USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=34 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 123 THR OG1 : rot 25:sc= 0.826 USER MOD Set 1.2: A 141 THR OG1 : rot -58:sc= 0.777 USER MOD Set 2.1: A 54 LYS NZ :NH3+ -157:sc= 1.26 (180deg=1) USER MOD Set 2.2: A 55 SER OG : rot -1:sc= 1.22 USER MOD Set 3.1: A 50 THR OG1 : rot 27:sc= 1.94 USER MOD Set 3.2: A 101 THR OG1 : rot 62:sc= 1.16 USER MOD Set 4.1: A 34 THR OG1 : rot -53:sc= 2.08 USER MOD Set 4.2: A 143 LYS NZ :NH3+ -134:sc= 2.46 (180deg=-0.626) USER MOD Single : A 29 THR OG1 : rot -29:sc= 0.549 USER MOD Single : A 31 GLN : amide:sc= -0.922 K(o=-0.92,f=-6!) USER MOD Single : A 41 SER OG : rot -100:sc= 0.844 USER MOD Single : A 45 THR OG1 : rot 167:sc= 0.639 USER MOD Single : A 48 TYR OH : rot 180:sc= -0.301 USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot 147:sc= 1.14 USER MOD Single : A 53 ASN : amide:sc= -3.46 K(o=-3.5,f=-5.7!) USER MOD Single : A 57 GLN : amide:sc= -0.388 X(o=-0.39,f=-0.86) USER MOD Single : A 60 LYS NZ :NH3+ 135:sc= 1.03 (180deg=-1.29!) USER MOD Single : A 66 THR OG1 : rot 160:sc= 0.786 USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.11 USER MOD Single : A 71 SER OG : rot 180:sc= -0.0174 USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl -163:sc= -0.592 (180deg=-1.29) USER MOD Single : A 76 THR OG1 : rot 57:sc= 1.77 USER MOD Single : A 77 THR OG1 : rot 105:sc= -0.551 USER MOD Single : A 78 THR OG1 : rot 143:sc= 0.433 USER MOD Single : A 79 HIS : no HD1:sc= -0.306 X(o=-0.31,f=-0.28) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 83 MET CE :methyl -175:sc= 0 (180deg=-0.0478) USER MOD Single : A 86 MET CE :methyl 163:sc=-0.00107 (180deg=-0.542) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 MET CE :methyl -169:sc= -0.027 (180deg=-0.264) USER MOD Single : A 93 THR OG1 : rot -12:sc= 0.0352 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= 0.489 X(o=0.49,f=0) USER MOD Single : A 108 HIS : no HD1:sc= -0.214 K(o=-0.21,f=-1.5) USER MOD Single : A 110 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 112 MET CE :methyl -173:sc= 0 (180deg=-0.0645) USER MOD Single : A 115 LYS NZ :NH3+ 174:sc= 1.23 (180deg=1.2) USER MOD Single : A 119 LYS NZ :NH3+ -175:sc= 1.17 (180deg=0.746) USER MOD Single : A 125 ASN : amide:sc= 0.971 K(o=0.97,f=0) USER MOD Single : A 127 THR OG1 : rot -8:sc= 0.678 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot -61:sc= 0.0178 USER MOD Single : A 137 ASN : amide:sc= -0.202 K(o=-0.2,f=-6.1!) USER MOD Single : A 144 LYS NZ :NH3+ -158:sc= 1.19 (180deg=1.12) USER MOD ----------------------------------------------------------------- ATOM 369 N VAL A 28 -4.850 1.793 -8.952 1.00 10.00 N ATOM 370 CA VAL A 28 -3.493 1.825 -9.478 1.00 10.00 C ATOM 371 C VAL A 28 -2.478 1.579 -8.357 1.00 10.00 C ATOM 372 O VAL A 28 -1.485 2.294 -8.231 1.00 10.00 O ATOM 373 CB VAL A 28 -3.263 3.213 -10.121 1.00 10.00 C ATOM 374 CG1 VAL A 28 -4.066 3.375 -11.413 1.00 10.00 C ATOM 375 CG2 VAL A 28 -3.592 4.389 -9.188 1.00 10.00 C ATOM 0 HA VAL A 28 -3.360 1.040 -10.222 1.00 10.00 H new ATOM 0 HB VAL A 28 -2.195 3.244 -10.335 1.00 10.00 H new ATOM 0 HG11 VAL A 28 -3.879 4.362 -11.836 1.00 10.00 H new ATOM 0 HG12 VAL A 28 -3.763 2.610 -12.128 1.00 10.00 H new ATOM 0 HG13 VAL A 28 -5.129 3.268 -11.197 1.00 10.00 H new ATOM 0 HG21 VAL A 28 -3.406 5.329 -9.708 1.00 10.00 H new ATOM 0 HG22 VAL A 28 -4.640 4.338 -8.894 1.00 10.00 H new ATOM 0 HG23 VAL A 28 -2.963 4.335 -8.299 1.00 10.00 H new ATOM 385 N THR A 29 -2.679 0.535 -7.550 1.00 10.00 N ATOM 386 CA THR A 29 -1.762 0.176 -6.491 1.00 10.00 C ATOM 387 C THR A 29 -1.972 -1.288 -6.109 1.00 10.00 C ATOM 388 O THR A 29 -2.971 -1.593 -5.463 1.00 10.00 O ATOM 389 CB THR A 29 -1.990 1.097 -5.279 1.00 10.00 C ATOM 390 OG1 THR A 29 -2.090 2.463 -5.631 1.00 10.00 O ATOM 391 CG2 THR A 29 -0.806 0.933 -4.342 1.00 10.00 C ATOM 0 H THR A 29 -3.489 -0.081 -7.621 1.00 10.00 H new ATOM 0 HA THR A 29 -0.734 0.301 -6.832 1.00 10.00 H new ATOM 0 HB THR A 29 -2.935 0.811 -4.817 1.00 10.00 H new ATOM 0 HG1 THR A 29 -1.558 2.633 -6.436 1.00 10.00 H new ATOM 0 HG21 THR A 29 -0.939 1.575 -3.471 1.00 10.00 H new ATOM 0 HG22 THR A 29 -0.738 -0.106 -4.020 1.00 10.00 H new ATOM 0 HG23 THR A 29 0.111 1.212 -4.862 1.00 10.00 H new ATOM 399 N VAL A 30 -1.055 -2.187 -6.486 1.00 10.00 N ATOM 400 CA VAL A 30 -1.056 -3.558 -5.987 1.00 10.00 C ATOM 401 C VAL A 30 0.334 -4.195 -6.125 1.00 10.00 C ATOM 402 O VAL A 30 0.628 -4.823 -7.140 1.00 10.00 O ATOM 403 CB VAL A 30 -2.210 -4.374 -6.616 1.00 10.00 C ATOM 404 CG1 VAL A 30 -2.185 -4.443 -8.151 1.00 10.00 C ATOM 405 CG2 VAL A 30 -2.278 -5.791 -6.033 1.00 10.00 C ATOM 0 H VAL A 30 -0.300 -1.983 -7.140 1.00 10.00 H new ATOM 0 HA VAL A 30 -1.260 -3.555 -4.916 1.00 10.00 H new ATOM 0 HB VAL A 30 -3.110 -3.820 -6.350 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -3.030 -5.035 -8.502 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -2.252 -3.435 -8.562 