USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 914 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 75 MET CE :methyl -135:sc= 0 (180deg=-0.332) USER MOD Set 1.2: A 110 MET CE :methyl -158:sc= -0.241 (180deg=-1.02) USER MOD Single : A 29 THR OG1 : rot -52:sc= 0.627 USER MOD Single : A 31 GLN : amide:sc= 1.02 K(o=1,f=-0.075) USER MOD Single : A 34 THR OG1 : rot -50:sc= 0.315 USER MOD Single : A 41 SER OG : rot 33:sc= 1.07 USER MOD Single : A 45 THR OG1 : rot 73:sc= 0.717 USER MOD Single : A 48 TYR OH : rot 180:sc= -0.654 USER MOD Single : A 49 MET CE :methyl -164:sc= 0 (180deg=-0.0481) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 71:sc= 0.802 USER MOD Single : A 53 ASN : amide:sc= 0.124 K(o=0.12,f=-8.2!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= 1.08 K(o=1.1,f=-0.065) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot 180:sc= -0.0265 USER MOD Single : A 70 THR OG1 : rot 79:sc= 1.14 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 MET CE :methyl 167:sc= -0.501 (180deg=-0.898) USER MOD Single : A 76 THR OG1 : rot 45:sc= 1.98 USER MOD Single : A 77 THR OG1 : rot 140:sc= -0.596 USER MOD Single : A 78 THR OG1 : rot 11:sc= 0.498 USER MOD Single : A 79 HIS : no HD1:sc= -0.0226 K(o=-0.023,f=-0.56) USER MOD Single : A 80 SER OG : rot -20:sc= 0.647 USER MOD Single : A 83 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 152:sc= -0.145 (180deg=-1.02) USER MOD Single : A 88 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot -45:sc= 1.35! USER MOD Single : A 99 THR OG1 : rot 61:sc= 1.97 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= 0.993 K(o=0.99,f=0) USER MOD Single : A 108 HIS : no HD1:sc= -0.475 K(o=-0.48,f=-2.9) USER MOD Single : A 112 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 160:sc= 2.5 (180deg=1.52) USER MOD Single : A 119 LYS NZ :NH3+ -173:sc= 0.88 (180deg=0.764) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 ASN : amide:sc=-0.00659 K(o=-0.0066,f=-1.3) USER MOD Single : A 127 THR OG1 : rot 180:sc= -0.0237 USER MOD Single : A 129 LYS NZ :NH3+ 171:sc= -0.0016 (180deg=-0.077) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 137 ASN : amide:sc= -0.462 K(o=-0.46,f=-5.4!) USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 LYS NZ :NH3+ -136:sc= 1.19 (180deg=-0.369) USER MOD Single : A 144 LYS NZ :NH3+ 171:sc= 1.51 (180deg=1.09) USER MOD ----------------------------------------------------------------- ATOM 369 N VAL A 28 -5.165 6.866 1.122 1.00 10.00 N ATOM 370 CA VAL A 28 -4.589 5.591 0.717 1.00 10.00 C ATOM 371 C VAL A 28 -3.275 5.333 1.462 1.00 10.00 C ATOM 372 O VAL A 28 -2.211 5.203 0.869 1.00 10.00 O ATOM 373 CB VAL A 28 -4.468 5.606 -0.818 1.00 10.00 C ATOM 374 CG1 VAL A 28 -3.409 6.571 -1.368 1.00 10.00 C ATOM 375 CG2 VAL A 28 -4.276 4.203 -1.398 1.00 10.00 C ATOM 0 HA VAL A 28 -5.224 4.749 0.990 1.00 10.00 H new ATOM 0 HB VAL A 28 -5.429 5.994 -1.156 1.00 10.00 H new ATOM 0 HG11 VAL A 28 -3.395 6.514 -2.456 1.00 10.00 H new ATOM 0 HG12 VAL A 28 -3.650 7.589 -1.061 1.00 10.00 H new ATOM 0 HG13 VAL A 28 -2.429 6.297 -0.978 1.00 10.00 H new ATOM 0 HG21 VAL A 28 -4.196 4.266 -2.483 1.00 10.00 H new ATOM 0 HG22 VAL A 28 -3.365 3.763 -0.992 1.00 10.00 H new ATOM 0 HG23 VAL A 28 -5.130 3.580 -1.133 1.00 10.00 H new ATOM 385 N THR A 29 -3.338 5.274 2.790 1.00 10.00 N ATOM 386 CA THR A 29 -2.157 5.099 3.620 1.00 10.00 C ATOM 387 C THR A 29 -2.568 4.515 4.967 1.00 10.00 C ATOM 388 O THR A 29 -2.277 5.091 6.015 1.00 10.00 O ATOM 389 CB THR A 29 -1.381 6.430 3.709 1.00 10.00 C ATOM 390 OG1 THR A 29 -0.331 6.346 4.650 1.00 10.00 O ATOM 391 CG2 THR A 29 -2.270 7.629 4.060 1.00 10.00 C ATOM 0 H THR A 29 -4.209 5.346 3.317 1.00 10.00 H new ATOM 0 HA THR A 29 -1.465 4.382 3.177 1.00 10.00 H new ATOM 0 HB THR A 29 -0.977 6.597 2.711 1.00 10.00 H new ATOM 0 HG1 THR A 29 -0.681 6.012 5.502 1.00 10.00 H new ATOM 0 HG21 THR A 29 -1.661 8.532 4.106 1.00 10.00 H new ATOM 0 HG22 THR A 29 -3.038 7.748 3.296 1.00 10.00 H new ATOM 0 HG23 THR A 29 -2.743 7.460 5.027 1.00 10.00 H new ATOM 399 N VAL A 30 -3.210 3.343 4.932 1.00 10.00 N ATOM 400 CA VAL A 30 -3.614 2.617 6.128 1.00 10.00 C ATOM 401 C VAL A 30 -2.996 1.216 6.125 1.00 10.00 C ATOM 402 O VAL A 30 -3.677 0.203 6.252 1.00 10.00 O ATOM 403 CB VAL A 30 -5.149 2.688 6.285 1.00 10.00 C ATOM 404 CG1 VAL A 30 -5.921 1.962 5.174 1.00 10.00 C ATOM 405 CG2 VAL A 30 -5.610 2.194 7.664 1.00 10.00 C ATOM 0 H VAL A 30 -3.463 2.872 4.063 1.00 10.00 H new ATOM 0 HA VAL A 30 -3.222 3.081 7.033 1.00 10.00 H new ATOM 0 HB VAL A 30 -5.389 3.747 6.193 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -6.992 2.056 5.354 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -5.674 2.406 4.210 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -5.646 0.907 5.169 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -6.696 2.262 7.730 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -5.302 1.157 7.801 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -5.160 2.812 8.441 1.00 10.00 H new ATOM 415 N GLN A 31 -1.665 1.168 6.039 1.00 10.00 N ATOM 416 CA GLN A 31 -0.886 -0.035 6.277 1.00 10.00 C ATOM 417 C GLN A 31 0.474 0.395 6.825 1.00 10.00 C ATOM 418 O GLN A 31 1.064 1.346 6.317 1.00 10.00 O ATOM 419 CB GLN A 31 -0.775 -0.823 4.965 1.00 10.00 C ATOM 420 CG GLN A 31 0.146 -2.048 5.038 1.00 10.00 C ATOM 421 CD GLN A 31 -0.180 -2.978 6.203 1.00 10.00 C ATOM 422 OE1 GLN A 31 -1.296 -3.468 6.319 1.00 10.00 O ATOM 423 NE2 GLN A 31 0.784 -3.223 7.084 1.00 10.00 N ATOM 0 H GLN A 31 -1.096 1.979 5.798 1.00 10.00 H new ATOM 0 HA GLN A 31 -1.357 -0.694 7.007 1.00 10.00 H new ATOM 0 HB2 GLN A 31 -1.771 -1.150 4.666 1.00 10.00 H new ATOM 0 HB3 GLN A 31 -0.411 -0.156 4.184 1.00 10.00 H new ATOM 0 HG2 GLN A 31 0.072 -2.606 4.105 1.00 10.00 H new ATOM 0 HG3 GLN A 31 1.179 -1.713 5.128 1.00 10.00 H new ATOM 0 HE21 GLN A 31 1.705 -2.801 6.963 1.00 10.00 H new ATOM 0 HE22 GLN A 31 0.603 -3.833 7.881 1.00 10.00 H new ATOM 432 N GLY A 32 0.963 -0.292 7.860 1.00 10.00 N ATOM 433 CA GLY A 32 2.304 -0.083 8.383 1.00 10.00 C ATOM 434 C GLY A 32 3.321 -0.608 7.373 1.00 10.00 C ATOM 435 O GLY A 32 3.142 -1.708 6.848 1.00 10.00 O ATOM 0 H GLY A 32 0.434 -1.009 8.356 1.00 10.00 H new ATOM 0 HA2 GLY A 32 2.473 0.977 8.571 1.00 10.00 H new ATOM 0 HA3 GLY A 32 2.420 -0.598 9.336 1.00 10.00 H new ATOM 439 N ALA A 33 4.356 0.179 7.076 1.00 10.00 N ATOM 440 CA ALA A 33 5.317 -0.137 6.029 1.00 10.00 C ATOM 441 C ALA A 33 6.533 -0.876 6.585 1.00 10.00 C ATOM 442 O ALA A 33 6.911 -0.676 7.742 1.00 10.00 O ATOM 443 CB ALA A 33 5.738 1.157 5.334 1.00 10.00 C ATOM 0 H ALA A 33 4.548 1.056 7.559 1.00 10.00 H new ATOM 0 HA ALA A 33 4.844 -0.803 5.307 1.00 10.00 H new ATOM 0 HB1 ALA A 33 6.458 0.930 4.548 1.00 10.00 H new ATOM 0 HB2 ALA A 33 4.862 1.637 4.897 1.00 10.00 H new ATOM 0 HB3 ALA A 33 6.194 1.829 6.061 1.00 10.00 H new ATOM 449 N THR A 34 7.154 -1.716 5.752 1.00 10.00 N ATOM 450 CA THR A 34 8.364 -2.447 6.089 1.00 10.00 C ATOM 451 C THR A 34 9.490 -1.984 5.161 1.00 10.00 C ATOM 452 O THR A 34 9.312 -2.009 3.947 1.00 10.00 O ATOM 453 CB THR A 34 8.095 -3.956 6.014 1.00 10.00 C ATOM 454 OG1 THR A 34 7.754 -4.363 4.708 1.00 10.00 O ATOM 455 CG2 THR A 34 6.914 -4.301 6.924 1.00 10.00 C ATOM 0 H THR A 34 6.818 -1.906 4.808 1.00 10.00 H new ATOM 0 HA THR A 34 8.678 -2.242 7.112 1.00 10.00 H new ATOM 0 HB THR A 34 9.007 -4.467 6.322 1.00 10.00 H new ATOM 0 HG1 THR A 34 7.049 -3.779 4.357 1.00 10.00 H new ATOM 0 HG21 THR A 34 6.718 -5.372 6.875 1.00 10.00 H new ATOM 0 HG22 THR A 34 7.152 -4.022 7.950 1.00 10.00 H new ATOM 0 HG23 THR A 34 6.030 -3.755 6.595 1.00 10.00 H new ATOM 463 N VAL A 35 10.614 -1.506 5.710 1.00 10.00 N ATOM 464 CA VAL A 35 11.731 -0.972 4.931 1.00 10.00 C ATOM 465 C VAL A 35 12.896 -1.957 4.961 1.00 10.00 C ATOM 466 O VAL A 35 13.404 -2.293 6.030 1.00 10.00 O ATOM 467 CB VAL A 35 12.141 0.425 5.429 1.00 10.00 C ATOM 468 CG1 VAL A 35 13.360 0.949 4.657 1.00 10.00 C ATOM 469 CG2 VAL A 35 10.991 1.416 5.224 1.00 10.00 C ATOM 0 H VAL A 35 10.772 -1.480 6.717 1.00 10.00 H new ATOM 0 HA VAL A 35 11.416 -0.850 3.895 1.00 10.00 H new ATOM 0 HB VAL A 35 12.387 0.336 6.487 1.00 10.00 H new ATOM 0 HG11 VAL A 35 13.629 1.938 5.029 1.00 10.00 H new ATOM 0 HG12 VAL A 35 14.200 0.268 4.797 1.00 10.00 H new ATOM 0 HG13 VAL A 35 13.118 1.014 3.596 1.00 10.00 H new ATOM 0 HG21 VAL A 35 11.292 2.401 5.580 1.00 10.00 H new ATOM 0 HG22 VAL A 35 10.744 1.473 4.164 1.00 10.00 H new ATOM 0 HG23 VAL A 35 10.117 1.080 5.782 1.00 10.00 H new ATOM 479 N ALA A 36 13.342 -2.426 3.796 1.00 10.00 N ATOM 480 CA ALA A 36 14.393 -3.432 3.745 1.00 10.00 C ATOM 481 C ALA A 36 15.772 -2.812 3.968 1.00 10.00 C ATOM 482 O ALA A 36 16.427 -2.455 2.994 1.00 10.00 O ATOM 483 CB ALA A 36 14.320 -4.189 2.418 1.00 10.00 C ATOM 0 H ALA A 36 12.994 -2.127 2.885 1.00 10.00 H new ATOM 0 HA ALA A 36 14.236 -4.143 4.556 1.00 10.00 H new ATOM 0 HB1 ALA A 36 15.108 -4.941 2.384 1.00 10.00 H new ATOM 0 HB2 ALA A 36 13.349 -4.677 2.330 1.00 10.00 H new ATOM 0 HB3 ALA A 36 14.450 -3.489 1.592 1.00 10.00 H new ATOM 489 N ALA A 37 16.226 -2.690 5.223 1.00 10.00 N ATOM 490 CA ALA A 37 17.600 -2.283 5.545 1.00 10.00 C ATOM 491 C ALA A 37 18.592 -2.962 4.593 1.00 10.00 C ATOM 492 O ALA A 37 18.579 -4.189 4.492 1.00 10.00 O ATOM 493 CB ALA A 37 17.950 -2.628 6.996 1.00 10.00 C ATOM 0 H ALA A 37 15.649 -2.871 6.045 1.00 10.00 H new ATOM 0 HA ALA A 37 17.669 -1.202 5.423 1.00 10.00 H new ATOM 0 HB1 ALA A 37 18.973 -2.316 7.208 1.00 10.00 H new ATOM 0 HB2 ALA A 37 17.266 -2.110 7.668 1.00 10.00 H new ATOM 0 HB3 ALA A 37 17.861 -3.704 7.146 1.00 10.00 H new ATOM 499 N VAL A 38 19.389 -2.152 3.882 1.00 10.00 N ATOM 500 CA VAL A 38 19.817 -2.403 2.507 1.00 10.00 C ATOM 501 C VAL A 38 20.030 -3.877 2.125 1.00 10.00 C ATOM 502 O VAL A 38 20.788 -4.597 2.782 1.00 10.00 O ATOM 503 CB VAL A 38 21.004 -1.519 2.077 1.00 10.00 C ATOM 504 CG1 VAL A 38 20.734 -0.030 2.324 1.00 10.00 C ATOM 505 CG2 VAL A 38 22.344 -1.894 2.718 1.00 10.00 C ATOM 0 H VAL A 38 19.761 -1.282 4.262 1.00 10.00 H new ATOM 0 HA VAL A 38 18.947 -2.102 1.923 1.00 10.00 H new ATOM 0 HB VAL A 38 21.093 -1.709 1.007 1.00 10.00 H new ATOM 0 HG11 VAL A 38 21.598 0.554 2.006 1.00 10.00 H new ATOM 0 HG12 VAL A 38 19.857 0.280 1.756 1.00 10.00 H new ATOM 0 HG13 VAL A 38 20.555 0.136 3.386 1.00 10.00 H new ATOM 0 HG21 VAL A 38 23.121 -1.220 2.358 1.00 10.00 H new ATOM 0 HG22 VAL A 38 22.265 -1.811 3.802 1.00 10.00 H new ATOM 0 HG23 VAL A 38 22.601 -2.919 2.451 1.00 10.00 H new ATOM 515 N PRO A 39 19.362 -4.372 1.076 1.00 10.00 N ATOM 516 CA PRO A 39 19.727 -5.616 0.424 1.00 10.00 C ATOM 517 C PRO A 39 21.183 -5.627 -0.043 1.00 10.00 C ATOM 518 O PRO A 39 21.791 -4.570 -0.197 1.00 10.00 O ATOM 519 CB PRO A 39 18.857 -5.638 -0.823 1.00 10.00 C ATOM 520 CG PRO A 39 17.606 -4.873 -0.422 1.00 10.00 C ATOM 521 CD PRO A 39 18.268 -3.745 0.352 1.00 10.00 C ATOM 0 HA PRO A 39 19.598 -6.457 1.105 1.00 10.00 H new ATOM 0 HB2 PRO A 39 19.359 -5.165 -1.667 1.00 10.00 H new ATOM 0 HB3 PRO A 39 18.620 -6.658 -1.125 1.00 10.00 H new ATOM 0 HG2 PRO A 39 17.034 -4.519 -1.280 1.00 10.00 H new ATOM 0 HG3 PRO A 39 16.927 -5.465 0.191 1.00 10.00 H new ATOM 0 HD2 PRO A 39 18.634 -2.968 -0.319 1.00 10.00 H new ATOM 0 HD3 PRO A 39 17.564 -3.270 1.035 1.00 10.00 H new ATOM 529 N PRO A 40 21.726 -6.799 -0.393 1.00 10.00 N ATOM 530 CA PRO A 40 22.949 -6.883 -1.165 1.00 10.00 C ATOM 531 C PRO A 40 22.633 -6.628 -2.651 1.00 10.00 C ATOM 532 O PRO A 40 22.971 -7.452 -3.498 1.00 10.00 O ATOM 533 CB PRO A 40 23.448 -8.308 -0.897 1.00 10.00 C ATOM 534 CG PRO A 40 22.146 -9.107 -0.802 1.00 10.00 C ATOM 535 CD PRO A 40 21.175 -8.123 -0.144 1.00 10.00 C ATOM 0 HA PRO A 40 23.705 -6.146 -0.896 1.00 10.00 H new ATOM 0 HB2 PRO A 40 24.088 -8.671 -1.701 1.00 10.00 H new ATOM 0 HB3 PRO A 40 24.028 -8.368 0.024 1.00 10.00 H new ATOM 0 HG2 PRO A 40 21.795 -9.422 -1.785 1.00 10.00 H new ATOM 0 HG3 PRO A 40 22.271 -10.010 -0.204 1.00 10.00 H new ATOM 0 HD2 PRO A 40 20.175 -8.217 -0.568 1.00 10.00 H new ATOM 0 HD3 PRO A 40 21.087 -8.316 0.925 1.00 10.00 H new ATOM 543 N SER A 41 21.987 -5.502 -2.988 1.00 10.00 N ATOM 544 CA SER A 41 21.658 -5.171 -4.375 1.00 10.00 C ATOM 545 C SER A 41 21.885 -3.687 -4.640 1.00 10.00 C ATOM 546 O SER A 41 21.017 -3.020 -5.196 1.00 10.00 O ATOM 547 CB SER A 41 20.234 -5.623 -4.736 1.00 10.00 C ATOM 548 OG SER A 41 19.245 -5.064 -3.892 1.00 10.00 O ATOM 0 H SER A 41 21.682 -4.803 -2.311 1.00 10.00 H new ATOM 0 HA SER A 41 22.331 -5.723 -5.031 1.00 10.00 H new ATOM 0 HB2 SER A 41 20.022 -5.346 -5.768 1.00 10.00 H new ATOM 0 HB3 SER A 41 20.179 -6.710 -4.680 1.00 10.00 H new ATOM 0 HG SER A 41 19.521 -4.165 -3.615 1.00 10.00 H new ATOM 554 N ILE A 42 23.087 -3.216 -4.286 1.00 10.00 N ATOM 555 CA ILE A 42 