497 CG1 ILE A 31 11.830 -6.479 2.826 1.00 32.55 C ATOM 498 CG2 ILE A 31 10.655 -8.704 2.972 1.00 53.41 C ATOM 499 CD1 ILE A 31 12.952 -6.974 1.932 1.00 23.02 C ATOM 0 H ILE A 31 11.811 -5.783 5.483 1.00 65.34 H new ATOM 0 HA ILE A 31 9.443 -6.443 4.143 1.00 2.43 H new ATOM 0 HB ILE A 31 12.082 -7.947 4.374 1.00 72.52 H new ATOM 0 HG12 ILE A 31 11.023 -6.098 2.201 1.00 32.55 H new ATOM 0 HG13 ILE A 31 12.196 -5.641 3.420 1.00 32.55 H new ATOM 0 HG21 ILE A 31 11.409 -9.120 2.303 1.00 53.41 H new ATOM 0 HG22 ILE A 31 10.309 -9.479 3.655 1.00 53.41 H new ATOM 0 HG23 ILE A 31 9.814 -8.335 2.386 1.00 53.41 H new ATOM 0 HD11 ILE A 31 13.297 -6.159 1.296 1.00 23.02 H new ATOM 0 HD12 ILE A 31 13.779 -7.328 2.548 1.00 23.02 H new ATOM 0 HD13 ILE A 31 12.588 -7.791 1.310 1.00 23.02 H new ATOM 511 N THR A 32 10.304 -8.471 6.620 1.00 71.54 N ATOM 512 CA THR A 32 9.786 -9.458 7.571 1.00 31.02 C ATOM 513 C THR A 32 8.469 -8.967 8.195 1.00 3.21 C ATOM 514 O THR A 32 7.495 -9.713 8.290 1.00 64.33 O ATOM 515 CB THR A 32 10.807 -9.751 8.699 1.00 1.23 C ATOM 516 OG1 THR A 32 12.036 -10.251 8.144 1.00 44.31 O ATOM 517 CG2 THR A 32 10.257 -10.767 9.693 1.00 5.01 C ATOM 0 H THR A 32 11.246 -8.140 6.829 1.00 71.54 H new ATOM 0 HA THR A 32 9.607 -10.379 7.016 1.00 31.02 H new ATOM 0 HB THR A 32 10.995 -8.814 9.223 1.00 1.23 H new ATOM 0 HG1 THR A 32 12.475 -9.542 7.630 1.00 44.31 H new ATOM 0 HG21 THR A 32 10.997 -10.951 10.472 1.00 5.01 H new ATOM 0 HG22 THR A 32 9.344 -10.377 10.144 1.00 5.01 H new ATOM 0 HG23 THR A 32 10.036 -11.700 9.175 1.00 5.01 H new ATOM 525 N GLN A 33 8.451 -7.694 8.593 1.00 34.43 N ATOM 526 CA GLN A 33 7.251 -7.063 9.158 1.00 12.04 C ATOM 527 C GLN A 33 6.092 -7.069 8.145 1.00 51.44 C ATOM 528 O GLN A 33 4.938 -7.313 8.501 1.00 45.32 O ATOM 529 CB GLN A 33 7.577 -5.621 9.588 1.00 74.23 C ATOM 530 CG GLN A 33 6.471 -4.935 10.384 1.00 21.31 C ATOM 531 CD GLN A 33 6.960 -3.688 11.110 1.00 31.54 C ATOM 532 OE1 GLN A 33 6.933 -2.584 10.577 1.00 55.40 O ATOM 533 NE2 GLN A 33 7.421 -3.858 12.336 1.00 62.11 N ATOM 0 H GLN A 33 9.259 -7.074 8.535 1.00 34.43 H new ATOM 0 HA GLN A 33 6.936 -7.637 10.029 1.00 12.04 H new ATOM 0 HB2 GLN A 33 8.487 -5.631 10.188 1.00 74.23 H new ATOM 0 HB3 GLN A 33 7.788 -5.028 8.698 1.00 74.23 H new ATOM 0 HG2 GLN A 33 5.658 -4.664 9.710 1.00 21.31 H new ATOM 0 HG3 GLN A 33 6.062 -5.637 11.110 1.00 21.31 H new ATOM 0 HE21 GLN A 33 7.431 -4.789 12.753 1.00 62.11 H new ATOM 0 HE22 GLN A 33 7.767 -3.058 12.866 1.00 62.11 H new ATOM 542 N GLN A 34 6.422 -6.812 6.881 1.00 41.52 N ATOM 543 CA GLN A 34 5.434 -6.798 5.790 1.00 13.45 C ATOM 544 C GLN A 34 4.717 -8.153 5.660 1.00 11.14 C ATOM 545 O GLN A 34 3.487 -8.225 5.732 1.00 62.33 O ATOM 546 CB GLN A 34 6.132 -6.405 4.471 1.00 70.34 C ATOM 547 CG GLN A 34 5.200 -6.244 3.265 1.00 65.43 C ATOM 548 CD GLN A 34 5.197 -7.456 2.346 1.00 14.41 C ATOM 549 OE1 GLN A 34 4.407 -8.378 2.511 1.00 32.12 O ATOM 550 NE2 GLN A 34 6.087 -7.460 1.371 1.00 44.13 N ATOM 0 H GLN A 34 7.375 -6.608 6.579 1.00 41.52 H new ATOM 0 HA GLN A 34 4.668 -6.058 6.021 1.00 13.45 H new ATOM 0 HB2 GLN A 34 6.666 -5.467 4.626 1.00 70.34 H new ATOM 0 HB3 GLN A 34 6.880 -7.162 4.234 1.00 70.34 H new ATOM 0 HG2 GLN A 34 4.185 -6.062 3.619 1.00 65.43 H new ATOM 0 HG3 GLN A 34 5.501 -5.365 2.696 1.00 65.43 H new ATOM 0 HE21 GLN A 34 6.729 -6.675 1.264 1.00 44.13 H new ATOM 0 HE22 GLN A 34 6.132 -8.248 0.725 1.00 44.13 H new ATOM 559 N ASN A 35 5.492 -9.223 5.497 1.00 73.34 N ATOM 560 CA ASN A 35 4.932 -10.578 5.383 1.00 64.01 C ATOM 561 C ASN A 35 4.140 -10.982 6.646 1.00 52.33 C ATOM 562 O ASN A 35 3.085 -11.620 6.552 1.00 51.41 O ATOM 563 CB ASN A 35 6.049 -11.595 5.113 1.00 14.32 C ATOM 564 CG ASN A 35 6.664 -11.433 3.731 1.00 34.13 C ATOM 565 OD1 ASN A 35 6.228 -12.051 2.763 1.00 1.43 O ATOM 566 ND2 ASN A 35 7.686 -10.609 3.624 1.00 2.55 N ATOM 0 H ASN A 35 6.510 -9.183 5.440 1.00 73.34 H new ATOM 0 HA ASN A 35 4.237 -10.575 4.544 1.00 64.01 H new ATOM 0 HB2 ASN A 35 6.827 -11.484 5.868 1.00 14.32 H new ATOM 0 HB3 ASN A 35 5.649 -12.604 5.213 1.00 14.32 H new ATOM 0 HD21 ASN A 35 8.137 -10.471 2.720 1.00 2.55 H new ATOM 0 HD22 ASN A 35 8.026 -10.109 4.445 1.00 2.55 H new ATOM 573 N ARG A 36 4.646 -10.602 7.822 1.00 62.11 N ATOM 574 CA ARG A 36 3.988 -10.939 9.093 1.00 43.33 C ATOM 575 C ARG A 36 2.622 -10.244 9.250 1.00 43.33 C ATOM 576 O ARG A 36 1.607 -10.904 9.482 1.00 35.31 O ATOM 577 CB ARG A 36 4.901 -10.593 10.278 1.00 45.43 C ATOM 578 CG ARG A 36 6.086 -11.542 10.424 1.00 14.43 C ATOM 579 CD ARG A 36 6.965 -11.192 11.621 1.00 14.23 C ATOM 580 NE ARG A 36 7.939 -12.250 11.902 1.00 4.25 N ATOM 581 CZ ARG A 36 8.985 -12.118 12.676 1.00 4.02 C ATOM 582 NH1 ARG A 36 9.282 -10.974 13.206 1.00 74.55 N ATOM 583 NH2 ARG A 36 9.743 -13.139 12.903 1.00 4.21 N ATOM 0 H ARG A 36 5.506 -10.063 7.924 1.00 62.11 H new ATOM 0 HA ARG A 36 3.804 -12.013 9.082 1.00 43.33 H new ATOM 0 HB2 ARG A 36 5.272 -9.575 10.157 1.00 45.43 H new ATOM 0 HB3 ARG A 36 4.315 -10.611 11.197 1.00 45.43 H new ATOM 0 HG2 ARG A 36 5.720 -12.563 10.531 1.00 14.43 H new ATOM 0 HG3 ARG A 36 6.686 -11.513 9.515 1.00 14.43 H new ATOM 0 HD2 ARG A 36 7.489 -10.256 11.427 1.00 14.23 H new ATOM 0 HD3 ARG A 36 6.339 -11.031 12.498 1.00 14.23 H new ATOM 0 HE ARG A 36 7.790 -13.158 11.461 1.00 4.25 H new ATOM 0 HH11 ARG A 36 8.697 -10.159 13.022 1.00 74.55 H new ATOM 0 HH12 ARG A 36 10.101 -10.888 13.807 1.00 74.55 H new ATOM 0 HH21 ARG A 36 9.524 -14.041 12.480 1.00 4.21 H new ATOM 0 HH22 ARG A 36 10.560 -13.043 13.506 1.00 4.21 H new ATOM 597 N LEU A 37 2.598 -8.916 9.121 1.00 41.22 N ATOM 598 CA LEU A 37 1.342 -8.156 9.224 1.00 51.45 C ATOM 599 C LEU A 37 0.308 -8.663 8.204 1.00 2.15 C ATOM 600 O LEU A 37 -0.876 -8.812 8.518 1.00 64.33 O ATOM 601 CB LEU A 37 1.605 -6.659 9.022 1.00 10.33 C ATOM 602 CG LEU A 37 2.524 -6.002 10.069 1.00 14.43 C ATOM 603 CD1 LEU A 37 2.757 -4.526 9.745 1.00 41.21 C ATOM 604 CD2 LEU A 37 1.951 -6.165 11.479 1.00 43.13 C ATOM 0 H LEU A 37 3.425 -8.345 8.946 1.00 41.22 H new ATOM 0 HA LEU A 37 0.934 -8.307 10.224 1.00 51.45 H new ATOM 0 HB2 LEU A 37 2.045 -6.515 8.035 1.00 10.33 H new ATOM 0 HB3 LEU A 37 0.649 -6.136 9.024 1.00 10.33 H new ATOM 0 HG LEU A 37 3.487 -6.511 10.034 1.00 14.43 H new ATOM 0 HD11 LEU A 37 3.409 -4.086 10.500 1.00 41.21 H new ATOM 0 HD12 LEU A 37 3.226 -4.438 8.765 1.00 41.21 H new ATOM 0 HD13 LEU A 37 1.802 -4.000 9.739 1.00 41.21 H new ATOM 0 HD21 LEU A 37 2.618 -5.693 12.200 1.00 43.13 H new ATOM 0 HD22 LEU A 37 0.970 -5.693 11.530 1.00 43.13 H new ATOM 0 HD23 LEU A 37 1.856 -7.225 11.713 1.00 43.13 H new ATOM 616 N ASN A 38 0.772 -8.942 6.986 1.00 71.01 N ATOM 617 CA ASN A 38 -0.067 -9.568 5.955 1.00 13.32 C ATOM 618 C ASN A 38 -0.708 -10.872 6.469 1.00 22.53 C ATOM 619 O ASN A 38 -1.902 -11.100 6.292 1.00 64.34 O ATOM 620 CB ASN A 38 0.774 -9.861 4.701 1.00 44.12 C ATOM 621 CG ASN A 38 0.673 -8.774 3.647 1.00 53.21 C ATOM 622 OD1 ASN A 38 -0.153 -8.851 2.749 1.00 4.44 O ATOM 623 ND2 ASN A 38 1.507 -7.757 3.740 1.00 11.01 N ATOM 0 H ASN A 38 1.727 -8.745 6.685 1.00 71.01 H new ATOM 0 HA ASN A 38 -0.867 -8.872 5.704 1.00 13.32 H new ATOM 0 HB2 ASN A 38 1.818 -9.981 4.991 1.00 44.12 H new ATOM 0 HB3 ASN A 38 0.452 -10.808 4.269 1.00 44.12 H new ATOM 0 HD21 ASN A 38 1.474 -7.006 3.051 1.00 11.01 H new ATOM 0 HD22 ASN A 38 2.185 -7.721 4.501 1.00 11.01 H new ATOM 630 N ALA A 39 0.101 -11.713 7.118 1.00 23.24 N ATOM 631 CA ALA A 39 -0.360 -13.011 7.628 1.00 11.32 C ATOM 632 C ALA A 39 -1.341 -12.868 8.809 1.00 23.40 C ATOM 633 O ALA A 39 -2.078 -13.805 9.132 1.00 20.13 O ATOM 634 CB ALA A 39 0.841 -13.863 8.036 1.00 64.22 C ATOM 0 H ALA A 39 1.085 -11.518 7.305 1.00 23.24 H new ATOM 0 HA ALA A 39 -0.905 -13.503 6.822 1.00 11.32 H new ATOM 0 HB1 ALA A 39 0.493 -14.825 8.414 1.00 64.22 H new ATOM 0 HB2 ALA A 39 1.484 -14.024 7.171 1.00 64.22 H new ATOM 0 HB3 ALA A 39 1.404 -13.349 8.815 1.00 64.22 H new ATOM 640 N LYS A 40 -1.332 -11.708 9.465 1.00 20.14 N ATOM 641 CA LYS A 40 -2.255 -11.444 10.582 1.00 14.31 C ATOM 642 C LYS A 40 -3.530 -10.715 10.114 1.00 53.22 C ATOM 643 O LYS A 40 -4.506 -10.600 10.866 1.00 24.45 O ATOM 644 CB LYS A 40 -1.551 -10.630 11.680 1.00 75.22 C ATOM 645 CG LYS A 40 -0.299 -11.309 12.233 1.00 60.22 C ATOM 646 CD LYS A 40 0.305 -10.555 13.421 1.00 14.04 C ATOM 647 CE LYS A 40 -0.494 -10.745 14.716 1.00 11.10 C ATOM 648 NZ LYS A 40 -1.777 -9.983 14.735 1.00 73.24 N ATOM 0 H LYS A 40 -0.701 -10.936 9.248 1.00 20.14 H new ATOM 0 HA LYS A 40 -2.557 -12.409 10.990 1.00 14.31 H new ATOM 0 HB2 LYS A 40 -1.278 -9.654 11.279 1.00 75.22 H new ATOM 0 HB3 LYS A 40 -2.251 -10.455 12.497 1.00 75.22 H new ATOM 0 HG2 LYS A 40 -0.547 -12.325 12.541 1.00 60.22 H new ATOM 0 HG3 LYS A 40 0.446 -11.389 11.441 1.00 60.22 H new ATOM 0 HD2 LYS A 40 1.329 -10.895 13.578 1.00 14.04 H new ATOM 0 HD3 LYS A 40 0.355 -9.492 13.183 1.00 14.04 H new ATOM 0 HE2 LYS A 40 -0.707 -11.805 14.851 1.00 11.10 H new ATOM 0 HE3 LYS A 40 0.119 -10.433 15.562 1.00 11.10 H new ATOM 0 HZ1 LYS A 40 -1.902 -9.536 15.666 1.00 73.24 H new ATOM 0 HZ2 LYS A 40 -1.756 -9.249 13.999 1.00 73.24 H new ATOM 0 HZ3 LYS A 40 -2.569 -10.632 14.554 1.00 73.24 H new ATOM 662 N SER A 41 -3.512 -10.210 8.880 1.00 61.12 N ATOM 663 CA SER A 41 -4.689 -9.557 8.280 1.00 73.42 C ATOM 664 C SER A 41 -5.624 -10.585 7.621 1.00 72.00 C ATOM 665 O SER A 41 -5.165 -11.555 7.017 1.00 73.23 O ATOM 666 CB SER A 41 -4.249 -8.522 7.236 1.00 14.22 C ATOM 667 OG SER A 41 -5.365 -7.929 6.585 1.00 4.33 O ATOM 0 H SER A 41 -2.695 -10.238 8.270 1.00 61.12 H new ATOM 0 HA SER A 41 -5.234 -9.058 9.081 1.00 73.42 H new ATOM 0 HB2 SER A 41 -3.655 -7.747 7.719 1.00 14.22 H new ATOM 0 HB3 SER A 41 -3.607 -9.001 6.496 1.00 14.22 H new ATOM 0 HG SER A 41 -5.131 -7.725 5.655 1.00 4.33 H new ATOM 673 N SER A 42 -6.939 -10.373 7.729 1.00 2.32 N ATOM 674 CA SER A 42 -7.919 -11.313 7.153 1.00 10.33 C ATOM 675 C SER A 42 -8.164 -11.029 5.665 1.00 0.40 C ATOM 676 O SER A 42 -8.257 -11.952 4.852 1.00 62.33 O ATOM 677 CB SER A 42 -9.252 -11.260 7.915 1.00 72.11 C ATOM 678 OG SER A 42 -9.966 -10.056 7.649 1.00 44.14 O ATOM 0 H SER A 42 -7.351 -9.570 8.203 1.00 2.32 H new ATOM 0 HA SER A 42 -7.496 -12.313 7.250 1.00 10.33 H new ATOM 0 HB2 SER A 42 -9.866 -12.116 7.634 1.00 72.11 H new ATOM 0 HB3 SER A 42 -9.062 -11.341 8.985 1.00 72.11 H new ATOM 0 HG SER A 42 -10.809 -10.058 8.149 1.00 44.14 H new ATOM 684 N SER A 43 -8.281 -9.750 5.311 1.00 55.22 N ATOM 685 CA SER A 43 -8.493 -9.348 3.911 1.00 52.32 C ATOM 686 C SER A 43 -7.842 -7.988 3.614 1.00 65.43 C ATOM 687 O SER A 43 -8.471 -6.940 3.747 1.00 13.53 O ATOM 688 CB SER A 43 -9.997 -9.290 3.583 1.00 3.23 C ATOM 689 OG SER A 43 -10.622 -10.555 3.764 1.00 53.13 O ATOM 0 H SER A 43 -8.233 -8.972 5.969 1.00 55.22 H new ATOM 0 HA SER A 43 -8.020 -10.100 3.280 1.00 52.32 H new ATOM 0 HB2 SER A 43 -10.481 -8.550 4.221 1.00 3.23 H new ATOM 0 HB3 SER A 43 -10.133 -8.961 2.553 1.00 3.23 H new ATOM 0 HG SER A 43 -11.575 -10.483 3.549 1.00 53.13 H new ATOM 695 N GLY A 44 -6.568 -8.010 3.232 1.00 42.20 N ATOM 696 CA GLY A 44 -5.850 -6.777 2.916 1.00 3.24 C ATOM 697 C GLY A 44 -4.357 -6.884 3.204 1.00 42.21 C ATOM 698 O GLY A 44 -3.943 -7.659 4.066 1.00 4.35 O ATOM 0 H GLY A 44 -6.014 -8.861 3.134 1.00 42.20 H new ATOM 0 HA2 GLY A 44 -5.998 -6.533 1.864 1.00 3.24 H new ATOM 0 HA3 GLY A 44 -6.271 -5.956 3.496 1.00 3.24 H new ATOM 702 N VAL A 45 -3.543 -6.103 2.492 1.00 51.01 N ATOM 703 CA VAL A 45 -2.080 -6.184 2.637 1.00 31.33 C ATOM 704 C VAL A 45 -1.499 -4.985 3.402 1.00 52.33 C ATOM 705 O VAL A 45 -2.000 -3.861 3.309 1.00 44.32 O ATOM 706 CB VAL A 45 -1.369 -6.294 1.261 1.00 44.11 C ATOM 707 CG1 VAL A 45 -1.864 -7.516 0.493 1.00 60.21 C ATOM 708 CG2 VAL A 45 -1.560 -5.024 0.439 1.00 13.53 C ATOM 0 H VAL A 45 -3.863 -5.412 1.814 1.00 51.01 H new ATOM 0 HA VAL A 45 -1.893 -7.090 3.214 1.00 31.33 H new ATOM 0 HB VAL A 45 -0.301 -6.415 1.445 1.00 44.11 H new ATOM 0 HG11 VAL A 45 -1.353 -7.574 -0.468 1.00 60.21 H new ATOM 0 HG12 VAL A 45 -1.655 -8.417 1.070 1.00 60.21 H new ATOM 0 HG13 VAL A 45 -2.938 -7.431 0.328 1.00 60.21 H new ATOM 0 HG21 VAL A 45 -1.051 -5.131 -0.519 1.00 13.53 H new ATOM 0 HG22 VAL A 45 -2.624 -4.858 0.268 1.00 13.53 H new ATOM 0 HG23 VAL A 45 -1.142 -4.175 0.979 1.00 13.53 H new ATOM 718 N TYR A 46 -0.439 -5.244 4.169 1.00 0.14 N ATOM 719 CA TYR A 46 0.300 -4.190 4.875 1.00 30.45 C ATOM 720 C TYR A 46 1.652 -3.921 4.197 1.00 25.13 C ATOM 721 O TYR A 46 2.597 -4.695 4.343 1.00 24.24 O ATOM 722 CB TYR A 46 0.524 -4.579 6.344 1.00 21.21 C ATOM 723 CG TYR A 46 -0.677 -4.343 7.243 1.00 73.22 C ATOM 724 CD1 TYR A 46 -1.874 -5.022 7.045 1.00 11.22 C ATOM 725 CD2 TYR A 46 -0.605 -3.435 8.294 1.00 61.52 C ATOM 726 CE1 TYR A 46 -2.965 -4.800 7.867 1.00 11.12 C ATOM 727 CE2 TYR A 46 -1.688 -3.208 9.118 1.00 61.14 C ATOM 728 CZ TYR A 46 -2.863 -3.894 8.904 1.00 34.51 C ATOM 729 OH TYR A 46 -3.946 -3.660 9.722 1.00 34.31 O ATOM 0 H TYR A 46 -0.069 -6.182 4.319 1.00 0.14 H new ATOM 0 HA TYR A 46 -0.298 -3.279 4.836 1.00 30.45 H new ATOM 0 HB2 TYR A 46 0.797 -5.633 6.391 1.00 21.21 H new ATOM 0 HB3 TYR A 46 1.371 -4.013 6.732 1.00 21.21 H new ATOM 0 HD1 TYR A 46 -1.954 -5.734 6.237 1.00 11.22 H new ATOM 0 HD2 TYR A 46 0.316 -2.898 8.468 1.00 61.52 H new ATOM 0 HE1 TYR A 46 -3.890 -5.332 7.699 1.00 11.12 H new ATOM 0 HE2 TYR A 46 -1.615 -2.496 9.927 1.00 61.14 H new ATOM 0 HH TYR A 46 -3.737 -2.928 10.340 1.00 34.31 H new ATOM 739 N LEU A 47 1.730 -2.833 3.444 1.00 1.01 N ATOM 740 CA LEU A 47 2.970 -2.439 2.771 1.00 73.20 C ATOM 741 C LEU A 47 3.791 -1.470 3.639 1.00 51.24 C ATOM 742 O LEU A 47 3.346 -0.363 3.945 1.00 31.02 O ATOM 743 CB LEU A 47 2.649 -1.795 1.413 1.00 3.14 C ATOM 744 CG LEU