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -1.255 -4.908 -8.479 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -3.100 -6.336 -6.497 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -1.340 -6.311 -6.230 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -2.442 -5.734 -4.957 1.00 10.00 H new ATOM 415 N GLN A 31 1.201 -4.036 -5.117 1.00 10.00 N ATOM 416 CA GLN A 31 2.397 -4.853 -4.947 1.00 10.00 C ATOM 417 C GLN A 31 2.823 -4.799 -3.470 1.00 10.00 C ATOM 418 O GLN A 31 2.500 -3.836 -2.776 1.00 10.00 O ATOM 419 CB GLN A 31 3.481 -4.373 -5.921 1.00 10.00 C ATOM 420 CG GLN A 31 4.675 -5.325 -6.040 1.00 10.00 C ATOM 421 CD GLN A 31 5.700 -5.106 -4.935 1.00 10.00 C ATOM 422 OE1 GLN A 31 5.899 -3.985 -4.475 1.00 10.00 O ATOM 423 NE2 GLN A 31 6.310 -6.181 -4.452 1.00 10.00 N ATOM 0 H GLN A 31 1.086 -3.328 -4.392 1.00 10.00 H new ATOM 0 HA GLN A 31 2.209 -5.899 -5.188 1.00 10.00 H new ATOM 0 HB2 GLN A 31 3.036 -4.239 -6.907 1.00 10.00 H new ATOM 0 HB3 GLN A 31 3.839 -3.396 -5.598 1.00 10.00 H new ATOM 0 HG2 GLN A 31 4.321 -6.355 -6.005 1.00 10.00 H new ATOM 0 HG3 GLN A 31 5.153 -5.185 -7.009 1.00 10.00 H new ATOM 0 HE21 GLN A 31 6.123 -7.098 -4.856 1.00 10.00 H new ATOM 0 HE22 GLN A 31 6.966 -6.090 -3.676 1.00 10.00 H new ATOM 432 N GLY A 32 3.513 -5.839 -2.986 1.00 10.00 N ATOM 433 CA GLY A 32 3.955 -5.972 -1.602 1.00 10.00 C ATOM 434 C GLY A 32 5.279 -5.244 -1.345 1.00 10.00 C ATOM 435 O GLY A 32 6.338 -5.691 -1.787 1.00 10.00 O ATOM 0 H GLY A 32 3.785 -6.632 -3.568 1.00 10.00 H new ATOM 0 HA2 GLY A 32 3.188 -5.574 -0.938 1.00 10.00 H new ATOM 0 HA3 GLY A 32 4.070 -7.028 -1.359 1.00 10.00 H new ATOM 439 N ALA A 33 5.221 -4.125 -0.621 1.00 10.00 N ATOM 440 CA ALA A 33 6.385 -3.318 -0.285 1.00 10.00 C ATOM 441 C ALA A 33 7.447 -4.095 0.494 1.00 10.00 C ATOM 442 O ALA A 33 7.140 -5.024 1.239 1.00 10.00 O ATOM 443 CB ALA A 33 5.926 -2.110 0.540 1.00 10.00 C ATOM 0 H ALA A 33 4.348 -3.752 -0.248 1.00 10.00 H new ATOM 0 HA ALA A 33 6.848 -3.004 -1.220 1.00 10.00 H new ATOM 0 HB1 ALA A 33 6.789 -1.497 0.798 1.00 10.00 H new ATOM 0 HB2 ALA A 33 5.222 -1.517 -0.044 1.00 10.00 H new ATOM 0 HB3 ALA A 33 5.440 -2.456 1.453 1.00 10.00 H new ATOM 449 N THR A 34 8.704 -3.664 0.374 1.00 10.00 N ATOM 450 CA THR A 34 9.767 -4.059 1.279 1.00 10.00 C ATOM 451 C THR A 34 10.558 -2.802 1.625 1.00 10.00 C ATOM 452 O THR A 34 10.589 -1.888 0.804 1.00 10.00 O ATOM 453 CB THR A 34 10.643 -5.148 0.640 1.00 10.00 C ATOM 454 OG1 THR A 34 11.586 -4.627 -0.279 1.00 10.00 O ATOM 455 CG2 THR A 34 9.807 -6.209 -0.085 1.00 10.00 C ATOM 0 H THR A 34 9.008 -3.026 -0.362 1.00 10.00 H new ATOM 0 HA THR A 34 9.366 -4.496 2.194 1.00 10.00 H new ATOM 0 HB THR A 34 11.175 -5.603 1.476 1.00 10.00 H new ATOM 0 HG1 THR A 34 11.126 -4.065 -0.937 1.00 10.00 H new ATOM 0 HG21 THR A 34 10.468 -6.958 -0.521 1.00 10.00 H new ATOM 0 HG22 THR A 34 9.133 -6.689 0.625 1.00 10.00 H new ATOM 0 HG23 THR A 34 9.224 -5.736 -0.875 1.00 10.00 H new ATOM 463 N VAL A 35 11.183 -2.743 2.804 1.00 10.00 N ATOM 464 CA VAL A 35 12.068 -1.655 3.208 1.00 10.00 C ATOM 465 C VAL A 35 13.463 -2.246 3.355 1.00 10.00 C ATOM 466 O VAL A 35 13.597 -3.344 3.894 1.00 10.00 O ATOM 467 CB VAL A 35 11.583 -1.020 4.524 1.00 10.00 C ATOM 468 CG1 VAL A 35 12.447 0.196 4.886 1.00 10.00 C ATOM 469 CG2 VAL A 35 10.120 -0.577 4.400 1.00 10.00 C ATOM 0 H VAL A 35 11.084 -3.466 3.516 1.00 10.00 H new ATOM 0 HA VAL A 35 12.073 -0.859 2.463 1.00 10.00 H new ATOM 0 HB VAL A 35 11.668 -1.771 5.310 1.00 10.00 H new ATOM 0 HG11 VAL A 35 12.089 0.632 5.819 1.00 10.00 H new ATOM 0 HG12 VAL A 35 13.484 -0.117 5.006 1.00 10.00 H new ATOM 0 HG13 VAL A 35 12.382 0.938 4.090 1.00 10.00 H new ATOM 0 HG21 VAL A 35 9.794 -0.131 5.339 1.00 10.00 H new ATOM 0 HG22 VAL A 35 10.029 0.156 3.599 1.00 10.00 H new ATOM 0 HG23 VAL A 35 9.496 -1.442 4.174 1.00 10.00 H new ATOM 479 N ALA A 36 14.513 -1.564 2.893 1.00 10.00 N ATOM 480 CA ALA A 36 15.862 -2.125 2.898 1.00 10.00 C ATOM 481 C ALA A 36 16.545 -2.059 4.271 1.00 10.00 C ATOM 482 O ALA A 36 17.708 -1.673 4.358 1.00 10.00 O ATOM 483 CB ALA A 36 16.694 -1.442 1.819 1.00 10.00 C ATOM 0 H ALA A 36 14.453 -0.620 2.510 1.00 10.00 H new ATOM 0 HA ALA A 36 15.780 -3.189 2.675 1.00 10.00 H new ATOM 0 HB1 ALA A 36 17.702 -1.858 1.819 1.00 10.00 H new ATOM 0 HB2 ALA A 36 16.233 -1.607 0.845 1.00 10.00 H new ATOM 0 HB3 ALA A 36 16.743 -0.372 2.020 1.00 10.00 H new ATOM 489 N ALA A 37 15.831 -2.467 5.328 1.00 10.00 N ATOM 490 CA ALA A 37 16.225 -2.399 6.739 1.00 10.00 C ATOM 491 C ALA A 37 17.179 -1.224 6.994 1.00 10.00 C ATOM 492 O ALA A 37 16.839 -0.106 6.617 1.00 10.00 O ATOM 493 CB ALA A 37 16.762 -3.760 7.195 1.00 10.00 C ATOM 0 H ALA A 37 14.905 -2.879 5.212 1.00 10.00 H new ATOM 0 HA ALA A 37 15.352 -2.189 7.357 1.00 10.00 H new ATOM 0 HB1 ALA A 37 17.053 -3.703 8.244 1.00 10.00 H new ATOM 0 HB2 ALA A 37 15.986 -4.516 7.074 1.00 10.00 H new ATOM 0 HB3 ALA A 37 17.629 -4.030 6.592 1.00 10.00 