23.499 -1.830 -4.184 1.00 10.00 C ATOM 556 C ILE A 42 23.121 -1.358 -2.775 1.00 10.00 C ATOM 557 O ILE A 42 22.450 -2.066 -2.031 1.00 10.00 O ATOM 558 CB ILE A 42 22.942 -0.948 -5.316 1.00 10.00 C ATOM 559 CG1 ILE A 42 23.238 -1.576 -6.695 1.00 10.00 C ATOM 560 CG2 ILE A 42 23.609 0.430 -5.293 1.00 10.00 C ATOM 561 CD1 ILE A 42 22.309 -1.017 -7.770 1.00 10.00 C ATOM 0 H ILE A 42 23.848 -3.852 -4.047 1.00 10.00 H new ATOM 0 HA ILE A 42 24.577 -1.739 -4.321 1.00 10.00 H new ATOM 0 HB ILE A 42 21.867 -0.861 -5.161 1.00 10.00 H new ATOM 0 HG12 ILE A 42 24.275 -1.382 -6.970 1.00 10.00 H new ATOM 0 HG13 ILE A 42 23.121 -2.658 -6.637 1.00 10.00 H new ATOM 0 HG21 ILE A 42 23.205 1.043 -6.099 1.00 10.00 H new ATOM 0 HG22 ILE A 42 23.412 0.913 -4.336 1.00 10.00 H new ATOM 0 HG23 ILE A 42 24.685 0.316 -5.428 1.00 10.00 H new ATOM 0 HD11 ILE A 42 22.543 -1.479 -8.729 1.00 10.00 H new ATOM 0 HD12 ILE A 42 21.274 -1.234 -7.505 1.00 10.00 H new ATOM 0 HD13 ILE A 42 22.446 0.062 -7.844 1.00 10.00 H new ATOM 573 N ARG A 43 23.519 -0.146 -2.394 1.00 10.00 N ATOM 574 CA ARG A 43 22.982 0.551 -1.234 1.00 10.00 C ATOM 575 C ARG A 43 21.550 1.040 -1.521 1.00 10.00 C ATOM 576 O ARG A 43 21.233 2.218 -1.326 1.00 10.00 O ATOM 577 CB ARG A 43 23.967 1.655 -0.817 1.00 10.00 C ATOM 578 CG ARG A 43 24.170 2.748 -1.873 1.00 10.00 C ATOM 579 CD ARG A 43 25.583 3.339 -1.824 1.00 10.00 C ATOM 580 NE ARG A 43 25.752 4.379 -2.853 1.00 10.00 N ATOM 581 CZ ARG A 43 26.921 4.942 -3.202 1.00 10.00 C ATOM 582 NH1 ARG A 43 28.046 4.591 -2.569 1.00 10.00 N ATOM 583 NH2 ARG A 43 26.961 5.850 -4.185 1.00 10.00 N ATOM 0 H ARG A 43 24.234 0.385 -2.892 1.00 10.00 H new ATOM 0 HA ARG A 43 22.886 -0.118 -0.379 1.00 10.00 H new ATOM 0 HB2 ARG A 43 23.609 2.117 0.103 1.00 10.00 H new ATOM 0 HB3 ARG A 43 24.931 1.200 -0.592 1.00 10.00 H new ATOM 0 HG2 ARG A 43 23.985 2.333 -2.864 1.00 10.00 H new ATOM 0 HG3 ARG A 43 23.439 3.542 -1.718 1.00 10.00 H new ATOM 0 HD2 ARG A 43 25.770 3.763 -0.838 1.00 10.00 H new ATOM 0 HD3 ARG A 43 26.318 2.548 -1.976 1.00 10.00 H new ATOM 0 HE ARG A 43 24.914 4.698 -3.340 1.00 10.00 H new ATOM 0 HH11 ARG A 43 28.016 3.897 -1.822 1.00 10.00 H new ATOM 0 HH12 ARG A 43 28.934 5.018 -2.833 1.00 10.00 H new ATOM 0 HH21 ARG A 43 26.104 6.115 -4.670 1.00 10.00 H new ATOM 0 HH22 ARG A 43 27.849 6.277 -4.449 1.00 10.00 H new ATOM 597 N ASP A 44 20.697 0.130 -2.006 1.00 10.00 N ATOM 598 CA ASP A 44 19.279 0.358 -2.226 1.00 10.00 C ATOM 599 C ASP A 44 18.515 0.069 -0.943 1.00 10.00 C ATOM 600 O ASP A 44 18.991 -0.653 -0.077 1.00 10.00 O ATOM 601 CB ASP A 44 18.736 -0.490 -3.394 1.00 10.00 C ATOM 602 CG ASP A 44 18.508 -1.972 -3.071 1.00 10.00 C ATOM 603 OD1 ASP A 44 19.507 -2.662 -2.783 1.00 10.00 O ATOM 604 OD2 ASP A 44 17.344 -2.430 -3.162 1.00 10.00 O ATOM 0 H ASP A 44 20.992 -0.812 -2.262 1.00 10.00 H new ATOM 0 HA ASP A 44 19.137 1.403 -2.503 1.00 10.00 H new ATOM 0 HB2 ASP A 44 17.793 -0.058 -3.729 1.00 10.00 H new ATOM 0 HB3 ASP A 44 19.433 -0.419 -4.229 1.00 10.00 H new ATOM 609 N THR A 45 17.316 0.624 -0.825 1.00 10.00 N ATOM 610 CA THR A 45 16.295 0.106 0.060 1.00 10.00 C ATOM 611 C THR A 45 14.970 0.621 -0.481 1.00 10.00 C ATOM 612 O THR A 45 14.941 1.435 -1.405 1.00 10.00 O ATOM 613 CB THR A 45 16.544 0.436 1.544 1.00 10.00 C ATOM 614 OG1 THR A 45 15.466 -0.033 2.322 1.00 10.00 O ATOM 615 CG2 THR A 45 16.729 1.915 1.861 1.00 10.00 C ATOM 0 H THR A 45 17.028 1.452 -1.347 1.00 10.00 H new ATOM 0 HA THR A 45 16.300 -0.984 0.065 1.00 10.00 H new ATOM 0 HB THR A 45 17.485 -0.059 1.782 1.00 10.00 H new ATOM 0 HG1 THR A 45 15.507 -1.010 2.383 1.00 10.00 H new ATOM 0 HG21 THR A 45 16.898 2.040 2.931 1.00 10.00 H new ATOM 0 HG22 THR A 45 17.587 2.300 1.311 1.00 10.00 H new ATOM 0 HG23 THR A 45 15.834 2.464 1.569 1.00 10.00 H new ATOM 623 N ALA A 46 13.874 0.090 0.043 1.00 10.00 N ATOM 624 CA ALA A 46 12.535 0.338 -0.427 1.00 10.00 C ATOM 625 C ALA A 46 11.597 0.019 0.720 1.00 10.00 C ATOM 626 O ALA A 46 11.944 -0.814 1.563 1.00 10.00 O ATOM 627 CB ALA A 46 12.261 -0.578 -1.613 1.00 10.00 C ATOM 0 H ALA A 46 13.904 -0.549 0.838 1.00 10.00 H new ATOM 0 HA ALA A 46 12.398 1.371 -0.747 1.00 10.00 H new ATOM 0 HB1 ALA A 46 11.250 -0.403 -1.982 1.00 10.00 H new ATOM 0 HB2 ALA A 46 12.978 -0.370 -2.407 1.00 10.00 H new ATOM 0 HB3 ALA A 46 12.358 -1.618 -1.300 1.00 10.00 H new ATOM 633 N ALA A 47 10.428 0.663 0.731 1.00 10.00 N ATOM 634 CA ALA A 47 9.339 0.267 1.605 1.00 10.00 C ATOM 635 C ALA A 47 8.478 -0.755 0.873 1.00 10.00 C ATOM 636 O ALA A 47 8.329 -0.665 -0.347 1.00 10.00 O ATOM 637 CB ALA A 47 8.494 1.464 2.035 1.00 10.00 C ATOM 0 H ALA A 47 10.218 1.465 0.138 1.00 10.00 H new ATOM 0 HA ALA A 47 9.756 -0.170 2.512 1.00 10.00 H new ATOM 0 HB1 ALA A 47 7.690 1.126 2.688 1.00 10.00 H new ATOM 0 HB2 ALA A 47 9.120 2.178 2.570 1.00 10.00 H new ATOM 0 HB3 ALA A 47 8.068 1.944 1.154 1.00 10.00 H new ATOM 643 N TYR A 48 7.895 -1.694 1.618 1.00 10.00 N ATOM 644 CA TYR A 48 6.948 -2.669 1.135 1.00 10.00 C ATOM 645 C TYR A 48 5.748 -2.528 2.062 1.00 10.00 C ATOM 646 O TYR A 48 5.911 -2.432 3.280 1.00 10.00 O ATOM 647 CB TYR A 48 7.566 -4.064 1.112 1.00 10.00 C ATOM 648 CG TYR A 48 8.799 -4.114 0.235 1.00 10.00 C ATOM 649 CD1 TYR A 48 8.746 -3.648 -1.096 1.00 10.00 C ATOM 650 CD2 TYR A 48 10.045 -4.385 0.820 1.00 10.00 C ATOM 651 CE1 TYR A 48 9.924 -3.456 -1.832 1.00 10.00 C ATOM 652 CE2 TYR A 48 11.210 -4.260 0.053 1.00 10.00 C ATOM 653 CZ TYR A 48 11.152 -3.837 -1.278 1.00 10.00 C ATOM 654 OH TYR A 48 12.290 -3.810 -2.026 1.00 10.00 O ATOM 0 H TYR A 48 8.085 -1.790 2.615 1.00 10.00 H new ATOM 0 HA TYR A 48 6.643 -2.507 0.101 1.00 10.00 H new ATOM 0 HB2 TYR A 48 7.829 -4.363 2.127 1.00 10.00 H new ATOM 0 HB3 TYR A 48 6.831 -4.782 0.748 1.00 10.00 H new ATOM 0 HD1 TYR A 48 7.790 -3.437 -1.552 1.00 10.00 H new ATOM 0 HD2 TYR A 48 10.105 -4.688 1.855 1.00 10.00 H new ATOM 0 HE1 TYR A 48 9.884 -3.018 -2.818 1.00 10.00 H new ATOM 0 HE2 TYR A 48 12.167 -4.494 0.496 1.00 10.00 H new ATOM 0 HH TYR A 48 13.048 -4.106 -1.479 1.00 10.00 H new ATOM 664 N MET A 49 4.570 -2.341 1.480 1.00 10.00 N ATOM 665 CA MET A 49 3.340 -2.023 2.183 1.00 10.00 C ATOM 666 C MET A 49 2.189 -2.352 1.241 1.00 10.00 C ATOM 667 O MET A 49 2.416 -2.881 0.158 1.00 10.00 O ATOM 668 CB MET A 49 3.331 -0.570 2.692 1.00 10.00 C ATOM 669 CG MET A 49 3.192 0.478 1.587 1.00 10.00 C ATOM 670 SD MET A 49 3.472 2.198 2.082 1.00 10.00 S ATOM 671 CE MET A 49 2.178 2.407 3.325 1.00 10.00 C ATOM 0 H MET A 49 4.444 -2.410 0.470 1.00 10.00 H new ATOM 0 HA MET A 49 3.239 -2.620 3.089 1.00 10.00 H new ATOM 0 HB2 MET A 49 2.510 -0.449 3.398 1.00 10.00 H new ATOM 0 HB3 MET A 49 4.254 -0.383 3.241 1.00 10.00 H new ATOM 0 HG2 MET A 49 3.894 0.232 0.790 1.00 10.00 H new ATOM 0 HG3 MET A 49 2.190 0.401 1.165 1.00 10.00 H new ATOM 0 HE1 MET A 49 2.028 3.469 3.519 1.00 10.00 H new ATOM 0 HE2 MET A 49 1.249 1.970 2.960 1.00 10.00 H new ATOM 0 HE3 MET A 49 2.475 1.908 4.247 1.00 10.00 H new ATOM 681 N THR A 50 0.966 -2.033 1.644 1.00 10.00 N ATOM 682 CA THR A 50 -0.214 -2.122 0.806 1.00 10.00 C ATOM 683 C THR A 50 -0.918 -0.764 0.798 1.00 10.00 C ATOM 684 O THR A 50 -1.383 -0.306 1.842 1.00 10.00 O ATOM 685 CB THR A 50 -1.111 -3.234 1.349 1.00 10.00 C ATOM 686 OG1 THR A 50 -0.379 -4.435 1.489 1.00 10.00 O ATOM 687 CG2 THR A 50 -2.254 -3.481 0.380 1.00 10.00 C ATOM 0 H THR A 50 0.766 -1.697 2.586 1.00 10.00 H new ATOM 0 HA THR A 50 0.045 -2.368 -0.224 1.00 10.00 H new ATOM 0 HB THR A 50 -1.494 -2.924 2.321 1.00 10.00 H new ATOM 0 HG1 THR A 50 -0.966 -5.137 1.839 1.00 10.00 H new ATOM 0 HG21 THR A 50 -2.894 -4.274 0.767 1.00 10.00 H new ATOM 0 HG22 THR A 50 -2.837 -2.567 0.265 1.00 10.00 H new ATOM 0 HG23 THR A 50 -1.852 -3.779 -0.588 1.00 10.00 H new ATOM 695 N LEU A 51 -1.021 -0.114 -0.364 1.00 10.00 N ATOM 696 CA LEU A 51 -1.744 1.136 -0.479 1.00 10.00 C ATOM 697 C LEU A 51 -3.190 0.722 -0.659 1.00 10.00 C ATOM 698 O LEU A 51 -3.530 0.075 -1.648 1.00 10.00 O ATOM 699 CB LEU A 51 -1.254 1.936 -1.685 1.00 10.00 C ATOM 700 CG LEU A 51 -0.518 3.232 -1.333 1.00 10.00 C ATOM 701 CD1 LEU A 51 0.622 3.064 -0.319 1.00 10.00 C ATOM 702 CD2 LEU A 51 0.041 3.833 -2.625 1.00 10.00 C ATOM 0 H LEU A 51 -0.608 -0.442 -1.237 1.00 10.00 H new ATOM 0 HA LEU A 51 -1.603 1.778 0.390 1.00 10.00 H new ATOM 0 HB2 LEU A 51 -0.590 1.306 -2.277 1.00 10.00 H new ATOM 0 HB3 LEU A 51 -2.109 2.179 -2.315 1.00 10.00 H new ATOM 0 HG LEU A 51 -1.246 3.886 -0.853 1.00 10.00 H new ATOM 0 HD11 LEU A 51 1.086 4.032 -0.130 1.00 10.00 H new ATOM 0 HD12 LEU A 51 0.224 2.664 0.613 1.00 10.00 H new ATOM 0 HD13 LEU A 51 1.367 2.377 -0.720 1.00 10.00 H new ATOM 0 HD21 LEU A 51 0.570 4.758 -2.397 1.00 10.00 H new ATOM 0 HD22 LEU A 51 0.730 3.126 -3.087 1.00 10.00 H new ATOM 0 HD23 LEU A 51 -0.778 4.043 -3.313 1.00 10.00 H new ATOM 714 N THR A 52 -3.975 1.054 0.359 1.00 10.00 N ATOM 715 CA THR A 52 -5.283 0.492 0.644 1.00 10.00 C ATOM 716 C THR A 52 -6.306 1.629 0.679 1.00 10.00 C ATOM 717 O THR A 52 -6.444 2.308 1.694 1.00 10.00 O ATOM 718 CB THR A 52 -5.190 -0.246 1.990 1.00 10.00 C ATOM 719 OG1 THR A 52 -4.081 -1.127 1.989 1.00 10.00 O ATOM 720 CG2 THR A 52 -6.453 -1.064 2.270 1.00 10.00 C ATOM 0 H THR A 52 -3.699 1.760 1.042 1.00 10.00 H new ATOM 0 HA THR A 52 -5.602 -0.216 -0.121 1.00 10.00 H new ATOM 0 HB THR A 52 -5.075 0.511 2.766 1.00 10.00 H new ATOM 0 HG1 THR A 52 -3.251 -0.608 2.026 1.00 10.00 H new ATOM 0 HG21 THR A 52 -6.352 -1.572 3.229 1.00 10.00 H new ATOM 0 HG22 THR A 52 -7.317 -0.400 2.300 1.00 10.00 H new ATOM 0 HG23 THR A 52 -6.590 -1.803 1.481 1.00 10.00 H new ATOM 728 N ASN A 53 -6.991 1.878 -0.438 1.00 10.00 N ATOM 729 CA ASN A 53 -7.823 3.065 -0.593 1.00 10.00 C ATOM 730 C ASN A 53 -9.214 2.872 0.010 1.00 10.00 C ATOM 731 O ASN A 53 -9.807 1.807 -0.152 1.00 10.00 O ATOM 732 CB ASN A 53 -7.958 3.395 -2.082 1.00 10.00 C ATOM 733 CG ASN A 53 -8.369 4.842 -2.258 1.00 10.00 C ATOM 734 OD1 ASN A 53 -9.516 5.203 -2.037 1.00 10.00 O ATOM 735 ND2 ASN A 53 -7.409 5.684 -2.618 1.00 10.00 N ATOM 0 H ASN A 53 -6.983 1.265 -1.254 1.00 10.00 H new ATOM 0 HA ASN A 53 -7.340 3.884 -0.060 1.00 10.00 H new ATOM 0 HB2 ASN A 53 -7.011 3.213 -2.590 1.00 10.00 H new ATOM 0 HB3 ASN A 53 -8.698 2.740 -2.542 1.00 10.00 H new ATOM 0 HD21 ASN A 53 -7.614 6.678 -2.721 1.00 10.00 H new ATOM 0 HD22 ASN A 53 -6.466 5.338 -2.792 1.00 10.00 H new ATOM 742 N LYS A 54 -9.754 3.908 0.662 1.00 10.00 N ATOM 743 CA LYS A 54 -11.153 3.982 1.049 1.00 10.00 C ATOM 744 C LYS A 54 -11.610 5.436 0.903 1.00 10.00 C ATOM 745 O LYS A 54 -12.022 6.072 1.869 1.00 10.00 O ATOM 746 CB LYS A 54 -11.351 3.461 2.476 1.00 10.00 C ATOM 747 CG LYS A 54 -11.114 1.951 2.612 1.00 10.00 C ATOM 748 CD LYS A 54 -11.749 1.383 3.891 1.00 10.00 C ATOM 749 CE LYS A 54 -11.151 1.998 5.167 1.00 10.00 C ATOM 750 NZ LYS A 54 -11.774 1.455 6.392 1.00 10.00 N ATOM 0 H LYS A 54 -9.215 4.729 0.937 1.00 10.00 H new ATOM 0 HA LYS A 54 -11.760 3.348 0.402 1.00 10.00 H new ATOM 0 HB2 LYS A 54 -10.672 3.990 3.145 1.00 10.00 H new ATOM 0 HB3 LYS A 54 -12.365 3.693 2.802 1.00 10.00 H new ATOM 0 HG2 LYS A 54 -11.528 1.439 1.743 1.00 10.00 H new ATOM 0 HG3 LYS A 54 -10.043 1.751 2.619 1.00 10.00 H new ATOM 0 HD2 LYS A 54 -12.823 1.566 3.872 1.00 10.00 H new ATOM 0 HD3 LYS A 54 -11.610 0.302 3.913 1.00 10.00 H new ATOM 0 HE2 LYS A 54 -10.078 1.808 5.192 1.00 10.00 H new ATOM 0 HE3 LYS A 54 -11.282 3.080 5.143 1.00 10.00 H new ATOM 0 HZ1 LYS A 54 -11.340 1.897 7.227 1.00 10.00 H new ATOM 0 HZ2 LYS A 54 -12.794 1.659 6.382 1.00 10.00 H new ATOM 0 HZ3 LYS A 54 -11.627 0.426 6.430 1.00 10.00 H new ATOM 764 N SER A 55 -11.525 5.951 -0.323 1.00 10.00 N ATOM 765 CA SER A 55 -11.943 7.302 -0.694 1.00 10.00 C ATOM 766 C SER A 55 -12.382 7.359 -2.158 1.00 10.00 C ATOM 767 O SER A 55 -13.338 8.058 -2.475 1.00 10.00 O ATOM 768 CB SER A 55 -10.819 8.309 -0.422 1.00 10.00 C ATOM 769 OG SER A 55 -11.288 9.636 -0.576 1.00 10.00 O ATOM 0 H SER A 55 -11.151 5.422 -1.111 1.00 10.00 H new ATOM 0 HA SER A 55 -12.801 7.572 -0.078 1.00 10.00 H new ATOM 0 HB2 SER A 55 -10.435 8.169 0.588 1.00 10.00 H new ATOM 0 HB3 SER A 55 -9.990 8.129 -1.106 1.00 10.00 H new ATOM 0 HG SER A 55 -10.557 10.264 -0.397 1.00 10.00 H new ATOM 775 N ASP A 56 -11.661 6.656 -3.035 1.00 10.00 N ATOM 776 CA ASP A 56 -11.940 6.492 -4.444 1.00 10.00 C ATOM 777 C ASP A 56 -11.804 7.826 -5.170 1.00 10.00 C ATOM 778 O ASP A 56 -12.750 8.363 -5.739 1.00 10.00 O ATOM 779 CB ASP A 56 -13.271 5.756 -4.658 1.00 10.00 C ATOM 780 CG ASP A 56 -13.236 4.919 -5.925 1.00 10.00 C ATOM 781 OD1 ASP A 56 -12.231 4.188 -6.069 1.00 10.00 O ATOM 782 OD2 ASP A 56 -14.198 5.006 -6.714 1.00 10.00 O ATOM 0 H ASP A 56 -10.816 6.159 -2.752 1.00 10.00 H new ATOM 0 HA ASP A 56 -11.194 5.842 -4.902 1.00 10.00 H new ATOM 0 HB2 ASP A 56 -13.478 