A 47 1.951 -2.715 0.395 1.00 35.11 C ATOM 745 CD1 LEU A 47 1.606 -1.950 -0.880 1.00 44.04 C ATOM 746 CD2 LEU A 47 2.825 -3.926 0.073 1.00 13.01 C ATOM 0 H LEU A 47 0.947 -2.201 3.280 1.00 1.01 H new ATOM 0 HA LEU A 47 3.569 -3.335 2.610 1.00 73.20 H new ATOM 0 HB2 LEU A 47 2.016 -0.924 1.583 1.00 3.14 H new ATOM 0 HB3 LEU A 47 3.578 -1.433 0.973 1.00 3.14 H new ATOM 0 HG LEU A 47 1.023 -3.071 0.842 1.00 35.11 H new ATOM 0 HD11 LEU A 47 1.114 -2.620 -1.585 1.00 44.04 H new ATOM 0 HD12 LEU A 47 0.938 -1.123 -0.639 1.00 44.04 H new ATOM 0 HD13 LEU A 47 2.520 -1.560 -1.329 1.00 44.04 H new ATOM 0 HD21 LEU A 47 2.313 -4.563 -0.648 1.00 13.01 H new ATOM 0 HD22 LEU A 47 3.772 -3.589 -0.349 1.00 13.01 H new ATOM 0 HD23 LEU A 47 3.014 -4.491 0.986 1.00 13.01 H new ATOM 758 N LEU A 48 4.980 -1.901 4.050 1.00 31.04 N ATOM 759 CA LEU A 48 5.888 -1.046 4.823 1.00 41.32 C ATOM 760 C LEU A 48 6.769 -0.196 3.884 1.00 45.35 C ATOM 761 O LEU A 48 7.571 -0.741 3.124 1.00 42.21 O ATOM 762 CB LEU A 48 6.782 -1.892 5.751 1.00 44.21 C ATOM 763 CG LEU A 48 6.109 -2.496 7.004 1.00 11.22 C ATOM 764 CD1 LEU A 48 5.499 -1.410 7.880 1.00 42.51 C ATOM 765 CD2 LEU A 48 5.060 -3.534 6.632 1.00 44.12 C ATOM 0 H LEU A 48 5.341 -2.836 3.863 1.00 31.04 H new ATOM 0 HA LEU A 48 5.278 -0.381 5.434 1.00 41.32 H new ATOM 0 HB2 LEU A 48 7.204 -2.708 5.165 1.00 44.21 H new ATOM 0 HB3 LEU A 48 7.616 -1.271 6.079 1.00 44.21 H new ATOM 0 HG LEU A 48 6.889 -2.999 7.576 1.00 11.22 H new ATOM 0 HD11 LEU A 48 5.033 -1.866 8.753 1.00 42.51 H new ATOM 0 HD12 LEU A 48 6.280 -0.722 8.203 1.00 42.51 H new ATOM 0 HD13 LEU A 48 4.747 -0.864 7.311 1.00 42.51 H new ATOM 0 HD21 LEU A 48 4.609 -3.936 7.539 1.00 44.12 H new ATOM 0 HD22 LEU A 48 4.289 -3.068 6.019 1.00 44.12 H new ATOM 0 HD23 LEU A 48 5.530 -4.342 6.072 1.00 44.12 H new ATOM 777 N PRO A 49 6.648 1.150 3.942 1.00 51.23 N ATOM 778 CA PRO A 49 7.400 2.070 3.054 1.00 14.14 C ATOM 779 C PRO A 49 8.918 1.803 3.025 1.00 32.11 C ATOM 780 O PRO A 49 9.569 1.953 1.985 1.00 44.13 O ATOM 781 CB PRO A 49 7.112 3.449 3.659 1.00 73.43 C ATOM 782 CG PRO A 49 5.795 3.293 4.341 1.00 3.12 C ATOM 783 CD PRO A 49 5.765 1.883 4.870 1.00 15.52 C ATOM 0 HA PRO A 49 7.091 1.957 2.015 1.00 14.14 H new ATOM 0 HB2 PRO A 49 7.890 3.744 4.363 1.00 73.43 H new ATOM 0 HB3 PRO A 49 7.071 4.219 2.889 1.00 73.43 H new ATOM 0 HG2 PRO A 49 5.687 4.015 5.150 1.00 3.12 H new ATOM 0 HG3 PRO A 49 4.973 3.467 3.646 1.00 3.12 H new ATOM 0 HD2 PRO A 49 6.129 1.831 5.896 1.00 15.52 H new ATOM 0 HD3 PRO A 49 4.754 1.475 4.869 1.00 15.52 H new ATOM 791 N GLY A 50 9.479 1.424 4.172 1.00 61.10 N ATOM 792 CA GLY A 50 10.892 1.066 4.234 1.00 31.31 C ATOM 793 C GLY A 50 11.225 -0.157 3.379 1.00 24.41 C ATOM 794 O GLY A 50 12.232 -0.177 2.670 1.00 13.03 O ATOM 0 H GLY A 50 8.982 1.358 5.061 1.00 61.10 H new ATOM 0 HA2 GLY A 50 11.493 1.912 3.901 1.00 31.31 H new ATOM 0 HA3 GLY A 50 11.168 0.867 5.270 1.00 31.31 H new ATOM 798 N ALA A 51 10.353 -1.161 3.425 1.00 32.43 N ATOM 799 CA ALA A 51 10.547 -2.404 2.674 1.00 75.14 C ATOM 800 C ALA A 51 9.987 -2.294 1.253 1.00 24.31 C ATOM 801 O ALA A 51 8.801 -2.532 1.024 1.00 11.04 O ATOM 802 CB ALA A 51 9.880 -3.561 3.404 1.00 22.25 C ATOM 0 H ALA A 51 9.497 -1.139 3.979 1.00 32.43 H new ATOM 0 HA ALA A 51 11.619 -2.587 2.600 1.00 75.14 H new ATOM 0 HB1 ALA A 51 10.029 -4.481 2.839 1.00 22.25 H new ATOM 0 HB2 ALA A 51 10.320 -3.668 4.395 1.00 22.25 H new ATOM 0 HB3 ALA A 51 8.812 -3.363 3.501 1.00 22.25 H new ATOM 808 N LYS A 52 10.838 -1.926 0.299 1.00 71.24 N ATOM 809 CA LYS A 52 10.420 -1.830 -1.105 1.00 25.15 C ATOM 810 C LYS A 52 10.099 -3.226 -1.661 1.00 50.53 C ATOM 811 O LYS A 52 10.911 -3.828 -2.367 1.00 31.52 O ATOM 812 CB LYS A 52 11.519 -1.161 -1.951 1.00 43.12 C ATOM 813 CG LYS A 52 12.048 0.148 -1.368 1.00 73.55 C ATOM 814 CD LYS A 52 10.956 1.203 -1.212 1.00 3.50 C ATOM 815 CE LYS A 52 11.506 2.489 -0.600 1.00 60.51 C ATOM 816 NZ LYS A 52 12.080 2.258 0.754 1.00 52.22 N ATOM 0 H LYS A 52 11.816 -1.690 0.466 1.00 71.24 H new ATOM 0 HA LYS A 52 9.521 -1.216 -1.156 1.00 25.15 H new ATOM 0 HB2 LYS A 52 12.350 -1.858 -2.064 1.00 43.12 H new ATOM 0 HB3 LYS A 52 11.127 -0.969 -2.950 1.00 43.12 H new ATOM 0 HG2 LYS A 52 12.501 -0.048 -0.396 1.00 73.55 H new ATOM 0 HG3 LYS A 52 12.835 0.537 -2.014 1.00 73.55 H new ATOM 0 HD2 LYS A 52 10.517 1.421 -2.186 1.00 3.50 H new ATOM 0 HD3 LYS A 52 10.157 0.811 -0.582 1.00 3.50 H new ATOM 0 HE2 LYS A 52 12.274 2.903 -1.254 1.00 60.51 H new ATOM 0 HE3 LYS A 52 10.709 3.230 -0.535 1.00 60.51 H new ATOM 0 HZ1 LYS A 52 12.381 3.166 1.163 1.00 52.22 H new ATOM 0 HZ2 LYS A 52 11.360 1.824 1.367 1.00 52.22 H new ATOM 0 HZ3 LYS A 52 12.900 1.623 0.680 1.00 52.22 H new ATOM 830 N THR A 53 8.927 -3.750 -1.305 1.00 23.11 N ATOM 831 CA THR A 53 8.532 -5.112 -1.693 1.00 73.33 C ATOM 832 C THR A 53 7.055 -5.215 -2.078 1.00 13.43 C ATOM 833 O THR A 53 6.209 -4.466 -1.588 1.00 74.14 O ATOM 834 CB THR A 53 8.807 -6.144 -0.566 1.00 2.13 C ATOM 835 OG1 THR A 53 8.392 -5.628 0.711 1.00 65.44 O ATOM 836 CG2 THR A 53 10.277 -6.538 -0.524 1.00 75.14 C ATOM 0 H THR A 53 8.231 -3.255 -0.748 1.00 23.11 H new ATOM 0 HA THR A 53 9.145 -5.341 -2.564 1.00 73.33 H new ATOM 0 HB THR A 53 8.223 -7.037 -0.787 1.00 2.13 H new ATOM 0 HG1 THR A 53 8.714 -6.219 1.423 1.00 65.44 H new ATOM 0 HG21 THR A 53 10.437 -7.261 0.275 1.00 75.14 H new ATOM 0 HG22 THR A 53 10.562 -6.982 -1.478 1.00 75.14 H new ATOM 0 HG23 THR A 53 10.886 -5.653 -0.340 1.00 75.14 H new ATOM 844 N PRO A 54 6.741 -6.150 -2.988 1.00 54.14 N ATOM 845 CA PRO A 54 5.359 -6.470 -3.376 1.00 51.21 C ATOM 846 C PRO A 54 4.646 -7.405 -2.375 1.00 23.23 C ATOM 847 O PRO A 54 5.290 -8.185 -1.668 1.00 63.32 O ATOM 848 CB PRO A 54 5.560 -7.176 -4.720 1.00 11.12 C ATOM 849 CG PRO A 54 6.874 -7.868 -4.575 1.00 64.22 C ATOM 850 CD PRO A 54 7.727 -6.954 -3.744 1.00 12.14 C ATOM 0 HA PRO A 54 4.724 -5.585 -3.412 1.00 51.21 H new ATOM 0 HB2 PRO A 54 4.757 -7.884 -4.922 1.00 11.12 H new ATOM 0 HB3 PRO A 54 5.573 -6.465 -5.546 1.00 11.12 H new ATOM 0 HG2 PRO A 54 6.754 -8.838 -4.092 1.00 64.22 H new ATOM 0 HG3 PRO A 54 7.329 -8.051 -5.548 1.00 64.22 H new ATOM 0 HD2 PRO A 54 8.383 -7.514 -3.078 1.00 12.14 H new ATOM 0 HD3 PRO A 54 8.365 -6.325 -4.366 1.00 12.14 H new ATOM 858 N ALA A 55 3.316 -7.330 -2.329 1.00 23.44 N ATOM 859 CA ALA A 55 2.510 -8.205 -1.461 1.00 40.30 C ATOM 860 C ALA A 55 1.302 -8.784 -2.213 1.00 63.43 C ATOM 861 O ALA A 55 0.639 -8.078 -2.977 1.00 42.24 O ATOM 862 CB ALA A 55 2.049 -7.437 -0.226 1.00 50.34 C ATOM 0 H ALA A 55 2.767 -6.672 -2.883 1.00 23.44 H new ATOM 0 HA ALA A 55 3.137 -9.040 -1.149 1.00 40.30 H new ATOM 0 HB1 ALA A 55 1.454 -8.093 0.409 1.00 50.34 H new ATOM 0 HB2 ALA A 55 2.918 -7.085 0.329 1.00 50.34 H new ATOM 0 HB3 ALA A 55 1.445 -6.583 -0.533 1.00 50.34 H new ATOM 868 N ARG A 56 1.026 -10.072 -1.998 1.00 71.42 N ATOM 869 CA ARG A 56 -0.092 -10.757 -2.667 1.00 13.04 C ATOM 870 C ARG A 56 -1.443 -10.439 -1.999 1.00 53.11 C ATOM 871 O ARG A 56 -1.573 -10.501 -0.775 1.00 2.13 O ATOM 872 CB ARG A 56 0.148 -12.276 -2.672 1.00 43.03 C ATOM 873 CG ARG A 56 -0.996 -13.075 -3.292 1.00 52.13 C ATOM 874 CD ARG A 56 -0.703 -14.572 -3.338 1.00 54.44 C ATOM 875 NE ARG A 56 -1.837 -15.323 -3.880 1.00 71.40 N ATOM 876 CZ ARG A 56 -1.853 -15.902 -5.048 1.00 11.40 C ATOM 877 NH1 ARG A 56 -0.808 -15.886 -5.806 1.00 31.25 N ATOM 878 NH2 ARG A 56 -2.928 -16.494 -5.457 1.00 72.30 N ATOM 0 H ARG A 56 1.561 -10.667 -1.365 1.00 71.42 H new ATOM 0 HA ARG A 56 -0.137 -10.391 -3.693 1.00 13.04 H new ATOM 0 HB2 ARG A 56 1.066 -12.488 -3.219 1.00 43.03 H new ATOM 0 HB3 ARG A 56 0.302 -12.614 -1.647 1.00 43.03 H new ATOM 0 HG2 ARG A 56 -1.907 -12.904 -2.719 1.00 52.13 H new ATOM 0 HG3 ARG A 56 -1.182 -12.713 -4.303 1.00 52.13 H new ATOM 0 HD2 ARG A 56 0.181 -14.752 -3.950 1.00 54.44 H new ATOM 0 HD3 ARG A 56 -0.474 -14.930 -2.334 1.00 54.44 H new ATOM 0 HE ARG A 56 -2.674 -15.399 -3.302 1.00 71.40 H new ATOM 0 HH11 ARG A 56 0.042 -15.417 -5.493 1.00 31.25 H new ATOM 0 HH12 ARG A 56 -0.832 -16.342 -6.718 1.00 31.25 H new ATOM 0 HH21 ARG A 56 -3.759 -16.507 -4.866 1.00 72.30 H new ATOM 0 HH22 ARG A 56 -2.944 -16.948 -6.370 1.00 72.30 H new ATOM 892 N LEU A 57 -2.450 -10.121 -2.811 1.00 75.42 N ATOM 893 CA LEU A 57 -3.777 -9.747 -2.299 1.00 73.35 C ATOM 894 C LEU A 57 -4.918 -10.376 -3.110 1.00 70.30 C ATOM 895 O LEU A 57 -5.041 -10.155 -4.317 1.00 3.32 O ATOM 896 CB LEU A 57 -3.920 -8.216 -2.303 1.00 45.21 C ATOM 897 CG LEU A 57 -5.301 -7.669 -1.897 1.00 73.02 C ATOM 898 CD1 LEU A 57 -5.677 -8.111 -0.485 1.00 12.34 C ATOM 899 CD2 LEU A 57 -5.327 -6.146 -2.005 1.00 4.24 C ATOM 0 H LEU A 57 -2.377 -10.113 -3.828 1.00 75.42 H new ATOM 0 HA LEU A 57 -3.853 -10.131 -1.282 1.00 73.35 H new ATOM 0 HB2 LEU A 57 -3.173 -7.799 -1.628 1.00 45.21 H new ATOM 0 HB3 LEU A 57 -3.686 -7.851 -3.303 1.00 45.21 H new ATOM 0 HG LEU A 57 -6.039 -8.080 -2.585 1.00 73.02 H new ATOM 0 HD11 LEU A 57 -6.657 -7.709 -0.227 1.00 12.34 H new ATOM 0 HD12 LEU A 57 -5.708 -9.200 -0.441 1.00 12.34 H new ATOM 0 HD13 LEU A 57 -4.935 -7.740 0.222 1.00 12.34 H new ATOM 0 HD21 LEU A 57 -6.311 -5.777 -1.714 1.00 4.24 H new ATOM 0 HD22 LEU A 57 -4.571 -5.721 -1.345 1.00 4.24 H new ATOM 0 HD23 LEU A 57 -5.118 -5.851 -3.033 1.00 4.24 H new ATOM 911 N GLU A 58 -5.748 -11.165 -2.426 1.00 61.43 N ATOM 912 CA GLU A 58 -6.982 -11.699 -3.007 1.00 2.32 C ATOM 913 C GLU A 58 -8.101 -10.649 -2.945 1.00 30.42 C ATOM 914 O GLU A 58 -8.456 -10.170 -1.866 1.00 52.24 O ATOM 915 CB GLU A 58 -7.430 -12.968 -2.262 1.00 25.25 C ATOM 916 CG GLU A 58 -6.592 -14.214 -2.554 1.00 44.54 C ATOM 917 CD GLU A 58 -5.117 -14.045 -2.226 1.00 1.55 C ATOM 918 OE1 GLU A 58 -4.798 -13.669 -1.076 1.00 61.05 O ATOM 919 OE2 GLU A 58 -4.278 -14.272 -3.123 1.00 23.20 O ATOM 0 H GLU A 58 -5.586 -11.451 -1.460 1.00 61.43 H new ATOM 0 HA GLU A 58 -6.781 -11.951 -4.048 1.00 2.32 H new ATOM 0 HB2 GLU A 58 -7.402 -12.772 -1.190 1.00 25.25 H new ATOM 0 HB3 GLU A 58 -8.468 -13.177 -2.521 1.00 25.25 H new ATOM 0 HG2 GLU A 58 -6.990 -15.052 -1.981 1.00 44.54 H new ATOM 0 HG3 GLU A 58 -6.694 -14.472 -3.608 1.00 44.54 H new ATOM 926 N SER A 59 -8.651 -10.292 -4.100 1.00 5.25 N ATOM 927 CA SER A 59 -9.706 -9.269 -4.170 1.00 61.22 C ATOM 928 C SER A 59 -10.973 -9.803 -4.848 1.00 11.12 C ATOM 929 O SER A 59 -11.032 -10.959 -5.272 1.00 22.42 O ATOM 930 CB SER A 59 -9.210 -8.038 -4.937 1.00 64.21 C ATOM 931 OG SER A 59 -9.078 -8.317 -6.324 1.00 63.21 O ATOM 0 H SER A 59 -8.390 -10.690 -5.002 1.00 5.25 H new ATOM 0 HA SER A 59 -9.951 -8.993 -3.144 1.00 61.22 H new ATOM 0 HB2 SER A 59 -9.907 -7.212 -4.794 1.00 64.21 H new ATOM 0 HB3 SER A 59 -8.249 -7.718 -4.534 1.00 64.21 H new ATOM 0 HG SER A 59 -8.515 -9.110 -6.446 1.00 63.21 H new ATOM 937 N GLN A 60 -11.979 -8.936 -4.967 1.00 53.21 N ATOM 938 CA GLN A 60 -13.265 -9.303 -5.571 1.00 45.21 C ATOM 939 C GLN A 60 -13.138 -9.587 -7.079 1.00 44.12 C ATOM 940 O GLN A 60 -14.007 -10.226 -7.672 1.00 72.10 O ATOM 941 CB GLN A 60 -14.285 -8.184 -5.328 1.00 14.32 C ATOM 942 CG GLN A 60 -14.517 -7.890 -3.850 1.00 5.33 C ATOM 943 CD GLN A 60 -15.417 -6.691 -3.620 1.00 32.51 C ATOM 944 OE1 GLN A 60 -16.633 -6.815 -3.541 1.00 63.33 O ATOM 945 NE2 GLN A 60 -14.828 -5.519 -3.509 1.00 11.43 N ATOM 0 H GLN A 60 -11.929 -7.967 -4.651 1.00 53.21 H new ATOM 0 HA GLN A 60 -13.605 -10.224 -5.097 1.00 45.21 H new ATOM 0 HB2 GLN A 60 -13.942 -7.275 -5.823 1.00 14.32 H new ATOM 0 HB3 GLN A 60 -15.233 -8.460 -5.790 1.00 14.32 H new ATOM 0 HG2 GLN A 60 -14.959 -8.766 -3.376 1.00 5.33 H new ATOM 0 HG3 GLN A 60 -13.557 -7.715 -3.365 1.00 5.33 H new ATOM 0 HE21 GLN A 60 -13.813 -5.450 -3.580 1.00 11.43 H new ATOM 0 HE22 GLN A 60 -15.387 -4.680 -3.352 1.00 11.43 H new ATOM 954 N ILE A 61 -12.058 -9.104 -7.696 1.00 4.24 N ATOM 955 CA ILE A 61 -11.815 -9.341 -9.131 1.00 0.05 C ATOM 956 C ILE A 61 -10.798 -10.477 -9.362 1.00 73.44 C ATOM 957 O ILE A 61 -10.808 -11.135 -10.404 1.00 54.25 O ATOM 958 CB ILE A 61 -11.314 -8.058 -9.844 1.00 31.22 C ATOM 959 CG1 ILE A 61 -10.004 -7.550 -9.207 1.00 15.55 C ATOM 960 CG2 ILE A 61 -12.387 -6.972 -9.807 1.00 72.12 C ATOM 961 CD1 ILE A 61 -9.427 -6.321 -9.882 1.00 1.40 C ATOM 0 H ILE A 61 -11.338 -8.549 -7.233 1.00 4.24 H new ATOM 0 HA ILE A 61 -12.774 -9.636 -9.557 1.00 0.05 H new ATOM 0 HB ILE A 61 -11.109 -8.306 -10.886 1.00 31.22 H new ATOM 0 HG12 ILE A 61 -10.187 -7.323 -8.157 1.00 15.55 H new ATOM 0 HG13 ILE A 61 -9.264 -8.349 -9.236 1.00 15.55 H new ATOM 0 HG21 ILE A 61 -12.018 -6.079 -10.312 1.00 72.12 H new ATOM 0 HG22 ILE A 61 -13.284 -7.330 -10.312 1.00 72.12 H new ATOM 0 HG23 ILE A 61 -12.625 -6.731 -8.771 1.00 72.12 H new ATOM 0 HD11 ILE A 61 -8.508 -6.026 -9.376 1.00 1.40 H new ATOM 0 HD12 ILE A 61 -9.210 -6.547 -10.926 1.00 1.40 H new ATOM 0 HD13 ILE A 61 -10.148 -5.505 -9.830 1.00 1.40 H new ATOM 973 N GLY A 62 -9.928 -10.701 -8.381 1.00 65.31 N ATOM 974 CA GLY A 62 -8.905 -11.736 -8.493 1.00 22.20 C ATOM 975 C GLY A 62 -7.693 -11.446 -7.617 1.00 52.30 C ATOM 976 O GLY A 62 -7.746 -10.579 -6.744 1.00 2.13 O ATOM 0 H GLY A 62 -9.911 -10.182 -7.503 1.00 65.31 H new ATOM 0 HA2 GLY A 62 -9.332 -12.698 -8.212 1.00 22.20 H new ATOM 0 HA3 GLY A 62 -8.588 -11.820 -9.532 1.00 22.20 H new ATOM 980 N THR A 63 -6.600 -12.165 -7.838 1.00 51.21 N ATOM 981 CA THR A 63 -5.374 -11.951 -7.061 1.00 14.13 C ATOM 982 C THR A 63 -4.412 -10.991 -7.772 1.00 51.14 C ATOM 983 O THR A 63 -4.060 -11.187 -8.937 1.00 43.34 O ATOM 984 CB THR A 63 -4.633 -13.280 -6.768 1.00 42.40 C ATOM 985 OG1 THR A 63 -5.414 -14.101 -5.881 1.00 61.34 O ATOM 986 CG2 THR A 63 -3.263 -13.021 -6.147 1.00 72.14 C ATOM 0 H THR A 63 -6.532 -12.899 -8.543 1.00 51.21 H new ATOM 0 HA THR A 63 -5.691 -11.508 -6.117 1.00 