H new ATOM 499 N VAL A 38 18.372 -1.461 7.557 1.00 10.00 N ATOM 500 CA VAL A 38 19.492 -0.531 7.402 1.00 10.00 C ATOM 501 C VAL A 38 20.479 -1.137 6.388 1.00 10.00 C ATOM 502 O VAL A 38 21.005 -2.233 6.624 1.00 10.00 O ATOM 503 CB VAL A 38 20.144 -0.195 8.760 1.00 10.00 C ATOM 504 CG1 VAL A 38 21.420 0.635 8.600 1.00 10.00 C ATOM 505 CG2 VAL A 38 19.164 0.601 9.626 1.00 10.00 C ATOM 0 H VAL A 38 18.583 -2.285 8.120 1.00 10.00 H new ATOM 0 HA VAL A 38 19.140 0.426 7.016 1.00 10.00 H new ATOM 0 HB VAL A 38 20.401 -1.144 9.231 1.00 10.00 H new ATOM 0 HG11 VAL A 38 21.842 0.846 9.582 1.00 10.00 H new ATOM 0 HG12 VAL A 38 22.144 0.078 8.006 1.00 10.00 H new ATOM 0 HG13 VAL A 38 21.183 1.573 8.097 1.00 10.00 H new ATOM 0 HG21 VAL A 38 19.631 0.835 10.583 1.00 10.00 H new ATOM 0 HG22 VAL A 38 18.898 1.527 9.117 1.00 10.00 H new ATOM 0 HG23 VAL A 38 18.265 0.009 9.796 1.00 10.00 H new ATOM 515 N PRO A 39 20.739 -0.472 5.250 1.00 10.00 N ATOM 516 CA PRO A 39 21.843 -0.813 4.367 1.00 10.00 C ATOM 517 C PRO A 39 23.123 -0.194 4.947 1.00 10.00 C ATOM 518 O PRO A 39 23.034 0.628 5.859 1.00 10.00 O ATOM 519 CB PRO A 39 21.454 -0.204 3.020 1.00 10.00 C ATOM 520 CG PRO A 39 20.614 1.020 3.386 1.00 10.00 C ATOM 521 CD PRO A 39 20.083 0.743 4.792 1.00 10.00 C ATOM 0 HA PRO A 39 22.029 -1.882 4.260 1.00 10.00 H new ATOM 0 HB2 PRO A 39 22.334 0.076 2.441 1.00 10.00 H new ATOM 0 HB3 PRO A 39 20.886 -0.910 2.414 1.00 10.00 H new ATOM 0 HG2 PRO A 39 21.215 1.929 3.365 1.00 10.00 H new ATOM 0 HG3 PRO A 39 19.797 1.162 2.678 1.00 10.00 H new ATOM 0 HD2 PRO A 39 20.300 1.577 5.460 1.00 10.00 H new ATOM 0 HD3 PRO A 39 19.000 0.618 4.780 1.00 10.00 H new ATOM 529 N PRO A 40 24.324 -0.543 4.460 1.00 10.00 N ATOM 530 CA PRO A 40 25.540 0.157 4.845 1.00 10.00 C ATOM 531 C PRO A 40 25.548 1.538 4.180 1.00 10.00 C ATOM 532 O PRO A 40 26.312 1.811 3.255 1.00 10.00 O ATOM 533 CB PRO A 40 26.690 -0.741 4.390 1.00 10.00 C ATOM 534 CG PRO A 40 26.107 -1.444 3.168 1.00 10.00 C ATOM 535 CD PRO A 40 24.620 -1.594 3.499 1.00 10.00 C ATOM 0 HA PRO A 40 25.624 0.337 5.917 1.00 10.00 H new ATOM 0 HB2 PRO A 40 27.579 -0.163 4.138 1.00 10.00 H new ATOM 0 HB3 PRO A 40 26.980 -1.451 5.165 1.00 10.00 H new ATOM 0 HG2 PRO A 40 26.257 -0.858 2.261 1.00 10.00 H new ATOM 0 HG3 PRO A 40 26.578 -2.413 3.002 1.00 10.00 H new ATOM 0 HD2 PRO A 40 24.007 -1.490 2.604 1.00 10.00 H new ATOM 0 HD3 PRO A 40 24.409 -2.578 3.917 1.00 10.00 H new ATOM 543 N SER A 41 24.654 2.416 4.630 1.00 10.00 N ATOM 544 CA SER A 41 24.539 3.786 4.168 1.00 10.00 C ATOM 545 C SER A 41 23.878 4.625 5.256 1.00 10.00 C ATOM 546 O SER A 41 23.082 5.494 4.936 1.00 10.00 O ATOM 547 CB SER A 41 23.710 3.853 2.878 1.00 10.00 C ATOM 548 OG SER A 41 24.125 2.883 1.925 1.00 10.00 O ATOM 0 H SER A 41 23.970 2.180 5.349 1.00 10.00 H new ATOM 0 HA SER A 41 25.534 4.176 3.955 1.00 10.00 H new ATOM 0 HB2 SER A 41 22.657 3.700 3.116 1.00 10.00 H new ATOM 0 HB3 SER A 41 23.797 4.849 2.443 1.00 10.00 H new ATOM 0 HG SER A 41 24.698 3.308 1.254 1.00 10.00 H new ATOM 554 N ILE A 42 24.217 4.366 6.524 1.00 10.00 N ATOM 555 CA ILE A 42 23.665 5.057 7.679 1.00 10.00 C ATOM 556 C ILE A 42 22.175 4.696 7.857 1.00 10.00 C ATOM 557 O ILE A 42 21.629 3.876 7.124 1.00 10.00 O ATOM 558 CB ILE A 42 23.976 6.573 7.595 1.00 10.00 C ATOM 559 CG1 ILE A 42 25.412 6.877 7.110 1.00 10.00 C ATOM 560 CG2 ILE A 42 23.768 7.294 8.934 1.00 10.00 C ATOM 561 CD1 ILE A 42 26.508 6.270 7.992 1.00 10.00 C ATOM 0 H ILE A 42 24.900 3.651 6.774 1.00 10.00 H new ATOM 0 HA ILE A 42 24.147 4.720 8.596 1.00 10.00 H new ATOM 0 HB ILE A 42 23.264 6.947 6.859 1.00 10.00 H new ATOM 0 HG12 ILE A 42 25.528 6.502 6.093 1.00 10.00 H new ATOM 0 HG13 ILE A 42 25.550 7.957 7.069 1.00 10.00 H new ATOM 0 HG21 ILE A 42 24.000 8.353 8.817 1.00 10.00 H new ATOM 0 HG22 ILE A 42 22.731 7.183 9.250 1.00 10.00 H new ATOM 0 HG23 ILE A 42 24.425 6.859 9.687 1.00 10.00 H new ATOM 0 HD11 ILE A 42 27.486 6.528 7.586 1.00 10.00 H new ATOM 0 HD12 ILE A 42 26.420 6.664 9.004 1.00 10.00 H new ATOM 0 HD13 ILE A 42 26.399 5.186 8.014 1.00 10.00 H new ATOM 573 N ARG A 43 21.550 5.232 8.909 1.00 10.00 N ATOM 574 CA ARG A 43 20.167 5.024 9.316 1.00 10.00 C ATOM 575 C ARG A 43 19.143 5.128 8.184 1.00 10.00 C ATOM 576 O ARG A 43 18.090 4.493 8.266 1.00 10.00 O ATOM 577 CB ARG A 43 19.810 6.061 10.399 1.00 10.00 C ATOM 578 CG ARG A 43 18.902 5.482 11.488 1.00 10.00 C ATOM 579 CD ARG A 43 19.711 4.601 12.446 1.00 10.00 C ATOM 580 NE ARG A 43 18.908 4.165 13.599 1.00 10.00 N ATOM 581 CZ ARG A 43 19.452 3.659 14.718 1.00 10.00 C ATOM 582 NH1 ARG A 43 20.767 3.412 14.764 1.00 10.00 N ATOM 583 NH2 ARG A 43 18.703 3.401 15.790 1.00 10.00 N ATOM 0 H ARG A 43 22.037 5.868 9.541 1.00 10.00 H new ATOM 0 HA ARG A 43 20.111 3.999 9.683 1.00 10.00 H new ATOM 0 HB2 ARG A 43 20.726 6.435 10.855 1.00 10.00 H new ATOM 0 HB3 ARG A 43 19.315 6.913 9.933 1.00 10.00 H new ATOM 0 HG2 ARG A 43 18.427 6.291 12.042 1.00 10.00 H new