5.115 -3.801 1.00 10.00 H new ATOM 0 HB3 ASP A 56 -14.084 6.479 -4.719 1.00 10.00 H new ATOM 787 N GLN A 57 -10.588 8.373 -5.103 1.00 10.00 N ATOM 788 CA GLN A 57 -10.200 9.670 -5.627 1.00 10.00 C ATOM 789 C GLN A 57 -8.795 9.527 -6.230 1.00 10.00 C ATOM 790 O GLN A 57 -8.043 8.657 -5.791 1.00 10.00 O ATOM 791 CB GLN A 57 -10.198 10.674 -4.463 1.00 10.00 C ATOM 792 CG GLN A 57 -11.601 11.029 -3.948 1.00 10.00 C ATOM 793 CD GLN A 57 -12.429 11.795 -4.977 1.00 10.00 C ATOM 794 OE1 GLN A 57 -12.343 13.015 -5.062 1.00 10.00 O ATOM 795 NE2 GLN A 57 -13.235 11.096 -5.769 1.00 10.00 N ATOM 0 H GLN A 57 -9.809 7.890 -4.655 1.00 10.00 H new ATOM 0 HA GLN A 57 -10.887 10.023 -6.396 1.00 10.00 H new ATOM 0 HB2 GLN A 57 -9.613 10.262 -3.641 1.00 10.00 H new ATOM 0 HB3 GLN A 57 -9.697 11.587 -4.784 1.00 10.00 H new ATOM 0 HG2 GLN A 57 -12.126 10.114 -3.674 1.00 10.00 H new ATOM 0 HG3 GLN A 57 -11.510 11.628 -3.042 1.00 10.00 H new ATOM 0 HE21 GLN A 57 -13.287 10.082 -5.676 1.00 10.00 H new ATOM 0 HE22 GLN A 57 -13.802 11.574 -6.470 1.00 10.00 H new ATOM 804 N PRO A 58 -8.430 10.340 -7.234 1.00 10.00 N ATOM 805 CA PRO A 58 -7.133 10.261 -7.890 1.00 10.00 C ATOM 806 C PRO A 58 -6.033 10.835 -6.986 1.00 10.00 C ATOM 807 O PRO A 58 -5.788 12.040 -7.011 1.00 10.00 O ATOM 808 CB PRO A 58 -7.301 11.056 -9.190 1.00 10.00 C ATOM 809 CG PRO A 58 -8.367 12.094 -8.838 1.00 10.00 C ATOM 810 CD PRO A 58 -9.277 11.334 -7.875 1.00 10.00 C ATOM 0 HA PRO A 58 -6.825 9.236 -8.097 1.00 10.00 H new ATOM 0 HB2 PRO A 58 -6.367 11.528 -9.496 1.00 10.00 H new ATOM 0 HB3 PRO A 58 -7.620 10.417 -10.013 1.00 10.00 H new ATOM 0 HG2 PRO A 58 -7.932 12.978 -8.371 1.00 10.00 H new ATOM 0 HG3 PRO A 58 -8.907 12.434 -9.721 1.00 10.00 H new ATOM 0 HD2 PRO A 58 -9.717 12.007 -7.139 1.00 10.00 H new ATOM 0 HD3 PRO A 58 -10.102 10.861 -8.407 1.00 10.00 H new ATOM 818 N ILE A 59 -5.366 9.993 -6.184 1.00 10.00 N ATOM 819 CA ILE A 59 -4.352 10.468 -5.237 1.00 10.00 C ATOM 820 C ILE A 59 -2.950 10.370 -5.855 1.00 10.00 C ATOM 821 O ILE A 59 -2.657 9.469 -6.643 1.00 10.00 O ATOM 822 CB ILE A 59 -4.447 9.765 -3.865 1.00 10.00 C ATOM 823 CG1 ILE A 59 -5.868 9.627 -3.303 1.00 10.00 C ATOM 824 CG2 ILE A 59 -3.535 10.436 -2.825 1.00 10.00 C ATOM 825 CD1 ILE A 59 -6.567 10.969 -3.155 1.00 10.00 C ATOM 0 H ILE A 59 -5.511 8.983 -6.173 1.00 10.00 H new ATOM 0 HA ILE A 59 -4.552 11.521 -5.037 1.00 10.00 H new ATOM 0 HB ILE A 59 -4.103 8.749 -4.061 1.00 10.00 H new ATOM 0 HG12 ILE A 59 -6.455 8.986 -3.961 1.00 10.00 H new ATOM 0 HG13 ILE A 59 -5.825 9.134 -2.332 1.00 10.00 H new ATOM 0 HG21 ILE A 59 -3.627 9.916 -1.871 1.00 10.00 H new ATOM 0 HG22 ILE A 59 -2.500 10.391 -3.165 1.00 10.00 H new ATOM 0 HG23 ILE A 59 -3.830 11.478 -2.700 1.00 10.00 H new ATOM 0 HD11 ILE A 59 -7.569 10.815 -2.754 1.00 10.00 H new ATOM 0 HD12 ILE A 59 -5.997 11.603 -2.476 1.00 10.00 H new ATOM 0 HD13 ILE A 59 -6.637 11.452 -4.129 1.00 10.00 H new ATOM 837 N LYS A 60 -2.096 11.332 -5.491 1.00 10.00 N ATOM 838 CA LYS A 60 -0.782 11.604 -6.051 1.00 10.00 C ATOM 839 C LYS A 60 0.244 11.770 -4.916 1.00 10.00 C ATOM 840 O LYS A 60 0.561 12.882 -4.491 1.00 10.00 O ATOM 841 CB LYS A 60 -0.893 12.845 -6.957 1.00 10.00 C ATOM 842 CG LYS A 60 -1.642 14.028 -6.318 1.00 10.00 C ATOM 843 CD LYS A 60 -1.804 15.182 -7.312 1.00 10.00 C ATOM 844 CE LYS A 60 -2.498 16.346 -6.588 1.00 10.00 C ATOM 845 NZ LYS A 60 -2.691 17.533 -7.446 1.00 10.00 N ATOM 0 H LYS A 60 -2.329 11.985 -4.742 1.00 10.00 H new ATOM 0 HA LYS A 60 -0.429 10.774 -6.662 1.00 10.00 H new ATOM 0 HB2 LYS A 60 0.110 13.171 -7.232 1.00 10.00 H new ATOM 0 HB3 LYS A 60 -1.401 12.563 -7.879 1.00 10.00 H new ATOM 0 HG2 LYS A 60 -2.623 13.699 -5.976 1.00 10.00 H new ATOM 0 HG3 LYS A 60 -1.098 14.375 -5.439 1.00 10.00 H new ATOM 0 HD2 LYS A 60 -0.832 15.496 -7.691 1.00 10.00 H new ATOM 0 HD3 LYS A 60 -2.394 14.863 -8.171 1.00 10.00 H new ATOM 0 HE2 LYS A 60 -3.468 16.010 -6.220 1.00 10.00 H new ATOM 0 HE3 LYS A 60 -1.907 16.628 -5.717 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 -3.163 18.282 -6.901 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 -1.767 17.876 -7.777 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 -3.279 17.278 -8.265 1.00 10.00 H new ATOM 859 N LEU A 61 0.772 10.656 -4.407 1.00 10.00 N ATOM 860 CA LEU A 61 1.634 10.648 -3.227 1.00 10.00 C ATOM 861 C LEU A 61 3.080 10.988 -3.593 1.00 10.00 C ATOM 862 O LEU A 61 3.966 10.137 -3.544 1.00 10.00 O ATOM 863 CB LEU A 61 1.551 9.277 -2.547 1.00 10.00 C ATOM 864 CG LEU A 61 0.217 9.033 -1.828 1.00 10.00 C ATOM 865 CD1 LEU A 61 0.160 7.561 -1.426 1.00 10.00 C ATOM 866 CD2 LEU A 61 0.062 9.903 -0.573 1.00 10.00 C ATOM 0 H LEU A 61 0.612 9.730 -4.804 1.00 10.00 H new ATOM 0 HA LEU A 61 1.288 11.415 -2.534 1.00 10.00 H new ATOM 0 HB2 LEU A 61 1.699 8.499 -3.296 1.00 10.00 H new ATOM 0 HB3 LEU A 61 2.365 9.187 -1.828 1.00 10.00 H new ATOM 0 HG LEU A 61 -0.593 9.297 -2.507 1.00 10.00 H new ATOM 0 HD11 LEU A 61 -0.780 7.360 -0.912 1.00 10.00 H new ATOM 0 HD12 LEU A 61 0.226 6.938 -2.318 1.00 10.00 H new ATOM 0 HD13 LEU A 61 0.993 7.333 -0.761 1.00 10.00 H new ATOM 0 HD21 LEU A 61 -0.898 9.693 -0.101 1.00 10.00 H new ATOM 0 HD22 LEU A 61 0.867 9.679 0.127 1.00 10.00 H new ATOM 0 HD23 LEU A 61 0.106 10.956 -0.852 1.00 10.00 H new ATOM 878 N VAL A 62 3.341 12.256 -3.914 1.00 10.00 N ATOM 879 CA VAL A 62 4.668 12.676 -4.364 1.00 10.00 C ATOM 880 C VAL A 62 5.594 12.935 -3.170 1.00 10.00 C ATOM 881 O VAL A 62 6.163 14.016 -3.045 1.00 10.00 O ATOM 882 CB VAL A 62 4.561 13.924 -5.269 1.00 10.00 C ATOM 883 CG1 VAL A 62 5.857 14.128 -6.072 1.00 10.00 C ATOM 884 CG2 VAL A 62 3.385 13.802 -6.239 1.00 10.00 C ATOM 0 H VAL A 62 2.653 13.008 -3.871 1.00 10.00 H new ATOM 0 HA VAL A 62 5.104 11.868 -4.951 1.00 10.00 H new ATOM 0 HB VAL A 62 4.398 14.784 -4.619 1.00 10.00 H new ATOM 0 HG11 VAL A 62 5.759 15.012 -6.702 1.00 10.00 H new ATOM 0 HG12 VAL A 62 6.693 14.262 -5.386 1.00 10.00 H new ATOM 0 HG13 VAL A 62 6.038 13.254 -6.698 1.00 10.00 H new ATOM 0 HG21 VAL A 62 3.334 14.694 -6.863 1.00 10.00 H new ATOM 0 HG22 VAL A 62 3.524 12.925 -6.871 1.00 10.00 H new ATOM 0 HG23 VAL A 62 2.458 13.700 -5.675 1.00 10.00 H new ATOM 894 N GLY A 63 5.781 11.952 -2.288 1.00 10.00 N ATOM 895 CA GLY A 63 6.909 11.991 -1.372 1.00 10.00 C ATOM 896 C GLY A 63 7.160 10.627 -0.748 1.00 10.00 C ATOM 897 O GLY A 63 6.239 9.821 -0.655 1.00 10.00 O ATOM 0 H GLY A 63 5.176 11.136 -2.193 1.00 10.00 H new ATOM 0 HA2 GLY A 63 7.802 12.320 -1.904 1.00 10.00 H new ATOM 0 HA3 GLY A 63 6.718 12.723 -0.587 1.00 10.00 H new ATOM 901 N ALA A 64 8.394 10.391 -0.296 1.00 10.00 N ATOM 902 CA ALA A 64 8.737 9.306 0.613 1.00 10.00 C ATOM 903 C ALA A 64 10.065 9.625 1.305 1.00 10.00 C ATOM 904 O ALA A 64 11.033 8.890 1.146 1.00 10.00 O ATOM 905 CB ALA A 64 8.800 7.989 -0.163 1.00 10.00 C ATOM 0 H ALA A 64 9.196 10.963 -0.560 1.00 10.00 H new ATOM 0 HA ALA A 64 7.973 9.201 1.384 1.00 10.00 H new ATOM 0 HB1 ALA A 64 9.057 7.177 0.518 1.00 10.00 H new ATOM 0 HB2 ALA A 64 7.830 7.788 -0.618 1.00 10.00 H new ATOM 0 HB3 ALA A 64 9.558 8.062 -0.943 1.00 10.00 H new ATOM 911 N ALA A 65 10.149 10.726 2.053 1.00 10.00 N ATOM 912 CA ALA A 65 11.408 11.129 2.674 1.00 10.00 C ATOM 913 C ALA A 65 11.611 10.336 3.966 1.00 10.00 C ATOM 914 O ALA A 65 10.662 9.752 4.483 1.00 10.00 O ATOM 915 CB ALA A 65 11.385 12.636 2.941 1.00 10.00 C ATOM 0 H ALA A 65 9.365 11.350 2.242 1.00 10.00 H new ATOM 0 HA ALA A 65 12.243 10.916 2.007 1.00 10.00 H new ATOM 0 HB1 ALA A 65 12.324 12.938 3.405 1.00 10.00 H new ATOM 0 HB2 ALA A 65 11.257 13.170 2.000 1.00 10.00 H new ATOM 0 HB3 ALA A 65 10.558 12.875 3.609 1.00 10.00 H new ATOM 921 N THR A 66 12.842 10.281 4.487 1.00 10.00 N ATOM 922 CA THR A 66 13.157 9.512 5.687 1.00 10.00 C ATOM 923 C THR A 66 14.566 9.875 6.174 1.00 10.00 C ATOM 924 O THR A 66 15.458 10.128 5.353 1.00 10.00 O ATOM 925 CB THR A 66 13.036 8.002 5.383 1.00 10.00 C ATOM 926 OG1 THR A 66 13.261 7.202 6.527 1.00 10.00 O ATOM 927 CG2 THR A 66 13.962 7.556 4.249 1.00 10.00 C ATOM 0 H THR A 66 13.643 10.769 4.087 1.00 10.00 H new ATOM 0 HA THR A 66 12.451 9.754 6.481 1.00 10.00 H new ATOM 0 HB THR A 66 12.006 7.855 5.059 1.00 10.00 H new ATOM 0 HG1 THR A 66 13.172 6.256 6.287 1.00 10.00 H new ATOM 0 HG21 THR A 66 13.837 6.487 4.076 1.00 10.00 H new ATOM 0 HG22 THR A 66 13.712 8.102 3.339 1.00 10.00 H new ATOM 0 HG23 THR A 66 14.997 7.761 4.523 1.00 10.00 H new ATOM 935 N PRO A 67 14.834 9.851 7.487 1.00 10.00 N ATOM 936 CA PRO A 67 16.185 9.951 8.014 1.00 10.00 C ATOM 937 C PRO A 67 16.875 8.584 7.887 1.00 10.00 C ATOM 938 O PRO A 67 17.306 8.016 8.884 1.00 10.00 O ATOM 939 CB PRO A 67 15.987 10.391 9.469 1.00 10.00 C ATOM 940 CG PRO A 67 14.692 9.679 9.859 1.00 10.00 C ATOM 941 CD PRO A 67 13.869 9.719 8.570 1.00 10.00 C ATOM 0 HA PRO A 67 16.825 10.656 7.485 1.00 10.00 H new ATOM 0 HB2 PRO A 67 16.822 10.089 10.101 1.00 10.00 H new ATOM 0 HB3 PRO A 67 15.897 11.474 9.556 1.00 10.00 H new ATOM 0 HG2 PRO A 67 14.878 8.656 10.186 1.00 10.00 H new ATOM 0 HG3 PRO A 67 14.183 10.188 10.677 1.00 10.00 H new ATOM 0 HD2 PRO A 67 13.276 8.812 8.457 1.00 10.00 H new ATOM 0 HD3 PRO A 67 13.172 10.557 8.577 1.00 10.00 H new ATOM 949 N LEU A 68 16.963 8.040 6.664 1.00 10.00 N ATOM 950 CA LEU A 68 17.498 6.699 6.420 1.00 10.00 C ATOM 951 C LEU A 68 18.291 6.682 5.108 1.00 10.00 C ATOM 952 O LEU A 68 19.518 6.589 5.129 1.00 10.00 O ATOM 953 CB LEU A 68 16.344 5.679 6.472 1.00 10.00 C ATOM 954 CG LEU A 68 16.788 4.214 6.610 1.00 10.00 C ATOM 955 CD1 LEU A 68 15.569 3.366 6.989 1.00 10.00 C ATOM 956 CD2 LEU A 68 17.401 3.654 5.320 1.00 10.00 C ATOM 0 H LEU A 68 16.663 8.522 5.816 1.00 10.00 H new ATOM 0 HA LEU A 68 18.206 6.411 7.197 1.00 10.00 H new ATOM 0 HB2 LEU A 68 15.694 5.928 7.311 1.00 10.00 H new ATOM 0 HB3 LEU A 68 15.747 5.780 5.566 1.00 10.00 H new ATOM 0 HG LEU A 68 17.559 4.175 7.379 1.00 10.00 H new ATOM 0 HD11 LEU A 68 15.869 2.323 7.091 1.00 10.00 H new ATOM 0 HD12 LEU A 68 15.160 3.720 7.935 1.00 10.00 H new ATOM 0 HD13 LEU A 68 14.810 3.451 6.211 1.00 10.00 H new ATOM 0 HD21 LEU A 68 17.696 2.617 5.478 1.00 10.00 H new ATOM 0 HD22 LEU A 68 16.666 3.704 4.516 1.00 10.00 H new ATOM 0 HD23 LEU A 68 18.277 4.243 5.048 1.00 10.00 H new ATOM 968 N ALA A 69 17.602 6.799 3.967 1.00 10.00 N ATOM 969 CA ALA A 69 18.194 6.830 2.633 1.00 10.00 C ATOM 970 C ALA A 69 17.891 8.157 1.935 1.00 10.00 C ATOM 971 O ALA A 69 17.118 8.966 2.450 1.00 10.00 O ATOM 972 CB ALA A 69 17.698 5.633 1.828 1.00 10.00 C ATOM 0 H ALA A 69 16.585 6.877 3.951 1.00 10.00 H new ATOM 0 HA ALA A 69 19.279 6.758 2.715 1.00 10.00 H new ATOM 0 HB1 ALA A 69 18.140 5.656 0.832 1.00 10.00 H new ATOM 0 HB2 ALA A 69 17.987 4.711 2.332 1.00 10.00 H new ATOM 0 HB3 ALA A 69 16.612 5.676 1.744 1.00 10.00 H new ATOM 978 N THR A 70 18.586 8.426 0.831 1.00 10.00 N ATOM 979 CA THR A 70 18.796 9.764 0.290 1.00 10.00 C ATOM 980 C THR A 70 17.882 10.055 -0.899 1.00 10.00 C ATOM 981 O THR A 70 17.405 11.177 -1.036 1.00 10.00 O ATOM 982 CB THR A 70 20.276 9.909 -0.102 1.00 10.00 C ATOM 983 OG1 THR A 70 21.090 9.554 0.998 1.00 10.00 O ATOM 984 CG2 THR A 70 20.636 11.339 -0.507 1.00 10.00 C ATOM 0 H THR A 70 19.031 7.697 0.274 1.00 10.00 H new ATOM 0 HA THR A 70 18.541 10.496 1.056 1.00 10.00 H new ATOM 0 HB THR A 70 20.444 9.253 -0.956 1.00 10.00 H new ATOM 0 HG1 THR A 70 21.137 8.578 1.069 1.00 10.00 H new ATOM 0 HG21 THR A 70 21.692 11.387 -0.774 1.00 10.00 H new ATOM 0 HG22 THR A 70 20.031 11.638 -1.363 1.00 10.00 H new ATOM 0 HG23 THR A 70 20.442 12.013 0.327 1.00 10.00 H new ATOM 992 N SER A 71 17.678 9.068 -1.774 1.00 10.00 N ATOM 993 CA SER A 71 16.985 9.222 -3.045 1.00 10.00 C ATOM 994 C SER A 71 15.617 8.524 -2.978 1.00 10.00 C ATOM 995 O SER A 71 15.535 7.329 -3.264 1.00 10.00 O ATOM 996 CB SER A 71 17.878 8.641 -4.152 1.00 10.00 C ATOM 997 OG SER A 71 17.443 9.066 -5.429 1.00 10.00 O ATOM 0 H SER A 71 18.001 8.115 -1.609 1.00 10.00 H new ATOM 0 HA SER A 71 16.797 10.273 -3.265 1.00 10.00 H new ATOM 0 HB2 SER A 71 18.910 8.953 -3.993 1.00 10.00 H new ATOM 0 HB3 SER A 71 17.863 7.552 -4.102 1.00 10.00 H new ATOM 0 HG SER A 71 18.027 8.685 -6.117 1.00 10.00 H new ATOM 1003 N PRO A 72 14.542 9.227 -2.580 1.00 10.00 N ATOM 1004 CA PRO A 72 13.205 8.660 -2.514 1.00 10.00 C ATOM 1005 C PRO A 72 12.607 8.581 -3.912 1.00 10.00 C ATOM 1006 O PRO A 72 11.977 9.521 -4.393 1.00 10.00 O ATOM 1007 CB PRO A 72 12.431 9.593 -1.585 1.00 10.00 C ATOM 1008 CG PRO A 72 13.064 10.957 -1.853 1.00 10.00 C ATOM 1009 CD PRO A 72 14.533 10.591 -2.068 1.00 10.00 C ATOM 0 HA PRO A 72 13.183 7.639 -2.132 1.00 10.00 H new ATOM 0 HB2 PRO A 72 11.365 9.593 -1.811 1.00 10.00 H new ATOM 0 HB3 PRO A 72 12.535 9.299 -0.541 1.00 10.00 H new ATOM 0 HG2 PRO A 72 12.632 11.442 -2.729 