14.13 H new ATOM 0 HB THR A 63 -4.493 -13.799 -7.716 1.00 42.40 H new ATOM 0 HG1 THR A 63 -4.993 -14.120 -4.996 1.00 61.34 H new ATOM 0 HG21 THR A 63 -2.766 -13.971 -5.952 1.00 72.14 H new ATOM 0 HG22 THR A 63 -2.658 -12.429 -6.834 1.00 72.14 H new ATOM 0 HG23 THR A 63 -3.385 -12.477 -5.210 1.00 72.14 H new ATOM 994 N LEU A 64 -3.986 -9.956 -7.056 1.00 25.03 N ATOM 995 CA LEU A 64 -2.993 -9.010 -7.569 1.00 30.34 C ATOM 996 C LEU A 64 -1.834 -8.847 -6.575 1.00 72.32 C ATOM 997 O LEU A 64 -1.904 -9.325 -5.443 1.00 41.01 O ATOM 998 CB LEU A 64 -3.632 -7.641 -7.929 1.00 35.02 C ATOM 999 CG LEU A 64 -4.521 -6.932 -6.868 1.00 55.33 C ATOM 1000 CD1 LEU A 64 -5.768 -7.745 -6.535 1.00 32.12 C ATOM 1001 CD2 LEU A 64 -3.741 -6.603 -5.597 1.00 1.43 C ATOM 0 H LEU A 64 -4.313 -9.747 -6.113 1.00 25.03 H new ATOM 0 HA LEU A 64 -2.589 -9.422 -8.494 1.00 30.34 H new ATOM 0 HB2 LEU A 64 -2.825 -6.958 -8.194 1.00 35.02 H new ATOM 0 HB3 LEU A 64 -4.236 -7.783 -8.825 1.00 35.02 H new ATOM 0 HG LEU A 64 -4.843 -5.992 -7.316 1.00 55.33 H new ATOM 0 HD11 LEU A 64 -6.361 -7.214 -5.790 1.00 32.12 H new ATOM 0 HD12 LEU A 64 -6.362 -7.886 -7.438 1.00 32.12 H new ATOM 0 HD13 LEU A 64 -5.474 -8.717 -6.139 1.00 32.12 H new ATOM 0 HD21 LEU A 64 -4.400 -6.109 -4.883 1.00 1.43 H new ATOM 0 HD22 LEU A 64 -3.356 -7.523 -5.158 1.00 1.43 H new ATOM 0 HD23 LEU A 64 -2.910 -5.942 -5.841 1.00 1.43 H new ATOM 1013 N ARG A 65 -0.770 -8.177 -7.000 1.00 50.52 N ATOM 1014 CA ARG A 65 0.417 -7.997 -6.159 1.00 31.41 C ATOM 1015 C ARG A 65 0.894 -6.533 -6.187 1.00 1.12 C ATOM 1016 O ARG A 65 1.466 -6.074 -7.177 1.00 34.50 O ATOM 1017 CB ARG A 65 1.533 -8.945 -6.633 1.00 74.35 C ATOM 1018 CG ARG A 65 2.691 -9.082 -5.652 1.00 33.35 C ATOM 1019 CD ARG A 65 3.723 -10.108 -6.119 1.00 52.11 C ATOM 1020 NE ARG A 65 4.476 -9.658 -7.291 1.00 31.41 N ATOM 1021 CZ ARG A 65 5.753 -9.886 -7.469 1.00 23.41 C ATOM 1022 NH1 ARG A 65 6.434 -10.546 -6.586 1.00 25.31 N ATOM 1023 NH2 ARG A 65 6.347 -9.459 -8.535 1.00 71.25 N ATOM 0 H ARG A 65 -0.700 -7.747 -7.922 1.00 50.52 H new ATOM 0 HA ARG A 65 0.159 -8.240 -5.128 1.00 31.41 H new ATOM 0 HB2 ARG A 65 1.105 -9.931 -6.813 1.00 74.35 H new ATOM 0 HB3 ARG A 65 1.919 -8.586 -7.587 1.00 74.35 H new ATOM 0 HG2 ARG A 65 3.175 -8.114 -5.526 1.00 33.35 H new ATOM 0 HG3 ARG A 65 2.305 -9.375 -4.676 1.00 33.35 H new ATOM 0 HD2 ARG A 65 4.417 -10.316 -5.304 1.00 52.11 H new ATOM 0 HD3 ARG A 65 3.218 -11.045 -6.355 1.00 52.11 H new ATOM 0 HE ARG A 65 3.977 -9.136 -8.011 1.00 31.41 H new ATOM 0 HH11 ARG A 65 5.976 -10.893 -5.743 1.00 25.31 H new ATOM 0 HH12 ARG A 65 7.428 -10.719 -6.734 1.00 25.31 H new ATOM 0 HH21 ARG A 65 5.821 -8.943 -9.240 1.00 71.25 H new ATOM 0 HH22 ARG A 65 7.342 -9.638 -8.671 1.00 71.25 H new ATOM 1037 N MET A 66 0.646 -5.803 -5.100 1.00 35.30 N ATOM 1038 CA MET A 66 0.968 -4.366 -5.034 1.00 51.22 C ATOM 1039 C MET A 66 2.332 -4.105 -4.371 1.00 64.33 C ATOM 1040 O MET A 66 2.760 -4.854 -3.494 1.00 71.54 O ATOM 1041 CB MET A 66 -0.132 -3.615 -4.274 1.00 61.11 C ATOM 1042 CG MET A 66 -1.485 -3.640 -4.971 1.00 73.40 C ATOM 1043 SD MET A 66 -2.743 -2.716 -4.070 1.00 43.40 S ATOM 1044 CE MET A 66 -4.176 -2.954 -5.121 1.00 43.50 C ATOM 0 H MET A 66 0.224 -6.177 -4.250 1.00 35.30 H new ATOM 0 HA MET A 66 1.025 -3.999 -6.059 1.00 51.22 H new ATOM 0 HB2 MET A 66 -0.237 -4.051 -3.281 1.00 61.11 H new ATOM 0 HB3 MET A 66 0.177 -2.579 -4.136 1.00 61.11 H new ATOM 0 HG2 MET A 66 -1.381 -3.224 -5.973 1.00 73.40 H new ATOM 0 HG3 MET A 66 -1.811 -4.674 -5.087 1.00 73.40 H new ATOM 0 HE1 MET A 66 -4.743 -2.025 -5.179 1.00 43.50 H new ATOM 0 HE2 MET A 66 -3.850 -3.243 -6.120 1.00 43.50 H new ATOM 0 HE3 MET A 66 -4.807 -3.739 -4.704 1.00 43.50 H new ATOM 1054 N SER A 67 3.007 -3.031 -4.795 1.00 23.42 N ATOM 1055 CA SER A 67 4.317 -2.657 -4.229 1.00 2.43 C ATOM 1056 C SER A 67 4.495 -1.132 -4.165 1.00 61.24 C ATOM 1057 O SER A 67 3.961 -0.398 -5.001 1.00 61.40 O ATOM 1058 CB SER A 67 5.460 -3.265 -5.054 1.00 14.10 C ATOM 1059 OG SER A 67 5.476 -2.754 -6.381 1.00 63.03 O ATOM 0 H SER A 67 2.672 -2.404 -5.526 1.00 23.42 H new ATOM 0 HA SER A 67 4.349 -3.053 -3.214 1.00 2.43 H new ATOM 0 HB2 SER A 67 6.413 -3.052 -4.570 1.00 14.10 H new ATOM 0 HB3 SER A 67 5.353 -4.349 -5.082 1.00 14.10 H new ATOM 0 HG SER A 67 5.208 -3.459 -7.006 1.00 63.03 H new ATOM 1065 N LEU A 68 5.249 -0.669 -3.167 1.00 15.10 N ATOM 1066 CA LEU A 68 5.550 0.763 -3.000 1.00 43.53 C ATOM 1067 C LEU A 68 6.915 1.128 -3.607 1.00 44.43 C ATOM 1068 O LEU A 68 7.956 0.680 -3.125 1.00 54.13 O ATOM 1069 CB LEU A 68 5.547 1.138 -1.509 1.00 42.32 C ATOM 1070 CG LEU A 68 4.214 0.949 -0.769 1.00 53.14 C ATOM 1071 CD1 LEU A 68 4.361 1.319 0.706 1.00 20.45 C ATOM 1072 CD2 LEU A 68 3.110 1.775 -1.423 1.00 12.34 C ATOM 0 H LEU A 68 5.668 -1.266 -2.454 1.00 15.10 H new ATOM 0 HA LEU A 68 4.775 1.321 -3.525 1.00 43.53 H new ATOM 0 HB2 LEU A 68 6.308 0.543 -1.004 1.00 42.32 H new ATOM 0 HB3 LEU A 68 5.846 2.182 -1.417 1.00 42.32 H new ATOM 0 HG LEU A 68 3.935 -0.103 -0.833 1.00 53.14 H new ATOM 0 HD11 LEU A 68 3.406 1.179 1.213 1.00 20.45 H new ATOM 0 HD12 LEU A 68 5.115 0.681 1.168 1.00 20.45 H new ATOM 0 HD13 LEU A 68 4.667 2.362 0.791 1.00 20.45 H new ATOM 0 HD21 LEU A 68 2.175 1.626 -0.883 1.00 12.34 H new ATOM 0 HD22 LEU A 68 3.381 2.831 -1.395 1.00 12.34 H new ATOM 0 HD23 LEU A 68 2.985 1.459 -2.459 1.00 12.34 H new ATOM 1084 N VAL A 69 6.908 1.943 -4.662 1.00 34.35 N ATOM 1085 CA VAL A 69 8.153 2.420 -5.290 1.00 43.44 C ATOM 1086 C VAL A 69 8.102 3.933 -5.574 1.00 52.55 C ATOM 1087 O VAL A 69 7.028 4.531 -5.585 1.00 14.33 O ATOM 1088 CB VAL A 69 8.453 1.664 -6.611 1.00 33.14 C ATOM 1089 CG1 VAL A 69 8.720 0.182 -6.344 1.00 43.24 C ATOM 1090 CG2 VAL A 69 7.304 1.836 -7.602 1.00 12.31 C ATOM 0 H VAL A 69 6.057 2.290 -5.104 1.00 34.35 H new ATOM 0 HA VAL A 69 8.953 2.220 -4.577 1.00 43.44 H new ATOM 0 HB VAL A 69 9.353 2.094 -7.051 1.00 33.14 H new ATOM 0 HG11 VAL A 69 8.928 -0.326 -7.286 1.00 43.24 H new ATOM 0 HG12 VAL A 69 9.579 0.081 -5.680 1.00 43.24 H new ATOM 0 HG13 VAL A 69 7.844 -0.267 -5.875 1.00 43.24 H new ATOM 0 HG21 VAL A 69 7.533 1.298 -8.522 1.00 12.31 H new ATOM 0 HG22 VAL A 69 6.387 1.438 -7.168 1.00 12.31 H new ATOM 0 HG23 VAL A 69 7.170 2.895 -7.824 1.00 12.31 H new ATOM 1100 N ASN A 70 9.271 4.539 -5.808 1.00 31.12 N ATOM 1101 CA ASN A 70 9.379 5.983 -6.098 1.00 51.33 C ATOM 1102 C ASN A 70 8.876 6.843 -4.920 1.00 31.41 C ATOM 1103 O ASN A 70 8.337 7.939 -5.116 1.00 1.33 O ATOM 1104 CB ASN A 70 8.608 6.340 -7.380 1.00 1.20 C ATOM 1105 CG ASN A 70 9.093 5.557 -8.588 1.00 70.41 C ATOM 1106 OD1 ASN A 70 10.062 5.929 -9.239 1.00 30.53 O ATOM 1107 ND2 ASN A 70 8.415 4.472 -8.904 1.00 0.34 N ATOM 0 H ASN A 70 10.167 4.051 -5.803 1.00 31.12 H new ATOM 0 HA ASN A 70 10.436 6.204 -6.246 1.00 51.33 H new ATOM 0 HB2 ASN A 70 7.546 6.146 -7.228 1.00 1.20 H new ATOM 0 HB3 ASN A 70 8.712 7.407 -7.577 1.00 1.20 H new ATOM 0 HD21 ASN A 70 8.693 3.914 -9.712 1.00 0.34 H new ATOM 0 HD22 ASN A 70 7.613 4.190 -8.341 1.00 0.34 H new ATOM 1114 N ILE A 71 9.089 6.357 -3.699 1.00 54.44 N ATOM 1115 CA ILE A 71 8.640 7.058 -2.491 1.00 22.24 C ATOM 1116 C ILE A 71 9.478 8.324 -2.231 1.00 24.13 C ATOM 1117 O ILE A 71 10.635 8.241 -1.827 1.00 73.03 O ATOM 1118 CB ILE A 71 8.711 6.135 -1.246 1.00 64.41 C ATOM 1119 CG1 ILE A 71 7.982 4.806 -1.516 1.00 60.21 C ATOM 1120 CG2 ILE A 71 8.114 6.834 -0.025 1.00 13.14 C ATOM 1121 CD1 ILE A 71 8.006 3.841 -0.346 1.00 65.44 C ATOM 0 H ILE A 71 9.571 5.477 -3.516 1.00 54.44 H new ATOM 0 HA ILE A 71 7.603 7.348 -2.662 1.00 22.24 H new ATOM 0 HB ILE A 71 9.759 5.917 -1.040 1.00 64.41 H new ATOM 0 HG12 ILE A 71 6.945 5.019 -1.777 1.00 60.21 H new ATOM 0 HG13 ILE A 71 8.436 4.323 -2.381 1.00 60.21 H new ATOM 0 HG21 ILE A 71 8.173 6.171 0.838 1.00 13.14 H new ATOM 0 HG22 ILE A 71 8.672 7.748 0.180 1.00 13.14 H new ATOM 0 HG23 ILE A 71 7.071 7.082 -0.222 1.00 13.14 H new ATOM 0 HD11 ILE A 71 7.472 2.930 -0.615 1.00 65.44 H new ATOM 0 HD12 ILE A 71 9.039 3.597 -0.097 1.00 65.44 H new ATOM 0 HD13 ILE A 71 7.525 4.302 0.516 1.00 65.44 H new ATOM 1133 N THR A 72 8.886 9.496 -2.473 1.00 44.23 N ATOM 1134 CA THR A 72 9.587 10.779 -2.284 1.00 65.50 C ATOM 1135 C THR A 72 8.666 11.852 -1.678 1.00 15.00 C ATOM 1136 O THR A 72 7.444 11.749 -1.763 1.00 25.22 O ATOM 1137 CB THR A 72 10.178 11.316 -3.615 1.00 51.41 C ATOM 1138 OG1 THR A 72 9.187 11.286 -4.654 1.00 64.02 O ATOM 1139 CG2 THR A 72 11.401 10.513 -4.039 1.00 15.14 C ATOM 0 H THR A 72 7.924 9.588 -2.800 1.00 44.23 H new ATOM 0 HA THR A 72 10.402 10.576 -1.589 1.00 65.50 H new ATOM 0 HB THR A 72 10.487 12.348 -3.448 1.00 51.41 H new ATOM 0 HG1 THR A 72 9.575 11.629 -5.486 1.00 64.02 H new ATOM 0 HG21 THR A 72 11.792 10.913 -4.974 1.00 15.14 H new ATOM 0 HG22 THR A 72 12.167 10.581 -3.266 1.00 15.14 H new ATOM 0 HG23 THR A 72 11.120 9.469 -4.180 1.00 15.14 H new ATOM 1147 N PRO A 73 9.246 12.900 -1.054 1.00 2.41 N ATOM 1148 CA PRO A 73 8.467 13.960 -0.381 1.00 5.20 C ATOM 1149 C PRO A 73 7.511 14.719 -1.329 1.00 24.22 C ATOM 1150 O PRO A 73 7.751 14.815 -2.537 1.00 61.15 O ATOM 1151 CB PRO A 73 9.549 14.906 0.175 1.00 1.24 C ATOM 1152 CG PRO A 73 10.779 14.601 -0.616 1.00 50.45 C ATOM 1153 CD PRO A 73 10.699 13.139 -0.952 1.00 13.12 C ATOM 0 HA PRO A 73 7.809 13.543 0.381 1.00 5.20 H new ATOM 0 HB2 PRO A 73 9.256 15.950 0.061 1.00 1.24 H new ATOM 0 HB3 PRO A 73 9.713 14.735 1.239 1.00 1.24 H new ATOM 0 HG2 PRO A 73 10.823 15.208 -1.520 1.00 50.45 H new ATOM 0 HG3 PRO A 73 11.678 14.821 -0.041 1.00 50.45 H new ATOM 0 HD2 PRO A 73 11.212 12.911 -1.886 1.00 13.12 H new ATOM 0 HD3 PRO A 73 11.156 12.522 -0.179 1.00 13.12 H new ATOM 1161 N ASP A 74 6.436 15.269 -0.763 1.00 24.02 N ATOM 1162 CA ASP A 74 5.416 15.990 -1.539 1.00 24.44 C ATOM 1163 C ASP A 74 5.102 17.371 -0.924 1.00 53.13 C ATOM 1164 O ASP A 74 5.587 17.710 0.155 1.00 62.11 O ATOM 1165 CB ASP A 74 4.139 15.136 -1.615 1.00 62.03 C ATOM 1166 CG ASP A 74 2.982 15.855 -2.286 1.00 63.11 C ATOM 1167 OD1 ASP A 74 3.057 16.089 -3.507 1.00 60.14 O ATOM 1168 OD2 ASP A 74 2.020 16.231 -1.584 1.00 24.32 O ATOM 0 H ASP A 74 6.245 15.230 0.238 1.00 24.02 H new ATOM 0 HA ASP A 74 5.805 16.163 -2.542 1.00 24.44 H new ATOM 0 HB2 ASP A 74 4.355 14.218 -2.162 1.00 62.03 H new ATOM 0 HB3 ASP A 74 3.843 14.845 -0.607 1.00 62.03 H new ATOM 1173 N ALA A 75 4.302 18.170 -1.635 1.00 44.15 N ATOM 1174 CA ALA A 75 3.839 19.473 -1.143 1.00 1.14 C ATOM 1175 C ALA A 75 3.168 19.371 0.238 1.00 41.12 C ATOM 1176 O ALA A 75 3.460 20.159 1.139 1.00 61.13 O ATOM 1177 CB ALA A 75 2.878 20.095 -2.151 1.00 72.44 C ATOM 0 H ALA A 75 3.957 17.934 -2.565 1.00 44.15 H new ATOM 0 HA ALA A 75 4.715 20.111 -1.028 1.00 1.14 H new ATOM 0 HB1 ALA A 75 2.538 21.062 -1.780 1.00 72.44 H new ATOM 0 HB2 ALA A 75 3.389 20.231 -3.104 1.00 72.44 H new ATOM 0 HB3 ALA A 75 2.020 19.437 -2.290 1.00 72.44 H new ATOM 1183 N ASP A 76 2.273 18.397 0.400 1.00 24.25 N ATOM 1184 CA ASP A 76 1.550 18.212 1.666 1.00 42.23 C ATOM 1185 C ASP A 76 1.987 16.940 2.415 1.00 75.53 C ATOM 1186 O ASP A 76 1.779 16.828 3.626 1.00 3.42 O ATOM 1187 CB ASP A 76 0.041 18.172 1.409 1.00 35.20 C ATOM 1188 CG ASP A 76 -0.488 19.506 0.916 1.00 74.35 C ATOM 1189 OD1 ASP A 76 -0.732 20.397 1.752 1.00 73.53 O ATOM 1190 OD2 ASP A 76 -0.663 19.674 -0.308 1.00 42.32 O ATOM 0 H ASP A 76 2.029 17.723 -0.326 1.00 24.25 H new ATOM 0 HA ASP A 76 1.795 19.063 2.302 1.00 42.23 H new ATOM 0 HB2 ASP A 76 -0.181 17.400 0.673 1.00 35.20 H new ATOM 0 HB3 ASP A 76 -0.476 17.894 2.328 1.00 35.20 H new ATOM 1195 N GLY A 77 2.575 15.975 1.706 1.00 4.20 N ATOM 1196 CA GLY A 77 3.014 14.744 2.363 1.00 11.31 C ATOM 1197 C GLY A 77 4.110 13.991 1.611 1.00 74.04 C ATOM 1198 O GLY A 77 5.277 14.387 1.640 1.00 0.04 O ATOM 0 H GLY A 77 2.755 16.018 0.703 1.00 4.20 H new ATOM 0 HA2 GLY A 77 3.376 14.987 3.362 1.00 11.31 H new ATOM 0 HA3 GLY A 77 2.155 14.085 2.487 1.00 11.31 H new ATOM 1202 N THR A 78 3.734 12.901 0.939 1.00 74.25 N ATOM 1203 CA THR A 78 4.704 12.031 0.249 1.00 51.33 C ATOM 1204 C THR A 78 4.081 11.351 -0.980 1.00 53.50 C ATOM 1205 O THR A 78 3.012 10.747 -0.890 1.00 73.24 O ATOM 1206 CB THR A 78 5.246 10.930 1.202 1.00 32.25 C ATOM 1207 OG1 THR A 78 5.915 11.530 2.320 1.00 11.22 O ATOM 1208 CG2 THR A 78 6.210 9.986 0.489 1.00 23.50 C ATOM 0 H THR A 78 2.765 12.595 0.855 1.00 74.25 H new ATOM 0 HA THR A 78 5.523 12.674 -0.074 1.00 51.33 H new ATOM 0 HB THR A 78 4.390 10.349 1.546 1.00 32.25 H new ATOM 0 HG1 THR A 78 5.253 11.812 2.985 1.00 11.22 H new ATOM 0 HG21 THR A 78 6.566 9.231 1.190 1.00 23.50 H new ATOM 0 HG22 THR A 78 5.696 9.498 -0.339 1.00 23.50 H new ATOM 0 HG23 THR A 78 7.058 10.553 0.106 1.00 23.50 H new ATOM 1216 N THR A 79 4.752 11.447 -2.128 1.00 44.10 N ATOM 1217 CA THR A 79 4.287 10.790 -3.360 1.00 31.43 C ATOM 1218 C THR A 79 5.000 9.454 -3.584 1.00 54.33 C ATOM 1219 O THR A 79 6.232 9.395 -3.640 1.00 30.32 O ATOM 1220 CB THR A 79 4.502 11.672 -4.619 1.00 31.24 C ATOM 1221 OG1 THR A 79 5.899 11.961 -4.802 1.00 42.34 O ATOM 1222 CG2 THR A 79 3.715 12.975 -4.522 1.00 42.33 C ATOM 0 H THR A 79 5.620 11.972 -2.235 1.00 44.10 H new ATOM 0 HA THR A 79 3.219 10.625 -3.220 1.00 31.43 H new ATOM 0 HB THR A 79 4.137 11.111 -5.480 1.00 31.24 H new ATOM 0 HG1 THR A 79 6.430 11.175 -4.557 1.00 42.34 H new ATOM 0 HG21 THR A 79 3.886 13.571 -5.418 1.00 42.33 H new ATOM 0 HG22 THR A 79 2.652 12.752 -4.432 1.00 42.33 H new ATOM 0 HG23 THR A 79 4.044 13.534 -3.646 1.00 42.33 H new ATOM 1230 N LEU A 80 4.227 8.378 -3.710 1.00 21.15 N ATOM 1231 CA LEU A 80 4.789 7.063 -4.021 1.00 50.43 C ATOM 1232 C LEU A 80 3.964 6.343 -5.093 1.00 12.44 C ATOM 1233 O LEU A 80 2.736 6.381 -5.083 1.00 64.43 O ATOM 1234 CB LEU A 80 4.935 6.209 -2.743 1.00 5.44 