ATOM 0 HG3 ARG A 43 18.104 4.896 11.032 1.00 10.00 H new ATOM 0 HD2 ARG A 43 20.082 3.727 11.910 1.00 10.00 H new ATOM 0 HD3 ARG A 43 20.583 5.153 12.798 1.00 10.00 H new ATOM 0 HE ARG A 43 17.893 4.251 13.546 1.00 10.00 H new ATOM 0 HH11 ARG A 43 21.351 3.608 13.951 1.00 10.00 H new ATOM 0 HH12 ARG A 43 21.184 3.028 15.612 1.00 10.00 H new ATOM 0 HH21 ARG A 43 17.700 3.588 15.769 1.00 10.00 H new ATOM 0 HH22 ARG A 43 19.132 3.017 16.632 1.00 10.00 H new ATOM 597 N ASP A 44 19.383 5.994 7.197 1.00 10.00 N ATOM 598 CA ASP A 44 18.464 6.164 6.090 1.00 10.00 C ATOM 599 C ASP A 44 18.385 4.891 5.254 1.00 10.00 C ATOM 600 O ASP A 44 19.300 4.072 5.215 1.00 10.00 O ATOM 601 CB ASP A 44 18.834 7.390 5.248 1.00 10.00 C ATOM 602 CG ASP A 44 20.288 7.376 4.827 1.00 10.00 C ATOM 603 OD1 ASP A 44 21.103 7.547 5.760 1.00 10.00 O ATOM 604 OD2 ASP A 44 20.530 7.221 3.609 1.00 10.00 O ATOM 0 H ASP A 44 20.212 6.587 7.150 1.00 10.00 H new ATOM 0 HA ASP A 44 17.468 6.348 6.493 1.00 10.00 H new ATOM 0 HB2 ASP A 44 18.201 7.424 4.361 1.00 10.00 H new ATOM 0 HB3 ASP A 44 18.632 8.296 5.819 1.00 10.00 H new ATOM 609 N THR A 45 17.232 4.696 4.624 1.00 10.00 N ATOM 610 CA THR A 45 16.905 3.486 3.905 1.00 10.00 C ATOM 611 C THR A 45 15.750 3.830 2.976 1.00 10.00 C ATOM 612 O THR A 45 15.252 4.957 3.012 1.00 10.00 O ATOM 613 CB THR A 45 16.582 2.360 4.899 1.00 10.00 C ATOM 614 OG1 THR A 45 16.379 1.140 4.219 1.00 10.00 O ATOM 615 CG2 THR A 45 15.355 2.660 5.765 1.00 10.00 C ATOM 0 H THR A 45 16.488 5.394 4.603 1.00 10.00 H new ATOM 0 HA THR A 45 17.737 3.116 3.307 1.00 10.00 H new ATOM 0 HB THR A 45 17.445 2.284 5.561 1.00 10.00 H new ATOM 0 HG1 THR A 45 16.387 0.401 4.863 1.00 10.00 H new ATOM 0 HG21 THR A 45 15.178 1.828 6.446 1.00 10.00 H new ATOM 0 HG22 THR A 45 15.529 3.569 6.340 1.00 10.00 H new ATOM 0 HG23 THR A 45 14.483 2.797 5.126 1.00 10.00 H new ATOM 623 N ALA A 46 15.337 2.882 2.138 1.00 10.00 N ATOM 624 CA ALA A 46 14.344 3.114 1.110 1.00 10.00 C ATOM 625 C ALA A 46 13.431 1.909 0.970 1.00 10.00 C ATOM 626 O ALA A 46 13.789 0.802 1.384 1.00 10.00 O ATOM 627 CB ALA A 46 15.033 3.447 -0.217 1.00 10.00 C ATOM 0 H ALA A 46 15.690 1.925 2.159 1.00 10.00 H new ATOM 0 HA ALA A 46 13.727 3.965 1.397 1.00 10.00 H new ATOM 0 HB1 ALA A 46 14.279 3.620 -0.985 1.00 10.00 H new ATOM 0 HB2 ALA A 46 15.641 4.344 -0.096 1.00 10.00 H new ATOM 0 HB3 ALA A 46 15.670 2.614 -0.515 1.00 10.00 H new ATOM 633 N ALA A 47 12.264 2.140 0.361 1.00 10.00 N ATOM 634 CA ALA A 47 11.393 1.055 -0.043 1.00 10.00 C ATOM 635 C ALA A 47 11.883 0.500 -1.370 1.00 10.00 C ATOM 636 O ALA A 47 12.314 1.252 -2.243 1.00 10.00 O ATOM 637 CB ALA A 47 9.931 1.483 -0.182 1.00 10.00 C ATOM 0 H ALA A 47 11.909 3.071 0.141 1.00 10.00 H new ATOM 0 HA ALA A 47 11.430 0.297 0.740 1.00 10.00 H new ATOM 0 HB1 ALA A 47 9.329 0.627 -0.487 1.00 10.00 H new ATOM 0 HB2 ALA A 47 9.569 1.859 0.775 1.00 10.00 H new ATOM 0 HB3 ALA A 47 9.852 2.268 -0.934 1.00 10.00 H new ATOM 643 N TYR A 48 11.783 -0.820 -1.505 1.00 10.00 N ATOM 644 CA TYR A 48 11.902 -1.522 -2.762 1.00 10.00 C ATOM 645 C TYR A 48 10.539 -2.182 -2.933 1.00 10.00 C ATOM 646 O TYR A 48 10.156 -3.027 -2.118 1.00 10.00 O ATOM 647 CB TYR A 48 13.085 -2.493 -2.752 1.00 10.00 C ATOM 648 CG TYR A 48 14.449 -1.823 -2.738 1.00 10.00 C ATOM 649 CD1 TYR A 48 14.880 -1.096 -1.612 1.00 10.00 C ATOM 650 CD2 TYR A 48 15.304 -1.948 -3.850 1.00 10.00 C ATOM 651 CE1 TYR A 48 16.169 -0.540 -1.584 1.00 10.00 C ATOM 652 CE2 TYR A 48 16.615 -1.445 -3.789 1.00 10.00 C ATOM 653 CZ TYR A 48 17.076 -0.830 -2.614 1.00 10.00 C ATOM 654 OH TYR A 48 18.401 -0.570 -2.435 1.00 10.00 O ATOM 0 H TYR A 48 11.612 -1.441 -0.714 1.00 10.00 H new ATOM 0 HA TYR A 48 12.128 -0.876 -3.611 1.00 10.00 H new ATOM 0 HB2 TYR A 48 13.002 -3.138 -1.877 1.00 10.00 H new ATOM 0 HB3 TYR A 48 13.019 -3.136 -3.630 1.00 10.00 H new ATOM 0 HD1 TYR A 48 14.218 -0.966 -0.769 1.00 10.00 H new ATOM 0 HD2 TYR A 48 14.952 -2.431 -4.750 1.00 10.00 H new ATOM 0 HE1 TYR A 48 16.461 0.109 -0.772 1.00 10.00 H new ATOM 0 HE2 TYR A 48 17.267 -1.531 -4.645 1.00 10.00 H new ATOM 0 HH TYR A 48 18.897 -0.828 -3.240 1.00 10.00 H new ATOM 664 N MET A 49 9.767 -1.656 -3.883 1.00 10.00 N ATOM 665 CA MET A 49 8.321 -1.798 -3.997 1.00 10.00 C ATOM 666 C MET A 49 7.976 -1.533 -5.469 1.00 10.00 C ATOM 667 O MET A 49 8.883 -1.295 -6.263 1.00 10.00 O ATOM 668 CB MET A 49 7.680 -0.806 -3.005 1.00 10.00 C ATOM 669 CG MET A 49 6.157 -0.890 -2.844 1.00 10.00 C ATOM 670 SD MET A 49 5.163 0.266 -3.814 1.00 10.00 S ATOM 671 CE MET A 49 3.515 -0.331 -3.369 1.00 10.00 C ATOM 0 H MET A 49 10.158 -1.088 -4.634 1.00 10.00 H new ATOM 0 HA MET A 49 7.940 -2.786 -3.740 1.00 10.00 H new ATOM 0 HB2 MET A 49 8.136 -0.959 -2.027 1.00 10.00 H new ATOM 0 HB3 MET A 49 7.935 0.206 -3.321 1.00 10.00 H new ATOM 0 HG2 MET A 49 5.845 -1.902 -3.100 1.00 10.00 H new ATOM 0 HG3 MET A 49 5.919 -0.740 -1.791 1.00 10.00 H new ATOM 0 HE1 MET A 49 2.761 0.269 -3.878 