1.00 10.00 H new ATOM 0 HG3 PRO A 72 12.933 11.640 -1.013 1.00 10.00 H new ATOM 0 HD2 PRO A 72 15.005 11.275 -2.774 1.00 10.00 H new ATOM 0 HD3 PRO A 72 15.092 10.660 -1.135 1.00 10.00 H new ATOM 1017 N MET A 73 12.834 7.446 -4.567 1.00 10.00 N ATOM 1018 CA MET A 73 12.525 7.254 -5.970 1.00 10.00 C ATOM 1019 C MET A 73 11.338 6.311 -6.108 1.00 10.00 C ATOM 1020 O MET A 73 11.409 5.126 -5.784 1.00 10.00 O ATOM 1021 CB MET A 73 13.762 6.708 -6.674 1.00 10.00 C ATOM 1022 CG MET A 73 14.890 7.744 -6.788 1.00 10.00 C ATOM 1023 SD MET A 73 14.984 8.711 -8.322 1.00 10.00 S ATOM 1024 CE MET A 73 13.425 9.621 -8.331 1.00 10.00 C ATOM 0 H MET A 73 13.245 6.624 -4.125 1.00 10.00 H new ATOM 0 HA MET A 73 12.251 8.201 -6.435 1.00 10.00 H new ATOM 0 HB2 MET A 73 14.129 5.837 -6.131 1.00 10.00 H new ATOM 0 HB3 MET A 73 13.486 6.368 -7.672 1.00 10.00 H new ATOM 0 HG2 MET A 73 14.793 8.441 -5.956 1.00 10.00 H new ATOM 0 HG3 MET A 73 15.839 7.224 -6.659 1.00 10.00 H new ATOM 0 HE1 MET A 73 13.467 10.407 -9.085 1.00 10.00 H new ATOM 0 HE2 MET A 73 12.607 8.939 -8.563 1.00 10.00 H new ATOM 0 HE3 MET A 73 13.258 10.067 -7.351 1.00 10.00 H new ATOM 1034 N LEU A 74 10.237 6.851 -6.615 1.00 10.00 N ATOM 1035 CA LEU A 74 8.984 6.136 -6.750 1.00 10.00 C ATOM 1036 C LEU A 74 9.051 5.258 -8.005 1.00 10.00 C ATOM 1037 O LEU A 74 9.521 5.699 -9.055 1.00 10.00 O ATOM 1038 CB LEU A 74 7.843 7.167 -6.803 1.00 10.00 C ATOM 1039 CG LEU A 74 7.707 7.918 -5.456 1.00 10.00 C ATOM 1040 CD1 LEU A 74 8.210 9.362 -5.561 1.00 10.00 C ATOM 1041 CD2 LEU A 74 6.264 7.914 -4.937 1.00 10.00 C ATOM 0 H LEU A 74 10.194 7.814 -6.948 1.00 10.00 H new ATOM 0 HA LEU A 74 8.798 5.477 -5.902 1.00 10.00 H new ATOM 0 HB2 LEU A 74 8.032 7.882 -7.604 1.00 10.00 H new ATOM 0 HB3 LEU A 74 6.905 6.664 -7.039 1.00 10.00 H new ATOM 0 HG LEU A 74 8.331 7.378 -4.743 1.00 10.00 H new ATOM 0 HD11 LEU A 74 8.099 9.857 -4.596 1.00 10.00 H new ATOM 0 HD12 LEU A 74 9.261 9.361 -5.849 1.00 10.00 H new ATOM 0 HD13 LEU A 74 7.628 9.896 -6.312 1.00 10.00 H new ATOM 0 HD21 LEU A 74 6.216 8.452 -3.990 1.00 10.00 H new ATOM 0 HD22 LEU A 74 5.614 8.401 -5.664 1.00 10.00 H new ATOM 0 HD23 LEU A 74 5.934 6.886 -4.787 1.00 10.00 H new ATOM 1053 N MET A 75 8.620 4.000 -7.874 1.00 10.00 N ATOM 1054 CA MET A 75 8.539 3.016 -8.944 1.00 10.00 C ATOM 1055 C MET A 75 7.092 2.549 -9.047 1.00 10.00 C ATOM 1056 O MET A 75 6.245 2.981 -8.271 1.00 10.00 O ATOM 1057 CB MET A 75 9.516 1.854 -8.657 1.00 10.00 C ATOM 1058 CG MET A 75 10.737 1.909 -9.584 1.00 10.00 C ATOM 1059 SD MET A 75 12.348 1.734 -8.797 1.00 10.00 S ATOM 1060 CE MET A 75 13.401 1.932 -10.256 1.00 10.00 C ATOM 0 H MET A 75 8.305 3.629 -6.978 1.00 10.00 H new ATOM 0 HA MET A 75 8.833 3.446 -9.902 1.00 10.00 H new ATOM 0 HB2 MET A 75 9.843 1.900 -7.618 1.00 10.00 H new ATOM 0 HB3 MET A 75 9.001 0.902 -8.787 1.00 10.00 H new ATOM 0 HG2 MET A 75 10.634 1.122 -10.331 1.00 10.00 H new ATOM 0 HG3 MET A 75 10.719 2.859 -10.117 1.00 10.00 H new ATOM 0 HE1 MET A 75 14.181 1.170 -10.248 1.00 10.00 H new ATOM 0 HE2 MET A 75 12.798 1.824 -11.157 1.00 10.00 H new ATOM 0 HE3 MET A 75 13.860 2.921 -10.242 1.00 10.00 H new ATOM 1070 N THR A 76 6.787 1.715 -10.044 1.00 10.00 N ATOM 1071 CA THR A 76 5.484 1.095 -10.155 1.00 10.00 C ATOM 1072 C THR A 76 5.598 -0.134 -11.049 1.00 10.00 C ATOM 1073 O THR A 76 6.303 -0.098 -12.058 1.00 10.00 O ATOM 1074 CB THR A 76 4.434 2.096 -10.614 1.00 10.00 C ATOM 1075 OG1 THR A 76 3.190 1.445 -10.617 1.00 10.00 O ATOM 1076 CG2 THR A 76 4.753 2.642 -12.003 1.00 10.00 C ATOM 0 H THR A 76 7.437 1.458 -10.787 1.00 10.00 H new ATOM 0 HA THR A 76 5.141 0.758 -9.177 1.00 10.00 H new ATOM 0 HB THR A 76 4.419 2.947 -9.933 1.00 10.00 H new ATOM 0 HG1 THR A 76 3.092 0.923 -9.793 1.00 10.00 H new ATOM 0 HG21 THR A 76 3.983 3.354 -12.300 1.00 10.00 H new ATOM 0 HG22 THR A 76 5.721 3.142 -11.984 1.00 10.00 H new ATOM 0 HG23 THR A 76 4.783 1.821 -12.719 1.00 10.00 H new ATOM 1084 N THR A 77 5.006 -1.263 -10.670 1.00 10.00 N ATOM 1085 CA THR A 77 5.088 -2.476 -11.466 1.00 10.00 C ATOM 1086 C THR A 77 3.898 -3.359 -11.102 1.00 10.00 C ATOM 1087 O THR A 77 4.031 -4.499 -10.670 1.00 10.00 O ATOM 1088 CB THR A 77 6.466 -3.156 -11.305 1.00 10.00 C ATOM 1089 OG1 THR A 77 7.425 -2.257 -10.788 1.00 10.00 O ATOM 1090 CG2 THR A 77 6.953 -3.732 -12.636 1.00 10.00 C ATOM 0 H THR A 77 4.463 -1.359 -9.812 1.00 10.00 H new ATOM 0 HA THR A 77 5.022 -2.256 -12.531 1.00 10.00 H new ATOM 0 HB THR A 77 6.343 -3.974 -10.595 1.00 10.00 H new ATOM 0 HG1 THR A 77 7.991 -2.721 -10.137 1.00 10.00 H new ATOM 0 HG21 THR A 77 7.925 -4.205 -12.494 1.00 10.00 H new ATOM 0 HG22 THR A 77 6.238 -4.472 -12.995 1.00 10.00 H new ATOM 0 HG23 THR A 77 7.043 -2.930 -13.368 1.00 10.00 H new ATOM 1098 N THR A 78 2.701 -2.808 -11.254 1.00 10.00 N ATOM 1099 CA THR A 78 1.450 -3.513 -11.013 1.00 10.00 C ATOM 1100 C THR A 78 0.358 -2.961 -11.930 1.00 10.00 C ATOM 1101 O THR A 78 0.030 -1.776 -11.887 1.00 10.00 O ATOM 1102 CB THR A 78 1.067 -3.416 -9.528 1.00 10.00 C ATOM 1103 OG1 THR A 78 1.957 -4.208 -8.770 1.00 10.00 O ATOM 1104 CG2 THR A 78 -0.341 -3.945 -9.250 1.00 10.00 C ATOM 0 H THR A 78 2.570 -1.842 -11.553 1.00 10.00 H new ATOM 0 HA THR A 78 1.571 -4.571 -11.247 1.00 10.00 H new ATOM 0 HB THR A 78 1.112 -2.361 -9.258 1.00 10.00 H new ATOM 0 HG1 THR A 78 2.709 -4.485 -9.334 1.00 10.00 H new ATOM 0 HG21 THR A 78 -0.561 -3.853 -8.186 1.00 10.00 H new ATOM 0 HG22 THR A 78 -1.067 -3.366 -9.822 1.00 10.00 H new ATOM 0 HG23 THR A 78 -0.400 -4.993 -9.544 1.00 10.00 H new ATOM 1112 N HIS A 79 -0.253 -3.842 -12.725 1.00 10.00 N ATOM 1113 CA HIS A 79 -1.408 -3.519 -13.551 1.00 10.00 C ATOM 1114 C HIS A 79 -2.620 -3.303 -12.639 1.00 10.00 C ATOM 1115 O HIS A 79 -3.417 -4.218 -12.456 1.00 10.00 O ATOM 1116 CB HIS A 79 -1.668 -4.651 -14.556 1.00 10.00 C ATOM 1117 CG HIS A 79 -0.630 -4.782 -15.640 1.00 10.00 C ATOM 1118 ND1 HIS A 79 -0.801 -4.359 -16.958 1.00 10.00 N ATOM 1119 CD2 HIS A 79 0.584 -5.398 -15.516 1.00 10.00 C ATOM 1120 CE1 HIS A 79 0.313 -4.734 -17.603 1.00 10.00 C ATOM 1121 NE2 HIS A 79 1.158 -5.364 -16.767 1.00 10.00 N ATOM 0 H HIS A 79 0.049 -4.813 -12.811 1.00 10.00 H new ATOM 0 HA HIS A 79 -1.222 -2.607 -14.118 1.00 10.00 H new ATOM 0 HB2 HIS A 79 -1.727 -5.594 -14.013 1.00 10.00 H new ATOM 0 HB3 HIS A 79 -2.641 -4.489 -15.021 1.00 10.00 H new ATOM 0 HD2 HIS A 79 1.007 -5.825 -14.619 1.00 10.00 H new ATOM 0 HE1 HIS A 79 0.506 -4.555 -18.650 1.00 10.00 H new ATOM 0 HE2 HIS A 79 2.068 -5.750 -17.017 1.00 10.00 H new ATOM 1129 N SER A 80 -2.715 -2.102 -12.056 1.00 10.00 N ATOM 1130 CA SER A 80 -3.722 -1.593 -11.113 1.00 10.00 C ATOM 1131 C SER A 80 -3.069 -0.663 -10.078 1.00 10.00 C ATOM 1132 O SER A 80 -3.786 -0.039 -9.296 1.00 10.00 O ATOM 1133 CB SER A 80 -4.535 -2.695 -10.401 1.00 10.00 C ATOM 1134 OG SER A 80 -5.500 -2.139 -9.524 1.00 10.00 O ATOM 0 H SER A 80 -2.015 -1.387 -12.253 1.00 10.00 H new ATOM 0 HA SER A 80 -4.437 -1.035 -11.718 1.00 10.00 H new ATOM 0 HB2 SER A 80 -5.032 -3.320 -11.143 1.00 10.00 H new ATOM 0 HB3 SER A 80 -3.861 -3.342 -9.840 1.00 10.00 H new ATOM 0 HG SER A 80 -5.248 -1.219 -9.301 1.00 10.00 H new ATOM 1140 N GLY A 81 -1.735 -0.590 -10.040 1.00 10.00 N ATOM 1141 CA GLY A 81 -1.012 0.396 -9.264 1.00 10.00 C ATOM 1142 C GLY A 81 -0.746 1.617 -10.130 1.00 10.00 C ATOM 1143 O GLY A 81 -1.603 2.009 -10.922 1.00 10.00 O ATOM 0 H GLY A 81 -1.128 -1.226 -10.557 1.00 10.00 H new ATOM 0 HA2 GLY A 81 -1.590 0.678 -8.384 1.00 10.00 H new ATOM 0 HA3 GLY A 81 -0.071 -0.023 -8.907 1.00 10.00 H new ATOM 1147 N GLY A 82 0.441 2.209 -9.997 1.00 10.00 N ATOM 1148 CA GLY A 82 0.819 3.352 -10.822 1.00 10.00 C ATOM 1149 C GLY A 82 0.805 3.001 -12.315 1.00 10.00 C ATOM 1150 O GLY A 82 0.167 3.684 -13.113 1.00 10.00 O ATOM 0 H GLY A 82 1.153 1.916 -9.328 1.00 10.00 H new ATOM 0 HA2 GLY A 82 0.133 4.178 -10.636 1.00 10.00 H new ATOM 0 HA3 GLY A 82 1.814 3.693 -10.537 1.00 10.00 H new ATOM 1154 N MET A 83 1.532 1.945 -12.689 1.00 10.00 N ATOM 1155 CA MET A 83 1.685 1.421 -14.035 1.00 10.00 C ATOM 1156 C MET A 83 2.400 0.065 -13.924 1.00 10.00 C ATOM 1157 O MET A 83 2.535 -0.489 -12.833 1.00 10.00 O ATOM 1158 CB MET A 83 2.454 2.425 -14.924 1.00 10.00 C ATOM 1159 CG MET A 83 1.905 2.485 -16.358 1.00 10.00 C ATOM 1160 SD MET A 83 0.226 3.147 -16.514 1.00 10.00 S ATOM 1161 CE MET A 83 0.000 3.008 -18.301 1.00 10.00 C ATOM 0 H MET A 83 2.062 1.402 -12.008 1.00 10.00 H new ATOM 0 HA MET A 83 0.717 1.276 -14.514 1.00 10.00 H new ATOM 0 HB2 MET A 83 2.399 3.417 -14.476 1.00 10.00 H new ATOM 0 HB3 MET A 83 3.507 2.146 -14.953 1.00 10.00 H new ATOM 0 HG2 MET A 83 2.577 3.095 -16.962 1.00 10.00 H new ATOM 0 HG3 MET A 83 1.923 1.480 -16.779 1.00 10.00 H new ATOM 0 HE1 MET A 83 -0.990 3.375 -18.572 1.00 10.00 H new ATOM 0 HE2 MET A 83 0.759 3.601 -18.811 1.00 10.00 H new ATOM 0 HE3 MET A 83 0.094 1.964 -18.600 1.00 10.00 H new ATOM 1171 N ALA A 84 2.891 -0.461 -15.048 1.00 10.00 N ATOM 1172 CA ALA A 84 3.545 -1.752 -15.150 1.00 10.00 C ATOM 1173 C ALA A 84 4.938 -1.487 -15.705 1.00 10.00 C ATOM 1174 O ALA A 84 5.260 -1.908 -16.812 1.00 10.00 O ATOM 1175 CB ALA A 84 2.718 -2.653 -16.067 1.00 10.00 C ATOM 0 H ALA A 84 2.838 0.026 -15.943 1.00 10.00 H new ATOM 0 HA ALA A 84 3.628 -2.261 -14.190 1.00 10.00 H new ATOM 0 HB1 ALA A 84 3.200 -3.627 -16.151 1.00 10.00 H new ATOM 0 HB2 ALA A 84 1.719 -2.778 -15.650 1.00 10.00 H new ATOM 0 HB3 ALA A 84 2.645 -2.198 -17.055 1.00 10.00 H new ATOM 1181 N GLY A 85 5.730 -0.700 -14.973 1.00 10.00 N ATOM 1182 CA GLY A 85 6.917 -0.087 -15.538 1.00 10.00 C ATOM 1183 C GLY A 85 7.848 0.388 -14.432 1.00 10.00 C ATOM 1184 O GLY A 85 7.730 1.530 -13.991 1.00 10.00 O ATOM 0 H GLY A 85 5.565 -0.477 -13.991 1.00 10.00 H new ATOM 0 HA2 GLY A 85 7.435 -0.803 -16.175 1.00 10.00 H new ATOM 0 HA3 GLY A 85 6.633 0.755 -16.170 1.00 10.00 H new ATOM 1188 N MET A 86 8.763 -0.479 -13.979 1.00 10.00 N ATOM 1189 CA MET A 86 9.602 -0.243 -12.807 1.00 10.00 C ATOM 1190 C MET A 86 10.735 0.735 -13.140 1.00 10.00 C ATOM 1191 O MET A 86 11.916 0.402 -13.111 1.00 10.00 O ATOM 1192 CB MET A 86 10.125 -1.591 -12.294 1.00 10.00 C ATOM 1193 CG MET A 86 10.516 -1.635 -10.807 1.00 10.00 C ATOM 1194 SD MET A 86 12.279 -1.432 -10.416 1.00 10.00 S ATOM 1195 CE MET A 86 12.779 -3.164 -10.307 1.00 10.00 C ATOM 0 H MET A 86 8.940 -1.378 -14.427 1.00 10.00 H new ATOM 0 HA MET A 86 9.017 0.223 -12.014 1.00 10.00 H new ATOM 0 HB2 MET A 86 9.361 -2.347 -12.472 1.00 10.00 H new ATOM 0 HB3 MET A 86 10.995 -1.871 -12.888 1.00 10.00 H new ATOM 0 HG2 MET A 86 9.961 -0.855 -10.287 1.00 10.00 H new ATOM 0 HG3 MET A 86 10.185 -2.589 -10.397 1.00 10.00 H new ATOM 0 HE1 MET A 86 13.842 -3.222 -10.072 1.00 10.00 H new ATOM 0 HE2 MET A 86 12.206 -3.659 -9.523 1.00 10.00 H new ATOM 0 HE3 MET A 86 12.591 -3.658 -11.261 1.00 10.00 H new ATOM 1205 N LYS A 87 10.346 1.962 -13.459 1.00 10.00 N ATOM 1206 CA LYS A 87 11.202 3.092 -13.777 1.00 10.00 C ATOM 1207 C LYS A 87 10.993 4.162 -12.711 1.00 10.00 C ATOM 1208 O LYS A 87 10.023 4.096 -11.961 1.00 10.00 O ATOM 1209 CB LYS A 87 10.852 3.608 -15.182 1.00 10.00 C ATOM 1210 CG LYS A 87 9.459 4.258 -15.237 1.00 10.00 C ATOM 1211 CD LYS A 87 8.784 4.192 -16.614 1.00 10.00 C ATOM 1212 CE LYS A 87 9.474 5.037 -17.695 1.00 10.00 C ATOM 1213 NZ LYS A 87 10.712 4.418 -18.212 1.00 10.00 N ATOM 0 H LYS A 87 9.357 2.208 -13.505 1.00 10.00 H new ATOM 0 HA LYS A 87 12.254 2.806 -13.781 1.00 10.00 H new ATOM 0 HB2 LYS A 87 11.602 4.334 -15.497 1.00 10.00 H new ATOM 0 HB3 LYS A 87 10.892 2.781 -15.891 1.00 10.00 H new ATOM 0 HG2 LYS A 87 8.814 3.770 -14.506 1.00 10.00 H new ATOM 0 HG3 LYS A 87 9.546 5.303 -14.938 1.00 10.00 H new ATOM 0 HD2 LYS A 87 8.757 3.153 -16.943 1.00 10.00 H new ATOM 0 HD3 LYS A 87 7.750 4.522 -16.515 1.00 10.00 H new ATOM 0 HE2 LYS A 87 8.781 5.195 -18.522 1.00 10.00 H new ATOM 0 HE3 LYS A 87 9.710 6.019 -17.285 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 10.873 4.729 -19.191 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 11.518 4.707 -17.621 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 10.619 3.382 -18.188 1.00 10.00 H new ATOM 1227 N MET A 88 11.861 5.172 -12.675 1.00 10.00 N ATOM 1228 CA MET A 88 11.801 6.213 -11.662 1.00 10.00 C ATOM 1229 C MET A 88 10.694 7.179 -12.079 1.00 10.00 C ATOM 1230 O MET A 88 10.939 8.154 -12.787 1.00 10.00 O ATOM 1231 CB MET A 88 13.170 6.903 -11.578 1.00 10.00 C ATOM 1232 CG MET A 88 14.229 5.954 -11.006 1.00 10.00 C ATOM 1233 SD MET A 88 15.931 6.568 -11.080 1.00 10.00 S ATOM 1234 CE MET A 88 16.776 5.235 -10.201 1.00 10.00 C ATOM 0 H MET A 88 12.621 5.287 -13.346 1.00 10.00 H new ATOM 0 HA MET A 88 11.576 5.817 -10.672 1.00 10.00 H new ATOM 0 HB2 MET A 88 13.474 7.238 -12.570 1.00 10.00 H new ATOM 0 HB3 MET A 88 13.096 7.791 -10.951 1.00 10.00 H new ATOM 0 HG2 MET A 88 13.981 5.742 -9.966 1.00 10.00 H new ATOM 0 HG3 MET A 88 14.177 5.008 -11.546 1.00 10.00 H new ATOM 0 HE1 MET A 88 17.843 5.450 -10.153 1.00 10.00 H new ATOM 0 HE2 MET A 88 16.376 5.155 -9.190 1.00 10.00 H new ATOM 0 HE3 MET A 88 16.619 4.294 -10.729 1.00 10.00 H new ATOM 1244 N VAL A 89 9.455 6.854 -11.704 1.00 10.00 N ATOM 1245 CA VAL A 89 8.297 7.646 -12.081 1.00 10.00 C ATOM 1246 C VAL A 89 8.279 8.946 -11.271 1.00 10.00 C ATOM 1247 O VAL A 89 8.845 8.992 -10.179 1.00 10.00 O ATOM 1248 CB VAL A 89 6.986 6.840 -11.932 1.00 10.00 C ATOM 1249 CG1 VAL A 89 6.882 5.769 -13.022 1.00 10.00 C ATOM 1250 CG2 VAL A 89 6.805 6.180 -10.561 1.00 10.00 C ATOM 0 H VAL A 89 9.234 6.038 -11.134 1.00 10.00 H new ATOM 0 HA VAL A 89 8.372 7.906 -13.137 1.00 10.00 H new ATOM 0 HB VAL A 89 6.187 7.574 -12.037 1.00 10.00 H new ATOM 0 HG11 VAL A 89 5.952 5.213 -12.899 1.00 10.00 H new ATOM 0 HG12 VAL A 89 6.893 6.245 -14.002 1.00 10.00 H new ATOM 0 HG13 VAL A 89 7.727 5.085 -12.942 1.00 10.00 H new ATOM 0 HG21 VAL A 89 5.861 5.635 -10.541 1.00 10.00 H new ATOM 0 HG22 VAL A 89 7.627 5.488 -10.379 1.00 10.00 H new ATOM 0 HG23 VAL A 89 6.798 6.947 -9.786 1.00 10.00 H new ATOM 1260 N PRO A 90 7.616 10.001 -11.777 1.00 10.00 N ATOM 1261 CA PRO A 90 7.375 11.222 -11.018 1.00 10.00 C ATOM 1262 C PRO A 90 6.750 10.910 -9.651 1.00 10.00 C ATOM 1263 O PRO A 90 7.108 11.526 -8.650 1.00 10.00 O ATOM 1264 CB PRO A 90 6.506 12.098 -11.928 1.00 10.00 C ATOM 1265 CG PRO A 90 5.855 11.118 -12.898 1.00 10.00 C ATOM 1266 CD PRO A 90 6.956 10.077 -13.074 1.00 10.00 C ATOM 0 HA PRO A 90 8.292 11.754 -10.764 1.00 10.00 H new ATOM 0 HB2 PRO A 90 5.757 12.645 -11.355 1.00 10.00 H new ATOM 0 HB3 PRO A 90 7.106 12.839 -12.456 1.00 10.00 H new ATOM 0 HG2 PRO A 90 4.943 10.683 -12.490 1.00 10.00 H new ATOM 0 HG3 PRO A 90 5.587 11.593 -13.842 1.00 10.00 H new ATOM 0 HD2 PRO A 90 6.543 9.111 -13.363 1.00 10.00 H new ATOM 0 HD3 PRO A 90 7.656 10.371 -13.856 1.00 10.00 H new ATOM 1274 N TRP A 91 5.846 9.929 -9.616 1.00 10.00 N ATOM 1275 CA TRP A 91 5.200 9.359 -8.449 1.00 10.00 C ATOM 1276 C TRP A 91 4.330 8.226 -8.996 1.00 10.00 C ATOM 1277 O TRP A 91 4.176 8.117 -10.214 1.00 10.00 O ATOM 1278 CB TRP A 91 4.358 10.415 -7.718 1.00 10.00 C ATOM 1279 CG TRP A 91 3.362 11.090 -8.594 1.00 10.00 C ATOM 1280 CD1 TRP A 91 2.168 10.571 -8.927 1.00 10.00 C ATOM 1281 CD2 TRP A 91 3.474 12.338 -9.332 1.00 10.00 C ATOM 1282 NE1 TRP A 91 1.610 11.315 -9.935 1.00 10.00 N ATOM 1283 CE2 TRP A 91 2.373 12.425 -10.224 1.00 10.00 C ATOM 1284 CE3 TRP A 91 4.409 13.390 -9.363 1.00 10.00 C ATOM 1285 CZ2 TRP A 91 2.259 13.460 -11.155 1.00 10.00 C ATOM 1286 CZ3 TRP A 91 4.246 14.492 -10.221 1.00 10.00 C ATOM 1287 CH2 TRP A 91 3.188 14.512 -11.145 1.00 10.00 C ATOM 0 H TRP A 91 5.527 9.482 -10.476 1.00 10.00 H new ATOM 0 HA TRP A 91 5.919 8.995 -7.715 1.00 10.00 H new ATOM 0 HB2 TRP A 91 3.837 9.941 -6.887 1.00 10.00 H new ATOM 0 HB3 TRP A 91 5.022 11.166 -7.291 1.00 10.00 H new ATOM 0 HD1 TRP A 91 1.717 9.702 -8.471 1.00 10.00 H new ATOM 0 HE1 TRP A 91 0.740 11.077 -10.411 1.00 10.00 H new ATOM 0 HE3 TRP A 91 5.271 13.350 -8.713 1.00 10.00 H new ATOM 0 HZ2 TRP A 91 1.459 13.451 -11.880 1.00 10.00 H new ATOM 0 HZ3 TRP A 91 4.934 15.323 -10.170 1.00 10.00 H new ATOM 0 HH2 TRP A 91 3.090 15.331 -11.842 1.00 10.00 H new ATOM 1298 N LEU A 92 3.739 7.411 -8.122 1.00 10.00 N ATOM 1299 CA LEU A 92 2.742 6.425 -8.519 1.00 10.00 C ATOM 1300 C LEU A 92 1.348 6.982 -8.220 1.00 10.00 C ATOM 1301 O LEU A 92 0.883 6.935 -7.084 1.00 10.00 O ATOM 1302 CB LEU A 92 3.029 5.057 -7.876 1.00 10.00 C ATOM 1303 CG LEU A 92 3.120 5.042 -6.337 1.00 10.00 C ATOM 1304 CD1 LEU A 92 2.007 4.170 -5.744 1.00 10.00 C ATOM 1305 CD2 LEU A 92 4.471 4.476 -5.885 1.00 10.00 C ATOM 0 H LEU A 92 3.939 7.418 -7.122 1.00 10.00 H new ATOM 0 HA LEU A 92 2.791 6.242 -9.592 1.00 10.00 H new ATOM 0 HB2 LEU A 92 2.246 4.362 -8.181 1.00 10.00 H new ATOM 0 HB3 LEU A 92 3.967 4.677 -8.280 1.00 10.00 H new ATOM 0 HG LEU A 92 3.013 6.069 -5.987 1.00 10.00 H new ATOM 0 HD11 LEU A 92 2.085 4.170 -4.657 1.00 10.00 H new ATOM 0 HD12 LEU A 92 1.036 4.569 -6.038 1.00 10.00 H new ATOM 0 HD13 LEU A 92 2.107 3.150 -6.115 1.00 10.00 H new ATOM 0 HD21 LEU A 92 4.518 4.473 -4.796 1.00 10.00 H new ATOM 0 HD22 LEU A 92 4.581 3.457 -6.256 1.00 10.00 H new ATOM 0 HD23 LEU A 92 5.276 5.095 -6.281 1.00 10.00 H new ATOM 1317 N THR A 93 0.675 7.540 -9.231 1.00 10.00 N ATOM 1318 CA THR A 93 -0.650 8.112 -9.047 1.00 10.00 C ATOM 1319 C THR A 93 -1.635 6.948 -8.986 1.00 10.00 C ATOM 1320 O THR A 93 -1.595 6.076 -9.851 1.00 10.00 O ATOM 1321 CB THR A 93 -1.013 9.001 -10.253 1.00 10.00 C ATOM 1322 OG1 THR A 93 0.132 9.316 -11.025 1.00 10.00 O ATOM 1323 CG2 THR A 93 -1.694 10.294 -9.811 1.00 10.00 C ATOM 0 H THR A 93 1.032 7.605 -10.184 1.00 10.00 H new ATOM 0 HA THR A 93 -0.681 8.716 -8.140 1.00 10.00 H new ATOM 0 HB THR A 93 -1.709 8.428 -10.866 1.00 10.00 H new ATOM 0 HG1 THR A 93 0.865 9.578 -10.430 1.00 10.00 H new ATOM 0 HG21 THR A 93 -1.936 10.896 -10.687 1.00 10.00 H new ATOM 0 HG22 THR A 93 -2.610 10.056 -9.270 1.00 10.00 H new ATOM 0 HG23 THR A 93 -1.023 10.854 -9.160 1.00 10.00 H new ATOM 1331 N ILE A 94 -2.518 6.930 -7.988 1.00 10.00 N ATOM 1332 CA ILE A 94 -3.530 5.889 -7.861 1.00 10.00 C ATOM 1333 C ILE A 94 -4.864 6.466 -8.353 1.00 10.00 C ATOM 1334 O ILE A 94 -5.402 7.380 -7.724 1.00 10.00 O ATOM 1335 CB ILE A 94 -3.557 5.325 -6.433 1.00 10.00 C ATOM 1336 CG1 ILE A 94 -3.893 6.359 -5.352 1.00 10.00 C ATOM 1337 CG2 ILE A 94 -2.192 4.697 -6.120 1.00 10.00 C ATOM 1338 CD1 ILE A 94 -5.317 6.173 -4.834 1.00 10.00 C ATOM 0 H ILE A 94 -2.550 7.634 -7.250 1.00 10.00 H new ATOM 0 HA ILE A 94 -3.300 5.025 -8.485 1.00 10.00 H new ATOM 0 HB ILE A 94 -4.359 4.587 -6.409 1.00 10.00 H new ATOM 0 HG12 ILE A 94 -3.188 6.268 -4.526 1.00 10.00 H new ATOM 0 HG13 ILE A 94 -3.779 7.364 -5.758 1.00 10.00 H new ATOM 0 HG21 ILE A 94 -2.201 4.293 -5.108 1.00 10.00 H new ATOM 0 HG22 ILE A 94 -1.990 3.894 -6.829 1.00 10.00 H new ATOM 0 HG23 ILE A 94 -1.415 5.457 -6.201 1.00 10.00 H new ATOM 0 HD11 ILE A 94 -5.526 6.920 -4.069 1.00 10.00 H new ATOM 0 HD12 ILE A 94 -6.022 6.289 -5.657 1.00 10.00 H new ATOM 0 HD13 ILE A 94 -5.421 5.176 -4.406 1.00 10.00 H new ATOM 1350 N PRO A 95 -5.378 6.016 -9.509 1.00 10.00 N ATOM 1351 CA PRO A 95 -6.527 6.634 -10.152 1.00 10.00 C ATOM 1352 C PRO A 95 -7.821 6.159 -9.490 1.00 10.00 C ATOM 1353 O PRO A 95 -8.581 5.403 -10.091 1.00 10.00 O ATOM 1354 CB PRO A 95 -6.439 6.186 -11.611 1.00 10.00 C ATOM 1355 CG PRO A 95 -5.803 4.800 -11.515 1.00 10.00 C ATOM 1356 CD PRO A 95 -4.829 4.959 -10.349 1.00 10.00 C ATOM 0 HA PRO A 95 -6.528 7.721 -10.068 1.00 10.00 H new ATOM 0 HB2 PRO A 95 -7.422 6.146 -12.080 1.00 10.00 H new ATOM 0 HB3 PRO A 95 -5.830 6.868 -12.205 1.00 10.00 H new ATOM 0 HG2 PRO A 95 -6.545 4.026 -11.320 1.00 10.00 H new ATOM 0 HG3 PRO A 95 -5.290 4.525 -12.437 1.00 10.00 H new ATOM 0 HD2 PRO A 95 -4.733 4.028 -9.791 1.00 10.00 H new ATOM 0 HD3 PRO A 95 -3.833 5.221 -10.705 1.00 10.00 H new ATOM 1364 N ALA A 96 -8.066 6.587 -8.248 1.00 10.00 N ATOM 1365 CA ALA A 96 -9.107 6.018 -7.410 1.00 10.00 C ATOM 1366 C ALA A 96 -8.772 4.558 -7.099 1.00 10.00 C ATOM 1367 O ALA A 96 -7.737 4.056 -7.536 1.00 10.00 O ATOM 1368 CB ALA A 96 -10.481 6.249 -8.043 1.00 10.00 C ATOM 0 H ALA A 96 -7.543 7.340 -7.801 1.00 10.00 H new ATOM 0 HA ALA A 96 -9.153 6.523 -6.445 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -11.253 5.818 -7.405 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -10.656 7.319 -8.152 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -10.514 5.775 -9.024 1.00 10.00 H new ATOM 1374 N ARG A 97 -9.578 3.908 -6.257 1.00 10.00 N ATOM 1375 CA ARG A 97 -9.487 2.514 -5.843 1.00 10.00 C ATOM 1376 C ARG A 97 -8.092 1.887 -5.662 1.00 10.00 C ATOM 1377 O ARG A 97 -7.980 0.662 -5.695 1.00 10.00 O ATOM 1378 CB ARG A 97 -10.399 1.675 -6.753 1.00 10.00 C ATOM 1379 CG ARG A 97 -11.414 0.881 -5.929 1.00 10.00 C ATOM 1380 CD ARG A 97 -10.750 -0.255 -5.135 1.00 10.00 C ATOM 1381 NE ARG A 97 -11.750 -1.158 -4.555 1.00 10.00 N ATOM 1382 CZ ARG A 97 -11.468 -2.252 -3.828 1.00 10.00 C ATOM 1383 NH1 ARG A 97 -10.206 -2.554 -3.500 1.00 10.00 N ATOM 1384 NH2 ARG A 97 -12.465 -3.052 -3.431 1.00 10.00 N ATOM 0 H ARG A 97 -10.368 4.380 -5.817 1.00 10.00 H new ATOM 0 HA ARG A 97 -9.828 2.509 -4.808 1.00 10.00 H new ATOM 0 HB2 ARG A 97 -10.923 2.328 -7.451 1.00 10.00 H new ATOM 0 HB3 ARG A 97 -9.795 0.991 -7.349 1.00 10.00 H new ATOM 0 HG2 ARG A 97 -11.927 1.553 -5.240 1.00 10.00 H new ATOM 0 HG3 ARG A 97 -12.172 0.465 -6.592 1.00 10.00 H new ATOM 0 HD2 ARG A 97 -10.085 -0.818 -5.790 1.00 10.00 H new ATOM 0 HD3 ARG A 97 -10.134 0.166 -4.341 1.00 10.00 H new ATOM 0 HE ARG A 97 -12.733 -0.939 -4.716 1.00 10.00 H new ATOM 0 HH11 ARG A 97 -9.442 -1.950 -3.803 1.00 10.00 H new ATOM 0 HH12 ARG A 97 -10.008 -3.388 -2.947 1.00 10.00 H new ATOM 0 HH21 ARG A 97 -13.428 -2.829 -3.681 1.00 10.00 H new ATOM 0 HH22 ARG A 97 -12.261 -3.885 -2.879 1.00 10.00 H new ATOM 1398 N GLY A 98 -7.043 2.679 -5.415 1.00 10.00 N ATOM 1399 CA GLY A 98 -5.692 2.196 -5.161 1.00 10.00 C ATOM 1400 C GLY A 98 -5.675 1.036 -4.169 1.00 10.00 C ATOM 1401 O GLY A 98 -5.823 1.238 -2.967 1.00 10.00 O ATOM 0 H GLY A 98 -7.117 3.696 -5.387 1.00 10.00 H new ATOM 0 HA2 GLY A 98 -5.239 1.877 -6.100 1.00 10.00 H new ATOM 0 HA3 GLY A 98 -5.082 3.012 -4.774 1.00 10.00 H new ATOM 1405 N THR A 99 -5.510 -0.179 -4.687 1.00 10.00 N ATOM 1406 CA THR A 99 -5.341 -1.381 -3.891 1.00 10.00 C ATOM 1407 C THR A 99 -4.131 -2.103 -4.475 1.00 10.00 C ATOM 1408 O THR A 99 -4.230 -3.257 -4.884 1.00 10.00 O ATOM 1409 CB THR A 99 -6.620 -2.232 -3.956 1.00 10.00 C ATOM 1410 OG1 THR A 99 -7.797 -1.437 -3.926 1.00 10.00 O ATOM 1411 CG2 THR A 99 -6.682 -3.233 -2.799 1.00 10.00 C ATOM 0 H THR A 99 -5.490 -0.353 -5.692 1.00 10.00 H new ATOM 0 HA THR A 99 -5.173 -1.166 -2.836 1.00 10.00 H new ATOM 0 HB THR A 99 -6.577 -2.765 -4.906 1.00 10.00 H new ATOM 0 HG1 THR A 99 -7.804 -0.834 -4.698 1.00 10.00 H new ATOM 0 HG21 THR A 99 -7.598 -3.819 -2.874 1.00 10.00 H new ATOM 0 HG22 THR A 99 -5.820 -3.899 -2.847 1.00 10.00 H new ATOM 0 HG23 THR A 99 -6.672 -2.695 -1.851 1.00 10.00 H new ATOM 1419 N LEU A 100 -2.996 -1.402 -4.536 1.00 10.00 N ATOM 1420 CA LEU A 100 -1.752 -1.989 -5.003 1.00 10.00 C ATOM 1421 C LEU A 100 -0.878 -2.325 -3.804 1.00 10.00 C ATOM 1422 O LEU A 100 -1.128 -1.867 -2.688 1.00 10.00 O ATOM 1423 CB LEU A 100 -1.090 -1.162 -6.120 1.00 10.00 C ATOM 1424 CG LEU A 100 -0.460 0.210 -5.815 1.00 10.00 C ATOM 1425 CD1 LEU A 100 -1.470 1.261 -5.352 1.00 10.00 C ATOM 1426 CD2 LEU A 100 0.719 0.127 -4.852 1.00 10.00 C ATOM 0 H LEU A 100 -2.920 -0.422 -4.264 1.00 10.00 H new ATOM 0 HA LEU A 100 -1.947 -2.935 -5.507 1.00 10.00 H new ATOM 0 HB2 LEU A 100 -0.309 -1.783 -6.559 1.00 10.00 H new ATOM 0 HB3 LEU A 100 -1.843 -1.004 -6.892 1.00 10.00 H new ATOM 0 HG LEU A 100 -0.073 0.547 -6.777 1.00 10.00 H new ATOM 0 HD11 LEU A 100 -0.953 2.201 -5.156 1.00 10.00 H new ATOM 0 HD12 LEU A 100 -2.219 1.414 -6.129 1.00 10.00 H new ATOM 0 HD13 LEU A 100 -1.959 0.919 -4.440 1.00 10.00 H new ATOM 0 HD21 LEU A 100 1.118 1.126 -4.678 1.00 10.00 H new ATOM 0 HD22 LEU A 100 0.387 -0.301 -3.906 1.00 10.00 H new ATOM 0 HD23 LEU A 100 1.497 -0.504 -5.282 1.00 10.00 H new ATOM 1438 N THR A 101 0.134 -3.151 -4.040 1.00 10.00 N ATOM 1439 CA THR A 101 0.919 -3.779 -3.003 1.00 10.00 C ATOM 1440 C THR A 101 2.357 -3.486 -3.369 1.00 10.00 C ATOM 1441 O THR A 101 2.826 -3.938 -4.406 1.00 10.00 O ATOM 1442 CB THR A 101 0.611 -5.282 -2.954 1.00 10.00 C ATOM 1443 OG1 THR A 101 -0.791 -5.475 -2.958 1.00 10.00 O ATOM 1444 CG2 THR A 101 1.180 -5.913 -1.680 1.00 10.00 C ATOM 0 H THR A 101 0.433 -3.404 -4.982 1.00 10.00 H new ATOM 0 HA THR A 101 0.697 -3.402 -2.005 1.00 10.00 H new ATOM 0 HB THR A 101 1.068 -5.752 -3.825 1.00 10.00 H new ATOM 0 HG1 THR A 101 -0.989 -6.434 -2.928 1.00 10.00 H new ATOM 0 HG21 THR A 101 0.949 -6.978 -1.667 1.00 10.00 H new ATOM 0 HG22 THR A 101 2.261 -5.775 -1.657 1.00 10.00 H new ATOM 0 HG23 THR A 101 0.735 -5.435 -0.807 1.00 10.00 H new ATOM 1452 N LEU A 102 3.043 -2.713 -2.538 1.00 10.00 N ATOM 1453 CA LEU A 102 4.386 -2.268 -2.807 1.00 10.00 C ATOM 1454 C LEU A 102 5.262 -3.462 -2.456 1.00 10.00 C ATOM 1455 O LEU A 102 5.326 -3.860 -1.294 1.00 10.00 O ATOM 1456 CB LEU A 102 4.712 -1.031 -1.954 1.00 10.00 C ATOM 1457 CG LEU A 102 4.074 0.261 -2.500 1.00 10.00 C ATOM 1458 CD1 LEU A 102 2.589 0.348 -2.152 1.00 10.00 C ATOM 1459 CD2 LEU A 102 4.780 1.500 -1.930 1.00 10.00 C ATOM 0 H LEU A 102 2.670 -2.378 -1.650 1.00 10.00 H new ATOM 0 HA LEU A 102 4.540 -1.961 -3.841 1.00 10.00 H new ATOM 0 HB2 LEU A 102 4.366 -1.198 -0.934 1.00 