C ATOM 1235 CG LEU A 80 3.725 6.163 -1.779 1.00 62.33 C ATOM 1236 CD1 LEU A 80 2.605 5.272 -2.313 1.00 75.41 C ATOM 1237 CD2 LEU A 80 4.166 5.687 -0.395 1.00 60.32 C ATOM 0 H LEU A 80 3.213 8.389 -3.602 1.00 21.15 H new ATOM 0 HA LEU A 80 5.787 7.213 -4.432 1.00 50.43 H new ATOM 0 HB2 LEU A 80 5.165 5.187 -3.044 1.00 5.44 H new ATOM 0 HB3 LEU A 80 5.796 6.579 -2.186 1.00 5.44 H new ATOM 0 HG LEU A 80 3.330 7.176 -1.701 1.00 62.33 H new ATOM 0 HD11 LEU A 80 1.775 5.268 -1.606 1.00 75.41 H new ATOM 0 HD12 LEU A 80 2.261 5.656 -3.274 1.00 75.41 H new ATOM 0 HD13 LEU A 80 2.978 4.256 -2.441 1.00 75.41 H new ATOM 0 HD21 LEU A 80 3.304 5.660 0.272 1.00 60.32 H new ATOM 0 HD22 LEU A 80 4.596 4.688 -0.474 1.00 60.32 H new ATOM 0 HD23 LEU A 80 4.913 6.373 0.005 1.00 60.32 H new ATOM 1249 N THR A 81 4.648 5.706 -6.030 1.00 55.13 N ATOM 1250 CA THR A 81 3.982 5.008 -7.132 1.00 43.31 C ATOM 1251 C THR A 81 3.546 3.596 -6.717 1.00 5.35 C ATOM 1252 O THR A 81 4.373 2.697 -6.547 1.00 61.24 O ATOM 1253 CB THR A 81 4.902 4.924 -8.373 1.00 4.11 C ATOM 1254 OG1 THR A 81 5.318 6.241 -8.767 1.00 4.14 O ATOM 1255 CG2 THR A 81 4.197 4.250 -9.546 1.00 71.25 C ATOM 0 H THR A 81 5.666 5.655 -6.054 1.00 55.13 H new ATOM 0 HA THR A 81 3.094 5.586 -7.388 1.00 43.31 H new ATOM 0 HB THR A 81 5.771 4.325 -8.100 1.00 4.11 H new ATOM 0 HG1 THR A 81 5.901 6.179 -9.552 1.00 4.14 H new ATOM 0 HG21 THR A 81 4.872 4.208 -10.401 1.00 71.25 H new ATOM 0 HG22 THR A 81 3.906 3.238 -9.263 1.00 71.25 H new ATOM 0 HG23 THR A 81 3.308 4.822 -9.813 1.00 71.25 H new ATOM 1263 N LEU A 82 2.241 3.420 -6.539 1.00 4.24 N ATOM 1264 CA LEU A 82 1.666 2.126 -6.156 1.00 71.53 C ATOM 1265 C LEU A 82 1.481 1.235 -7.395 1.00 33.00 C ATOM 1266 O LEU A 82 0.635 1.507 -8.245 1.00 4.40 O ATOM 1267 CB LEU A 82 0.322 2.356 -5.429 1.00 13.32 C ATOM 1268 CG LEU A 82 -0.286 1.151 -4.671 1.00 61.54 C ATOM 1269 CD1 LEU A 82 -0.961 0.169 -5.618 1.00 3.33 C ATOM 1270 CD2 LEU A 82 0.773 0.435 -3.836 1.00 2.43 C ATOM 0 H LEU A 82 1.552 4.163 -6.654 1.00 4.24 H new ATOM 0 HA LEU A 82 2.347 1.612 -5.477 1.00 71.53 H new ATOM 0 HB2 LEU A 82 0.458 3.170 -4.717 1.00 13.32 H new ATOM 0 HB3 LEU A 82 -0.407 2.695 -6.165 1.00 13.32 H new ATOM 0 HG LEU A 82 -1.048 1.549 -4.001 1.00 61.54 H new ATOM 0 HD11 LEU A 82 -1.375 -0.662 -5.046 1.00 3.33 H new ATOM 0 HD12 LEU A 82 -1.763 0.675 -6.155 1.00 3.33 H new ATOM 0 HD13 LEU A 82 -0.229 -0.210 -6.331 1.00 3.33 H new ATOM 0 HD21 LEU A 82 0.317 -0.407 -3.315 1.00 2.43 H new ATOM 0 HD22 LEU A 82 1.566 0.071 -4.489 1.00 2.43 H new ATOM 0 HD23 LEU A 82 1.192 1.129 -3.107 1.00 2.43 H new ATOM 1282 N ARG A 83 2.284 0.179 -7.500 1.00 23.20 N ATOM 1283 CA ARG A 83 2.216 -0.726 -8.654 1.00 12.34 C ATOM 1284 C ARG A 83 1.297 -1.926 -8.383 1.00 32.14 C ATOM 1285 O ARG A 83 1.609 -2.774 -7.545 1.00 11.31 O ATOM 1286 CB ARG A 83 3.616 -1.237 -9.020 1.00 73.34 C ATOM 1287 CG ARG A 83 4.628 -0.138 -9.330 1.00 53.05 C ATOM 1288 CD ARG A 83 5.967 -0.730 -9.753 1.00 11.10 C ATOM 1289 NE ARG A 83 6.499 -1.649 -8.744 1.00 22.12 N ATOM 1290 CZ ARG A 83 7.108 -2.772 -9.017 1.00 12.03 C ATOM 1291 NH1 ARG A 83 7.259 -3.159 -10.239 1.00 5.32 N ATOM 1292 NH2 ARG A 83 7.548 -3.517 -8.057 1.00 11.40 N ATOM 0 H ARG A 83 2.987 -0.074 -6.806 1.00 23.20 H new ATOM 0 HA ARG A 83 1.803 -0.154 -9.485 1.00 12.34 H new ATOM 0 HB2 ARG A 83 3.996 -1.841 -8.196 1.00 73.34 H new ATOM 0 HB3 ARG A 83 3.535 -1.894 -9.886 1.00 73.34 H new ATOM 0 HG2 ARG A 83 4.243 0.502 -10.124 1.00 53.05 H new ATOM 0 HG3 ARG A 83 4.766 0.492 -8.451 1.00 53.05 H new ATOM 0 HD2 ARG A 83 5.848 -1.258 -10.699 1.00 11.10 H new ATOM 0 HD3 ARG A 83 6.682 0.075 -9.925 1.00 11.10 H new ATOM 0 HE ARG A 83 6.386 -1.395 -7.763 1.00 22.12 H new ATOM 0 HH11 ARG A 83 6.901 -2.586 -11.003 1.00 5.32 H new ATOM 0 HH12 ARG A 83 7.736 -4.038 -10.440 1.00 5.32 H new ATOM 0 HH21 ARG A 83 7.420 -3.228 -7.087 1.00 11.40 H new ATOM 0 HH22 ARG A 83 8.024 -4.394 -8.269 1.00 11.40 H new ATOM 1306 N ILE A 84 0.167 -1.993 -9.085 1.00 12.14 N ATOM 1307 CA ILE A 84 -0.728 -3.153 -8.998 1.00 61.02 C ATOM 1308 C ILE A 84 -0.383 -4.185 -10.083 1.00 30.40 C ATOM 1309 O ILE A 84 -0.844 -4.087 -11.225 1.00 20.55 O ATOM 1310 CB ILE A 84 -2.229 -2.768 -9.137 1.00 73.24 C ATOM 1311 CG1 ILE A 84 -2.615 -1.645 -8.152 1.00 35.12 C ATOM 1312 CG2 ILE A 84 -3.115 -3.998 -8.926 1.00 75.35 C ATOM 1313 CD1 ILE A 84 -2.328 -0.248 -8.665 1.00 52.12 C ATOM 0 H ILE A 84 -0.153 -1.261 -9.720 1.00 12.14 H new ATOM 0 HA ILE A 84 -0.577 -3.578 -8.006 1.00 61.02 H new ATOM 0 HB ILE A 84 -2.387 -2.391 -10.147 1.00 73.24 H new ATOM 0 HG12 ILE A 84 -3.678 -1.726 -7.924 1.00 35.12 H new ATOM 0 HG13 ILE A 84 -2.076 -1.795 -7.217 1.00 35.12 H new ATOM 0 HG21 ILE A 84 -4.162 -3.713 -9.026 1.00 75.35 H new ATOM 0 HG22 ILE A 84 -2.871 -4.754 -9.672 1.00 75.35 H new ATOM 0 HG23 ILE A 84 -2.943 -4.404 -7.929 1.00 75.35 H new ATOM 0 HD11 ILE A 84 -2.627 0.484 -7.915 1.00 52.12 H new ATOM 0 HD12 ILE A 84 -1.262 -0.146 -8.866 1.00 52.12 H new ATOM 0 HD13 ILE A 84 -2.888 -0.076 -9.584 1.00 52.12 H new ATOM 1325 N GLN A 85 0.448 -5.159 -9.727 1.00 34.13 N ATOM 1326 CA GLN A 85 0.840 -6.225 -10.655 1.00 51.12 C ATOM 1327 C GLN A 85 -0.067 -7.455 -10.488 1.00 62.54 C ATOM 1328 O GLN A 85 0.065 -8.207 -9.522 1.00 25.31 O ATOM 1329 CB GLN A 85 2.309 -6.607 -10.419 1.00 71.32 C ATOM 1330 CG GLN A 85 2.866 -7.591 -11.438 1.00 71.23 C ATOM 1331 CD GLN A 85 4.344 -7.865 -11.227 1.00 41.45 C ATOM 1332 OE1 GLN A 85 4.724 -8.787 -10.510 1.00 63.34 O ATOM 1333 NE2 GLN A 85 5.185 -7.052 -11.831 1.00 62.51 N ATOM 0 H GLN A 85 0.867 -5.236 -8.800 1.00 34.13 H new ATOM 0 HA GLN A 85 0.727 -5.858 -11.675 1.00 51.12 H new ATOM 0 HB2 GLN A 85 2.916 -5.702 -10.435 1.00 71.32 H new ATOM 0 HB3 GLN A 85 2.406 -7.038 -9.423 1.00 71.32 H new ATOM 0 HG2 GLN A 85 2.313 -8.528 -11.375 1.00 71.23 H new ATOM 0 HG3 GLN A 85 2.712 -7.197 -12.442 1.00 71.23 H new ATOM 0 HE21 GLN A 85 4.831 -6.297 -12.419 1.00 62.51 H new ATOM 0 HE22 GLN A 85 6.190 -7.177 -11.711 1.00 62.51 H new ATOM 1342 N GLY A 86 -0.995 -7.649 -11.419 1.00 21.23 N ATOM 1343 CA GLY A 86 -1.937 -8.762 -11.317 1.00 51.40 C ATOM 1344 C GLY A 86 -1.290 -10.125 -11.546 1.00 52.25 C ATOM 1345 O GLY A 86 -0.365 -10.250 -12.352 1.00 33.40 O ATOM 0 H GLY A 86 -1.116 -7.060 -12.243 1.00 21.23 H new ATOM 0 HA2 GLY A 86 -2.399 -8.748 -10.330 1.00 51.40 H new ATOM 0 HA3 GLY A 86 -2.736 -8.620 -12.045 1.00 51.40 H new ATOM 1349 N GLU A 87 -1.769 -11.150 -10.831 1.00 54.45 N ATOM 1350 CA GLU A 87 -1.282 -12.521 -11.032 1.00 21.31 C ATOM 1351 C GLU A 87 -1.581 -12.992 -12.463 1.00 30.24 C ATOM 1352 O GLU A 87 -0.733 -13.579 -13.136 1.00 55.23 O ATOM 1353 CB GLU A 87 -1.929 -13.484 -10.024 1.00 54.20 C ATOM 1354 CG GLU A 87 -1.450 -14.927 -10.164 1.00 14.40 C ATOM 1355 CD GLU A 87 -2.252 -15.904 -9.320 1.00 1.44 C ATOM 1356 OE1 GLU A 87 -3.412 -16.193 -9.686 1.00 4.43 O ATOM 1357 OE2 GLU A 87 -1.733 -16.389 -8.294 1.00 55.11 O ATOM 0 H GLU A 87 -2.488 -11.058 -10.113 1.00 54.45 H new ATOM 0 HA GLU A 87 -0.204 -12.521 -10.874 1.00 21.31 H new ATOM 0 HB2 GLU A 87 -1.716 -13.136 -9.013 1.00 54.20 H new ATOM 0 HB3 GLU A 87 -3.011 -13.455 -10.150 1.00 54.20 H new ATOM 0 HG2 GLU A 87 -1.511 -15.224 -11.211 1.00 14.40 H new ATOM 0 HG3 GLU A 87 -0.400 -14.985 -9.877 1.00 14.40 H new ATOM 1364 N SER A 88 -2.801 -12.728 -12.917 1.00 43.43 N ATOM 1365 CA SER A 88 -3.205 -13.042 -14.291 1.00 55.22 C ATOM 1366 C SER A 88 -2.709 -11.963 -15.262 1.00 62.51 C ATOM 1367 O SER A 88 -3.129 -10.810 -15.187 1.00 24.53 O ATOM 1368 CB SER A 88 -4.734 -13.159 -14.386 1.00 21.04 C ATOM 1369 OG SER A 88 -5.236 -14.128 -13.475 1.00 33.12 O ATOM 0 H SER A 88 -3.533 -12.295 -12.354 1.00 43.43 H new ATOM 0 HA SER A 88 -2.756 -13.996 -14.566 1.00 55.22 H new ATOM 0 HB2 SER A 88 -5.189 -12.191 -14.177 1.00 21.04 H new ATOM 0 HB3 SER A 88 -5.017 -13.431 -15.403 1.00 21.04 H new ATOM 0 HG SER A 88 -6.211 -14.179 -13.557 1.00 33.12 H new ATOM 1375 N ASN A 89 -1.811 -12.344 -16.171 1.00 65.13 N ATOM 1376 CA ASN A 89 -1.245 -11.405 -17.149 1.00 40.33 C ATOM 1377 C ASN A 89 -2.337 -10.814 -18.056 1.00 53.43 C ATOM 1378 O ASN A 89 -2.201 -9.701 -18.567 1.00 41.34 O ATOM 1379 CB ASN A 89 -0.186 -12.107 -18.011 1.00 33.02 C ATOM 1380 CG ASN A 89 0.910 -12.741 -17.174 1.00 20.14 C ATOM 1381 OD1 ASN A 89 1.909 -12.106 -16.853 1.00 60.00 O ATOM 1382 ND2 ASN A 89 0.736 -13.999 -16.821 1.00 44.33 N ATOM 0 H ASN A 89 -1.457 -13.297 -16.253 1.00 65.13 H new ATOM 0 HA ASN A 89 -0.781 -10.590 -16.593 1.00 40.33 H new ATOM 0 HB2 ASN A 89 -0.666 -12.874 -18.619 1.00 33.02 H new ATOM 0 HB3 ASN A 89 0.256 -11.386 -18.698 1.00 33.02 H new ATOM 0 HD21 ASN A 89 1.445 -14.475 -16.263 1.00 44.33 H new ATOM 0 HD22 ASN A 89 -0.108 -14.497 -17.106 1.00 44.33 H new ATOM 1389 N ASP A 90 -3.414 -11.575 -18.236 1.00 63.21 N ATOM 1390 CA ASP A 90 -4.539 -11.180 -19.092 1.00 21.14 C ATOM 1391 C ASP A 90 -5.101 -9.794 -18.706 1.00 71.41 C ATOM 1392 O ASP A 90 -5.206 -9.470 -17.523 1.00 63.44 O ATOM 1393 CB ASP A 90 -5.633 -12.244 -18.986 1.00 51.34 C ATOM 1394 CG ASP A 90 -5.086 -13.637 -19.238 1.00 12.52 C ATOM 1395 OD1 ASP A 90 -4.620 -14.286 -18.275 1.00 54.11 O ATOM 1396 OD2 ASP A 90 -5.098 -14.085 -20.402 1.00 31.01 O ATOM 0 H ASP A 90 -3.535 -12.486 -17.793 1.00 63.21 H new ATOM 0 HA ASP A 90 -4.183 -11.103 -20.119 1.00 21.14 H new ATOM 0 HB2 ASP A 90 -6.085 -12.204 -17.995 1.00 51.34 H new ATOM 0 HB3 ASP A 90 -6.423 -12.027 -19.705 1.00 51.34 H new ATOM 1401 N PRO A 91 -5.488 -8.967 -19.705 1.00 63.23 N ATOM 1402 CA PRO A 91 -5.950 -7.579 -19.474 1.00 64.41 C ATOM 1403 C PRO A 91 -7.084 -7.473 -18.433 1.00 72.02 C ATOM 1404 O PRO A 91 -8.231 -7.854 -18.695 1.00 42.40 O ATOM 1405 CB PRO A 91 -6.428 -7.116 -20.866 1.00 45.11 C ATOM 1406 CG PRO A 91 -6.556 -8.365 -21.677 1.00 52.51 C ATOM 1407 CD PRO A 91 -5.520 -9.311 -21.136 1.00 33.43 C ATOM 0 HA PRO A 91 -5.154 -6.962 -19.057 1.00 64.41 H new ATOM 0 HB2 PRO A 91 -7.381 -6.591 -20.800 1.00 45.11 H new ATOM 0 HB3 PRO A 91 -5.715 -6.426 -21.317 1.00 45.11 H new ATOM 0 HG2 PRO A 91 -7.557 -8.788 -21.588 1.00 52.51 H new ATOM 0 HG3 PRO A 91 -6.388 -8.164 -22.735 1.00 52.51 H new ATOM 0 HD2 PRO A 91 -5.799 -10.352 -21.297 1.00 33.43 H new ATOM 0 HD3 PRO A 91 -4.550 -9.164 -21.610 1.00 33.43 H new ATOM 1415 N LEU A 92 -6.749 -6.967 -17.246 1.00 11.11 N ATOM 1416 CA LEU A 92 -7.721 -6.804 -16.156 1.00 12.42 C ATOM 1417 C LEU A 92 -8.555 -5.517 -16.325 1.00 23.51 C ATOM 1418 O LEU A 92 -8.075 -4.521 -16.870 1.00 15.04 O ATOM 1419 CB LEU A 92 -6.990 -6.775 -14.802 1.00 53.31 C ATOM 1420 CG LEU A 92 -6.186 -8.044 -14.456 1.00 72.30 C ATOM 1421 CD1 LEU A 92 -5.513 -7.902 -13.091 1.00 11.44 C ATOM 1422 CD2 LEU A 92 -7.082 -9.282 -14.491 1.00 51.41 C ATOM 0 H LEU A 92 -5.805 -6.660 -17.010 1.00 11.11 H new ATOM 0 HA LEU A 92 -8.403 -7.654 -16.189 1.00 12.42 H new ATOM 0 HB2 LEU A 92 -6.311 -5.922 -14.793 1.00 53.31 H new ATOM 0 HB3 LEU A 92 -7.725 -6.606 -14.015 1.00 53.31 H new ATOM 0 HG LEU A 92 -5.408 -8.168 -15.209 1.00 72.30 H new ATOM 0 HD11 LEU A 92 -4.951 -8.809 -12.866 1.00 11.44 H new ATOM 0 HD12 LEU A 92 -4.835 -7.049 -13.107 1.00 11.44 H new ATOM 0 HD13 LEU A 92 -6.273 -7.747 -12.325 1.00 11.44 H new ATOM 0 HD21 LEU A 92 -6.493 -10.165 -14.244 1.00 51.41 H new ATOM 0 HD22 LEU A 92 -7.888 -9.169 -13.766 1.00 51.41 H new ATOM 0 HD23 LEU A 92 -7.506 -9.396 -15.489 1.00 51.41 H new ATOM 1434 N PRO A 93 -9.823 -5.526 -15.858 1.00 42.35 N ATOM 1435 CA PRO A 93 -10.711 -4.347 -15.942 1.00 20.25 C ATOM 1436 C PRO A 93 -10.325 -3.225 -14.955 1.00 21.22 C ATOM 1437 O PRO A 93 -9.368 -3.357 -14.190 1.00 34.40 O ATOM 1438 CB PRO A 93 -12.090 -4.932 -15.596 1.00 12.10 C ATOM 1439 CG PRO A 93 -11.787 -6.090 -14.707 1.00 32.14 C ATOM 1440 CD PRO A 93 -10.499 -6.678 -15.225 1.00 52.43 C ATOM 0 HA PRO A 93 -10.662 -3.868 -16.920 1.00 20.25 H new ATOM 0 HB2 PRO A 93 -12.718 -4.198 -15.092 1.00 12.10 H new ATOM 0 HB3 PRO A 93 -12.624 -5.248 -16.492 1.00 12.10 H new ATOM 0 HG2 PRO A 93 -11.682 -5.770 -13.670 1.00 32.14 H new ATOM 0 HG3 PRO A 93 -12.591 -6.825 -14.734 1.00 32.14 H new ATOM 0 HD2 PRO A 93 -9.899 -7.102 -14.420 1.00 52.43 H new ATOM 0 HD3 PRO A 93 -10.683 -7.479 -15.941 1.00 52.43 H new ATOM 1448 N ALA A 94 -11.079 -2.124 -14.974 1.00 23.02 N ATOM 1449 CA ALA A 94 -10.806 -0.982 -14.092 1.00 3.41 C ATOM 1450 C ALA A 94 -11.354 -1.215 -12.675 1.00 32.31 C ATOM 1451 O ALA A 94 -12.463 -1.728 -12.497 1.00 42.23 O ATOM 1452 CB ALA A 94 -11.391 0.294 -14.690 1.00 62.01 C ATOM 0 H ALA A 94 -11.883 -1.997 -15.589 1.00 23.02 H new ATOM 0 HA ALA A 94 -9.725 -0.873 -14.010 1.00 3.41 H new ATOM 0 HB1 ALA A 94 -11.183 1.135 -14.028 1.00 62.01 H new ATOM 0 HB2 ALA A 94 -10.940 0.479 -15.665 1.00 62.01 H new ATOM 0 HB3 ALA A 94 -12.469 0.181 -14.805 1.00 62.01 H new ATOM 1458 N PHE A 95 -10.583 -0.813 -11.666 1.00 71.52 N ATOM 1459 CA PHE A 95 -10.934 -1.093 -10.269 1.00 13.24 C ATOM 1460 C PHE A 95 -10.601 0.080 -9.333 1.00 73.15 C ATOM 1461 O PHE A 95 -10.023 1.091 -9.744 1.00 4.14 O ATOM 1462 CB PHE A 95 -10.222 -2.370 -9.792 1.00 61.41 C ATOM 1463 CG PHE A 95 -8.717 -2.315 -9.910 1.00 31.12 C ATOM 1464 CD1 PHE A 95 -8.090 -2.624 -11.110 1.00 33.14 C ATOM 1465 CD2 PHE A 95 -7.932 -1.957 -8.823 1.00 4.55 C ATOM 1466 CE1 PHE A 95 -6.714 -2.576 -11.221 1.00 31.33 C ATOM 1467 CE2 PHE A 95 -6.555 -1.908 -8.929 1.00 2.41 C ATOM 1468 CZ PHE A 95 -5.947 -2.218 -10.131 1.00 1.33 C ATOM 0 H PHE A 95 -9.713 -0.294 -11.786 1.00 71.52 H new ATOM 0 HA PHE A 95 -12.014 -1.238 -10.230 1.00 13.24 H new ATOM 0 HB2 PHE A 95 -10.488 -2.555 -8.751 1.00 61.41 H new ATOM 0 HB3 PHE A 95 -10.591 -3.217 -10.371 1.00 61.41 H new ATOM 0 HD1 PHE A 95 -8.685 -2.905 -11.966 1.00 33.14 H new ATOM 0 HD2 PHE A 