1.00 10.00 H new ATOM 0 HE2 MET A 49 3.413 -1.374 -3.669 1.00 10.00 H new ATOM 0 HE3 MET A 49 3.377 -0.248 -2.291 1.00 10.00 H new ATOM 681 N THR A 50 6.711 -1.575 -5.883 1.00 10.00 N ATOM 682 CA THR A 50 6.302 -1.193 -7.228 1.00 10.00 C ATOM 683 C THR A 50 4.869 -0.652 -7.208 1.00 10.00 C ATOM 684 O THR A 50 3.998 -1.213 -6.549 1.00 10.00 O ATOM 685 CB THR A 50 6.481 -2.412 -8.148 1.00 10.00 C ATOM 686 OG1 THR A 50 7.853 -2.582 -8.451 1.00 10.00 O ATOM 687 CG2 THR A 50 5.685 -2.338 -9.449 1.00 10.00 C ATOM 0 H THR A 50 5.939 -1.877 -5.289 1.00 10.00 H new ATOM 0 HA THR A 50 6.922 -0.385 -7.617 1.00 10.00 H new ATOM 0 HB THR A 50 6.089 -3.265 -7.595 1.00 10.00 H new ATOM 0 HG1 THR A 50 8.397 -2.209 -7.726 1.00 10.00 H new ATOM 0 HG21 THR A 50 5.868 -3.236 -10.039 1.00 10.00 H new ATOM 0 HG22 THR A 50 4.622 -2.264 -9.221 1.00 10.00 H new ATOM 0 HG23 THR A 50 5.997 -1.461 -10.017 1.00 10.00 H new ATOM 695 N LEU A 51 4.615 0.429 -7.948 1.00 10.00 N ATOM 696 CA LEU A 51 3.269 0.886 -8.247 1.00 10.00 C ATOM 697 C LEU A 51 2.845 0.207 -9.528 1.00 10.00 C ATOM 698 O LEU A 51 3.441 0.445 -10.575 1.00 10.00 O ATOM 699 CB LEU A 51 3.230 2.394 -8.471 1.00 10.00 C ATOM 700 CG LEU A 51 2.933 3.160 -7.174 1.00 10.00 C ATOM 701 CD1 LEU A 51 3.707 2.671 -5.948 1.00 10.00 C ATOM 702 CD2 LEU A 51 3.237 4.636 -7.402 1.00 10.00 C ATOM 0 H LEU A 51 5.346 1.011 -8.356 1.00 10.00 H new ATOM 0 HA LEU A 51 2.612 0.648 -7.411 1.00 10.00 H new ATOM 0 HB2 LEU A 51 4.186 2.725 -8.877 1.00 10.00 H new ATOM 0 HB3 LEU A 51 2.469 2.631 -9.214 1.00 10.00 H new ATOM 0 HG LEU A 51 1.881 2.985 -6.948 1.00 10.00 H new ATOM 0 HD11 LEU A 51 3.432 3.271 -5.081 1.00 10.00 H new ATOM 0 HD12 LEU A 51 3.464 1.626 -5.758 1.00 10.00 H new ATOM 0 HD13 LEU A 51 4.777 2.767 -6.131 1.00 10.00 H new ATOM 0 HD21 LEU A 51 3.031 5.195 -6.489 1.00 10.00 H new ATOM 0 HD22 LEU A 51 4.287 4.754 -7.671 1.00 10.00 H new ATOM 0 HD23 LEU A 51 2.611 5.016 -8.209 1.00 10.00 H new ATOM 714 N THR A 52 1.810 -0.616 -9.407 1.00 10.00 N ATOM 715 CA THR A 52 1.156 -1.318 -10.488 1.00 10.00 C ATOM 716 C THR A 52 -0.031 -0.474 -10.961 1.00 10.00 C ATOM 717 O THR A 52 -1.157 -0.680 -10.501 1.00 10.00 O ATOM 718 CB THR A 52 0.718 -2.700 -9.967 1.00 10.00 C ATOM 719 OG1 THR A 52 1.736 -3.265 -9.162 1.00 10.00 O ATOM 720 CG2 THR A 52 0.400 -3.646 -11.126 1.00 10.00 C ATOM 0 H THR A 52 1.387 -0.817 -8.501 1.00 10.00 H new ATOM 0 HA THR A 52 1.820 -1.471 -11.339 1.00 10.00 H new ATOM 0 HB THR A 52 -0.183 -2.563 -9.370 1.00 10.00 H new ATOM 0 HG1 THR A 52 1.330 -3.808 -8.455 1.00 10.00 H new ATOM 0 HG21 THR A 52 0.093 -4.615 -10.731 1.00 10.00 H new ATOM 0 HG22 THR A 52 -0.407 -3.227 -11.727 1.00 10.00 H new ATOM 0 HG23 THR A 52 1.287 -3.772 -11.747 1.00 10.00 H new ATOM 728 N ASN A 53 0.184 0.462 -11.895 1.00 10.00 N ATOM 729 CA ASN A 53 -0.928 1.286 -12.365 1.00 10.00 C ATOM 730 C ASN A 53 -1.787 0.509 -13.353 1.00 10.00 C ATOM 731 O ASN A 53 -1.741 0.724 -14.564 1.00 10.00 O ATOM 732 CB ASN A 53 -0.447 2.590 -12.997 1.00 10.00 C ATOM 733 CG ASN A 53 -0.142 3.637 -11.937 1.00 10.00 C ATOM 734 OD1 ASN A 53 0.364 3.322 -10.869 1.00 10.00 O ATOM 735 ND2 ASN A 53 -0.514 4.887 -12.194 1.00 10.00 N ATOM 0 H ASN A 53 1.087 0.661 -12.326 1.00 10.00 H new ATOM 0 HA ASN A 53 -1.529 1.545 -11.494 1.00 10.00 H new ATOM 0 HB2 ASN A 53 0.446 2.401 -13.592 1.00 10.00 H new ATOM 0 HB3 ASN A 53 -1.209 2.970 -13.678 1.00 10.00 H new ATOM 0 HD21 ASN A 53 -0.380 5.614 -11.491 1.00 10.00 H new ATOM 0 HD22 ASN A 53 -0.933 5.119 -13.094 1.00 10.00 H new ATOM 742 N LYS A 54 -2.647 -0.350 -12.810 1.00 10.00 N ATOM 743 CA LYS A 54 -3.602 -1.130 -13.578 1.00 10.00 C ATOM 744 C LYS A 54 -4.818 -0.244 -13.806 1.00 10.00 C ATOM 745 O LYS A 54 -5.914 -0.602 -13.407 1.00 10.00 O ATOM 746 CB LYS A 54 -3.929 -2.414 -12.792 1.00 10.00 C ATOM 747 CG LYS A 54 -4.689 -3.531 -13.544 1.00 10.00 C ATOM 748 CD LYS A 54 -6.221 -3.416 -13.724 1.00 10.00 C ATOM 749 CE LYS A 54 -6.993 -3.258 -12.394 1.00 10.00 C ATOM 750 NZ LYS A 54 -7.801 -2.017 -12.306 1.00 10.00 N ATOM 0 H LYS A 54 -2.697 -0.523 -11.806 1.00 10.00 H new ATOM 0 HA LYS A 54 -3.216 -1.442 -14.548 1.00 10.00 H new ATOM 0 HB2 LYS A 54 -2.992 -2.832 -12.424 1.00 10.00 H new ATOM 0 HB3 LYS A 54 -4.518 -2.134 -11.919 1.00 10.00 H new ATOM 0 HG2 LYS A 54 -4.248 -3.616 -14.537 1.00 10.00 H new ATOM 0 HG3 LYS A 54 -4.490 -4.469 -13.026 1.00 10.00 H new ATOM 0 HD2 LYS A 54 -6.440 -2.561 -14.364 1.00 10.00 H new ATOM 0 HD3 LYS A 54 -6.585 -4.304 -14.242 1.00 10.00 H new ATOM 0 HE2 LYS A 54 -7.651 -4.117 -12.264 1.00 10.00 H new ATOM 0 HE3 LYS A 54 -6.281 -3.274 -11.569 1.00 10.00 H new ATOM 0 HZ1 LYS A 54 -7.964 -1.779 -11.307 1.00 10.00 H new ATOM 0 HZ2 LYS A 54 -7.291 -1.237 -12.769 1.00 10.00 H new ATOM 0 HZ3 LYS A 54 -8.715 -2.163 -12.781 1.00 10.00 H new ATOM 764 N SER A 55 -4.637 0.915 -14.435 1.00 10.00 N ATOM 765 CA SER A 55 -5.723 1.760 -14.914 1.00 10.00 C ATOM 766 C SER A 55 -5.132 2.902 -15.734 1.00 10.00 C ATOM 767 O SER A 55 -4.104 3.479 -15.370 1.00 10.00 O ATOM 768 CB SER A 55 -6.546 2.412 -13.790 1.00 10.00 C ATOM 769 OG SER A 55 -7.174 1.541 -12.870 1.00 10.00 O ATOM 0 H SER A 55 -3.712 1.299 -14.629 1.00 10.00 H new ATOM 0 HA SER A 55 -6.381 1.108 -15.488 1.00 10.00 H new ATOM 0 HB2 SER A 55 -5.889 3.079 -13.232 1.00 10.00 H new ATOM 0 HB3 SER A 55 -7.315 3.033 -14.249 1.00 10.00 H new ATOM 0 HG SER A 55 -6.985 0.612 -13.118 1.00 10.00 H new ATOM 775 N ASP A 56 -5.844 3.296 -16.784 1.00 10.00 N ATOM 776 CA ASP A 56 -5.589 4.487 -17.576 1.00 10.00 C ATOM 777 C ASP A 56 -6.039 5.732 -16.803 1.00 10.00 C ATOM 778 O ASP A 56 -6.805 6.544 -17.322 1.00 10.00 O ATOM 779 CB ASP A 56 -6.352 4.349 -18.899 1.00 10.00 C ATOM 780 CG ASP A 56 -6.088 3.007 -19.557 1.00 10.00 C ATOM 781 OD1 ASP A 56 -6.701 2.026 -19.085 1.00 10.00 O ATOM 782 OD2 ASP A 56 -5.220 2.984 -20.458 1.00 10.00 O ATOM 0 H ASP A 56 -6.650 2.768 -17.119 1.00 10.00 H new ATOM 0 HA ASP A 56 -4.524 4.595 -17.782 1.00 10.00 H new ATOM 0 HB2 ASP A 56 -7.421 4.462 -18.717 1.00 10.00 H new ATOM 0 HB3 ASP A 56 -6.057 5.151 -19.575 1.00 10.00 H new ATOM 787 N GLN A 57 -5.634 5.857 -15.536 1.00 10.00 N ATOM 788 CA GLN A 57 -6.143 6.864 -14.620 1.00 10.00 C ATOM 789 C GLN A 57 -4.967 7.517 -13.875 1.00 10.00 C ATOM 790 O GLN A 57 -4.156 6.791 -13.301 1.00 10.00 O ATOM 791 CB GLN A 57 -7.109 6.204 -13.624 1.00 10.00 C ATOM 792 CG GLN A 57 -8.591 6.222 -14.047 1.00 10.00 C ATOM 793 CD GLN A 57 -9.045 5.036 -14.893 1.00 10.00 C ATOM 794 OE1 GLN A 57 -9.571 4.064 -14.365 1.00 10.00 O ATOM 795 NE2 GLN A 57 -8.884 5.098 -16.210 1.00 10.00 N ATOM 0 H GLN A 57 -4.931 5.248 -15.118 1.00 10.00 H new ATOM 0 HA GLN A 57 -6.680 7.634 -15.174 1.00 10.00 H new ATOM 0 HB2 GLN A 57 -6.802 5.169 -13.474 1.00 10.00 H new ATOM 0 HB3 GLN A 57 -7.015 6.707 -12.662 1.00 10.00 H new ATOM 0 HG2 GLN A 57 -9.207 6.263 -13.149 1.00 10.00 H new ATOM 0 HG3 GLN A 57 -8.781 7.139 -14.605 1.00 10.00 H new ATOM 0 HE21 GLN A 57 -8.444 5.916 -16.632 1.00 10.00 H new ATOM 0 HE22 GLN A 57 -9.201 4.328 -16.799 1.00 10.00 H new ATOM 804 N PRO A 58 -4.851 8.858 -13.876 1.00 10.00 N ATOM 805 CA PRO A 58 -3.808 9.575 -13.159 1.00 10.00 C ATOM 806 C PRO A 58 -4.223 9.823 -11.703 1.00 10.00 C ATOM 807 O PRO A 58 -5.247 10.454 -11.457 1.00 10.00 O ATOM 808 CB PRO A 58 -3.641 10.885 -13.933 1.00 10.00 C ATOM 809 CG PRO A 58 -5.054 11.179 -14.435 1.00 10.00 C ATOM 810 CD PRO A 58 -5.637 9.785 -14.682 1.00 10.00 C ATOM 0 HA PRO A 58 -2.873 9.017 -13.106 1.00 10.00 H new ATOM 0 HB2 PRO A 58 -3.267 11.685 -13.294 1.00 10.00 H new ATOM 0 HB3 PRO A 58 -2.935 10.778 -14.757 1.00 10.00 H new ATOM 0 HG2 PRO A 58 -5.635 11.733 -13.698 1.00 10.00 H new ATOM 0 HG3 PRO A 58 -5.041 11.777 -15.346 1.00 10.00 H new ATOM 0 HD2 PRO A 58 -6.689 9.749 -14.399 1.00 10.00 H new ATOM 0 HD3 PRO A 58 -5.582 9.523 -15.739 1.00 10.00 H new ATOM 818 N ILE A 59 -3.430 9.339 -10.740 1.00 10.00 N ATOM 819 CA ILE A 59 -3.669 9.542 -9.301 1.00 10.00 C ATOM 820 C ILE A 59 -2.326 9.542 -8.586 1.00 10.00 C ATOM 821 O ILE A 59 -1.670 8.509 -8.537 1.00 10.00 O ATOM 822 CB ILE A 59 -4.553 8.453 -8.639 1.00 10.00 C ATOM 823 CG1 ILE A 59 -5.975 8.336 -9.207 1.00 10.00 C ATOM 824 CG2 ILE A 59 -4.699 8.735 -7.132 1.00 10.00 C ATOM 825 CD1 ILE A 59 -6.035 7.280 -10.304 1.00 10.00 C ATOM 0 H ILE A 59 -2.594 8.789 -10.937 1.00 10.00 H new ATOM 0 HA ILE A 59 -4.204 10.488 -9.211 1.00 10.00 H new ATOM 0 HB ILE A 59 -4.032 7.519 -8.849 1.00 10.00 H new ATOM 0 HG12 ILE A 59 -6.670 8.077 -8.408 1.00 10.00 H new ATOM 0 HG13 ILE A 59 -6.292 9.299 -9.606 1.00 10.00 H new ATOM 0 HG21 ILE A 59 -5.321 7.965 -6.676 1.00 10.00 H new ATOM 0 HG22 ILE A 59 -3.715 8.730 -6.664 1.00 10.00 H new ATOM 0 HG23 ILE A 59 -5.164 9.710 -6.988 1.00 10.00 H new ATOM 0 HD11 ILE A 59 -7.052 7.215 -10.691 1.00 10.00 H new ATOM 0 HD12 ILE A 59 -5.356 7.555 -11.111 1.00 10.00 H new ATOM 0 HD13 ILE A 59 -5.740 6.314 -9.895 1.00 10.00 H new ATOM 837 N LYS A 60 -1.941 10.655 -7.963 1.00 10.00 N ATOM 838 CA LYS A 60 -0.648 10.760 -7.305 1.00 10.00 C ATOM 839 C LYS A 60 -0.685 10.086 -5.927 1.00 10.00 C ATOM 840 O LYS A 60 -1.727 10.090 -5.273 1.00 10.00 O ATOM 841 CB LYS A 60 -0.286 12.244 -7.175 1.00 10.00 C ATOM 842 CG LYS A 60 -1.295 13.055 -6.336 1.00 10.00 C ATOM 843 CD LYS A 60 -2.070 14.074 -7.183 1.00 10.00 C ATOM 844 CE LYS A 60 -3.324 14.517 -6.407 1.00 10.00 C ATOM 845 NZ LYS A 60 -4.334 15.180 -7.254 1.00 10.00 N ATOM 0 H LYS A 60 -2.512 11.498 -7.902 1.00 10.00 H new ATOM 0 HA LYS A 60 0.110 10.249 -7.899 1.00 10.00 H new ATOM 0 HB2 LYS A 60 0.702 12.330 -6.723 1.00 10.00 H new ATOM 0 HB3 LYS A 60 -0.220 12.682 -8.171 1.00 10.00 H new ATOM 0 HG2 LYS A 60 -1.998 12.373 -5.858 1.00 10.00 H new ATOM 0 HG3 LYS A 60 -0.765 13.576 -5.539 1.00 10.00 H new ATOM 0 HD2 LYS A 60 -1.441 14.936 -7.405 1.00 10.00 H new ATOM 0 HD3 LYS A 60 -2.354 13.632 -8.138 1.00 10.00 H new ATOM 0 HE2 LYS A 60 -3.775 13.646 -5.932 1.00 10.00 H new ATOM 0 HE3 LYS A 60 -3.027 15.197 -5.609 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 -5.277 14.805 -7.028 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 -4.317 16.205 -7.076 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 -4.120 14.999 -8.256 1.00 10.00 H new ATOM 859 N LEU A 61 0.449 9.550 -5.462 1.00 10.00 N ATOM 860 CA LEU A 61 0.588 9.037 -4.101 1.00 10.00 C ATOM 861 C LEU A 61 1.512 9.965 -3.315 1.00 10.00 C ATOM 862 O LEU A 61 2.486 10.445 -3.882 1.00 10.00 O ATOM 863 CB LEU A 61 0.909 7.532 -4.093 1.00 10.00 C ATOM 864 CG LEU A 61 2.365 7.070 -4.228 1.00 10.00 C ATOM 865 CD1 LEU A 61 3.075 7.641 -5.460 1.00 10.00 C ATOM 866 CD2 LEU A 61 3.152 7.325 -2.941 1.00 10.00 C ATOM 0 H LEU A 61 1.296 9.461 -6.023 1.00 10.00 H new ATOM 0 HA LEU A 61 -0.357 9.062 -3.559 1.00 10.00 H new ATOM 0 HB2 LEU A 61 0.521 7.120 -3.162 1.00 10.00 H new ATOM 0 HB3 LEU A 61 0.344 7.073 -4.904 1.00 10.00 H new ATOM 0 HG LEU A 61 2.329 5.992 -4.389 1.00 10.00 H new ATOM 0 HD11 LEU A 61 4.100 7.273 -5.492 1.00 10.00 H new ATOM 0 HD12 LEU A 61 2.548 7.328 -6.361 1.00 10.00 H new ATOM 0 HD13 LEU A 61 3.082 8.730 -5.404 1.00 10.00 H new ATOM 0 HD21 LEU A 61 4.180 6.986 -3.070 1.00 10.00 H new ATOM 0 HD22 LEU A 61 3.147 8.392 -2.717 1.00 10.00 H new ATOM 0 HD23 LEU A 61 2.691 6.779 -2.118 1.00 10.00 H new ATOM 878 N VAL A 62 1.208 10.284 -2.051 1.00 10.00 N ATOM 879 CA VAL A 62 2.063 11.159 -1.249 1.00 10.00 C ATOM 880 C VAL A 62 1.878 10.813 0.231 1.00 10.00 C ATOM 881 O VAL A 62 1.581 11.662 1.068 1.00 10.00 O ATOM 882 CB VAL A 62 1.792 12.638 -1.601 1.00 10.00 C ATOM 883 CG1 VAL A 62 0.343 13.091 -1.414 1.00 10.00 C ATOM 884 CG2 VAL A 62 2.761 13.605 -0.908 1.00 10.00 C ATOM 0 H VAL A 62 0.377 9.948 -1.565 1.00 10.00 H new ATOM 0 HA VAL A 62 3.117 10.999 -1.477 1.00 10.00 H new ATOM 0 HB VAL A 62 1.980 12.680 -2.674 1.00 10.00 H new ATOM 0 HG11 VAL A 62 0.253 14.143 -1.686 1.00 10.00 H new ATOM 0 HG12 VAL A 62 -0.310 12.494 -2.051 1.00 10.00 H new ATOM 0 HG13 VAL A 62 0.052 12.960 -0.372 1.00 10.00 H new ATOM 0 HG21 VAL A 62 2.520 14.629 -1.194 1.00 10.00 H new ATOM 0 HG22 VAL A 62 2.669 13.500 0.173 1.00 10.00 H new ATOM 0 HG23 VAL A 62 3.783 13.375 -1.210 1.00 10.00 H new ATOM 894 N GLY A 63 2.073 9.538 0.564 1.00 10.00 N ATOM 895 CA GLY A 63 2.161 9.098 1.940 1.00 10.00 C ATOM 896 C GLY A 63 2.814 7.727 1.970 1.00 10.00 C ATOM 897 O GLY A 63 2.587 6.927 1.062 1.00 10.00 O ATOM 0 H GLY A 63 2.173 8.787 -0.119 1.00 10.00 H new ATOM 0 HA2 GLY A 63 2.744 9.807 2.527 1.00 10.00 H new ATOM 0 HA3 GLY A 63 1.168 9.054 2.387 1.00 10.00 H new ATOM 901 N ALA A 64 3.616 7.474 3.003 1.00 10.00 N ATOM 902 CA ALA A 64 4.264 6.202 3.279 1.00 10.00 C ATOM 903 C ALA A 64 4.635 6.173 4.764 1.00 10.00 C ATOM 904 O ALA A 64 5.810 6.192 5.121 1.00 10.00 O ATOM 905 CB ALA A 64 5.486 6.050 2.371 1.00 10.00 C ATOM 0 H ALA A 64 3.839 8.185 3.699 1.00 10.00 H new ATOM 0 HA ALA A 64 3.602 5.361 3.071 1.00 10.00 H new ATOM 0 HB1 ALA A 64 5.975 5.097 2.575 1.00 10.00 H new ATOM 0 HB2 ALA A 64 5.170 6.080 1.328 1.00 10.00 H new ATOM 0 HB3 ALA A 64 6.185 6.864 2.562 1.00 10.00 H new ATOM 911 N ALA A 65 3.633 6.172 5.642 1.00 10.00 N ATOM 912 CA ALA A 65 3.852 6.182 7.081 1.00 10.00 C ATOM 913 C ALA A 65 4.132 4.757 7.555 1.00 10.00 C ATOM 914 O ALA A 65 3.824 3.796 6.854 1.00 10.00 O ATOM 915 CB ALA A 65 2.615 6.755 7.778 1.00 10.00 C ATOM 0 H ALA A 65 2.649 6.164 5.373 1.00 10.00 H new ATOM 0 HA ALA A 65 4.710 6.808 7.328 1.00 10.00 H new ATOM 0 HB1 ALA A 65 2.776 6.764 8.856 1.00 10.00 H new ATOM 0 HB2 ALA A 65 2.439 7.773 7.429 1.00 10.00 H new ATOM 0 HB3 ALA A 65 1.748 6.137 7.546 1.00 10.00 H new ATOM 921 N THR A 66 4.730 4.606 8.736 1.00 10.00 N ATOM 922 CA THR A 66 5.080 3.313 9.303 1.00 10.00 C ATOM 923 C THR A 66 5.599 3.555 10.722 1.00 10.00 C ATOM 924 O THR A 66 6.150 4.625 10.979 1.00 10.00 O ATOM 925 CB THR A 66 6.155 2.623 8.438 1.00 10.00 C ATOM 926 OG1 THR A 66 6.710 1.519 9.124 1.00 10.00 O ATOM 927 CG2 THR A 66 7.292 3.569 8.044 1.00 10.00 C ATOM 0 H THR A 66 4.987 5.393 9.332 1.00 10.00 H new ATOM 0 HA THR A 66 4.210 2.657 9.328 1.00 10.00 H new ATOM 0 HB THR A 66 5.650 2.296 7.529 1.00 10.00 H new ATOM 0 HG1 THR A 66 7.134 0.914 8.481 1.00 10.00 H new ATOM 0 HG21 THR A 66 8.019 3.030 7.436 1.00 10.00 H new ATOM 0 HG22 THR A 66 6.889 4.404 7.472 1.00 10.00 H new ATOM 0 HG23 THR A 66 7.779 3.947 8.943 1.00 10.00 H new ATOM 935 N PRO A 67 5.463 2.588 11.642 1.00 10.00 N ATOM 936 CA PRO A 67 6.145 2.625 12.921 1.00 10.00 C ATOM 937 C PRO A 67 7.609 2.161 12.812 1.00 10.00 C ATOM 938 O PRO A 67 8.302 2.172 13.829 1.00 10.00 O ATOM 939 CB PRO A 67 5.319 1.705 13.825 1.00 10.00 C ATOM 940 CG PRO A 67 4.811 0.643 12.852 1.00 10.00 C ATOM 941 CD PRO A 67 4.598 1.421 11.551 1.00 10.00 C ATOM 0 HA PRO A 67 6.209 3.638 13.317 1.00 10.00 H new ATOM 0 HB2 PRO A 67 5.924 1.269 14.620 1.00 10.00 H new ATOM 0 HB3 PRO A 67 