10.00 H new ATOM 0 HB3 LEU A 102 5.794 -0.904 -1.906 1.00 10.00 H new ATOM 0 HG LEU A 102 4.186 0.232 -3.584 1.00 10.00 H new ATOM 0 HD11 LEU A 102 2.175 1.273 -2.554 1.00 10.00 H new ATOM 0 HD12 LEU A 102 2.063 -0.503 -2.585 1.00 10.00 H new ATOM 0 HD13 LEU A 102 2.468 0.337 -1.069 1.00 10.00 H new ATOM 0 HD21 LEU A 102 4.313 2.401 -2.329 1.00 10.00 H new ATOM 0 HD22 LEU A 102 4.696 1.499 -0.843 1.00 10.00 H new ATOM 0 HD23 LEU A 102 5.833 1.481 -2.213 1.00 10.00 H new ATOM 1471 N GLN A 103 5.852 -4.080 -3.480 1.00 10.00 N ATOM 1472 CA GLN A 103 6.607 -5.315 -3.427 1.00 10.00 C ATOM 1473 C GLN A 103 7.933 -5.118 -4.157 1.00 10.00 C ATOM 1474 O GLN A 103 8.005 -4.387 -5.144 1.00 10.00 O ATOM 1475 CB GLN A 103 5.832 -6.417 -4.151 1.00 10.00 C ATOM 1476 CG GLN A 103 4.478 -6.728 -3.506 1.00 10.00 C ATOM 1477 CD GLN A 103 3.532 -7.311 -4.544 1.00 10.00 C ATOM 1478 OE1 GLN A 103 3.179 -8.484 -4.487 1.00 10.00 O ATOM 1479 NE2 GLN A 103 3.128 -6.498 -5.513 1.00 10.00 N ATOM 0 H GLN A 103 5.807 -3.700 -4.426 1.00 10.00 H new ATOM 0 HA GLN A 103 6.775 -5.590 -2.386 1.00 10.00 H new ATOM 0 HB2 GLN A 103 5.673 -6.119 -5.187 1.00 10.00 H new ATOM 0 HB3 GLN A 103 6.435 -7.325 -4.169 1.00 10.00 H new ATOM 0 HG2 GLN A 103 4.610 -7.433 -2.685 1.00 10.00 H new ATOM 0 HG3 GLN A 103 4.051 -5.820 -3.081 1.00 10.00 H new ATOM 0 HE21 GLN A 103 3.442 -5.528 -5.529 1.00 10.00 H new ATOM 0 HE22 GLN A 103 2.504 -6.844 -6.242 1.00 10.00 H new ATOM 1488 N ARG A 104 8.951 -5.833 -3.677 1.00 10.00 N ATOM 1489 CA ARG A 104 10.333 -5.845 -4.166 1.00 10.00 C ATOM 1490 C ARG A 104 10.470 -5.482 -5.647 1.00 10.00 C ATOM 1491 O ARG A 104 11.217 -4.566 -5.992 1.00 10.00 O ATOM 1492 CB ARG A 104 10.998 -7.190 -3.837 1.00 10.00 C ATOM 1493 CG ARG A 104 12.381 -7.032 -3.189 1.00 10.00 C ATOM 1494 CD ARG A 104 13.378 -6.201 -4.015 1.00 10.00 C ATOM 1495 NE ARG A 104 14.757 -6.608 -3.692 1.00 10.00 N ATOM 1496 CZ ARG A 104 15.843 -5.826 -3.568 1.00 10.00 C ATOM 1497 NH1 ARG A 104 15.772 -4.505 -3.796 1.00 10.00 N ATOM 1498 NH2 ARG A 104 17.001 -6.376 -3.211 1.00 10.00 N ATOM 0 H ARG A 104 8.825 -6.461 -2.883 1.00 10.00 H new ATOM 0 HA ARG A 104 10.862 -5.052 -3.638 1.00 10.00 H new ATOM 0 HB2 ARG A 104 10.351 -7.755 -3.166 1.00 10.00 H new ATOM 0 HB3 ARG A 104 11.096 -7.774 -4.752 1.00 10.00 H new ATOM 0 HG2 ARG A 104 12.260 -6.565 -2.211 1.00 10.00 H new ATOM 0 HG3 ARG A 104 12.805 -8.022 -3.019 1.00 10.00 H new ATOM 0 HD2 ARG A 104 13.188 -6.341 -5.079 1.00 10.00 H new ATOM 0 HD3 ARG A 104 13.244 -5.140 -3.804 1.00 10.00 H new ATOM 0 HE ARG A 104 14.906 -7.606 -3.544 1.00 10.00 H new ATOM 0 HH11 ARG A 104 14.885 -4.081 -4.068 1.00 10.00 H new ATOM 0 HH12 ARG A 104 16.605 -3.925 -3.698 1.00 10.00 H new ATOM 0 HH21 ARG A 104 17.056 -7.379 -3.035 1.00 10.00 H new ATOM 0 HH22 ARG A 104 17.833 -5.794 -3.113 1.00 10.00 H new ATOM 1512 N ASP A 105 9.722 -6.181 -6.507 1.00 10.00 N ATOM 1513 CA ASP A 105 9.584 -5.835 -7.911 1.00 10.00 C ATOM 1514 C ASP A 105 8.132 -6.044 -8.352 1.00 10.00 C ATOM 1515 O ASP A 105 7.836 -6.922 -9.160 1.00 10.00 O ATOM 1516 CB ASP A 105 10.590 -6.652 -8.728 1.00 10.00 C ATOM 1517 CG ASP A 105 10.640 -6.222 -10.184 1.00 10.00 C ATOM 1518 OD1 ASP A 105 10.175 -5.106 -10.494 1.00 10.00 O ATOM 1519 OD2 ASP A 105 11.206 -7.022 -10.963 1.00 10.00 O ATOM 0 H ASP A 105 9.193 -7.010 -6.237 1.00 10.00 H new ATOM 0 HA ASP A 105 9.811 -4.782 -8.080 1.00 10.00 H new ATOM 0 HB2 ASP A 105 11.581 -6.548 -8.287 1.00 10.00 H new ATOM 0 HB3 ASP A 105 10.326 -7.708 -8.673 1.00 10.00 H new ATOM 1524 N GLY A 106 7.207 -5.260 -7.784 1.00 10.00 N ATOM 1525 CA GLY A 106 5.800 -5.316 -8.136 1.00 10.00 C ATOM 1526 C GLY A 106 5.088 -4.097 -7.583 1.00 10.00 C ATOM 1527 O GLY A 106 4.281 -4.228 -6.671 1.00 10.00 O ATOM 0 H GLY A 106 7.424 -4.569 -7.065 1.00 10.00 H new ATOM 0 HA2 GLY A 106 5.687 -5.355 -9.219 1.00 10.00 H new ATOM 0 HA3 GLY A 106 5.351 -6.225 -7.736 1.00 10.00 H new ATOM 1531 N ASP A 107 5.442 -2.923 -8.120 1.00 10.00 N ATOM 1532 CA ASP A 107 5.137 -1.610 -7.561 1.00 10.00 C ATOM 1533 C ASP A 107 5.859 -1.434 -6.234 1.00 10.00 C ATOM 1534 O ASP A 107 6.186 -2.427 -5.608 1.00 10.00 O ATOM 1535 CB ASP A 107 3.624 -1.325 -7.521 1.00 10.00 C ATOM 1536 CG ASP A 107 3.296 0.163 -7.493 1.00 10.00 C ATOM 1537 OD1 ASP A 107 4.010 0.881 -6.766 1.00 10.00 O ATOM 1538 OD2 ASP A 107 2.400 0.576 -8.269 1.00 10.00 O ATOM 0 H ASP A 107 5.970 -2.865 -8.991 1.00 10.00 H new ATOM 0 HA ASP A 107 5.522 -0.837 -8.226 1.00 10.00 H new ATOM 0 HB2 ASP A 107 3.152 -1.779 -8.392 1.00 10.00 H new ATOM 0 HB3 ASP A 107 3.194 -1.802 -6.641 1.00 10.00 H new ATOM 1543 N HIS A 108 6.237 -0.210 -5.876 1.00 10.00 N ATOM 1544 CA HIS A 108 7.030 0.147 -4.696 1.00 10.00 C ATOM 1545 C HIS A 108 7.668 1.532 -4.845 1.00 10.00 C ATOM 1546 O HIS A 108 7.638 2.144 -5.911 1.00 10.00 O ATOM 1547 CB HIS A 108 8.140 -0.869 -4.353 1.00 10.00 C ATOM 1548 CG HIS A 108 9.106 -1.105 -5.483 1.00 10.00 C ATOM 1549 ND1 HIS A 108 8.882 -1.874 -6.597 1.00 10.00 N ATOM 1550 CD2 HIS A 108 10.392 -0.649 -5.548 1.00 10.00 C ATOM 1551 CE1 HIS A 108 10.037 -1.931 -7.277 1.00 10.00 C ATOM 1552 NE2 HIS A 108 10.985 -1.158 -6.713 1.00 10.00 N ATOM 0 H HIS A 108 5.985 0.608 -6.431 1.00 10.00 H new ATOM 0 HA HIS A 108 6.312 0.144 -3.875 1.00 10.00 H new ATOM 0 HB2 HIS A 108 8.691 -0.513 -3.482 1.00 10.00 H new ATOM 0 HB3 HIS A 108 7.680 -1.817 -4.074 1.00 10.00 H new ATOM 0 HD2 HIS A 108 10.871 -0.006 -4.825 1.00 10.00 H new ATOM 0 HE1 HIS A 108 10.188 -2.524 -8.167 1.00 10.00 H new ATOM 0 HE2 HIS A 108 11.929 -0.981 -7.058 1.00 10.00 H new ATOM 1560 N VAL A 109 8.328 1.990 -3.779 1.00 10.00 N ATOM 1561 CA VAL A 109 9.225 3.132 -3.794 1.00 10.00 C ATOM 1562 C VAL A 109 10.596 2.601 -3.391 1.00 10.00 C ATOM 1563 O VAL A 109 10.686 1.929 -2.365 1.00 10.00 O ATOM 1564 CB VAL A 109 8.726 4.186 -2.792 1.00 10.00 C ATOM 1565 CG1 VAL A 109 9.681 5.383 -2.738 1.00 10.00 C ATOM 1566 CG2 VAL A 109 7.315 4.665 -3.160 1.00 10.00 C ATOM 0 H VAL A 109 8.246 1.559 -2.858 1.00 10.00 H new ATOM 0 HA VAL A 109 9.270 3.607 -4.774 1.00 10.00 H new ATOM 0 HB VAL A 109 8.693 3.718 -1.808 1.00 10.00 H new ATOM 0 HG11 VAL A 109 9.307 6.115 -2.022 1.00 10.00 H new ATOM 0 HG12 VAL A 109 10.670 5.046 -2.428 1.00 10.00 H new ATOM 0 HG13 VAL A 109 9.746 5.841 -3.725 1.00 10.00 H new ATOM 0 HG21 VAL A 109 6.984 5.410 -2.437 1.00 10.00 H new ATOM 0 HG22 VAL A 109 7.329 5.107 -4.156 1.00 10.00 H new ATOM 0 HG23 VAL A 109 6.629 3.818 -3.149 1.00 10.00 H new ATOM 1576 N MET A 110 11.641 2.886 -4.177 1.00 10.00 N ATOM 1577 CA MET A 110 13.018 2.641 -3.779 1.00 10.00 C ATOM 1578 C MET A 110 13.557 3.911 -3.134 1.00 10.00 C ATOM 1579 O MET A 110 13.797 4.917 -3.794 1.00 10.00 O ATOM 1580 CB MET A 110 13.898 2.173 -4.945 1.00 10.00 C ATOM 1581 CG MET A 110 13.334 0.873 -5.523 1.00 10.00 C ATOM 1582 SD MET A 110 14.373 -0.139 -6.611 1.00 10.00 S ATOM 1583 CE MET A 110 15.458 1.113 -7.340 1.00 10.00 C ATOM 0 H MET A 110 11.547 3.294 -5.107 1.00 10.00 H new ATOM 0 HA MET A 110 13.041 1.821 -3.061 1.00 10.00 H new ATOM 0 HB2 MET A 110 13.934 2.941 -5.718 1.00 10.00 H new ATOM 0 HB3 MET A 110 14.921 2.017 -4.602 1.00 10.00 H new ATOM 0 HG2 MET A 110 13.030 0.246 -4.684 1.00 10.00 H new ATOM 0 HG3 MET A 110 12.429 1.126 -6.076 1.00 10.00 H new ATOM 0 HE1 MET A 110 15.866 0.739 -8.279 1.00 10.00 H new ATOM 0 HE2 MET A 110 14.888 2.023 -7.529 1.00 10.00 H new ATOM 0 HE3 MET A 110 16.274 1.332 -6.652 1.00 10.00 H new ATOM 1593 N LEU A 111 13.749 3.857 -1.825 1.00 10.00 N ATOM 1594 CA LEU A 111 14.452 4.872 -1.079 1.00 10.00 C ATOM 1595 C LEU A 111 15.935 4.535 -1.194 1.00 10.00 C ATOM 1596 O LEU A 111 16.525 3.946 -0.296 1.00 10.00 O ATOM 1597 CB LEU A 111 13.922 4.903 0.358 1.00 10.00 C ATOM 1598 CG LEU A 111 12.422 5.251 0.388 1.00 10.00 C ATOM 1599 CD1 LEU A 111 11.515 4.016 0.447 1.00 10.00 C ATOM 1600 CD2 LEU A 111 12.138 6.116 1.609 1.00 10.00 C ATOM 0 H LEU A 111 13.411 3.088 -1.246 1.00 10.00 H new ATOM 0 HA LEU A 111 14.297 5.880 -1.464 1.00 10.00 H new ATOM 0 HB2 LEU A 111 14.083 3.933 0.829 1.00 10.00 H new ATOM 0 HB3 LEU A 111 14.480 5.637 0.939 1.00 10.00 H new ATOM 0 HG LEU A 111 12.200 5.776 -0.541 1.00 10.00 H new ATOM 0 HD11 LEU A 111 10.472 4.331 0.466 1.00 10.00 H new ATOM 0 HD12 LEU A 111 11.690 3.394 -0.431 1.00 10.00 H new ATOM 0 HD13 LEU A 111 11.737 3.444 1.348 1.00 10.00 H new ATOM 0 HD21 LEU A 111 11.078 6.367 1.638 1.00 10.00 H new ATOM 0 HD22 LEU A 111 12.406 5.569 2.513 1.00 10.00 H new ATOM 0 HD23 LEU A 111 12.726 7.032 1.551 1.00 10.00 H new ATOM 1612 N MET A 112 16.529 4.854 -2.342 1.00 10.00 N ATOM 1613 CA MET A 112 17.858 4.385 -2.698 1.00 10.00 C ATOM 1614 C MET A 112 18.911 5.301 -2.068 1.00 10.00 C ATOM 1615 O MET A 112 18.641 6.473 -1.805 1.00 10.00 O ATOM 1616 CB MET A 112 17.942 4.329 -4.232 1.00 10.00 C ATOM 1617 CG MET A 112 19.190 3.621 -4.767 1.00 10.00 C ATOM 1618 SD MET A 112 19.221 3.455 -6.569 1.00 10.00 S ATOM 1619 CE MET A 112 20.740 2.498 -6.766 1.00 10.00 C ATOM 0 H MET A 112 16.097 5.447 -3.051 1.00 10.00 H new ATOM 0 HA MET A 112 18.053 3.384 -2.312 1.00 10.00 H new ATOM 0 HB2 MET A 112 17.057 3.820 -4.615 1.00 10.00 H new ATOM 0 HB3 MET A 112 17.919 5.346 -4.623 1.00 10.00 H new ATOM 0 HG2 MET A 112 20.074 4.172 -4.447 1.00 10.00 H new ATOM 0 HG3 MET A 112 19.254 2.629 -4.319 1.00 10.00 H new ATOM 0 HE1 MET A 112 20.913 2.304 -7.825 1.00 10.00 H new ATOM 0 HE2 MET A 112 21.580 3.060 -6.358 1.00 10.00 H new ATOM 0 HE3 MET A 112 20.645 1.551 -6.235 1.00 10.00 H new ATOM 1629 N GLY A 113 20.124 4.798 -1.822 1.00 10.00 N ATOM 1630 CA GLY A 113 21.215 5.644 -1.372 1.00 10.00 C ATOM 1631 C GLY A 113 21.191 5.806 0.142 1.00 10.00 C ATOM 1632 O GLY A 113 20.804 6.867 0.624 1.00 10.00 O ATOM 0 H GLY A 113 20.367 3.813 -1.928 1.00 10.00 H new ATOM 0 HA2 GLY A 113 22.167 5.211 -1.680 1.00 10.00 H new ATOM 0 HA3 GLY A 113 21.141 6.622 -1.847 1.00 10.00 H new ATOM 1636 N LEU A 114 21.591 4.782 0.903 1.00 10.00 N ATOM 1637 CA LEU A 114 21.677 4.904 2.361 1.00 10.00 C ATOM 1638 C LEU A 114 22.463 6.156 2.779 1.00 10.00 C ATOM 1639 O LEU A 114 23.490 6.458 2.174 1.00 10.00 O ATOM 1640 CB LEU A 114 22.236 3.620 3.004 1.00 10.00 C ATOM 1641 CG LEU A 114 23.735 3.318 2.784 1.00 10.00 C ATOM 1642 CD1 LEU A 114 24.633 3.937 3.866 1.00 10.00 C ATOM 1643 CD2 LEU A 114 23.983 1.805 2.856 1.00 10.00 C ATOM 0 H LEU A 114 21.858 3.868 0.538 1.00 10.00 H new ATOM 0 HA LEU A 114 20.663 5.030 2.741 1.00 10.00 H new ATOM 0 HB2 LEU A 114 22.056 3.673 4.078 1.00 10.00 H new ATOM 0 HB3 LEU A 114 21.661 2.774 2.626 1.00 10.00 H new ATOM 0 HG LEU A 114 23.980 3.740 1.809 1.00 10.00 H new ATOM 0 HD11 LEU A 114 25.675 3.691 3.659 1.00 10.00 H new ATOM 0 HD12 LEU A 114 24.509 5.020 3.866 1.00 10.00 H new ATOM 0 HD13 LEU A 114 24.354 3.540 4.842 1.00 10.00 H new ATOM 0 HD21 LEU A 114 25.042 1.602 2.700 1.00 10.00 H new ATOM 0 HD22 LEU A 114 23.683 1.433 3.836 1.00 10.00 H new ATOM 0 HD23 LEU A 114 23.400 1.304 2.084 1.00 10.00 H new ATOM 1655 N LYS A 115 21.997 6.876 3.810 1.00 10.00 N ATOM 1656 CA LYS A 115 22.830 7.840 4.522 1.00 10.00 C ATOM 1657 C LYS A 115 23.718 7.079 5.509 1.00 10.00 C ATOM 1658 O LYS A 115 24.939 7.171 5.429 1.00 10.00 O ATOM 1659 CB LYS A 115 21.997 8.912 5.256 1.00 10.00 C ATOM 1660 CG LYS A 115 21.612 10.114 4.375 1.00 10.00 C ATOM 1661 CD LYS A 115 20.175 10.094 3.839 1.00 10.00 C ATOM 1662 CE LYS A 115 19.113 10.403 4.909 1.00 10.00 C ATOM 1663 NZ LYS A 115 17.814 10.773 4.302 1.00 10.00 N ATOM 0 H LYS A 115 21.044 6.804 4.166 1.00 10.00 H new ATOM 0 HA LYS A 115 23.441 8.373 3.793 1.00 10.00 H new ATOM 0 HB2 LYS A 115 21.088 8.451 5.641 1.00 10.00 H new ATOM 0 HB3 LYS A 115 22.562 9.271 6.116 1.00 10.00 H new ATOM 0 HG2 LYS A 115 21.756 11.028 4.951 1.00 10.00 H new ATOM 0 HG3 LYS A 115 22.298 10.159 3.529 1.00 10.00 H new ATOM 0 HD2 LYS A 115 20.087 10.821 3.032 1.00 10.00 H new ATOM 0 HD3 LYS A 115 19.970 9.114 3.409 1.00 10.00 H new ATOM 0 HE2 LYS A 115 18.980 9.532 5.551 1.00 10.00 H new ATOM 0 HE3 LYS A 115 19.463 11.217 5.544 1.00 10.00 H new ATOM 0 HZ1 LYS A 115 17.055 10.645 5.001 1.00 10.00 H new ATOM 0 HZ2 LYS A 115 17.843 11.768 4.001 1.00 10.00 H new ATOM 0 HZ3 LYS A 115 17.631 10.166 3.477 1.00 10.00 H new ATOM 1677 N ARG A 116 23.102 6.343 6.444 1.00 10.00 N ATOM 1678 CA ARG A 116 23.791 5.564 7.475 1.00 10.00 C ATOM 1679 C ARG A 116 22.820 4.839 8.421 1.00 10.00 C ATOM 1680 O ARG A 116 22.914 3.619 8.544 1.00 10.00 O ATOM 1681 CB ARG A 116 24.813 6.407 8.273 1.00 10.00 C ATOM 1682 CG ARG A 116 26.251 5.932 8.016 1.00 10.00 C ATOM 1683 CD ARG A 116 27.260 6.833 8.737 1.00 10.00 C ATOM 1684 NE ARG A 116 28.639 6.386 8.483 1.00 10.00 N ATOM 1685 CZ ARG A 116 29.743 6.989 8.955 1.00 10.00 C ATOM 1686 NH1 ARG A 116 29.629 8.076 9.725 1.00 