95 -8.403 -1.714 -7.882 1.00 4.55 H new ATOM 0 HE1 PHE A 95 -6.239 -2.818 -12.160 1.00 31.33 H new ATOM 0 HE2 PHE A 95 -5.956 -1.628 -8.075 1.00 2.41 H new ATOM 0 HZ PHE A 95 -4.871 -2.180 -10.217 1.00 1.33 H new ATOM 1478 N SER A 96 -10.969 -0.077 -8.062 1.00 31.43 N ATOM 1479 CA SER A 96 -10.779 0.969 -7.044 1.00 13.31 C ATOM 1480 C SER A 96 -10.639 0.357 -5.643 1.00 13.31 C ATOM 1481 O SER A 96 -10.892 -0.831 -5.454 1.00 25.23 O ATOM 1482 CB SER A 96 -11.965 1.947 -7.063 1.00 30.23 C ATOM 1483 OG SER A 96 -13.199 1.273 -6.847 1.00 32.44 O ATOM 0 H SER A 96 -11.406 -0.927 -7.705 1.00 31.43 H new ATOM 0 HA SER A 96 -9.860 1.506 -7.281 1.00 13.31 H new ATOM 0 HB2 SER A 96 -11.824 2.706 -6.294 1.00 30.23 H new ATOM 0 HB3 SER A 96 -11.995 2.466 -8.021 1.00 30.23 H new ATOM 0 HG SER A 96 -13.095 0.322 -7.062 1.00 32.44 H new ATOM 1489 N GLY A 97 -10.233 1.167 -4.665 1.00 52.14 N ATOM 1490 CA GLY A 97 -10.107 0.679 -3.291 1.00 20.45 C ATOM 1491 C GLY A 97 -9.734 1.769 -2.286 1.00 24.52 C ATOM 1492 O GLY A 97 -9.595 2.941 -2.647 1.00 12.50 O ATOM 0 H GLY A 97 -9.989 2.149 -4.794 1.00 52.14 H new ATOM 0 HA2 GLY A 97 -11.050 0.224 -2.988 1.00 20.45 H new ATOM 0 HA3 GLY A 97 -9.351 -0.105 -3.261 1.00 20.45 H new ATOM 1496 N THR A 98 -9.560 1.377 -1.025 1.00 74.21 N ATOM 1497 CA THR A 98 -9.202 2.319 0.049 1.00 20.43 C ATOM 1498 C THR A 98 -7.787 2.043 0.586 1.00 52.03 C ATOM 1499 O THR A 98 -7.511 0.959 1.104 1.00 42.44 O ATOM 1500 CB THR A 98 -10.196 2.243 1.239 1.00 20.34 C ATOM 1501 OG1 THR A 98 -11.541 2.485 0.791 1.00 20.13 O ATOM 1502 CG2 THR A 98 -9.838 3.254 2.329 1.00 74.34 C ATOM 0 H THR A 98 -9.660 0.410 -0.715 1.00 74.21 H new ATOM 0 HA THR A 98 -9.244 3.314 -0.394 1.00 20.43 H new ATOM 0 HB THR A 98 -10.126 1.239 1.657 1.00 20.34 H new ATOM 0 HG1 THR A 98 -12.129 1.775 1.123 1.00 20.13 H new ATOM 0 HG21 THR A 98 -10.553 3.175 3.148 1.00 74.34 H new ATOM 0 HG22 THR A 98 -8.835 3.047 2.702 1.00 74.34 H new ATOM 0 HG23 THR A 98 -9.870 4.262 1.915 1.00 74.34 H new ATOM 1510 N VAL A 99 -6.899 3.029 0.462 1.00 51.21 N ATOM 1511 CA VAL A 99 -5.537 2.923 0.999 1.00 2.45 C ATOM 1512 C VAL A 99 -5.395 3.705 2.317 1.00 62.24 C ATOM 1513 O VAL A 99 -5.539 4.927 2.350 1.00 20.41 O ATOM 1514 CB VAL A 99 -4.478 3.418 -0.025 1.00 1.52 C ATOM 1515 CG1 VAL A 99 -4.780 4.837 -0.497 1.00 14.24 C ATOM 1516 CG2 VAL A 99 -3.072 3.343 0.569 1.00 23.22 C ATOM 0 H VAL A 99 -7.096 3.913 -0.006 1.00 51.21 H new ATOM 0 HA VAL A 99 -5.356 1.867 1.197 1.00 2.45 H new ATOM 0 HB VAL A 99 -4.526 2.758 -0.891 1.00 1.52 H new ATOM 0 HG11 VAL A 99 -4.020 5.152 -1.212 1.00 14.24 H new ATOM 0 HG12 VAL A 99 -5.760 4.861 -0.974 1.00 14.24 H new ATOM 0 HG13 VAL A 99 -4.776 5.513 0.358 1.00 14.24 H new ATOM 0 HG21 VAL A 99 -2.347 3.694 -0.166 1.00 23.22 H new ATOM 0 HG22 VAL A 99 -3.019 3.970 1.459 1.00 23.22 H new ATOM 0 HG23 VAL A 99 -2.845 2.311 0.838 1.00 23.22 H new ATOM 1526 N GLU A 100 -5.128 2.994 3.407 1.00 62.41 N ATOM 1527 CA GLU A 100 -4.974 3.627 4.724 1.00 42.43 C ATOM 1528 C GLU A 100 -3.505 3.652 5.157 1.00 54.01 C ATOM 1529 O GLU A 100 -2.900 2.610 5.405 1.00 41.11 O ATOM 1530 CB GLU A 100 -5.819 2.885 5.766 1.00 73.32 C ATOM 1531 CG GLU A 100 -7.306 2.874 5.438 1.00 33.23 C ATOM 1532 CD GLU A 100 -8.130 2.134 6.474 1.00 71.32 C ATOM 1533 OE1 GLU A 100 -7.951 0.906 6.605 1.00 74.54 O ATOM 1534 OE2 GLU A 100 -8.969 2.765 7.147 1.00 31.34 O ATOM 0 H GLU A 100 -5.013 1.981 3.411 1.00 62.41 H new ATOM 0 HA GLU A 100 -5.322 4.657 4.648 1.00 42.43 H new ATOM 0 HB2 GLU A 100 -5.464 1.858 5.847 1.00 73.32 H new ATOM 0 HB3 GLU A 100 -5.672 3.350 6.741 1.00 73.32 H new ATOM 0 HG2 GLU A 100 -7.664 3.901 5.361 1.00 33.23 H new ATOM 0 HG3 GLU A 100 -7.455 2.410 4.463 1.00 33.23 H new ATOM 1541 N TYR A 101 -2.938 4.851 5.249 1.00 72.14 N ATOM 1542 CA TYR A 101 -1.524 5.020 5.591 1.00 63.24 C ATOM 1543 C TYR A 101 -1.348 5.777 6.916 1.00 45.43 C ATOM 1544 O TYR A 101 -1.921 6.852 7.116 1.00 54.55 O ATOM 1545 CB TYR A 101 -0.789 5.741 4.449 1.00 44.22 C ATOM 1546 CG TYR A 101 -1.430 7.046 4.001 1.00 72.34 C ATOM 1547 CD1 TYR A 101 -2.549 7.050 3.172 1.00 32.43 C ATOM 1548 CD2 TYR A 101 -0.903 8.275 4.384 1.00 51.41 C ATOM 1549 CE1 TYR A 101 -3.118 8.235 2.740 1.00 74.02 C ATOM 1550 CE2 TYR A 101 -1.470 9.462 3.961 1.00 2.31 C ATOM 1551 CZ TYR A 101 -2.575 9.438 3.139 1.00 44.05 C ATOM 1552 OH TYR A 101 -3.126 10.623 2.698 1.00 30.34 O ATOM 0 H TYR A 101 -3.437 5.726 5.091 1.00 72.14 H new ATOM 0 HA TYR A 101 -1.088 4.030 5.724 1.00 63.24 H new ATOM 0 HB2 TYR A 101 0.234 5.945 4.766 1.00 44.22 H new ATOM 0 HB3 TYR A 101 -0.730 5.069 3.593 1.00 44.22 H new ATOM 0 HD1 TYR A 101 -2.981 6.110 2.860 1.00 32.43 H new ATOM 0 HD2 TYR A 101 -0.034 8.302 5.024 1.00 51.41 H new ATOM 0 HE1 TYR A 101 -3.983 8.218 2.094 1.00 74.02 H new ATOM 0 HE2 TYR A 101 -1.048 10.406 4.274 1.00 2.31 H new ATOM 0 HH TYR A 101 -3.282 11.216 3.463 1.00 30.34 H new ATOM 1562 N GLY A 102 -0.549 5.207 7.815 1.00 35.13 N ATOM 1563 CA GLY A 102 -0.325 5.817 9.121 1.00 32.42 C ATOM 1564 C GLY A 102 0.968 5.355 9.786 1.00 72.41 C ATOM 1565 O GLY A 102 1.954 5.069 9.106 1.00 0.40 O ATOM 0 H GLY A 102 -0.050 4.330 7.664 1.00 35.13 H new ATOM 0 HA2 GLY A 102 -0.301 6.901 9.009 1.00 32.42 H new ATOM 0 HA3 GLY A 102 -1.166 5.582 9.774 1.00 32.42 H new ATOM 1569 N GLN A 103 0.960 5.263 11.115 1.00 34.14 N ATOM 1570 CA GLN A 103 2.158 4.886 11.880 1.00 55.43 C ATOM 1571 C GLN A 103 1.872 3.736 12.858 1.00 40.14 C ATOM 1572 O GLN A 103 0.746 3.561 13.324 1.00 50.40 O ATOM 1573 CB GLN A 103 2.691 6.094 12.657 1.00 23.43 C ATOM 1574 CG GLN A 103 3.090 7.273 11.779 1.00 54.04 C ATOM 1575 CD GLN A 103 3.672 8.427 12.577 1.00 3.13 C ATOM 1576 OE1 GLN A 103 3.321 8.647 13.732 1.00 53.41 O ATOM 1577 NE2 GLN A 103 4.564 9.173 11.971 1.00 2.32 N ATOM 0 H GLN A 103 0.137 5.444 11.690 1.00 34.14 H new ATOM 0 HA GLN A 103 2.907 4.546 11.165 1.00 55.43 H new ATOM 0 HB2 GLN A 103 1.929 6.423 13.363 1.00 23.43 H new ATOM 0 HB3 GLN A 103 3.556 5.782 13.243 1.00 23.43 H new ATOM 0 HG2 GLN A 103 3.821 6.941 11.042 1.00 54.04 H new ATOM 0 HG3 GLN A 103 2.217 7.622 11.227 1.00 54.04 H new ATOM 0 HE21 GLN A 103 4.835 8.965 11.010 1.00 2.32 H new ATOM 0 HE22 GLN A 103 4.987 9.962 12.461 1.00 2.32 H new ATOM 1586 N ILE A 104 2.908 2.960 13.171 1.00 21.12 N ATOM 1587 CA ILE A 104 2.796 1.838 14.114 1.00 41.04 C ATOM 1588 C ILE A 104 3.637 2.093 15.375 1.00 4.21 C ATOM 1589 O ILE A 104 4.831 2.375 15.287 1.00 11.32 O ATOM 1590 CB ILE A 104 3.258 0.509 13.459 1.00 23.21 C ATOM 1591 CG1 ILE A 104 2.449 0.228 12.181 1.00 65.23 C ATOM 1592 CG2 ILE A 104 3.131 -0.654 14.445 1.00 33.00 C ATOM 1593 CD1 ILE A 104 2.847 -1.049 11.467 1.00 74.12 C ATOM 0 H ILE A 104 3.843 3.086 12.784 1.00 21.12 H new ATOM 0 HA ILE A 104 1.745 1.755 14.391 1.00 41.04 H new ATOM 0 HB ILE A 104 4.308 0.609 13.186 1.00 23.21 H new ATOM 0 HG12 ILE A 104 1.391 0.174 12.438 1.00 65.23 H new ATOM 0 HG13 ILE A 104 2.568 1.067 11.496 1.00 65.23 H new ATOM 0 HG21 ILE A 104 3.460 -1.576 13.965 1.00 33.00 H new ATOM 0 HG22 ILE A 104 3.751 -0.459 15.320 1.00 33.00 H new ATOM 0 HG23 ILE A 104 2.091 -0.757 14.754 1.00 33.00 H new ATOM 0 HD11 ILE A 104 2.231 -1.175 10.577 1.00 74.12 H new ATOM 0 HD12 ILE A 104 3.896 -0.992 11.177 1.00 74.12 H new ATOM 0 HD13 ILE A 104 2.701 -1.899 12.133 1.00 74.12 H new ATOM 1605 N GLN A 105 3.008 2.000 16.547 1.00 63.22 N ATOM 1606 CA GLN A 105 3.719 2.183 17.826 1.00 75.13 C ATOM 1607 C GLN A 105 3.788 0.872 18.638 1.00 64.34 C ATOM 1608 O GLN A 105 4.078 0.887 19.839 1.00 4.22 O ATOM 1609 CB GLN A 105 3.036 3.277 18.665 1.00 22.21 C ATOM 1610 CG GLN A 105 1.576 2.979 18.999 1.00 53.23 C ATOM 1611 CD GLN A 105 0.951 3.986 19.956 1.00 71.14 C ATOM 1612 OE1 GLN A 105 0.063 3.648 20.729 1.00 74.31 O ATOM 1613 NE2 GLN A 105 1.397 5.227 19.914 1.00 42.00 N ATOM 0 H GLN A 105 2.012 1.800 16.644 1.00 63.22 H new ATOM 0 HA GLN A 105 4.739 2.487 17.590 1.00 75.13 H new ATOM 0 HB2 GLN A 105 3.591 3.409 19.594 1.00 22.21 H new ATOM 0 HB3 GLN A 105 3.089 4.222 18.125 1.00 22.21 H new ATOM 0 HG2 GLN A 105 0.997 2.961 18.075 1.00 53.23 H new ATOM 0 HG3 GLN A 105 1.508 1.983 19.437 1.00 53.23 H new ATOM 0 HE21 GLN A 105 2.138 5.481 19.260 1.00 42.00 H new ATOM 0 HE22 GLN A 105 1.001 5.932 20.535 1.00 42.00 H new ATOM 1622 N GLY A 106 3.550 -0.262 17.978 1.00 64.45 N ATOM 1623 CA GLY A 106 3.511 -1.544 18.678 1.00 23.23 C ATOM 1624 C GLY A 106 4.312 -2.646 17.994 1.00 65.44 C ATOM 1625 O GLY A 106 5.127 -2.381 17.108 1.00 33.51 O ATOM 0 H GLY A 106 3.384 -0.319 16.973 1.00 64.45 H new ATOM 0 HA2 GLY A 106 3.892 -1.406 19.690 1.00 23.23 H new ATOM 0 HA3 GLY A 106 2.474 -1.866 18.769 1.00 23.23 H new ATOM 1629 N THR A 107 4.066 -3.887 18.404 1.00 31.03 N ATOM 1630 CA THR A 107 4.792 -5.053 17.878 1.00 74.50 C ATOM 1631 C THR A 107 3.949 -5.830 16.865 1.00 63.42 C ATOM 1632 O THR A 107 2.785 -5.513 16.636 1.00 13.21 O ATOM 1633 CB THR A 107 5.179 -6.029 19.015 1.00 4.31 C ATOM 1634 OG1 THR A 107 4.000 -6.670 19.536 1.00 2.11 O ATOM 1635 CG2 THR A 107 5.896 -5.297 20.142 1.00 65.21 C ATOM 0 H THR A 107 3.363 -4.119 19.106 1.00 31.03 H new ATOM 0 HA THR A 107 5.687 -4.663 17.393 1.00 74.50 H new ATOM 0 HB THR A 107 5.853 -6.779 18.601 1.00 4.31 H new ATOM 0 HG1 THR A 107 4.253 -7.287 20.254 1.00 2.11 H new ATOM 0 HG21 THR A 107 6.157 -6.006 20.928 1.00 65.21 H new ATOM 0 HG22 THR A 107 6.804 -4.834 19.755 1.00 65.21 H new ATOM 0 HG23 THR A 107 5.241 -4.527 20.550 1.00 65.21 H new ATOM 1643 N ILE A 108 4.544 -6.860 16.265 1.00 55.33 N ATOM 1644 CA ILE A 108 3.802 -7.771 15.384 1.00 4.13 C ATOM 1645 C ILE A 108 2.638 -8.428 16.142 1.00 0.41 C ATOM 1646 O ILE A 108 1.551 -8.619 15.596 1.00 44.44 O ATOM 1647 CB ILE A 108 4.727 -8.877 14.811 1.00 4.44 C ATOM 1648 CG1 ILE A 108 5.881 -8.249 14.010 1.00 72.02 C ATOM 1649 CG2 ILE A 108 3.936 -9.861 13.943 1.00 65.14 C ATOM 1650 CD1 ILE A 108 5.432 -7.425 12.819 1.00 52.53 C ATOM 0 H ILE A 108 5.533 -7.087 16.370 1.00 55.33 H new ATOM 0 HA ILE A 108 3.410 -7.178 14.558 1.00 4.13 H new ATOM 0 HB ILE A 108 5.149 -9.435 15.647 1.00 4.44 H new ATOM 0 HG12 ILE A 108 6.468 -7.616 14.675 1.00 72.02 H new ATOM 0 HG13 ILE A 108 6.541 -9.043 13.661 1.00 72.02 H new ATOM 0 HG21 ILE A 108 4.609 -10.625 13.554 1.00 65.14 H new ATOM 0 HG22 ILE A 108 3.159 -10.333 14.544 1.00 65.14 H new ATOM 0 HG23 ILE A 108 3.477 -9.325 13.112 1.00 65.14 H new ATOM 0 HD11 ILE A 108 6.305 -7.018 12.309 1.00 52.53 H new ATOM 0 HD12 ILE A 108 4.871 -8.057 12.130 1.00 52.53 H new ATOM 0 HD13 ILE A 108 4.797 -6.607 13.161 1.00 52.53 H new ATOM 1662 N ASP A 109 2.883 -8.762 17.409 1.00 2.42 N ATOM 1663 CA ASP A 109 1.863 -9.366 18.268 1.00 64.51 C ATOM 1664 C ASP A 109 0.770 -8.346 18.626 1.00 11.44 C ATOM 1665 O ASP A 109 -0.429 -8.623 18.512 1.00 63.21 O ATOM 1666 CB ASP A 109 2.509 -9.891 19.556 1.00 22.14 C ATOM 1667 CG ASP A 109 3.756 -10.713 19.290 1.00 55.11 C ATOM 1668 OD1 ASP A 109 3.642 -11.941 19.088 1.00 51.11 O ATOM 1669 OD2 ASP A 109 4.864 -10.132 19.285 1.00 61.13 O ATOM 0 H ASP A 109 3.784 -8.624 17.866 1.00 2.42 H new ATOM 0 HA ASP A 109 1.405 -10.191 17.722 1.00 64.51 H new ATOM 0 HB2 ASP A 109 2.764 -9.049 20.200 1.00 22.14 H new ATOM 0 HB3 ASP A 109 1.786 -10.500 20.099 1.00 22.14 H new ATOM 1674 N ASN A 110 1.198 -7.158 19.048 1.00 34.34 N ATOM 1675 CA ASN A 110 0.284 -6.118 19.537 1.00 41.42 C ATOM 1676 C ASN A 110 0.678 -4.720 19.021 1.00 33.42 C ATOM 1677 O ASN A 110 1.486 -4.017 19.632 1.00 12.23 O ATOM 1678 CB ASN A 110 0.246 -6.148 21.074 1.00 44.53 C ATOM 1679 CG ASN A 110 1.637 -6.145 21.700 1.00 11.21 C ATOM 1680 OD1 ASN A 110 2.258 -7.190 21.871 1.00 11.14 O ATOM 1681 ND2 ASN A 110 2.140 -4.979 22.051 1.00 51.01 N ATOM 0 H ASN A 110 2.181 -6.886 19.062 1.00 34.34 H new ATOM 0 HA ASN A 110 -0.713 -6.327 19.149 1.00 41.42 H new ATOM 0 HB2 ASN A 110 -0.312 -5.285 21.436 1.00 44.53 H new ATOM 0 HB3 ASN A 110 -0.293 -7.037 21.402 1.00 44.53 H new ATOM 0 HD21 ASN A 110 3.066 -4.930 22.476 1.00 51.01 H new ATOM 0 HD22 ASN A 110 1.603 -4.125 21.898 1.00 51.01 H new ATOM 1688 N PHE A 111 0.109 -4.329 17.883 1.00 61.33 N ATOM 1689 CA PHE A 111 0.403 -3.027 17.275 1.00 54.15 C ATOM 1690 C PHE A 111 -0.830 -2.110 17.241 1.00 62.22 C ATOM 1691 O PHE A 111 -1.906 -2.503 16.782 1.00 44.54 O ATOM 1692 CB PHE A 111 0.965 -3.209 15.851 1.00 64.14 C ATOM 1693 CG PHE A 111 0.053 -3.956 14.900 1.00 40.53 C ATOM 1694 CD1 PHE A 111 0.016 -5.345 14.894 1.00 73.33 C ATOM 1695 CD2 PHE A 111 -0.764 -3.269 14.008 1.00 3.52 C ATOM 1696 CE1 PHE A 111 -0.815 -6.029 14.025 1.00 2.00 C ATOM 1697 CE2 PHE A 111 -1.594 -3.951 13.137 1.00 51.21 C ATOM 1698 CZ PHE A 111 -1.619 -5.331 13.144 1.00 12.31 C ATOM 0 H PHE A 111 -0.560 -4.894 17.360 1.00 61.33 H new ATOM 0 HA PHE A 111 1.154 -2.545 17.901 1.00 54.15 H new ATOM 0 HB2 PHE A 111 1.178 -2.226 15.431 1.00 64.14 H new ATOM 0 HB3 PHE A 111 1.914 -3.741 15.915 1.00 64.14 H new ATOM 0 HD1 PHE A 111 0.644 -5.898 15.577 1.00 73.33 H new ATOM 0 HD2 PHE A 111 -0.750 -2.189 13.995 1.00 3.52 H new ATOM 0 HE1 PHE A 111 -0.835 -7.109 14.035 1.00 2.00 H new ATOM 0 HE2 PHE A 111 -2.223 -3.403 12.451 1.00 51.21 H new ATOM 0 HZ PHE A 111 -2.265 -5.864 12.463 1.00 12.31 H new ATOM 1708 N GLN A 112 -0.667 -0.892 17.754 1.00 34.14 N ATOM 1709 CA GLN A 112 -1.697 0.146 17.644 1.00 45.40 C ATOM 1710 C GLN A 112 -1.404 1.083 16.463 1.00 22.02 C ATOM 1711 O GLN A 112 -0.317 1.667 16.365 1.00 70.12 O ATOM 1712 CB GLN A 112 -1.797 0.948 18.948 1.00 13.44 C ATOM 1713 CG GLN A 112 -2.301 0.131 20.133 1.00 2.23 C ATOM 1714 CD GLN A 112 -2.418 0.954 21.404 1.00 61.14 C ATOM 1715 OE1 GLN A 112 -3.454 1.554 21.675 1.00 40.52 O ATOM 1716 NE2 GLN A 112 -1.363 0.989 22.193 1.00 54.23 N ATOM 0 H GLN A 112 0.172 -0.596 18.253 1.00 34.14 H new ATOM 0 HA GLN A 112 -2.653 -0.345 17.464 1.00 45.40 H new ATOM 0 HB2 GLN A 112 -0.815 1.355 19.190 1.00 13.44 H new ATOM 0 HB3 GLN A 112 -2.464 1.796 18.793 1.00 13.44 H new ATOM 0 HG2 GLN A 112 -3.275 -0.293 19.889 1.00 2.23 H new ATOM 0 HG3 GLN A 112 -1.624 -0.705 20.307 1.00 2.23 H new ATOM 0 HE21 GLN A 112 -0.518 0.478 21.937 1.00 54.23 H new ATOM 0 HE22 GLN A 112 -1.392 1.527 23.059 1.00 54.23 H new ATOM 1725 N GLU A 113 -2.377 1.206 15.565 1.00 13.04 N ATOM 1726 CA GLU A 113 -2.240 2.035 14.364 1.00 52.11 C ATOM 1727 C GLU A 113 -2.636 3.493 14.647 1.00 24.03 C ATOM 1728 O GLU A 113 -3.820 3.811 14.780 1.00 15.14 O ATOM 1729 CB GLU A 113 -3.116 1.461 13.242 1.00 51.02 C ATOM 1730 CG GLU A 113 -2.917 -0.035 13.020 1.00 71.12 C ATOM 1731 CD GLU A 113 -3.828 -0.601 11.941 1.00 43.15 C ATOM 1732 OE1 GLU A 113 -5.070 -0.519 12.096 1.00 62.41 O ATOM 1733 OE2 GLU A 113 -3.313 -1.121 10.936 1.00 21.44 O ATOM 0 H GLU A 113 -3.280 0.738 15.645 1.00 13.04 H new ATOM 0 HA GLU A 113 -1.195 2.025 14.055 1.00 52.11 H new ATOM 0 HB2 GLU A 113 -4.164 1.649 13.477 1.00 51.02 H new ATOM 0 HB3 GLU A 113 -2.898 1.990 12.314 1.00 51.02 H new ATOM 0 HG2 GLU A 113 -1.879 -0.221 12.746 1.00 71.12 H new ATOM 0 HG3 GLU A 113 -3.099 -0.563 13.956 1.00 71.12 H new ATOM 1740 N ILE A 114 -1.643 4.373 14.741 1.00 50.03 N ATOM 1741 CA ILE A 114 -1.882 5.790 15.049 1.00 1.10 C ATOM 1742 C ILE A 114 -1.623 6.686 13.830 1.00 21.34 C ATOM 1743 O ILE A 114 -0.876 6.313 12.925 1.00 12.22 O ATOM 1744 CB ILE A 114 -0.983 6.268 16.218 1.00 1.13 C ATOM 1745 CG1 ILE A 114 0.508 6.115 15.856 1.00 63.13 C ATOM 1746 CG2 ILE A 114 -1.313 5.495 17.492 1.00 61.42 C ATOM 1747 CD1 ILE A 114 1.458 6.658 16.904 1.00 21.20 C ATOM 0 H ILE A 114 -0.660 4.134 14.609 1.00 50.03 H new ATOM 0 HA ILE A 114 -2.930 5.873 15.336 1.00 1.10 H new ATOM 0 HB ILE A 114 -1.181 7.325 16.396 1.00 1.13 H new ATOM 0 HG12 ILE A 114 0.725 5.059 15.696 1.00 63.13 H new ATOM 0 HG13 ILE A 114 0.696 6.626 14.911 1.00 63.13 H new ATOM 0 HG21 ILE A 114 -0.674 5.842 18.304 1.00 61.42 H new ATOM 0 HG22 ILE A 114 -2.357 5.659 17.757 1.00 61.42 H new ATOM 0 HG23 ILE A 114 -1.144 4.431 17.326 1.00 61.42 H new ATOM 0 HD11 ILE A 114 2.486 6.512 16.573 1.00 21.20 H new ATOM 0 HD12 ILE A 114 1.271 7.722 17.048 1.00 21.20 H new ATOM 0 HD13 ILE A 114 1.301 6.131 17.845 1.00 21.20 H new ATOM 1759 N ASN A 115 -2.251 7.866 13.814 1.00 42.54 N ATOM 1760 CA ASN A 115 -2.016 8.872 12.762 1.00 64.11 C ATOM 1761 C ASN A 115 -2.287 8.306 11.356 1.00 34.22 C ATOM 1762 O ASN A 115 -1.571 8.614 10.399 1.00 25.40 O ATOM 1763 CB ASN A 115 -0.575 9.385 12.857 1.00 51.15 C ATOM 1764 CG ASN A 115 -0.261 9.974 14.221 1.00 30.51 C ATOM 1765 OD1 ASN A 115 -1.128 10.526 14.885 1.00 21.34 O ATOM 1766 ND2 ASN A 115 0.974 9.850 14.657 1.00 65.44 N ATOM 0 H ASN A 115 -2.930 8.153 14.519 1.00 42.54 H new ATOM 0 HA ASN A 115 -2.712 9.695 12.921 1.00 64.11 H new ATOM 0 HB2 ASN A 115 0.114 8.566 12.650 1.00 51.15 H new ATOM 0 HB3 ASN A 115 -0.410 10.142 12.090 1.00 51.15 H new ATOM 0 HD21 ASN A 115 1.231 10.219 15.572 1.00 65.44 H new ATOM 0 HD22 ASN A 115 1.674 9.384 14.080 1.00 65.44 H new ATOM 1773 N VAL A 116 -3.336 7.496 11.238 1.00 3.10 N ATOM 1774 CA VAL A 116 -3.659 6.822 9.974 1.00 63.12 C ATOM 1775 C VAL A 116 -4.728 7.580 9.158 1.00 72.01 C ATOM 1776 O VAL A 116 -5.873 7.743 9.590 1.00 60.12 O ATOM 1777 CB VAL A 116 -4.111 5.355 10.220 1.00 65.55 C ATOM 1778 CG1 VAL A 116 -5.264 5.290 11.219 1.00 41.24 C ATOM 1779 CG2 VAL A 116 -4.485 4.665 8.903 1.00 4.12 C ATOM 0 H VAL A 116 -3.980 7.287 12.001 1.00 3.10 H new ATOM 0 HA VAL A 116 -2.742 6.814 9.385 1.00 63.12 H new ATOM 0 HB VAL A 116 -3.267 4.818 10.653 1.00 65.55 H new ATOM 0 HG11 VAL A 116 -5.557 4.251 11.369 1.00 41.24 H new ATOM 0 HG12 VAL A 116 -4.946 5.719 12.169 1.00 41.24 H new ATOM 0 HG13 VAL A 116 -6.113 5.854 10.832 1.00 41.24 H new ATOM 0 HG21 VAL A 116 -4.797 3.640 9.105 1.00 4.12 H new ATOM 0 HG22 VAL A 116 -5.303 5.207 8.428 1.00 4.12 H new ATOM 0 HG23 VAL A 116 -3.621 4.657 8.238 1.00 4.12 H new ATOM 1789 N GLN A 117 -4.334 8.051 7.974 1.00 20.52 N ATOM 1790 CA GLN A 117 -5.251 8.724 7.043 1.00 12.15 C ATOM 1791 C GLN A 117 -5.606 7.791 5.875 1.00 62.13 C ATOM 1792 O GLN A 117 -4.785 6.976 5.454 1.00 53.11 O ATOM 1793 CB GLN A 117 -4.624 10.024 6.498 1.00 10.11 C ATOM 1794 CG GLN A 117 -4.408 11.121 7.545 1.00 55.32 C ATOM 1795 CD GLN A 117 -3.337 10.794 8.576 1.00 42.23 C ATOM 1796 OE1 GLN A 117 -3.417 11.219 9.726 1.00 4.03 O ATOM 1797 NE2 GLN A 117 -2.315 10.060 8.173 1.00 12.12 N ATOM 0 H GLN A 117 -3.376 7.979 7.631 1.00 20.52 H new ATOM 0 HA GLN A 117 -6.160 8.977 7.589 1.00 12.15 H new ATOM 0 HB2 GLN A 117 -3.664 9.784 6.041 1.00 10.11 H new ATOM 0 HB3 GLN A 117 -5.264 10.416 5.708 1.00 10.11 H new ATOM 0 HG2 GLN A 117 -4.137 12.046 7.036 1.00 55.32 H new ATOM 0 HG3 GLN A 117 -5.350 11.306 8.061 1.00 55.32 H new ATOM 0 HE21 GLN A 117 -2.278 9.722 7.211 1.00 12.12 H new ATOM 0 HE22 GLN A 117 -1.563 9.831 8.824 1.00 12.12 H new ATOM 1806 N ASN A 118 -6.824 7.908 5.348 1.00 20.14 N ATOM 1807 CA ASN A 118 -7.275 7.039 4.248 1.00 30.02 C ATOM 1808 C ASN A 118 -7.476 7.826 2.938 1.00 35.11 C ATOM 1809 O ASN A 118 -8.043 8.920 2.928 1.00 40.04 O ATOM 1810 CB ASN A 118 -8.571 6.317 4.642 1.00 52.35 C ATOM 1811 CG ASN A 118 -9.680 7.276 5.025 1.00 24.04 C ATOM 1812 OD1 ASN A 118 -10.459 7.709 4.185 1.00 40.15 O ATOM 1813 ND2 ASN A 118 -9.761 7.614 6.296 1.00 54.12 N ATOM 0 H ASN A 118 -7.516 8.590 5.658 1.00 20.14 H new ATOM 0 HA ASN A 118 -6.493 6.301 4.068 1.00 30.02 H new ATOM 0 HB2 ASN A 118 -8.904 5.696 3.810 1.00 52.35 H new ATOM 0 HB3 ASN A 118 -8.370 5.648 5.478 1.00 52.35 H new ATOM 0 HD21 ASN A 118 -10.490 8.256 6.608 1.00 54.12 H new ATOM 0 HD22 ASN A 118 -9.095 7.234 6.968 1.00 54.12 H new ATOM 1820 N GLN A 119 -7.008 7.248 1.833 1.00 44.15 N ATOM 1821 CA GLN A 119 -7.117 7.859 0.501 1.00 32.22 C ATOM 1822 C GLN A 119 -7.757 6.866 -0.490 1.00 73.31 C ATOM 1823 O GLN A 119 -7.738 5.655 -0.263 1.00 2.33 O ATOM 1824 CB GLN A 119 -5.718 8.285 0.018 1.00 54.41 C ATOM 1825 CG GLN A 119 -5.708 9.067 -1.296 1.00 35.41 C ATOM 1826 CD GLN A 119 -4.308 9.421 -1.778 1.00 33.33 C ATOM 1827 OE1 GLN A 119 -4.056 9.522 -2.973 1.00 31.55 O ATOM 1828 NE2 GLN A 119 -3.389 9.630 -0.857 1.00 20.32 N ATOM 0 H GLN A 119 -6.541 6.341 1.832 1.00 44.15 H new ATOM 0 HA GLN A 119 -7.756 8.740 0.557 1.00 32.22 H new ATOM 0 HB2 GLN A 119 -5.251 8.895 0.792 1.00 54.41 H new ATOM 0 HB3 GLN A 119 -5.102 7.394 -0.100 1.00 54.41 H new ATOM 0 HG2 GLN A 119 -6.211 8.479 -2.064 1.00 35.41 H new ATOM 0 HG3 GLN A 119 -6.283 9.984 -1.169 1.00 35.41 H new ATOM 0 HE21 GLN A 119 -3.627 9.539 0.131 1.00 20.32 H new ATOM 0 HE22 GLN A 119 -2.440 9.883 -1.132 1.00 20.32 H new ATOM 1837 N LEU A 120 -8.335 7.376 -1.574 1.00 54.35 N ATOM 1838 CA LEU A 120 -8.989 6.519 -2.576 1.00 2.13 C ATOM 1839 C LEU A 120 -8.053 6.182 -3.749 1.00 21.41 C ATOM 1840 O LEU A 120 -7.554 7.075 -4.438 1.00 53.05 O ATOM 1841 CB LEU A 120 -10.259 7.201 -3.106 1.00 62.55 C ATOM 1842 CG LEU A 120 -11.364 7.430 -2.060 1.00 72.34 C ATOM 1843 CD1 LEU A 120 -12.563 8.141 -2.680 1.00 33.35 C ATOM 1844 CD2 LEU A 120 -11.791 6.105 -1.428 1.00 31.04 C ATOM 0 H LEU A 120 -8.367 8.373 -1.786 1.00 54.35 H new ATOM 0 HA LEU A 120 -9.251 5.584 -2.081 1.00 2.13 H new ATOM 0 HB2 LEU A 120 -9.983 8.164 -3.536 1.00 62.55 H new ATOM 0 HB3 LEU A 120 -10.667 6.595 -3.915 1.00 62.55 H new ATOM 0 HG LEU A 120 -10.960 8.070 -1.276 1.00 72.34 H new ATOM 0 HD11 LEU A 120 -13.330 8.291 -1.920 1.00 33.35 H new ATOM 0 HD12 LEU A 120 -12.249 9.107 -3.074 1.00 33.35 H new ATOM 0 HD13 LEU A 120 -12.968 7.533 -3.489 1.00 33.35 H new ATOM 0 HD21 LEU A 120 -12.573 6.289 -0.691 1.00 31.04 H new ATOM 0 HD22 LEU A 120 -12.171 5.438 -2.202 1.00 31.04 H new ATOM 0 HD23 LEU A 120 -10.934 5.642 -0.939 1.00 31.04 H new ATOM 1856 N ILE A 121 -7.826 4.888 -3.982 1.00 61.33 N ATOM 1857 CA ILE A 121 -7.004 4.432 -5.114 1.00 35.03 C ATOM 1858 C ILE A 121 -7.876 3.943 -6.285 1.00 10.12 C ATOM 1859 O ILE A 121 -8.484 2.872 -6.224 1.00 13.14 O ATOM 1860 CB ILE A 121 -6.000 3.313 -4.702 1.00 5.52 C ATOM 1861 CG1 ILE A 121 -6.706 2.168 -3.955 1.00 64.54 C ATOM 1862 CG2 ILE A 121 -4.875 3.893 -3.852 1.00 23.30 C ATOM 1863 CD1 ILE A 121 -5.787 1.023 -3.574 1.00 1.24 C ATOM 0 H ILE A 121 -8.198 4.134 -3.404 1.00 61.33 H new ATOM 0 HA ILE A 121 -6.429 5.299 -5.440 1.00 35.03 H new ATOM 0 HB ILE A 121 -5.572 2.898 -5.615 1.00 5.52 H new ATOM 0 HG12 ILE A 121 -7.167 2.567 -3.051 1.00 64.54 H new ATOM 0 HG13 ILE A 121 -7.511 1.782 -4.580 1.00 64.54 H new ATOM 0 HG21 ILE A 121 -4.183 3.098 -3.573 1.00 23.30 H new ATOM 0 HG22 ILE A 121 -4.343 4.654 -4.423 1.00 23.30 H new ATOM 0 HG23 ILE A 121 -5.294 4.342 -2.951 1.00 23.30 H new ATOM 0 HD11 ILE A 121 -6.359 0.256 -3.051 1.00 1.24 H new ATOM 0 HD12 ILE A 121 -5.345 0.596 -4.474 1.00 1.24 H new ATOM 0 HD13 ILE A 121 -4.996 1.393 -2.922 1.00 1.24 H new ATOM 1875 N ASN A 122 -7.956 4.751 -7.339 1.00 24.02 N ATOM 1876 CA ASN A 122 -8.686 4.383 -8.557 1.00 41.32 C ATOM 1877 C ASN A 122 -7.703 4.140 -9.711 1.00 44.44 C ATOM 1878 O ASN A 122 -6.961 5.042 -10.103 1.00 13.54 O ATOM 1879 CB ASN A 122 -9.679 5.493 -8.938 1.00 11.13 C ATOM 1880 CG ASN A 122 -10.710 5.752 -7.854 1.00 55.15 C ATOM 1881 OD1 ASN A 122 -10.500 6.557 -6.955 1.00 31.42 O ATOM 1882 ND2 ASN A 122 -11.844 5.087 -7.943 1.00 52.44 N ATOM 0 H ASN A 122 -7.522 5.673 -7.377 1.00 24.02 H new ATOM 0 HA ASN A 122 -9.241 3.464 -8.366 1.00 41.32 H new ATOM 0 HB2 ASN A 122 -9.130 6.413 -9.139 1.00 11.13 H new ATOM 0 HB3 ASN A 122 -10.189 5.218 -9.861 1.00 11.13 H new ATOM 0 HD21 ASN A 122 -12.578 5.236 -7.251 1.00 52.44 H new ATOM 0 HD22 ASN A 122 -11.988 4.423 -8.704 1.00 52.44 H new ATOM 1889 N ALA A 123 -7.696 2.923 -10.252 1.00 34.05 N ATOM 1890 CA ALA A 123 -6.757 2.554 -11.320 1.00 65.30 C ATOM 1891 C ALA A 123 -7.483 2.262 -12.646 1.00 11.05 C ATOM 1892 O ALA A 123 -8.488 1.541 -12.669 1.00 53.41 O ATOM 1893 CB ALA A 123 -5.927 1.346 -10.891 1.00 63.05 C ATOM 0 H ALA A 123 -8.328 2.173 -9.971 1.00 34.05 H new ATOM 0 HA ALA A 123 -6.096 3.404 -11.491 1.00 65.30 H new ATOM 0 HB1 ALA A 123 -5.234 1.079 -11.689 1.00 63.05 H new ATOM 0 HB2 ALA A 123 -5.366 1.592 -9.989 1.00 63.05 H new ATOM 0 HB3 ALA A 123 -6.588 0.504 -10.688 1.00 63.05 H new ATOM 1899 N PRO A 124 -6.985 2.822 -13.772 1.00 64.30 N ATOM 1900 CA PRO A 124 -7.577 2.611 -15.111 1.00 34.32 C ATOM 1901 C PRO A 124 -7.499 1.147 -15.586 1.00 44.04 C ATOM 1902 O PRO A 124 -6.675 0.364 -15.107 1.00 74.00 O ATOM 1903 CB PRO A 124 -6.736 3.521 -16.032 1.00 25.23 C ATOM 1904 CG PRO A 124 -6.047 4.476 -15.114 1.00 65.33 C ATOM 1905 CD PRO A 124 -5.816 3.718 -13.835 1.00 24.31 C ATOM 0 HA PRO A 124 -8.642 2.844 -15.112 1.00 34.32 H new ATOM 0 HB2 PRO A 124 -6.016 2.940 -16.609 1.00 25.23 H new ATOM 0 HB3 PRO A 124 -7.367 4.048 -16.748 1.00 25.23 H new ATOM 0 HG2 PRO A 124 -5.105 4.819 -15.541 1.00 65.33 H new ATOM 0 HG3 PRO A 124 -6.659 5.361 -14.939 1.00 65.33 H new ATOM 0 HD2 PRO A 124 -4.880 3.161 -13.858 1.00 24.31 H new ATOM 0 HD3 PRO A 124 -5.769 4.383 -12.973 1.00 24.31 H new ATOM 1913 N ALA A 125 -8.345 0.793 -16.553 1.00 53.25 N ATOM 1914 CA ALA A 125 -8.401 -0.578 -17.080 1.00 3.31 C ATOM 1915 C ALA A 125 -7.141 -0.942 -17.882 1.00 0.32 C ATOM 1916 O ALA A 125 -6.530 -0.084 -18.528 1.00 4.12 O ATOM 1917 CB ALA A 125 -9.642 -0.749 -17.950 1.00 24.21 C ATOM 0 H ALA A 125 -9.005 1.436 -16.991 1.00 53.25 H new ATOM 0 HA ALA A 125 -8.452 -1.256 -16.228 1.00 3.31 H new ATOM 0 HB1 ALA A 125 -9.677 -1.767 -18.337 1.00 24.21 H new ATOM 0 HB2 ALA A 125 -10.534 -0.556 -17.354 1.00 24.21 H new ATOM 0 HB3 ALA A 125 -9.603 -0.046 -18.782 1.00 24.21 H new ATOM 1923 N SER A 126 -6.757 -2.216 -17.833 1.00 61.20 N ATOM 1924 CA SER A 126 -5.606 -2.716 -18.596 1.00 20.51 C ATOM 1925 C SER A 126 -6.038 -3.142 -20.004 1.00 60.33 C ATOM 1926 O SER A 126 -6.942 -3.965 -20.165 1.00 50.51 O ATOM 1927 CB SER A 126 -4.953 -3.902 -17.872 1.00 42.01 C ATOM 1928 OG SER A 126 -3.813 -4.374 -18.574 1.00 15.45 O ATOM 0 H SER A 126 -7.226 -2.927 -17.271 1.00 61.20 H new ATOM 0 HA SER A 126 -4.878 -1.909 -18.679 1.00 20.51 H new ATOM 0 HB2 SER A 126 -4.663 -3.601 -16.865 1.00 42.01 H new ATOM 0 HB3 SER A 126 -5.677 -4.710 -17.767 1.00 42.01 H new ATOM 0 HG SER A 126 -3.632 -5.302 -18.317 1.00 15.45 H new ATOM 1934 N VAL A 127 -5.396 -2.578 -21.021 1.00 65.33 N ATOM 1935 CA VAL A 127 -5.769 -2.843 -22.416 1.00 10.12 C ATOM 1936 C VAL A 127 -4.996 -4.038 -22.994 1.00 24.24 C ATOM 1937 O VAL A 127 -5.527 -4.805 -23.803 1.00 24.25 O ATOM 1938 CB VAL A 127 -5.521 -1.592 -23.300 1.00 0.13 C ATOM 1939 CG1 VAL A 127 -5.901 -1.855 -24.759 1.00 72.00 C ATOM 1940 CG2 VAL A 127 -6.287 -0.385 -22.751 1.00 21.32 C ATOM 0 H VAL A 127 -4.613 -1.933 -20.911 1.00 65.33 H new ATOM 0 HA VAL A 127 -6.832 -3.085 -22.421 1.00 10.12 H new ATOM 0 HB VAL A 127 -4.454 -1.369 -23.270 1.00 0.13 H new ATOM 0 HG11 VAL A 127 -5.715 -0.959 -25.351 1.00 72.00 H new ATOM 0 HG12 VAL A 127 -5.301 -2.678 -25.148 1.00 72.00 H new ATOM 0 HG13 VAL A 127 -6.958 -2.116 -24.818 1.00 72.00 H new ATOM 0 HG21 VAL A 127 -6.101 0.483 -23.384 1.00 21.32 H new ATOM 0 HG22 VAL A 127 -7.355 -0.605 -22.742 1.00 21.32 H new ATOM 0 HG23 VAL A 127 -5.952 -0.172 -21.736 1.00 21.32 H new ATOM 1950 N LEU A 128 -3.741 -4.194 -22.574 1.00 32.11 N ATOM 1951 CA LEU A 128 -2.876 -5.268 -23.079 1.00 25.23 C ATOM 1952 C LEU A 128 -2.286 -6.108 -21.933 1.00 35.21 C ATOM 1953 O LEU A 128 -2.709 -5.993 -20.782 1.00 62.44 O ATOM 1954 CB LEU A 128 -1.747 -4.668 -23.937 1.00 71.23 C ATOM 1955 CG LEU A 128 -2.210 -3.934 -25.209 1.00 42.35 C ATOM 1956 CD1 LEU A 128 -1.022 -3.333 -25.954 1.00 22.44 C ATOM 1957 CD2 LEU A 128 -2.996 -4.878 -26.122 1.00 25.31 C ATOM 0 H LEU A 128 -3.296 -3.590 -21.883 1.00 32.11 H new ATOM 0 HA LEU A 128 -3.485 -5.932 -23.693 1.00 25.23 H new ATOM 0 HB2 LEU A 128 -1.176 -3.972 -23.323 1.00 71.23 H new ATOM 0 HB3 LEU A 128 -1.067 -5.469 -24.226 1.00 71.23 H new ATOM 0 HG LEU A 128 -2.869 -3.120 -24.908 1.00 42.35 H new ATOM 0 HD11 LEU A 128 -1.375 -2.820 -26.849 1.00 22.44 H new ATOM 0 HD12 LEU A 128 -0.509 -2.622 -25.307 1.00 22.44 H new ATOM 0 HD13 LEU A 128 -0.332 -4.127 -26.240 1.00 22.44 H new ATOM 0 HD21 LEU A 128 -3.314 -4.340 -27.015 1.00 25.31 H new ATOM 0 HD22 LEU A 128 -2.362 -5.717 -26.410 1.00 25.31 H new ATOM 0 HD23 LEU A 128 -3.872 -5.251 -25.592 1.00 25.31 H new ATOM 1969 N ALA A 129 -1.315 -6.963 -22.260 1.00 24.52 N ATOM 1970 CA ALA A 129 -0.670 -7.840 -21.269 1.00 23.54 C ATOM 1971 C ALA A 129 0.851 -7.594 -21.207 1.00 33.21 C ATOM 1972 O ALA A 129 1.465 -7.226 -22.209 1.00 21.23 O ATOM 1973 CB ALA A 129 -0.958 -9.301 -21.610 1.00 22.41 C ATOM 0 H ALA A 129 -0.953 -7.070 -23.208 1.00 24.52 H new ATOM 0 HA ALA A 129 -1.083 -7.609 -20.287 1.00 23.54 H new ATOM 0 HB1 ALA A 129 -0.479 -9.947 -20.875 1.00 22.41 H new ATOM 0 HB2 ALA A 129 -2.034 -9.472 -21.597 1.00 22.41 H new ATOM 0 HB3 ALA A 129 -0.566 -9.527 -22.602 1.00 22.41 H new ATOM 1979 N PRO A 130 1.493 -7.795 -20.034 1.00 70.41 N ATOM 1980 CA PRO A 130 0.823 -8.212 -18.788 1.00 73.33 C ATOM 1981 C PRO A 130 0.181 -7.039 -18.018 1.00 54.35 C ATOM 1982 O PRO A 130 0.687 -5.912 -18.038 1.00 21.14 O ATOM 1983 CB PRO A 130 1.978 -8.818 -17.985 1.00 45.53 C ATOM 1984 CG PRO A 130 3.173 -8.028 -18.397 1.00 71.34 C ATOM 1985 CD PRO A 130 2.952 -7.639 -19.842 1.00 51.24 C ATOM 0 HA PRO A 130 -0.009 -8.891 -18.975 1.00 73.33 H new ATOM 0 HB2 PRO A 130 1.800 -8.739 -16.912 1.00 45.53 H new ATOM 0 HB3 PRO A 130 2.105 -9.877 -18.210 1.00 45.53 H new ATOM 0 HG2 PRO A 130 3.289 -7.144 -17.770 1.00 71.34 H new ATOM 0 HG3 PRO A 130 4.084 -8.617 -18.288 1.00 71.34 H new ATOM 0 HD2 PRO A 130 3.273 -6.615 -20.034 1.00 51.24 H new ATOM 0 HD3 PRO A 130 3.515 -8.281 -20.519 1.00 51.24 H new ATOM 1993 N SER A 131 -0.937 -7.315 -17.339 1.00 75.22 N ATOM 1994 CA SER A 131 -1.639 -6.295 -16.540 1.00 54.43 C ATOM 1995 C SER A 131 -0.805 -5.825 -15.340 1.00 21.53 C ATOM 1996 O SER A 131 -0.965 -6.311 -14.217 1.00 11.40 O ATOM 1997 CB SER A 131 -3.000 -6.817 -16.058 1.00 1.21 C ATOM 1998 OG SER A 131 -3.868 -7.082 -17.149 1.00 70.42 O ATOM 0 H SER A 131 -1.378 -8.235 -17.324 1.00 75.22 H new ATOM 0 HA SER A 131 -1.796 -5.437 -17.194 1.00 54.43 H new ATOM 0 HB2 SER A 131 -2.857 -7.727 -15.475 1.00 1.21 H new ATOM 0 HB3 SER A 131 -3.459 -6.083 -15.395 1.00 1.21 H new ATOM 0 HG SER A 131 -4.236 -7.986 -17.062 1.00 70.42 H new ATOM 2004 N ASP A 132 0.100 -4.891 -15.604 1.00 3.34 N ATOM 2005 CA ASP A 132 0.914 -4.255 -14.566 1.00 62.34 C ATOM 2006 C ASP A 132 0.567 -2.760 -14.494 1.00 42.10 C ATOM 2007 O ASP A 132 1.105 -1.946 -15.249 1.00 21.43 O ATOM 2008 CB ASP A 132 2.406 -4.463 -14.876 1.00 65.31 C ATOM 2009 CG ASP A 132 3.322 -3.901 -13.800 1.00 61.01 C ATOM 2010 OD1 ASP A 132 3.688 -2.709 -13.885 1.00 23.42 O ATOM 2011 OD2 ASP A 132 3.698 -4.651 -12.877 1.00 1.51 O ATOM 0 H ASP A 132 0.294 -4.550 -16.545 1.00 3.34 H new ATOM 0 HA ASP A 132 0.703 -4.708 -13.597 1.00 62.34 H new ATOM 0 HB2 ASP A 132 2.602 -5.529 -14.991 1.00 65.31 H new ATOM 0 HB3 ASP A 132 2.642 -3.990 -15.829 1.00 65.31 H new ATOM 2016 N VAL A 133 -0.364 -2.408 -13.610 1.00 20.50 N ATOM 2017 CA VAL A 133 -0.901 -1.042 -13.551 1.00 62.44 C ATOM 2018 C VAL A 133 -0.364 -0.271 -12.340 1.00 15.55 C ATOM 2019 O VAL A 133 -0.761 -0.527 -11.209 1.00 14.51 O ATOM 2020 CB VAL A 133 -2.453 -1.053 -13.494 1.00 24.04 C ATOM 2021 CG1 VAL A 133 -3.013 0.372 -13.478 1.00 44.42 C ATOM 2022 CG2 VAL A 133 -3.029 -1.855 -14.661 1.00 14.52 C ATOM 0 H VAL A 133 -0.765 -3.047 -12.923 1.00 20.50 H new ATOM 0 HA VAL A 133 -0.573 -0.540 -14.461 1.00 62.44 H new ATOM 0 HB VAL A 133 -2.755 -1.539 -12.566 1.00 24.04 H new ATOM 0 HG11 VAL A 133 -4.102 0.335 -13.438 1.00 44.42 H new ATOM 0 HG12 VAL A 133 -2.636 0.901 -12.603 1.00 44.42 H new ATOM 0 HG13 VAL A 133 -2.701 0.896 -14.382 1.00 44.42 H new ATOM 0 HG21 VAL A 133 -4.117 -1.851 -14.603 1.00 14.52 H new ATOM 0 HG22 VAL A 133 -2.714 -1.405 -15.602 1.00 14.52 H new ATOM 0 HG23 VAL A 133 -2.667 -2.882 -14.611 1.00 14.52 H new ATOM 2032 N ASP A 134 0.554 0.660 -12.577 1.00 52.22 N ATOM 2033 CA ASP A 134 1.062 1.524 -11.508 1.00 62.40 C ATOM 2034 C ASP A 134 0.335 2.881 -11.483 1.00 13.22 C ATOM 2035 O ASP A 134 -0.014 3.434 -12.529 1.00 14.30 O ATOM 2036 CB ASP A 134 2.575 1.724 -11.654 1.00 23.25 C ATOM 2037 CG ASP A 134 2.982 2.209 -13.033 1.00 44.34 C ATOM 2038 OD1 ASP A 134 3.051 1.376 -13.959 1.00 31.15 O ATOM 2039 OD2 ASP A 134 3.249 3.416 -13.197 1.00 53.02 O ATOM 0 H ASP A 134 0.962 0.838 -13.494 1.00 52.22 H new ATOM 0 HA ASP A 134 0.865 1.028 -10.558 1.00 62.40 H new ATOM 0 HB2 ASP A 134 2.914 2.443 -10.908 1.00 23.25 H new ATOM 0 HB3 ASP A 134 3.082 0.782 -11.443 1.00 23.25 H new ATOM 2044 N ILE A 135 0.098 3.403 -10.278 1.00 31.44 N ATOM 2045 CA ILE A 135 -0.560 4.706 -10.100 1.00 0.21 C ATOM 2046 C ILE A 135 0.157 5.556 -9.029 1.00 1.12 C ATOM 2047 O ILE A 135 0.530 5.050 -7.969 1.00 30.53 O ATOM 2048 CB ILE A 135 -2.059 4.547 -9.715 1.00 61.32 C ATOM 2049 CG1 ILE A 135 -2.220 3.566 -8.539 1.00 75.13 C ATOM 2050 CG2 ILE A 135 -2.884 4.093 -10.920 1.00 23.30 C ATOM 2051 CD1 ILE A 135 -3.652 3.405 -8.066 1.00 2.31 C ATOM 0 H ILE A 135 0.352 2.943 -9.404 1.00 31.44 H new ATOM 0 HA ILE A 135 -0.500 5.218 -11.060 1.00 0.21 H new ATOM 0 HB ILE A 135 -2.433 5.520 -9.397 1.00 61.32 H new ATOM 0 HG12 ILE A 135 -1.834 2.591 -8.836 1.00 75.13 H new ATOM 0 HG13 ILE A 135 -1.609 3.910 -7.705 1.00 75.13 H new ATOM 0 HG21 ILE A 135 -3.929 3.989 -10.627 1.00 23.30 H new ATOM 0 HG22 ILE A 135 -2.803 4.833 -11.716 1.00 23.30 H new ATOM 0 HG23 ILE A 135 -2.509 3.134 -11.277 1.00 23.30 H new ATOM 0 HD11 ILE A 135 -3.684 2.699 -7.236 1.00 2.31 H new ATOM 0 HD12 ILE A 135 -4.037 4.370 -7.736 1.00 2.31 H new ATOM 0 HD13 ILE A 135 -4.266 3.030 -8.885 1.00 2.31 H new ATOM 2063 N PRO A 136 0.373 6.860 -9.299 1.00 52.22 N ATOM 2064 CA PRO A 136 1.051 7.771 -8.360 1.00 21.14 C ATOM 2065 C PRO A 136 0.154 8.197 -7.180 1.00 73.41 C ATOM 2066 O PRO A 136 -0.877 8.843 -7.370 1.00 12.04 O ATOM 2067 CB PRO A 136 1.413 8.993 -9.233 1.00 25.31 C ATOM 2068 CG PRO A 136 1.063 8.610 -10.640 1.00 75.13 C ATOM 2069 CD PRO A 136 -0.003 7.558 -10.534 1.00 71.30 C ATOM 0 HA PRO A 136 1.912 7.292 -7.894 1.00 21.14 H new ATOM 0 HB2 PRO A 136 0.857 9.876 -8.919 1.00 25.31 H new ATOM 0 HB3 PRO A 136 2.472 9.235 -9.146 1.00 25.31 H new ATOM 0 HG2 PRO A 136 0.704 9.473 -11.201 1.00 75.13 H new ATOM 0 HG3 PRO A 136 1.936 8.228 -11.168 1.00 75.13 H new ATOM 0 HD2 PRO A 136 -1.000 7.994 -10.468 1.00 71.30 H new ATOM 0 HD3 PRO A 136 -0.003 6.890 -11.395 1.00 71.30 H new ATOM 2077 N LEU A 137 0.555 7.830 -5.966 1.00 11.42 N ATOM 2078 CA LEU A 137 -0.182 8.203 -4.751 1.00 62.44 C ATOM 2079 C LEU A 137 0.412 9.443 -4.071 1.00 2.32 C ATOM 2080 O LEU A 137 1.523 9.403 -3.541 1.00 31.10 O ATOM 2081 CB LEU A 137 -0.205 7.031 -3.757 1.00 52.30 C ATOM 2082 CG LEU A 137 -1.169 5.897 -4.116 1.00 52.43 C ATOM 2083 CD1 LEU A 137 -1.117 4.787 -3.067 1.00 51.41 C ATOM 2084 CD2 LEU A 137 -2.584 6.444 -4.258 1.00 61.31 C ATOM 0 H LEU A 137 1.390 7.271 -5.792 1.00 11.42 H new ATOM 0 HA LEU A 137 -1.200 8.445 -5.057 1.00 62.44 H new ATOM 0 HB2 LEU A 137 0.802 6.621 -3.679 1.00 52.30 H new ATOM 0 HB3 LEU A 137 -0.470 7.415 -2.772 1.00 52.30 H new ATOM 0 HG LEU A 137 -0.864 5.467 -5.070 1.00 52.43 H new ATOM 0 HD11 LEU A 137 -1.810 3.992 -3.343 1.00 51.41 H new ATOM 0 HD12 LEU A 137 -0.106 4.384 -3.014 1.00 51.41 H new ATOM 0 HD13 LEU A 137 -1.398 5.192 -2.095 1.00 51.41 H new ATOM 0 HD21 LEU A 137 -3.264 5.632 -4.513 1.00 61.31 H new ATOM 0 HD22 LEU A 137 -2.896 6.896 -3.316 1.00 61.31 H new ATOM 0 HD23 LEU A 137 -2.606 7.197 -5.046 1.00 61.31 H new ATOM 2096 N GLN A 138 -0.337 10.538 -4.087 1.00 2.43 N ATOM 2097 CA GLN A 138 0.056 11.756 -3.377 1.00 51.32 C ATOM 2098 C GLN A 138 -0.523 11.745 -1.952 1.00 62.14 C ATOM 2099 O GLN A 138 -1.656 12.171 -1.722 1.00 40.43 O ATOM 2100 CB GLN A 138 -0.418 12.997 -4.150 1.00 22.15 C ATOM 2101 CG GLN A 138 0.060 14.316 -3.555 1.00 12.25 C ATOM 2102 CD GLN A 138 -0.419 15.524 -4.343 1.00 55.32 C ATOM 2103 OE1 GLN A 138 -1.476 15.498 -4.964 1.00 54.45 O ATOM 2104 NE2 GLN A 138 0.350 16.592 -4.325 1.00 62.44 N ATOM 0 H GLN A 138 -1.224 10.611 -4.585 1.00 2.43 H new ATOM 0 HA GLN A 138 1.143 11.792 -3.307 1.00 51.32 H new ATOM 0 HB2 GLN A 138 -0.068 12.927 -5.180 1.00 22.15 H new ATOM 0 HB3 GLN A 138 -1.508 12.998 -4.183 1.00 22.15 H new ATOM 0 HG2 GLN A 138 -0.293 14.395 -2.527 1.00 12.25 H new ATOM 0 HG3 GLN A 138 1.149 14.320 -3.519 1.00 12.25 H new ATOM 0 HE21 GLN A 138 1.224 16.582 -3.799 1.00 62.44 H new ATOM 0 HE22 GLN A 138 0.072 17.429 -4.837 1.00 62.44 H new ATOM 2113 N LEU A 139 0.244 11.207 -1.008 1.00 11.45 N ATOM 2114 CA LEU A 139 -0.208 11.072 0.382 1.00 63.44 C ATOM 2115 C LEU A 139 -0.144 12.418 1.122 1.00 43.24 C ATOM 2116 O LEU A 139 0.826 13.162 0.984 1.00 11.01 O ATOM 2117 CB LEU A 139 0.642 10.020 1.105 1.00 33.44 C ATOM 2118 CG LEU A 139 0.695 8.646 0.414 1.00 25.02 C ATOM 2119 CD1 LEU A 139 1.568 7.672 1.199 1.00 54.03 C ATOM 2120 CD2 LEU A 139 -0.710 8.078 0.222 1.00 42.10 C ATOM 0 H LEU A 139 1.186 10.855 -1.177 1.00 11.45 H new ATOM 0 HA LEU A 139 -1.249 10.748 0.375 1.00 63.44 H new ATOM 0 HB2 LEU A 139 1.659 10.400 1.204 1.00 33.44 H new ATOM 0 HB3 LEU A 139 0.251 9.889 2.114 1.00 33.44 H new ATOM 0 HG LEU A 139 1.143 8.784 -0.570 1.00 25.02 H new ATOM 0 HD11 LEU A 139 1.588 6.709 0.689 1.00 54.03 H new ATOM 0 HD12 LEU A 139 2.582 8.067 1.269 1.00 54.03 H new ATOM 0 HD13 LEU A 139 1.159 7.543 2.201 1.00 54.03 H new ATOM 0 HD21 LEU A 139 -0.646 7.107 -0.268 1.00 42.10 H new ATOM 0 HD22 LEU A 139 -1.192 7.963 1.193 1.00 42.10 H new ATOM 0 HD23 LEU A 139 -1.296 8.758 -0.396 1.00 42.10 H new ATOM 2132 N LYS A 140 -1.175 12.719 1.913 1.00 42.34 N ATOM 2133 CA LYS A 140 -1.306 14.037 2.556 1.00 3.50 C ATOM 2134 C LYS A 140 -1.039 13.975 4.071 1.00 71.13 C ATOM 2135 O LYS A 140 -1.519 13.074 4.761 1.00 51.21 O ATOM 2136 CB LYS A 140 -2.717 14.597 2.316 1.00 64.31 C ATOM 2137 CG LYS A 140 -3.153 14.613 0.850 1.00 53.40 C ATOM 2138 CD LYS A 140 -2.236 15.471 -0.019 1.00 24.33 C ATOM 2139 CE LYS A 140 -2.720 15.535 -1.466 1.00 13.21 C ATOM 2140 NZ LYS A 140 -4.043 16.205 -1.592 1.00 24.11 N ATOM 0 H LYS A 140 -1.934 12.071 2.127 1.00 42.34 H new ATOM 0 HA LYS A 140 -0.556 14.690 2.109 1.00 3.50 H new ATOM 0 HB2 LYS A 140 -3.431 14.004 2.888 1.00 64.31 H new ATOM 0 HB3 LYS A 140 -2.762 15.614 2.706 1.00 64.31 H new ATOM 0 HG2 LYS A 140 -3.164 13.593 0.466 1.00 53.40 H new ATOM 0 HG3 LYS A 140 -4.173 14.991 0.781 1.00 53.40 H new ATOM 0 HD2 LYS A 140 -2.185 16.479 0.392 1.00 24.33 H new ATOM 0 HD3 LYS A 140 -1.225 15.064 0.008 1.00 24.33 H new ATOM 0 HE2 LYS A 140 -1.986 16.070 -2.069 1.00 13.21 H new ATOM 0 HE3 LYS A 140 -2.788 14.524 -1.869 1.00 13.21 H new ATOM 0 HZ1 LYS A 140 -4.244 16.391 -2.595 1.00 24.11 H new ATOM 0 HZ2 LYS A 140 -4.783 15.589 -1.200 1.00 24.11 H new ATOM 0 HZ3 LYS A 140 -4.028 17.104 -1.069 1.00 24.11 H new ATOM 2154 N GLY A 141 -0.270 14.942 4.579 1.00 61.11 N ATOM 2155 CA GLY A 141 -0.083 15.089 6.023 1.00 1.42 C ATOM 2156 C GLY A 141 0.896 14.092 6.642 1.00 13.14 C ATOM 2157 O GLY A 141 0.919 13.917 7.863 1.00 42.25 O ATOM 0 H GLY A 141 0.230 15.630 4.015 1.00 61.11 H new ATOM 0 HA2 GLY A 141 0.269 16.100 6.230 1.00 1.42 H new ATOM 0 HA3 GLY A 141 -1.050 14.981 6.514 1.00 1.42 H new ATOM 2161 N ILE A 142 1.721 13.452 5.814 1.00 62.31 N ATOM 2162 CA ILE A 142 2.685 12.461 6.311 1.00 10.34 C ATOM 2163 C ILE A 142 3.973 12.450 5.468 1.00 20.25 C ATOM 2164 O ILE A 142 3.931 12.384 4.237 1.00 63.10 O ATOM 2165 CB ILE A 142 2.057 11.038 6.338 1.00 33.11 C ATOM 2166 CG1 ILE A 142 2.998 10.036 7.028 1.00 15.02 C ATOM 2167 CG2 ILE A 142 1.710 10.573 4.923 1.00 41.22 C ATOM 2168 CD1 ILE A 142 2.373 8.676 7.264 1.00 0.40 C ATOM 0 H ILE A 142 1.745 13.597 4.805 1.00 62.31 H new ATOM 0 HA ILE A 142 2.946 12.751 7.329 1.00 10.34 H new ATOM 0 HB ILE A 142 1.134 11.086 6.916 1.00 33.11 H new ATOM 0 HG12 ILE A 142 3.894 9.914 6.419 1.00 15.02 H new ATOM 0 HG13 ILE A 142 3.317 10.450 7.984 1.00 15.02 H new ATOM 0 HG21 ILE A 142 1.272 9.576 4.965 1.00 41.22 H new ATOM 0 HG22 ILE A 142 0.995 11.265 4.478 1.00 41.22 H new ATOM 0 HG23 ILE A 142 2.615 10.547 4.316 1.00 41.22 H new ATOM 0 HD11 ILE A 142 3.096 8.023 7.754 1.00 0.40 H new ATOM 0 HD12 ILE A 142 1.494 8.785 7.899 1.00 0.40 H new ATOM 0 HD13 ILE A 142 2.079 8.240 6.309 1.00 0.40 H new ATOM 2180 N SER A 143 5.121 12.532 6.138 1.00 11.54 N ATOM 2181 CA SER A 143 6.424 12.507 5.456 1.00 54.23 C ATOM 2182 C SER A 143 6.991 11.085 5.362 1.00 72.15 C ATOM 2183 O SER A 143 6.649 10.212 6.161 1.00 71.12 O ATOM 2184 CB SER A 143 7.437 13.399 6.184 1.00 43.24 C ATOM 2185 OG SER A 143 8.727 13.283 5.601 1.00 54.55 O ATOM 0 H SER A 143 5.181 12.616 7.153 1.00 11.54 H new ATOM 0 HA SER A 143 6.258 12.885 4.447 1.00 54.23 H new ATOM 0 HB2 SER A 143 7.108 14.437 6.144 1.00 43.24 H new ATOM 0 HB3 SER A 143 7.483 13.120 7.237 1.00 43.24 H new ATOM 0 HG SER A 143 9.356 13.862 6.080 1.00 54.55 H new ATOM 2191 N VAL A 144 7.875 10.873 4.389 1.00 65.25 N ATOM 2192 CA VAL A 144 8.547 9.581 4.194 1.00 52.12 C ATOM 2193 C VAL A 144 9.284 9.122 5.470 1.00 5.03 C ATOM 2194 O VAL A 144 9.358 7.928 5.769 1.00 32.30 O ATOM 2195 CB VAL A 144 9.542 9.660 3.006 1.00 75.24 C