10.00 N ATOM 1687 NH2 ARG A 116 30.953 6.502 8.654 1.00 10.00 N ATOM 0 H ARG A 116 22.086 6.273 6.504 1.00 10.00 H new ATOM 0 HA ARG A 116 24.349 4.799 6.935 1.00 10.00 H new ATOM 0 HB2 ARG A 116 24.719 7.456 7.993 1.00 10.00 H new ATOM 0 HB3 ARG A 116 24.590 6.340 9.338 1.00 10.00 H new ATOM 0 HG2 ARG A 116 26.366 4.904 8.359 1.00 10.00 H new ATOM 0 HG3 ARG A 116 26.454 5.936 6.945 1.00 10.00 H new ATOM 0 HD2 ARG A 116 27.139 7.863 8.400 1.00 10.00 H new ATOM 0 HD3 ARG A 116 27.062 6.823 9.809 1.00 10.00 H new ATOM 0 HE ARG A 116 28.766 5.555 7.905 1.00 10.00 H new ATOM 0 HH11 ARG A 116 28.706 8.445 9.953 1.00 10.00 H new ATOM 0 HH12 ARG A 116 30.465 8.536 10.085 1.00 10.00 H new ATOM 0 HH21 ARG A 116 31.037 5.673 8.066 1.00 10.00 H new ATOM 0 HH22 ARG A 116 31.791 6.960 9.013 1.00 10.00 H new ATOM 1701 N PRO A 117 21.935 5.548 9.144 1.00 10.00 N ATOM 1702 CA PRO A 117 21.204 4.958 10.257 1.00 10.00 C ATOM 1703 C PRO A 117 20.091 4.024 9.768 1.00 10.00 C ATOM 1704 O PRO A 117 18.950 4.442 9.593 1.00 10.00 O ATOM 1705 CB PRO A 117 20.676 6.141 11.075 1.00 10.00 C ATOM 1706 CG PRO A 117 20.520 7.242 10.028 1.00 10.00 C ATOM 1707 CD PRO A 117 21.692 6.984 9.083 1.00 10.00 C ATOM 0 HA PRO A 117 21.841 4.322 10.872 1.00 10.00 H new ATOM 0 HB2 PRO A 117 19.727 5.906 11.558 1.00 10.00 H new ATOM 0 HB3 PRO A 117 21.372 6.429 11.863 1.00 10.00 H new ATOM 0 HG2 PRO A 117 19.562 7.175 9.511 1.00 10.00 H new ATOM 0 HG3 PRO A 117 20.573 8.235 10.475 1.00 10.00 H new ATOM 0 HD2 PRO A 117 21.453 7.298 8.067 1.00 10.00 H new ATOM 0 HD3 PRO A 117 22.575 7.544 9.391 1.00 10.00 H new ATOM 1715 N LEU A 118 20.426 2.746 9.575 1.00 10.00 N ATOM 1716 CA LEU A 118 19.487 1.678 9.270 1.00 10.00 C ATOM 1717 C LEU A 118 19.946 0.399 9.962 1.00 10.00 C ATOM 1718 O LEU A 118 21.130 0.255 10.268 1.00 10.00 O ATOM 1719 CB LEU A 118 19.393 1.485 7.752 1.00 10.00 C ATOM 1720 CG LEU A 118 20.736 1.100 7.100 1.00 10.00 C ATOM 1721 CD1 LEU A 118 20.828 -0.405 6.830 1.00 10.00 C ATOM 1722 CD2 LEU A 118 20.896 1.863 5.785 1.00 10.00 C ATOM 0 H LEU A 118 21.391 2.422 9.630 1.00 10.00 H new ATOM 0 HA LEU A 118 18.494 1.936 9.637 1.00 10.00 H new ATOM 0 HB2 LEU A 118 18.657 0.710 7.536 1.00 10.00 H new ATOM 0 HB3 LEU A 118 19.028 2.406 7.298 1.00 10.00 H new ATOM 0 HG LEU A 118 21.534 1.364 7.793 1.00 10.00 H new ATOM 0 HD11 LEU A 118 21.789 -0.634 6.370 1.00 10.00 H new ATOM 0 HD12 LEU A 118 20.736 -0.950 7.770 1.00 10.00 H new ATOM 0 HD13 LEU A 118 20.024 -0.704 6.157 1.00 10.00 H new ATOM 0 HD21 LEU A 118 21.845 1.593 5.321 1.00 10.00 H new ATOM 0 HD22 LEU A 118 20.077 1.606 5.113 1.00 10.00 H new ATOM 0 HD23 LEU A 118 20.880 2.935 5.982 1.00 10.00 H new ATOM 1734 N LYS A 119 19.019 -0.528 10.208 1.00 10.00 N ATOM 1735 CA LYS A 119 19.301 -1.814 10.816 1.00 10.00 C ATOM 1736 C LYS A 119 18.072 -2.680 10.556 1.00 10.00 C ATOM 1737 O LYS A 119 16.963 -2.152 10.535 1.00 10.00 O ATOM 1738 CB LYS A 119 19.499 -1.600 12.321 1.00 10.00 C ATOM 1739 CG LYS A 119 19.975 -2.852 13.080 1.00 10.00 C ATOM 1740 CD LYS A 119 21.482 -2.793 13.374 1.00 10.00 C ATOM 1741 CE LYS A 119 21.788 -2.140 14.733 1.00 10.00 C ATOM 1742 NZ LYS A 119 21.112 -0.840 14.921 1.00 10.00 N ATOM 0 H LYS A 119 18.033 -0.396 9.983 1.00 10.00 H new ATOM 0 HA LYS A 119 20.197 -2.286 10.413 1.00 10.00 H new ATOM 0 HB2 LYS A 119 20.225 -0.801 12.470 1.00 10.00 H new ATOM 0 HB3 LYS A 119 18.558 -1.262 12.755 1.00 10.00 H new ATOM 0 HG2 LYS A 119 19.424 -2.943 14.016 1.00 10.00 H new ATOM 0 HG3 LYS A 119 19.753 -3.742 12.491 1.00 10.00 H new ATOM 0 HD2 LYS A 119 21.893 -3.803 13.358 1.00 10.00 H new ATOM 0 HD3 LYS A 119 21.982 -2.233 12.584 1.00 10.00 H new ATOM 0 HE2 LYS A 119 21.485 -2.818 15.531 1.00 10.00 H new ATOM 0 HE3 LYS A 119 22.865 -1.999 14.826 1.00 10.00 H new ATOM 0 HZ1 LYS A 119 21.449 -0.397 15.799 1.00 10.00 H new ATOM 0 HZ2 LYS A 119 21.326 -0.218 14.115 1.00 10.00 H new ATOM 0 HZ3 LYS A 119 20.084 -0.988 14.981 1.00 10.00 H new ATOM 1756 N VAL A 120 18.243 -3.986 10.354 1.00 10.00 N ATOM 1757 CA VAL A 120 17.115 -4.900 10.418 1.00 10.00 C ATOM 1758 C VAL A 120 16.712 -5.007 11.889 1.00 10.00 C ATOM 1759 O VAL A 120 17.415 -5.668 12.651 1.00 10.00 O ATOM 1760 CB VAL A 120 17.505 -6.273 9.840 1.00 10.00 C ATOM 1761 CG1 VAL A 120 16.362 -7.278 10.031 1.00 10.00 C ATOM 1762 CG2 VAL A 120 17.828 -6.164 8.346 1.00 10.00 C ATOM 0 H VAL A 120 19.140 -4.425 10.148 1.00 10.00 H new ATOM 0 HA VAL A 120 16.277 -4.536 9.824 1.00 10.00 H new ATOM 0 HB VAL A 120 18.390 -6.619 10.374 1.00 10.00 H new ATOM 0 HG11 VAL A 120 16.653 -8.243 9.617 1.00 10.00 H new ATOM 0 HG12 VAL A 120 16.148 -7.388 11.094 1.00 10.00 H new ATOM 0 HG13 VAL A 120 15.471 -6.917 9.518 1.00 10.00 H new ATOM 0 HG21 VAL A 120 18.101 -7.146 7.960 1.00 10.00 H new ATOM 0 HG22 VAL A 120 16.954 -5.794 7.811 1.00 10.00 H new ATOM 0 HG23 VAL A 120 18.660 -5.474 8.203 1.00 10.00 H new ATOM 1772 N GLY A 121 15.602 -4.389 12.299 1.00 10.00 N ATOM 1773 CA GLY A 121 15.153 -4.516 13.679 1.00 10.00 C ATOM 1774 C GLY A 121 14.138 -3.436 14.010 1.00 10.00 C ATOM 1775 O GLY A 121 12.989 -3.739 14.345 1.00 10.00 O ATOM 0 H GLY A 121 15.010 -3.808 11.705 1.00 10.00 H new ATOM 0 HA2 GLY A 121 14.710 -5.500 13.834 1.00 10.00 H new ATOM 0 HA3 GLY A 121 16.006 -4.441 14.353 1.00 10.00 H new ATOM 1779 N GLU A 122 14.603 -2.199 13.893 1.00 10.00 N ATOM 1780 CA GLU A 122 14.082 -0.972 14.404 1.00 10.00 C ATOM 1781 C GLU A 122 12.826 -0.544 13.661 1.00 10.00 C ATOM 1782 O GLU A 122 12.306 -1.243 12.793 1.00 10.00 O ATOM 1783 CB GLU A 122 15.241 0.035 14.235 1.00 10.00 C ATOM 1784 CG GLU A 122 16.290 -0.043 15.358 1.00 10.00 C ATOM 1785 CD GLU A 122 17.417 -1.029 15.085 1.00 10.00 C ATOM 1786 OE1 GLU A 122 17.132 -2.094 14.500 1.00 10.00 O ATOM 1787 OE2 GLU A 122 18.574 -0.690 15.419 1.00 10.00 O ATOM 0 H GLU A 122 15.462 -2.030 13.369 1.00 10.00 H new ATOM 0 HA GLU A 122 13.767 -1.052 15.444 1.00 10.00 H new ATOM 0 HB2 GLU A 122 15.731 -0.144 13.278 1.00 10.00 H new ATOM 0 HB3 GLU A 122 14.832 1.045 14.200 1.00 10.00 H new ATOM 0 HG2 GLU A 122 16.717 0.948 15.512 1.00 10.00 H new ATOM 0 HG3 GLU A 122 15.793 -0.323 16.287 1.00 10.00 H new ATOM 1794 N THR A 123 12.382 0.651 14.022 1.00 10.00 N ATOM 1795 CA THR A 123 11.280 1.368 13.422 1.00 10.00 C ATOM 1796 C THR A 123 11.755 2.801 13.209 1.00 10.00 C ATOM 1797 O THR A 123 12.287 3.403 14.141 1.00 10.00 O ATOM 1798 CB THR A 123 10.061 1.280 14.348 1.00 10.00 C ATOM 1799 OG1 THR A 123 9.759 -0.079 14.600 1.00 10.00 O ATOM 1800 CG2 THR A 123 8.827 1.945 13.731 1.00 10.00 C ATOM 0 H THR A 123 12.811 1.172 14.787 1.00 10.00 H new ATOM 0 HA THR A 123 10.976 0.947 12.464 1.00 10.00 H new ATOM 0 HB THR A 123 10.311 1.803 15.271 1.00 10.00 H new ATOM 0 HG1 THR A 123 8.981 -0.137 15.193 1.00 10.00 H new ATOM 0 HG21 THR A 123 7.986 1.860 14.419 1.00 10.00 H new ATOM 0 HG22 THR A 123 9.037 2.998 13.542 1.00 10.00 H new ATOM 0 HG23 THR A 123 8.579 1.451 12.792 1.00 10.00 H new ATOM 1808 N VAL A 124 11.605 3.324 11.992 1.00 10.00 N ATOM 1809 CA VAL A 124 11.987 4.676 11.621 1.00 10.00 C ATOM 1810 C VAL A 124 10.735 5.365 11.085 1.00 10.00 C ATOM 1811 O VAL A 124 9.938 4.747 10.381 1.00 10.00 O ATOM 1812 CB VAL A 124 13.123 4.623 10.582 1.00 10.00 C ATOM 1813 CG1 VAL A 124 13.432 6.011 10.005 1.00 10.00 C ATOM 1814 CG2 VAL A 124 14.401 4.068 11.227 1.00 10.00 C ATOM 0 H VAL A 124 11.201 2.798 11.217 1.00 10.00 H new ATOM 0 HA VAL A 124 12.368 5.242 12.471 1.00 10.00 H new ATOM 0 HB VAL A 124 12.789 3.973 9.773 1.00 10.00 H new ATOM 0 HG11 VAL A 124 14.239 5.931 9.276 1.00 10.00 H new ATOM 0 HG12 VAL A 124 12.542 6.409 9.518 1.00 10.00 H new ATOM 0 HG13 VAL A 124 13.736 6.680 10.810 1.00 10.00 H new ATOM 0 HG21 VAL A 124 15.198 4.034 10.484 1.00 10.00 H new ATOM 0 HG22 VAL A 124 14.701 4.713 12.053 1.00 10.00 H new ATOM 0 HG23 VAL A 124 14.212 3.062 11.602 1.00 10.00 H new ATOM 1824 N ASN A 125 10.549 6.640 11.430 1.00 10.00 N ATOM 1825 CA ASN A 125 9.455 7.424 10.881 1.00 10.00 C ATOM 1826 C ASN A 125 9.835 7.854 9.471 1.00 10.00 C ATOM 1827 O ASN A 125 10.878 8.477 9.278 1.00 10.00 O ATOM 1828 CB ASN A 125 9.145 8.645 11.759 1.00 10.00 C ATOM 1829 CG ASN A 125 8.449 8.280 13.069 1.00 10.00 C ATOM 1830 OD1 ASN A 125 8.078 7.134 13.304 1.00 10.00 O ATOM 1831 ND2 ASN A 125 8.264 9.261 13.948 1.00 10.00 N ATOM 0 H ASN A 125 11.144 7.146 12.086 1.00 10.00 H new ATOM 0 HA ASN A 125 8.551 6.816 10.855 1.00 10.00 H new ATOM 0 HB2 ASN A 125 10.074 9.170 11.982 1.00 10.00 H new ATOM 0 HB3 ASN A 125 8.515 9.336 11.200 1.00 10.00 H new ATOM 0 HD21 ASN A 125 7.806 9.068 14.839 1.00 10.00 H new ATOM 0 HD22 ASN A 125 8.581 10.206 13.732 1.00 10.00 H new ATOM 1838 N ILE A 126 8.974 7.558 8.499 1.00 10.00 N ATOM 1839 CA ILE A 126 9.098 8.080 7.149 1.00 10.00 C ATOM 1840 C ILE A 126 8.530 9.502 7.186 1.00 10.00 C ATOM 1841 O ILE A 126 8.054 9.963 8.228 1.00 10.00 O ATOM 1842 CB ILE A 126 8.330 7.138 6.189 1.00 10.00 C ATOM 1843 CG1 ILE A 126 8.897 7.142 4.760 1.00 10.00 C ATOM 1844 CG2 ILE A 126 6.825 7.439 6.152 1.00 10.00 C ATOM 1845 CD1 ILE A 126 8.333 5.993 3.920 1.00 10.00 C ATOM 0 H ILE A 126 8.169 6.946 8.631 1.00 10.00 H new ATOM 0 HA ILE A 126 10.126 8.122 6.789 1.00 10.00 H new ATOM 0 HB ILE A 126 8.473 6.139 6.602 1.00 10.00 H new ATOM 0 HG12 ILE A 126 8.664 8.092 4.279 1.00 10.00 H new ATOM 0 HG13 ILE A 126 9.983 7.063 4.800 1.00 10.00 H new ATOM 0 HG21 ILE A 126 6.333 6.751 5.464 1.00 10.00 H new ATOM 0 HG22 ILE A 126 6.405 7.317 7.150 1.00 10.00 H new ATOM 0 HG23 ILE A 126 6.667 8.463 5.815 1.00 10.00 H new ATOM 0 HD11 ILE A 126 8.759 6.032 2.917 1.00 10.00 H new ATOM 0 HD12 ILE A 126 8.589 5.042 4.386 1.00 10.00 H new ATOM 0 HD13 ILE A 126 7.249 6.086 3.857 1.00 10.00 H new ATOM 1857 N THR A 127 8.541 10.219 6.066 1.00 10.00 N ATOM 1858 CA THR A 127 7.781 11.441 5.939 1.00 10.00 C ATOM 1859 C THR A 127 7.258 11.548 4.516 1.00 10.00 C ATOM 1860 O THR A 127 8.023 11.683 3.561 1.00 10.00 O ATOM 1861 CB THR A 127 8.565 12.679 6.387 1.00 10.00 C ATOM 1862 OG1 THR A 127 9.174 12.448 7.642 1.00 10.00 O ATOM 1863 CG2 THR A 127 7.599 13.864 6.520 1.00 10.00 C ATOM 0 H THR A 127 9.074 9.966 5.234 1.00 10.00 H new ATOM 0 HA THR A 127 6.931 11.401 6.620 1.00 10.00 H new ATOM 0 HB THR A 127 9.336 12.895 5.647 1.00 10.00 H new ATOM 0 HG1 THR A 127 9.673 13.246 7.915 1.00 10.00 H new ATOM 0 HG21 THR A 127 8.150 14.749 6.839 1.00 10.00 H new ATOM 0 HG22 THR A 127 7.126 14.058 5.557 1.00 10.00 H new ATOM 0 HG23 THR A 127 6.833 13.628 7.259 1.00 10.00 H new ATOM 1871 N LEU A 128 5.939 11.482 4.390 1.00 10.00 N ATOM 1872 CA LEU A 128 5.239 11.766 3.159 1.00 10.00 C ATOM 1873 C LEU A 128 5.058 13.276 3.107 1.00 10.00 C ATOM 1874 O LEU A 128 4.788 13.887 4.141 1.00 10.00 O ATOM 1875 CB LEU A 128 3.879 11.050 3.190 1.00 10.00 C ATOM 1876 CG LEU A 128 3.618 10.149 1.982 1.00 10.00 C ATOM 1877 CD1 LEU A 128 3.561 10.978 0.694 1.00 10.00 C ATOM 1878 CD2 LEU A 128 4.605 8.978 1.900 1.00 10.00 C ATOM 0 H LEU A 128 5.321 11.224 5.159 1.00 10.00 H new ATOM 0 HA LEU A 128 5.783 11.420 2.280 1.00 10.00 H new ATOM 0 HB2 LEU A 128 3.818 10.449 4.097 1.00 10.00 H new ATOM 0 HB3 LEU A 128 3.088 11.798 3.249 1.00 10.00 H new ATOM 0 HG LEU A 128 2.639 9.687 2.113 1.00 10.00 H new ATOM 0 HD11 LEU A 128 3.375 10.320 -0.154 1.00 10.00 H new ATOM 0 HD12 LEU A 128 2.757 11.711 0.768 1.00 10.00 H new ATOM 0 HD13 LEU A 128 4.510 11.494 0.551 1.00 10.00 H new ATOM 0 HD21 LEU A 128 4.376 8.370 1.025 1.00 10.00 H new ATOM 0 HD22 LEU A 128 5.621 9.364 1.818 1.00 10.00 H new ATOM 0 HD23 LEU A 128 4.520 8.367 2.799 1.00 10.00 H new ATOM 1890 N LYS A 129 5.207 13.871 1.923 1.00 10.00 N ATOM 1891 CA LYS A 129 4.928 15.278 1.690 1.00 10.00 C ATOM 1892 C LYS A 129 4.412 15.403 0.259 1.00 10.00 C ATOM 1893 O LYS A 129 5.183 15.618 -0.670 1.00 10.00 O ATOM 1894 CB LYS A 129 6.171 16.133 1.983 1.00 10.00 C ATOM 1895 CG LYS A 129 5.816 17.581 2.351 1.00 10.00 C ATOM 1896 CD LYS A 129 5.062 18.326 1.236 1.00 10.00 C ATOM 1897 CE LYS A 129 4.777 19.792 1.590 1.00 10.00 C ATOM 1898 NZ LYS A 129 6.008 20.594 1.741 1.00 10.00 N ATOM 0 H LYS A 129 5.530 13.377 1.091 1.00 10.00 H new ATOM 0 HA LYS A 129 4.163 15.659 2.367 1.00 10.00 H new ATOM 0 HB2 LYS A 129 6.734 15.682 2.800 1.00 10.00 H new ATOM 0 HB3 LYS A 129 6.822 16.133 1.109 1.00 10.00 H new ATOM 0 HG2 LYS A 129 5.206 17.580 3.254 1.00 10.00 H new ATOM 0 HG3 LYS A 129 6.732 18.124 2.586 1.00 10.00 H new ATOM 0 HD2 LYS A 129 5.648 18.286 0.318 1.00 10.00 H new ATOM 0 HD3 LYS A 129 4.120 17.815 1.036 1.00 10.00 H new ATOM 0 HE2 LYS A 129 4.154 20.234 0.813 1.00 10.00 H new ATOM 0 HE3 LYS A 129 4.206 19.833 2.518 1.00 10.00 H new ATOM 0 HZ1 LYS A 129 5.759 21.600 1.828 1.00 10.00 H new ATOM 0 HZ2 LYS A 129 6.519 20.289 2.594 1.00 10.00 H new ATOM 0 HZ3 LYS A 129 