ATOM 2196 CG1 VAL A 144 10.610 10.729 3.249 1.00 33.44 C ATOM 2197 CG2 VAL A 144 10.178 8.298 2.727 1.00 72.41 C ATOM 0 H VAL A 144 8.148 11.587 3.713 1.00 65.25 H new ATOM 0 HA VAL A 144 7.777 8.844 3.968 1.00 52.12 H new ATOM 0 HB VAL A 144 8.978 9.951 2.120 1.00 75.24 H new ATOM 0 HG11 VAL A 144 11.293 10.761 2.400 1.00 33.44 H new ATOM 0 HG12 VAL A 144 10.131 11.701 3.367 1.00 33.44 H new ATOM 0 HG13 VAL A 144 11.168 10.487 4.154 1.00 33.44 H new ATOM 0 HG21 VAL A 144 10.870 8.384 1.890 1.00 72.41 H new ATOM 0 HG22 VAL A 144 10.719 7.961 3.611 1.00 72.41 H new ATOM 0 HG23 VAL A 144 9.399 7.576 2.481 1.00 72.41 H new ATOM 2207 N ASP A 145 9.814 10.083 6.224 1.00 23.14 N ATOM 2208 CA ASP A 145 10.482 9.800 7.501 1.00 51.33 C ATOM 2209 C ASP A 145 9.502 9.232 8.543 1.00 11.13 C ATOM 2210 O ASP A 145 9.879 8.427 9.394 1.00 41.50 O ATOM 2211 CB ASP A 145 11.121 11.084 8.036 1.00 3.54 C ATOM 2212 CG ASP A 145 11.714 10.917 9.424 1.00 10.33 C ATOM 2213 OD1 ASP A 145 12.746 10.230 9.555 1.00 21.42 O ATOM 2214 OD2 ASP A 145 11.146 11.471 10.390 1.00 50.45 O ATOM 0 H ASP A 145 9.795 11.072 5.974 1.00 23.14 H new ATOM 0 HA ASP A 145 11.249 9.046 7.322 1.00 51.33 H new ATOM 0 HB2 ASP A 145 11.903 11.408 7.349 1.00 3.54 H new ATOM 0 HB3 ASP A 145 10.371 11.874 8.060 1.00 3.54 H new ATOM 2219 N GLN A 146 8.244 9.656 8.461 1.00 73.32 N ATOM 2220 CA GLN A 146 7.220 9.285 9.445 1.00 52.41 C ATOM 2221 C GLN A 146 6.169 8.338 8.847 1.00 4.33 C ATOM 2222 O GLN A 146 5.079 8.176 9.397 1.00 74.14 O ATOM 2223 CB GLN A 146 6.555 10.560 9.986 1.00 72.42 C ATOM 2224 CG GLN A 146 7.499 11.415 10.823 1.00 14.51 C ATOM 2225 CD GLN A 146 7.860 10.763 12.150 1.00 12.43 C ATOM 2226 OE1 GLN A 146 7.048 10.074 12.761 1.00 71.04 O ATOM 2227 NE2 GLN A 146 9.089 10.942 12.591 1.00 52.04 N ATOM 0 H GLN A 146 7.902 10.264 7.716 1.00 73.32 H new ATOM 0 HA GLN A 146 7.704 8.748 10.261 1.00 52.41 H new ATOM 0 HB2 GLN A 146 6.183 11.152 9.150 1.00 72.42 H new ATOM 0 HB3 GLN A 146 5.691 10.284 10.591 1.00 72.42 H new ATOM 0 HG2 GLN A 146 8.410 11.604 10.256 1.00 14.51 H new ATOM 0 HG3 GLN A 146 7.035 12.383 11.013 1.00 14.51 H new ATOM 0 HE21 GLN A 146 9.742 11.520 12.062 1.00 52.04 H new ATOM 0 HE22 GLN A 146 9.387 10.502 13.462 1.00 52.04 H new ATOM 2236 N LEU A 147 6.506 7.705 7.729 1.00 32.54 N ATOM 2237 CA LEU A 147 5.609 6.741 7.088 1.00 62.21 C ATOM 2238 C LEU A 147 5.727 5.357 7.753 1.00 71.03 C ATOM 2239 O LEU A 147 6.723 4.650 7.574 1.00 24.34 O ATOM 2240 CB LEU A 147 5.914 6.652 5.577 1.00 61.54 C ATOM 2241 CG LEU A 147 4.745 7.023 4.645 1.00 44.03 C ATOM 2242 CD1 LEU A 147 5.175 6.963 3.183 1.00 34.12 C ATOM 2243 CD2 LEU A 147 3.538 6.114 4.892 1.00 41.24 C ATOM 0 H LEU A 147 7.394 7.840 7.245 1.00 32.54 H new ATOM 0 HA LEU A 147 4.583 7.086 7.214 1.00 62.21 H new ATOM 0 HB2 LEU A 147 6.756 7.307 5.354 1.00 61.54 H new ATOM 0 HB3 LEU A 147 6.232 5.635 5.347 1.00 61.54 H new ATOM 0 HG LEU A 147 4.449 8.048 4.870 1.00 44.03 H new ATOM 0 HD11 LEU A 147 4.332 7.229 2.545 1.00 34.12 H new ATOM 0 HD12 LEU A 147 5.993 7.664 3.015 1.00 34.12 H new ATOM 0 HD13 LEU A 147 5.508 5.953 2.943 1.00 34.12 H new ATOM 0 HD21 LEU A 147 2.726 6.397 4.222 1.00 41.24 H new ATOM 0 HD22 LEU A 147 3.819 5.078 4.705 1.00 41.24 H new ATOM 0 HD23 LEU A 147 3.208 6.220 5.926 1.00 41.24 H new ATOM 2255 N GLY A 148 4.710 4.982 8.531 1.00 31.22 N ATOM 2256 CA GLY A 148 4.732 3.707 9.241 1.00 60.05 C ATOM 2257 C GLY A 148 4.272 2.530 8.389 1.00 24.35 C ATOM 2258 O GLY A 148 5.064 1.651 8.057 1.00 44.33 O ATOM 0 H GLY A 148 3.869 5.539 8.683 1.00 31.22 H new ATOM 0 HA2 GLY A 148 5.745 3.515 9.596 1.00 60.05 H new ATOM 0 HA3 GLY A 148 4.094 3.779 10.122 1.00 60.05 H new ATOM 2262 N PHE A 149 2.989 2.510 8.027 1.00 3.13 N ATOM 2263 CA PHE A 149 2.425 1.397 7.251 1.00 4.40 C ATOM 2264 C PHE A 149 1.432 1.889 6.188 1.00 51.11 C ATOM 2265 O PHE A 149 0.866 2.979 6.304 1.00 52.11 O ATOM 2266 CB PHE A 149 1.719 0.399 8.183 1.00 4.52 C ATOM 2267 CG PHE A 149 0.407 0.908 8.741 1.00 62.25 C ATOM 2268 CD1 PHE A 149 0.384 1.792 9.811 1.00 3.14 C ATOM 2269 CD2 PHE A 149 -0.803 0.498 8.192 1.00 34.02 C ATOM 2270 CE1 PHE A 149 -0.816 2.260 10.315 1.00 64.52 C ATOM 2271 CE2 PHE A 149 -2.003 0.965 8.692 1.00 44.13 C ATOM 2272 CZ PHE A 149 -2.010 1.845 9.756 1.00 3.11 C ATOM 0 H PHE A 149 2.321 3.246 8.256 1.00 3.13 H new ATOM 0 HA PHE A 149 3.254 0.905 6.743 1.00 4.40 H new ATOM 0 HB2 PHE A 149 1.536 -0.527 7.637 1.00 4.52 H new ATOM 0 HB3 PHE A 149 2.385 0.155 9.011 1.00 4.52 H new ATOM 0 HD1 PHE A 149 1.313 2.118 10.255 1.00 3.14 H new ATOM 0 HD2 PHE A 149 -0.805 -0.195 7.364 1.00 34.02 H new ATOM 0 HE1 PHE A 149 -0.820 2.950 11.146 1.00 64.52 H new ATOM 0 HE2 PHE A 149 -2.935 0.642 8.251 1.00 44.13 H new ATOM 0 HZ PHE A 149 -2.947 2.209 10.151 1.00 3.11 H new ATOM 2282 N VAL A 150 1.228 1.070 5.157 1.00 64.03 N ATOM 2283 CA VAL A 150 0.228 1.337 4.114 1.00 1.12 C ATOM 2284 C VAL A 150 -0.695 0.114 3.918 1.00 75.24 C ATOM 2285 O VAL A 150 -0.299 -0.883 3.312 1.00 44.14 O ATOM 2286 CB VAL A 150 0.912 1.692 2.764 1.00 75.11 C ATOM 2287 CG1 VAL A 150 -0.120 1.897 1.656 1.00 5.00 C ATOM 2288 CG2 VAL A 150 1.799 2.930 2.913 1.00 23.02 C ATOM 0 H VAL A 150 1.748 0.204 5.018 1.00 64.03 H new ATOM 0 HA VAL A 150 -0.370 2.188 4.440 1.00 1.12 H new ATOM 0 HB VAL A 150 1.543 0.850 2.480 1.00 75.11 H new ATOM 0 HG11 VAL A 150 0.390 2.144 0.725 1.00 5.00 H new ATOM 0 HG12 VAL A 150 -0.697 0.982 1.522 1.00 5.00 H new ATOM 0 HG13 VAL A 150 -0.791 2.712 1.929 1.00 5.00 H new ATOM 0 HG21 VAL A 150 2.267 3.159 1.956 1.00 23.02 H new ATOM 0 HG22 VAL A 150 1.191 3.777 3.232 1.00 23.02 H new ATOM 0 HG23 VAL A 150 2.571 2.737 3.658 1.00 23.02 H new ATOM 2298 N ARG A 151 -1.917 0.185 4.450 1.00 14.50 N ATOM 2299 CA ARG A 151 -2.877 -0.928 4.351 1.00 63.25 C ATOM 2300 C ARG A 151 -3.811 -0.786 3.137 1.00 52.23 C ATOM 2301 O ARG A 151 -4.630 0.133 3.069 1.00 42.32 O ATOM 2302 CB ARG A 151 -3.714 -1.047 5.637 1.00 30.14 C ATOM 2303 CG ARG A 151 -4.803 -2.119 5.560 1.00 44.15 C ATOM 2304 CD ARG A 151 -5.509 -2.329 6.897 1.00 71.12 C ATOM 2305 NE ARG A 151 -6.131 -1.107 7.404 1.00 54.41 N ATOM 2306 CZ ARG A 151 -6.120 -0.752 8.660 1.00 34.24 C ATOM 2307 NH1 ARG A 151 -5.576 -1.514 9.548 1.00 32.24 N ATOM 2308 NH2 ARG A 151 -6.679 0.359 9.024 1.00 2.31 N ATOM 0 H ARG A 151 -2.269 0.999 4.954 1.00 14.50 H new ATOM 0 HA ARG A 151 -2.289 -1.836 4.217 1.00 63.25 H new ATOM 0 HB2 ARG A 151 -3.051 -1.273 6.473 1.00 30.14 H new ATOM 0 HB3 ARG A 151 -4.178 -0.084 5.849 1.00 30.14 H new ATOM 0 HG2 ARG A 151 -5.537 -1.834 4.806 1.00 44.15 H new ATOM 0 HG3 ARG A 151 -4.360 -3.060 5.234 1.00 44.15 H new ATOM 0 HD2 ARG A 151 -6.271 -3.100 6.784 1.00 71.12 H new ATOM 0 HD3 ARG A 151 -4.790 -2.697 7.629 1.00 71.12 H new ATOM 0 HE ARG A 151 -6.601 -0.496 6.737 1.00 54.41 H new ATOM 0 HH11 ARG A 151 -5.152 -2.399 9.270 1.00 32.24 H new ATOM 0 HH12 ARG A 151 -5.570 -1.231 10.528 1.00 32.24 H new ATOM 0 HH21 ARG A 151 -7.128 0.956 8.329 1.00 2.31 H new ATOM 0 HH22 ARG A 151 -6.671 0.637 10.005 1.00 2.31 H new ATOM 2322 N ILE A 152 -3.691 -1.718 2.193 1.00 13.13 N ATOM 2323 CA ILE A 152 -4.547 -1.745 1.001 1.00 3.40 C ATOM 2324 C ILE A 152 -5.738 -2.705 1.194 1.00 35.43 C ATOM 2325 O ILE A 152 -5.558 -3.851 1.612 1.00 35.54 O ATOM 2326 CB ILE A 152 -3.752 -2.195 -0.253 1.00 73.14 C ATOM 2327 CG1 ILE A 152 -2.522 -1.295 -0.480 1.00 61.22 C ATOM 2328 CG2 ILE A 152 -4.654 -2.196 -1.484 1.00 24.33 C ATOM 2329 CD1 ILE A 152 -2.858 0.151 -0.781 1.00 21.24 C ATOM 0 H ILE A 152 -3.004 -2.471 2.229 1.00 13.13 H new ATOM 0 HA ILE A 152 -4.914 -0.729 0.854 1.00 3.40 H new ATOM 0 HB ILE A 152 -3.397 -3.211 -0.083 1.00 73.14 H new ATOM 0 HG12 ILE A 152 -1.890 -1.332 0.407 1.00 61.22 H new ATOM 0 HG13 ILE A 152 -1.937 -1.700 -1.306 1.00 61.22 H new ATOM 0 HG21 ILE A 152 -4.081 -2.514 -2.355 1.00 24.33 H new ATOM 0 HG22 ILE A 152 -5.485 -2.883 -1.326 1.00 24.33 H new ATOM 0 HG23 ILE A 152 -5.042 -1.191 -1.652 1.00 24.33 H new ATOM 0 HD11 ILE A 152 -1.937 0.716 -0.927 1.00 21.24 H new ATOM 0 HD12 ILE A 152 -3.463 0.203 -1.686 1.00 21.24 H new ATOM 0 HD13 ILE A 152 -3.415 0.576 0.054 1.00 21.24 H new ATOM 2341 N HIS A 153 -6.953 -2.236 0.893 1.00 75.45 N ATOM 2342 CA HIS A 153 -8.155 -3.081 0.980 1.00 53.35 C ATOM 2343 C HIS A 153 -9.352 -2.442 0.252 1.00 75.21 C ATOM 2344 O HIS A 153 -9.214 -1.394 -0.382 1.00 22.52 O ATOM 2345 CB HIS A 153 -8.514 -3.358 2.448 1.00 53.11 C ATOM 2346 CG HIS A 153 -8.892 -2.133 3.225 1.00 33.34 C ATOM 2347 ND1 HIS A 153 -10.176 -1.885 3.661 1.00 72.04 N ATOM 2348 CD2 HIS A 153 -8.148 -1.088 3.661 1.00 53.52 C ATOM 2349 CE1 HIS A 153 -10.205 -0.752 4.325 1.00 55.00 C ATOM 2350 NE2 HIS A 153 -8.991 -0.247 4.340 1.00 75.24 N ATOM 0 H HIS A 153 -7.133 -1.280 0.588 1.00 75.45 H new ATOM 0 HA HIS A 153 -7.928 -4.025 0.485 1.00 53.35 H new ATOM 0 HB2 HIS A 153 -9.342 -4.067 2.481 1.00 53.11 H new ATOM 0 HB3 HIS A 153 -7.664 -3.837 2.935 1.00 53.11 H new ATOM 0 HD1 HIS A 153 -10.981 -2.489 3.494 1.00 72.04 H new ATOM 0 HD2 HIS A 153 -7.089 -0.945 3.503 1.00 53.52 H new ATOM 0 HE1 HIS A 153 -11.078 -0.310 4.781 1.00 55.00 H new ATOM 2359 N ASP A 154 -10.521 -3.085 0.354 1.00 53.54 N ATOM 2360 CA ASP A 154 -11.760 -2.614 -0.296 1.00 61.51 C ATOM 2361 C ASP A 154 -11.649 -2.633 -1.830 1.00 24.01 C ATOM 2362 O ASP A 154 -12.376 -1.913 -2.522 1.00 3.34 O ATOM 2363 CB ASP A 154 -12.132 -1.199 0.183 1.00 61.53 C ATOM 2364 CG ASP A 154 -12.408 -1.126 1.674 1.00 52.11 C ATOM 2365 OD1 ASP A 154 -12.617 -2.185 2.310 1.00 31.22 O ATOM 2366 OD2 ASP A 154 -12.406 -0.007 2.221 1.00 1.23 O ATOM 0 H ASP A 154 -10.640 -3.946 0.888 1.00 53.54 H new ATOM 0 HA ASP A 154 -12.550 -3.307 -0.006 1.00 61.51 H new ATOM 0 HB2 ASP A 154 -11.321 -0.514 -0.064 1.00 61.53 H new ATOM 0 HB3 ASP A 154 -13.013 -0.858 -0.360 1.00 61.53 H new ATOM 2371 N ILE A 155 -10.765 -3.481 -2.358 1.00 42.54 N ATOM 2372 CA ILE A 155 -10.528 -3.556 -3.803 1.00 25.21 C ATOM 2373 C ILE A 155 -11.778 -4.046 -4.556 1.00 75.34 C ATOM 2374 O ILE A 155 -12.123 -5.233 -4.533 1.00 54.41 O ATOM 2375 CB ILE A 155 -9.321 -4.472 -4.130 1.00 34.34 C ATOM 2376 CG1 ILE A 155 -8.062 -3.986 -3.388 1.00 73.43 C ATOM 2377 CG2 ILE A 155 -9.068 -4.525 -5.638 1.00 44.34 C ATOM 2378 CD1 ILE A 155 -7.655 -2.565 -3.722 1.00 52.22 C ATOM 0 H ILE A 155 -10.200 -4.127 -1.807 1.00 42.54 H new ATOM 0 HA ILE A 155 -10.298 -2.545 -4.139 1.00 25.21 H new ATOM 0 HB ILE A 155 -9.557 -5.481 -3.791 1.00 34.34 H new ATOM 0 HG12 ILE A 155 -8.235 -4.060 -2.314 1.00 73.43 H new ATOM 0 HG13 ILE A 155 -7.234 -4.654 -3.624 1.00 73.43 H new ATOM 0 HG21 ILE A 155 -8.216 -5.174 -5.841 1.00 44.34 H new ATOM 0 HG22 ILE A 155 -9.952 -4.917 -6.142 1.00 44.34 H new ATOM 0 HG23 ILE A 155 -8.856 -3.521 -6.007 1.00 44.34 H new ATOM 0 HD11 ILE A 155 -6.760 -2.301 -3.158 1.00 52.22 H new ATOM 0 HD12 ILE A 155 -7.447 -2.487 -4.789 1.00 52.22 H new ATOM 0 HD13 ILE A 155 -8.464 -1.883 -3.459 1.00 52.22 H new ATOM 2390 N GLN A 156 -12.452 -3.109 -5.212 1.00 35.44 N ATOM 2391 CA GLN A 156 -13.693 -3.384 -5.940 1.00 41.24 C ATOM 2392 C GLN A 156 -13.662 -2.760 -7.346 1.00 62.53 C ATOM 2393 O GLN A 156 -13.129 -1.661 -7.535 1.00 40.02 O ATOM 2394 CB GLN A 156 -14.878 -2.833 -5.134 1.00 25.24 C ATOM 2395 CG GLN A 156 -14.775 -1.341 -4.829 1.00 64.21 C ATOM 2396 CD GLN A 156 -15.710 -0.902 -3.714 1.00 40.30 C ATOM 2397 OE1 GLN A 156 -16.852 -0.526 -3.949 1.00 72.34 O ATOM 2398 NE2 GLN A 156 -15.229 -0.942 -2.488 1.00 55.51 N ATOM 0 H GLN A 156 -12.156 -2.134 -5.257 1.00 35.44 H new ATOM 0 HA GLN A 156 -13.801 -4.462 -6.062 1.00 41.24 H new ATOM 0 HB2 GLN A 156 -15.799 -3.019 -5.687 1.00 25.24 H new ATOM 0 HB3 GLN A 156 -14.953 -3.382 -4.195 1.00 25.24 H new ATOM 0 HG2 GLN A 156 -13.748 -1.102 -4.552 1.00 64.21 H new ATOM 0 HG3 GLN A 156 -15.002 -0.774 -5.732 1.00 64.21 H new ATOM 0 HE21 GLN A 156 -14.274 -1.260 -2.325 1.00 55.51 H new ATOM 0 HE22 GLN A 156 -15.812 -0.655 -1.702 1.00 55.51 H new ATOM 2407 N PRO A 157 -14.233 -3.447 -8.357 1.00 24.11 N ATOM 2408 CA PRO A 157 -14.249 -2.943 -9.740 1.00 74.35 C ATOM 2409 C PRO A 157 -15.212 -1.762 -9.929 1.00 41.33 C ATOM 2410 O PRO A 157 -16.214 -1.638 -9.220 1.00 61.55 O ATOM 2411 CB PRO A 157 -14.714 -4.160 -10.549 1.00 61.24 C ATOM 2412 CG PRO A 157 -15.541 -4.954 -9.590 1.00 44.44 C ATOM 2413 CD PRO A 157 -14.916 -4.753 -8.233 1.00 75.21 C ATOM 0 HA PRO A 157 -13.277 -2.555 -10.045 1.00 74.35 H new ATOM 0 HB2 PRO A 157 -15.296 -3.859 -11.420 1.00 61.24 H new ATOM 0 HB3 PRO A 157 -13.867 -4.739 -10.917 1.00 61.24 H new ATOM 0 HG2 PRO A 157 -16.577 -4.616 -9.596 1.00 44.44 H new ATOM 0 HG3 PRO A 157 -15.549 -6.009 -9.863 1.00 44.44 H new ATOM 0 HD2 PRO A 157 -15.667 -4.740 -7.443 1.00 75.21 H new ATOM 0 HD3 PRO A 157 -14.214 -5.552 -7.992 1.00 75.21 H new ATOM 2421 N VAL A 158 -14.906 -0.891 -10.886 1.00 54.32 N ATOM 2422 CA VAL A 158 -15.770 0.255 -11.188 1.00 45.24 C ATOM 2423 C VAL A 158 -16.816 -0.115 -12.252 1.00 32.41 C ATOM 2424 O VAL A 158 -16.538 -0.906 -13.156 1.00 12.11 O ATOM 2425 CB VAL A 158 -14.952 1.485 -11.661 1.00 31.01 C ATOM 2426 CG1 VAL A 158 -13.937 1.902 -10.596 1.00 4.24 C ATOM 2427 CG2 VAL A 158 -14.265 1.214 -12.998 1.00 73.42 C ATOM 0 H VAL A 158 -14.070 -0.953 -11.466 1.00 54.32 H new ATOM 0 HA VAL A 158 -16.280 0.523 -10.263 1.00 45.24 H new ATOM 0 HB VAL A 158 -15.647 2.312 -11.810 1.00 31.01 H new ATOM 0 HG11 VAL A 158 -13.374 2.766 -10.948 1.00 4.24 H new ATOM 0 HG12 VAL A 158 -14.461 2.161 -9.676 1.00 4.24 H new ATOM 0 HG13 VAL A 158 -13.252 1.077 -10.404 1.00 4.24 H new ATOM 0 HG21 VAL A 158 -13.700 2.095 -13.302 1.00 73.42 H new ATOM 0 HG22 VAL A 158 -13.587 0.367 -12.894 1.00 73.42 H new ATOM 0 HG23 VAL A 158 -15.017 0.987 -13.754 1.00 73.42 H new