6.615 20.459 0.907 1.00 10.00 H new ATOM 1912 N ALA A 130 3.105 15.224 0.076 1.00 10.00 N ATOM 1913 CA ALA A 130 2.516 15.088 -1.247 1.00 10.00 C ATOM 1914 C ALA A 130 2.245 16.458 -1.867 1.00 10.00 C ATOM 1915 O ALA A 130 1.841 17.389 -1.169 1.00 10.00 O ATOM 1916 CB ALA A 130 1.224 14.274 -1.145 1.00 10.00 C ATOM 0 H ALA A 130 2.431 15.170 0.839 1.00 10.00 H new ATOM 0 HA ALA A 130 3.218 14.566 -1.897 1.00 10.00 H new ATOM 0 HB1 ALA A 130 0.780 14.170 -2.135 1.00 10.00 H new ATOM 0 HB2 ALA A 130 1.447 13.286 -0.742 1.00 10.00 H new ATOM 0 HB3 ALA A 130 0.523 14.785 -0.485 1.00 10.00 H new ATOM 1922 N THR A 131 2.393 16.552 -3.195 1.00 10.00 N ATOM 1923 CA THR A 131 2.029 17.728 -3.991 1.00 10.00 C ATOM 1924 C THR A 131 0.558 18.103 -3.792 1.00 10.00 C ATOM 1925 O THR A 131 0.162 19.254 -3.957 1.00 10.00 O ATOM 1926 CB THR A 131 2.386 17.478 -5.470 1.00 10.00 C ATOM 1927 OG1 THR A 131 2.469 18.699 -6.171 1.00 10.00 O ATOM 1928 CG2 THR A 131 1.366 16.580 -6.181 1.00 10.00 C ATOM 0 H THR A 131 2.778 15.793 -3.758 1.00 10.00 H new ATOM 0 HA THR A 131 2.604 18.588 -3.649 1.00 10.00 H new ATOM 0 HB THR A 131 3.350 16.969 -5.468 1.00 10.00 H new ATOM 0 HG1 THR A 131 2.698 18.524 -7.108 1.00 10.00 H new ATOM 0 HG21 THR A 131 1.667 16.438 -7.219 1.00 10.00 H new ATOM 0 HG22 THR A 131 1.321 15.613 -5.680 1.00 10.00 H new ATOM 0 HG23 THR A 131 0.383 17.050 -6.150 1.00 10.00 H new ATOM 1936 N ASP A 132 -0.249 17.114 -3.405 1.00 10.00 N ATOM 1937 CA ASP A 132 -1.622 17.287 -2.980 1.00 10.00 C ATOM 1938 C ASP A 132 -1.785 18.335 -1.868 1.00 10.00 C ATOM 1939 O ASP A 132 -2.835 18.964 -1.764 1.00 10.00 O ATOM 1940 CB ASP A 132 -2.131 15.909 -2.556 1.00 10.00 C ATOM 1941 CG ASP A 132 -3.576 15.967 -2.111 1.00 10.00 C ATOM 1942 OD1 ASP A 132 -4.444 16.049 -3.003 1.00 10.00 O ATOM 1943 OD2 ASP A 132 -3.783 15.903 -0.881 1.00 10.00 O ATOM 0 H ASP A 132 0.054 16.140 -3.381 1.00 10.00 H new ATOM 0 HA ASP A 132 -2.216 17.682 -3.804 1.00 10.00 H new ATOM 0 HB2 ASP A 132 -2.033 15.211 -3.388 1.00 10.00 H new ATOM 0 HB3 ASP A 132 -1.514 15.526 -1.744 1.00 10.00 H new ATOM 1948 N GLY A 133 -0.740 18.549 -1.065 1.00 10.00 N ATOM 1949 CA GLY A 133 -0.717 19.571 -0.031 1.00 10.00 C ATOM 1950 C GLY A 133 -1.009 18.940 1.322 1.00 10.00 C ATOM 1951 O GLY A 133 -1.880 19.400 2.058 1.00 10.00 O ATOM 0 H GLY A 133 0.122 18.007 -1.120 1.00 10.00 H new ATOM 0 HA2 GLY A 133 0.257 20.060 -0.012 1.00 10.00 H new ATOM 0 HA3 GLY A 133 -1.457 20.341 -0.251 1.00 10.00 H new ATOM 1955 N ARG A 134 -0.258 17.889 1.655 1.00 10.00 N ATOM 1956 CA ARG A 134 -0.281 17.251 2.959 1.00 10.00 C ATOM 1957 C ARG A 134 1.132 16.782 3.286 1.00 10.00 C ATOM 1958 O ARG A 134 1.954 16.613 2.383 1.00 10.00 O ATOM 1959 CB ARG A 134 -1.257 16.061 2.980 1.00 10.00 C ATOM 1960 CG ARG A 134 -2.704 16.455 3.318 1.00 10.00 C ATOM 1961 CD ARG A 134 -3.638 16.458 2.103 1.00 10.00 C ATOM 1962 NE ARG A 134 -5.025 16.701 2.531 1.00 10.00 N ATOM 1963 CZ ARG A 134 -6.120 16.551 1.766 1.00 10.00 C ATOM 1964 NH1 ARG A 134 -6.012 16.249 0.472 1.00 10.00 N ATOM 1965 NH2 ARG A 134 -7.332 16.699 2.314 1.00 10.00 N ATOM 0 H ARG A 134 0.396 17.452 1.006 1.00 10.00 H new ATOM 0 HA ARG A 134 -0.625 17.966 3.706 1.00 10.00 H new ATOM 0 HB2 ARG A 134 -1.241 15.572 2.006 1.00 10.00 H new ATOM 0 HB3 ARG A 134 -0.909 15.330 3.710 1.00 10.00 H new ATOM 0 HG2 ARG A 134 -3.095 15.764 4.065 1.00 10.00 H new ATOM 0 HG3 ARG A 134 -2.706 17.447 3.770 1.00 10.00 H new ATOM 0 HD2 ARG A 134 -3.327 17.228 1.397 1.00 10.00 H new ATOM 0 HD3 ARG A 134 -3.572 15.503 1.582 1.00 10.00 H new ATOM 0 HE ARG A 134 -5.168 17.010 3.492 1.00 10.00 H new ATOM 0 HH11 ARG A 134 -5.090 16.129 0.051 1.00 10.00 H new ATOM 0 HH12 ARG A 134 -6.851 16.138 -0.098 1.00 10.00 H new ATOM 0 HH21 ARG A 134 -7.420 16.924 3.305 1.00 10.00 H new ATOM 0 HH22 ARG A 134 -8.168 16.587 1.741 1.00 10.00 H new ATOM 1979 N THR A 135 1.369 16.552 4.578 1.00 10.00 N ATOM 1980 CA THR A 135 2.580 16.017 5.165 1.00 10.00 C ATOM 1981 C THR A 135 2.108 14.908 6.104 1.00 10.00 C ATOM 1982 O THR A 135 1.037 15.052 6.694 1.00 10.00 O ATOM 1983 CB THR A 135 3.323 17.124 5.930 1.00 10.00 C ATOM 1984 OG1 THR A 135 3.531 18.246 5.091 1.00 10.00 O ATOM 1985 CG2 THR A 135 4.684 16.642 6.444 1.00 10.00 C ATOM 0 H THR A 135 0.663 16.752 5.286 1.00 10.00 H new ATOM 0 HA THR A 135 3.277 15.634 4.420 1.00 10.00 H new ATOM 0 HB THR A 135 2.700 17.398 6.782 1.00 10.00 H new ATOM 0 HG1 THR A 135 4.003 18.945 5.590 1.00 10.00 H new ATOM 0 HG21 THR A 135 5.179 17.453 6.979 1.00 10.00 H new ATOM 0 HG22 THR A 135 4.540 15.797 7.117 1.00 10.00 H new ATOM 0 HG23 THR A 135 5.303 16.333 5.601 1.00 10.00 H new ATOM 1993 N LEU A 136 2.853 13.808 6.223 1.00 10.00 N ATOM 1994 CA LEU A 136 2.467 12.672 7.053 1.00 10.00 C ATOM 1995 C LEU A 136 3.739 11.970 7.516 1.00 10.00 C ATOM 1996 O LEU A 136 4.760 12.098 6.849 1.00 10.00 O ATOM 1997 CB LEU A 136 1.583 11.742 6.219 1.00 10.00 C ATOM 1998 CG LEU A 136 0.892 10.619 7.009 1.00 10.00 C ATOM 1999 CD1 LEU A 136 -0.122 11.165 8.022 1.00 10.00 C ATOM 2000 CD2 LEU A 136 0.169 9.697 6.022 1.00 10.00 C ATOM 0 H LEU A 136 3.744 13.682 5.743 1.00 10.00 H new ATOM 0 HA LEU A 136 1.902 12.986 7.931 1.00 10.00 H new ATOM 0 HB2 LEU A 136 0.818 12.340 5.724 1.00 10.00 H new ATOM 0 HB3 LEU A 136 2.193 11.292 5.436 1.00 10.00 H new ATOM 0 HG LEU A 136 1.656 10.077 7.566 1.00 10.00 H new ATOM 0 HD11 LEU A 136 -0.585 10.336 8.556 1.00 10.00 H new ATOM 0 HD12 LEU A 136 0.388 11.815 8.733 1.00 10.00 H new ATOM 0 HD13 LEU A 136 -0.891 11.733 7.498 1.00 10.00 H new ATOM 0 HD21 LEU A 136 -0.326 8.895 6.569 1.00 10.00 H new ATOM 0 HD22 LEU A 136 -0.574 10.270 5.466 1.00 10.00 H new ATOM 0 HD23 LEU A 136 0.892 9.270 5.327 1.00 10.00 H new ATOM 2012 N ASN A 137 3.694 11.264 8.648 1.00 10.00 N ATOM 2013 CA ASN A 137 4.849 10.854 9.437 1.00 10.00 C ATOM 2014 C ASN A 137 4.665 9.414 9.909 1.00 10.00 C ATOM 2015 O ASN A 137 4.587 9.140 11.104 1.00 10.00 O ATOM 2016 CB ASN A 137 5.001 11.808 10.632 1.00 10.00 C ATOM 2017 CG ASN A 137 3.778 11.832 11.557 1.00 10.00 C ATOM 2018 OD1 ASN A 137 2.648 11.619 11.122 1.00 10.00 O ATOM 2019 ND2 ASN A 137 3.984 12.118 12.840 1.00 10.00 N ATOM 0 H ASN A 137 2.812 10.951 9.054 1.00 10.00 H new ATOM 0 HA ASN A 137 5.754 10.900 8.831 1.00 10.00 H new ATOM 0 HB2 ASN A 137 5.878 11.516 11.210 1.00 10.00 H new ATOM 0 HB3 ASN A 137 5.185 12.816 10.260 1.00 10.00 H new ATOM 0 HD21 ASN A 137 3.195 12.164 13.485 1.00 10.00 H new ATOM 0 HD22 ASN A 137 4.931 12.291 13.178 1.00 10.00 H new ATOM 2026 N VAL A 138 4.582 8.482 8.964 1.00 10.00 N ATOM 2027 CA VAL A 138 4.179 7.118 9.265 1.00 10.00 C ATOM 2028 C VAL A 138 5.380 6.346 9.825 1.00 10.00 C ATOM 2029 O VAL A 138 6.503 6.509 9.350 1.00 10.00 O ATOM 2030 CB VAL A 138 3.633 6.453 7.988 1.00 10.00 C ATOM 2031 CG1 VAL A 138 3.091 5.044 8.268 1.00 10.00 C ATOM 2032 CG2 VAL A 138 2.537 7.284 7.311 1.00 10.00 C ATOM 0 H VAL A 138 4.790 8.651 7.980 1.00 10.00 H new ATOM 0 HA VAL A 138 3.389 7.115 10.016 1.00 10.00 H new ATOM 0 HB VAL A 138 4.483 6.386 7.309 1.00 10.00 H new ATOM 0 HG11 VAL A 138 2.715 4.608 7.342 1.00 10.00 H new ATOM 0 HG12 VAL A 138 3.891 4.419 8.665 1.00 10.00 H new ATOM 0 HG13 VAL A 138 2.282 5.103 8.996 1.00 10.00 H new ATOM 0 HG21 VAL A 138 2.189 6.768 6.416 1.00 10.00 H new ATOM 0 HG22 VAL A 138 1.703 7.417 8.000 1.00 10.00 H new ATOM 0 HG23 VAL A 138 2.938 8.259 7.034 1.00 10.00 H new ATOM 2042 N ALA A 139 5.149 5.490 10.823 1.00 10.00 N ATOM 2043 CA ALA A 139 6.190 4.661 11.412 1.00 10.00 C ATOM 2044 C ALA A 139 6.382 3.420 10.539 1.00 10.00 C ATOM 2045 O ALA A 139 5.412 2.712 10.271 1.00 10.00 O ATOM 2046 CB ALA A 139 5.784 4.278 12.837 1.00 10.00 C ATOM 0 H ALA A 139 4.229 5.356 11.243 1.00 10.00 H new ATOM 0 HA ALA A 139 7.134 5.204 11.461 1.00 10.00 H new ATOM 0 HB1 ALA A 139 6.561 3.657 13.282 1.00 10.00 H new ATOM 0 HB2 ALA A 139 5.655 5.181 13.434 1.00 10.00 H new ATOM 0 HB3 ALA A 139 4.846 3.723 12.811 1.00 10.00 H new ATOM 2052 N ALA A 140 7.613 3.171 10.080 1.00 10.00 N ATOM 2053 CA ALA A 140 7.948 2.053 9.210 1.00 10.00 C ATOM 2054 C ALA A 140 8.983 1.157 9.888 1.00 10.00 C ATOM 2055 O ALA A 140 9.997 1.647 10.381 1.00 10.00 O ATOM 2056 CB ALA A 140 8.494 2.588 7.888 1.00 10.00 C ATOM 0 H ALA A 140 8.416 3.756 10.311 1.00 10.00 H new ATOM 0 HA ALA A 140 7.053 1.462 9.015 1.00 10.00 H new ATOM 0 HB1 ALA A 140 8.746 1.753 7.234 1.00 10.00 H new ATOM 0 HB2 ALA A 140 7.739 3.210 7.408 1.00 10.00 H new ATOM 0 HB3 ALA A 140 9.387 3.183 8.077 1.00 10.00 H new ATOM 2062 N THR A 141 8.736 -0.152 9.914 1.00 10.00 N ATOM 2063 CA THR A 141 9.595 -1.125 10.580 1.00 10.00 C ATOM 2064 C THR A 141 10.722 -1.509 9.625 1.00 10.00 C ATOM 2065 O THR A 141 10.465 -1.899 8.490 1.00 10.00 O ATOM 2066 CB THR A 141 8.748 -2.341 10.979 1.00 10.00 C ATOM 2067 OG1 THR A 141 7.459 -1.926 11.389 1.00 10.00 O ATOM 2068 CG2 THR A 141 9.415 -3.078 12.141 1.00 10.00 C ATOM 0 H THR A 141 7.921 -0.571 9.466 1.00 10.00 H new ATOM 0 HA THR A 141 10.038 -0.710 11.485 1.00 10.00 H new ATOM 0 HB THR A 141 8.664 -3.001 10.116 1.00 10.00 H new ATOM 0 HG1 THR A 141 6.927 -2.710 11.639 1.00 10.00 H new ATOM 0 HG21 THR A 141 8.810 -3.940 12.420 1.00 10.00 H new ATOM 0 HG22 THR A 141 10.407 -3.414 11.838 1.00 10.00 H new ATOM 0 HG23 THR A 141 9.505 -2.406 12.994 1.00 10.00 H new ATOM 2076 N VAL A 142 11.979 -1.406 10.048 1.00 10.00 N ATOM 2077 CA VAL A 142 13.097 -1.637 9.165 1.00 10.00 C ATOM 2078 C VAL A 142 13.383 -3.141 9.206 1.00 10.00 C ATOM 2079 O VAL A 142 13.917 -3.648 10.193 1.00 10.00 O ATOM 2080 CB VAL A 142 14.276 -0.742 9.569 1.00 10.00 C ATOM 2081 CG1 VAL A 142 15.303 -0.766 8.435 1.00 10.00 C ATOM 2082 CG2 VAL A 142 13.842 0.714 9.790 1.00 10.00 C ATOM 0 H VAL A 142 12.240 -1.162 11.003 1.00 10.00 H new ATOM 0 HA VAL A 142 12.890 -1.363 8.130 1.00 10.00 H new ATOM 0 HB VAL A 142 14.689 -1.122 10.504 1.00 10.00 H new ATOM 0 HG11 VAL A 142 16.152 -0.136 8.700 1.00 10.00 H new ATOM 0 HG12 VAL A 142 15.646 -1.788 8.276 1.00 10.00 H new ATOM 0 HG13 VAL A 142 14.844 -0.391 7.520 1.00 10.00 H new ATOM 0 HG21 VAL A 142 14.707 1.312 10.074 1.00 10.00 H new ATOM 0 HG22 VAL A 142 13.414 1.110 8.869 1.00 10.00 H new ATOM 0 HG23 VAL A 142 13.096 0.755 10.584 1.00 10.00 H new ATOM 2092 N LYS A 143 12.923 -3.868 8.184 1.00 10.00 N ATOM 2093 CA LYS A 143 12.906 -5.321 8.097 1.00 10.00 C ATOM 2094 C LYS A 143 13.119 -5.715 6.632 1.00 10.00 C ATOM 2095 O LYS A 143 12.339 -5.305 5.778 1.00 10.00 O ATOM 2096 CB LYS A 143 11.541 -5.864 8.571 1.00 10.00 C ATOM 2097 CG LYS A 143 11.263 -5.693 10.072 1.00 10.00 C ATOM 2098 CD LYS A 143 11.996 -6.749 10.919 1.00 10.00 C ATOM 2099 CE LYS A 143 12.567 -6.157 12.213 1.00 10.00 C ATOM 2100 NZ LYS A 143 11.543 -5.642 13.147 1.00 10.00 N ATOM 0 H LYS A 143 12.532 -3.428 7.351 1.00 10.00 H new ATOM 0 HA LYS A 143 13.691 -5.738 8.728 1.00 10.00 H new ATOM 0 HB2 LYS A 143 10.752 -5.362 8.011 1.00 10.00 H new ATOM 0 HB3 LYS A 143 11.482 -6.924 8.324 1.00 10.00 H new ATOM 0 HG2 LYS A 143 11.573 -4.697 10.387 1.00 10.00 H new ATOM 0 HG3 LYS A 143 10.190 -5.765 10.252 1.00 10.00 H new ATOM 0 HD2 LYS A 143 11.308 -7.558 11.164 1.00 10.00 H new ATOM 0 HD3 LYS A 143 12.805 -7.185 10.333 1.00 10.00 H new ATOM 0 HE2 LYS A 143 13.154 -6.922 12.721 1.00 10.00 H new ATOM 0 HE3 LYS A 143 13.251 -5.347 11.958 1.00 10.00 H new ATOM 0 HZ1 LYS A 143 11.847 -4.721 13.522 1.00 10.00 H new ATOM 0 HZ2 LYS A 143 10.640 -5.530 12.644 1.00 10.00 H new ATOM 0 HZ3 LYS A 143 11.421 -6.313 13.933 1.00 10.00 H new ATOM 2114 N LYS A 144 14.149 -6.522 6.344 1.00 10.00 N ATOM 2115 CA LYS A 144 14.377 -7.103 5.020 1.00 10.00 C ATOM 2116 C LYS A 144 13.144 -7.884 4.562 1.00 10.00 C ATOM 2117 O LYS A 144 12.681 -7.714 3.437 1.00 10.00 O ATOM 2118 CB LYS A 144 15.606 -8.027 5.061 1.00 10.00 C ATOM 2119 CG LYS A 144 16.236 -8.155 3.664 1.00 10.00 C ATOM 2120 CD LYS A 144 17.318 -7.082 3.463 1.00 10.00 C ATOM 2121 CE LYS A 144 18.666 -7.609 3.982 1.00 10.00 C ATOM 2122 NZ LYS A 144 19.678 -6.543 4.124 1.00 10.00 N ATOM 0 H LYS A 144 14.852 -6.791 7.032 1.00 10.00 H new ATOM 0 HA LYS A 144 14.560 -6.298 4.308 1.00 10.00 H new ATOM 0 HB2 LYS A 144 16.341 -7.632 5.762 1.00 10.00 H new ATOM 0 HB3 LYS A 144 15.315 -9.012 5.426 1.00 10.00 H new ATOM 0 HG2 LYS A 144 16.672 -9.147 3.544 1.00 10.00 H new ATOM 0 HG3 LYS A 144 15.466 -8.051 2.900 1.00 10.00 H new ATOM 0 HD2 LYS A 144 17.398 -6.825 2.407 1.00 10.00 H new ATOM 0 HD3 LYS A 144 17.044 -6.170 3.993 1.00 10.00 H new ATOM 0 HE2 LYS A 144 18.515 -8.092 4.947 1.00 10.00 H new ATOM 0 HE3 LYS A 144 19.041 -8.371 3.299 1.00 10.00 H new ATOM 0 HZ1 LYS A 144 20.513 -6.920 4.617 1.00 10.00 H new ATOM 0 HZ2 LYS A 144 19.957 -6.202 3.182 1.00 10.00 H new ATOM 0 HZ3 LYS A 144 19.278 -5.756 4.673 1.00 10.00 H new