4.499 2.239 14.305 1.00 10.00 H new ATOM 0 HG2 PRO A 67 5.534 -0.162 12.724 1.00 10.00 H new ATOM 0 HG3 PRO A 67 3.885 0.187 13.203 1.00 10.00 H new ATOM 0 HD2 PRO A 67 4.853 0.811 10.684 1.00 10.00 H new ATOM 0 HD3 PRO A 67 3.555 1.715 11.437 1.00 10.00 H new ATOM 949 N LEU A 68 8.090 1.759 11.626 1.00 10.00 N ATOM 950 CA LEU A 68 9.456 1.282 11.401 1.00 10.00 C ATOM 951 C LEU A 68 10.410 2.466 11.191 1.00 10.00 C ATOM 952 O LEU A 68 11.436 2.591 11.867 1.00 10.00 O ATOM 953 CB LEU A 68 9.423 0.333 10.187 1.00 10.00 C ATOM 954 CG LEU A 68 10.701 -0.447 9.835 1.00 10.00 C ATOM 955 CD1 LEU A 68 11.670 0.364 8.969 1.00 10.00 C ATOM 956 CD2 LEU A 68 11.412 -1.037 11.057 1.00 10.00 C ATOM 0 H LEU A 68 7.523 1.758 10.778 1.00 10.00 H new ATOM 0 HA LEU A 68 9.831 0.740 12.269 1.00 10.00 H new ATOM 0 HB2 LEU A 68 8.626 -0.392 10.354 1.00 10.00 H new ATOM 0 HB3 LEU A 68 9.141 0.921 9.313 1.00 10.00 H new ATOM 0 HG LEU A 68 10.357 -1.291 9.237 1.00 10.00 H new ATOM 0 HD11 LEU A 68 12.553 -0.236 8.752 1.00 10.00 H new ATOM 0 HD12 LEU A 68 11.180 0.640 8.035 1.00 10.00 H new ATOM 0 HD13 LEU A 68 11.967 1.267 9.503 1.00 10.00 H new ATOM 0 HD21 LEU A 68 12.305 -1.573 10.735 1.00 10.00 H new ATOM 0 HD22 LEU A 68 11.697 -0.233 11.736 1.00 10.00 H new ATOM 0 HD23 LEU A 68 10.741 -1.725 11.571 1.00 10.00 H new ATOM 968 N ALA A 69 10.057 3.332 10.239 1.00 10.00 N ATOM 969 CA ALA A 69 10.799 4.534 9.875 1.00 10.00 C ATOM 970 C ALA A 69 10.231 5.757 10.597 1.00 10.00 C ATOM 971 O ALA A 69 9.280 5.641 11.368 1.00 10.00 O ATOM 972 CB ALA A 69 10.748 4.703 8.356 1.00 10.00 C ATOM 0 H ALA A 69 9.213 3.207 9.680 1.00 10.00 H new ATOM 0 HA ALA A 69 11.840 4.436 10.185 1.00 10.00 H new ATOM 0 HB1 ALA A 69 11.300 5.599 8.071 1.00 10.00 H new ATOM 0 HB2 ALA A 69 11.197 3.833 7.878 1.00 10.00 H new ATOM 0 HB3 ALA A 69 9.711 4.798 8.035 1.00 10.00 H new ATOM 978 N THR A 70 10.821 6.937 10.396 1.00 10.00 N ATOM 979 CA THR A 70 10.344 8.180 11.015 1.00 10.00 C ATOM 980 C THR A 70 10.481 9.389 10.082 1.00 10.00 C ATOM 981 O THR A 70 10.140 10.510 10.451 1.00 10.00 O ATOM 982 CB THR A 70 11.074 8.371 12.355 1.00 10.00 C ATOM 983 OG1 THR A 70 10.832 7.230 13.151 1.00 10.00 O ATOM 984 CG2 THR A 70 10.620 9.578 13.183 1.00 10.00 C ATOM 0 H THR A 70 11.641 7.060 9.802 1.00 10.00 H new ATOM 0 HA THR A 70 9.274 8.100 11.206 1.00 10.00 H new ATOM 0 HB THR A 70 12.121 8.532 12.097 1.00 10.00 H new ATOM 0 HG1 THR A 70 11.290 7.329 14.012 1.00 10.00 H new ATOM 0 HG21 THR A 70 11.196 9.623 14.107 1.00 10.00 H new ATOM 0 HG22 THR A 70 10.780 10.492 12.611 1.00 10.00 H new ATOM 0 HG23 THR A 70 9.561 9.479 13.420 1.00 10.00 H new ATOM 992 N SER A 71 10.980 9.200 8.863 1.00 10.00 N ATOM 993 CA SER A 71 11.208 10.281 7.927 1.00 10.00 C ATOM 994 C SER A 71 10.996 9.735 6.509 1.00 10.00 C ATOM 995 O SER A 71 11.965 9.378 5.846 1.00 10.00 O ATOM 996 CB SER A 71 12.618 10.816 8.212 1.00 10.00 C ATOM 997 OG SER A 71 12.626 11.480 9.463 1.00 10.00 O ATOM 0 H SER A 71 11.237 8.282 8.501 1.00 10.00 H new ATOM 0 HA SER A 71 10.517 11.117 8.029 1.00 10.00 H new ATOM 0 HB2 SER A 71 13.336 9.996 8.219 1.00 10.00 H new ATOM 0 HB3 SER A 71 12.925 11.501 7.422 1.00 10.00 H new ATOM 0 HG SER A 71 13.526 11.821 9.647 1.00 10.00 H new ATOM 1003 N PRO A 72 9.732 9.622 6.060 1.00 10.00 N ATOM 1004 CA PRO A 72 9.379 9.105 4.747 1.00 10.00 C ATOM 1005 C PRO A 72 9.418 10.208 3.693 1.00 10.00 C ATOM 1006 O PRO A 72 8.462 10.963 3.529 1.00 10.00 O ATOM 1007 CB PRO A 72 7.975 8.524 4.921 1.00 10.00 C ATOM 1008 CG PRO A 72 7.347 9.435 5.975 1.00 10.00 C ATOM 1009 CD PRO A 72 8.532 9.818 6.864 1.00 10.00 C ATOM 0 HA PRO A 72 10.082 8.350 4.395 1.00 10.00 H new ATOM 0 HB2 PRO A 72 7.413 8.542 3.987 1.00 10.00 H new ATOM 0 HB3 PRO A 72 8.007 7.486 5.253 1.00 10.00 H new ATOM 0 HG2 PRO A 72 6.884 10.312 5.523 1.00 10.00 H new ATOM 0 HG3 PRO A 72 6.571 8.920 6.540 1.00 10.00 H new ATOM 0 HD2 PRO A 72 8.451 10.854 7.194 1.00 10.00 H new ATOM 0 HD3 PRO A 72 8.560 9.199 7.761 1.00 10.00 H new ATOM 1017 N MET A 73 10.524 10.275 2.955 1.00 10.00 N ATOM 1018 CA MET A 73 10.732 11.255 1.902 1.00 10.00 C ATOM 1019 C MET A 73 10.542 10.577 0.548 1.00 10.00 C ATOM 1020 O MET A 73 11.268 9.650 0.206 1.00 10.00 O ATOM 1021 CB MET A 73 12.149 11.809 2.015 1.00 10.00 C ATOM 1022 CG MET A 73 12.283 12.912 3.071 1.00 10.00 C ATOM 1023 SD MET A 73 12.015 12.449 4.799 1.00 10.00 S ATOM 1024 CE MET A 73 12.264 14.053 5.590 1.00 10.00 C ATOM 0 H MET A 73 11.311 9.638 3.077 1.00 10.00 H new ATOM 0 HA MET A 73 10.017 12.072 1.998 1.00 10.00 H new ATOM 0 HB2 MET A 73 12.832 10.995 2.260 1.00 10.00 H new ATOM 0 HB3 MET A 73 12.457 12.203 1.046 1.00 10.00 H new ATOM 0 HG2 MET A 73 13.283 13.338 2.988 1.00 10.00 H new ATOM 0 HG3 MET A 73 11.577 13.704 2.822 1.00 10.00 H new ATOM 0 HE1 MET A 73 12.135 13.951 6.668 1.00 10.00 H new ATOM 0 HE2 MET A 73 13.271 14.411 5.377 1.00 10.00 H new ATOM 0 HE3 MET A 73 11.536 14.766 5.203 1.00 10.00 H new ATOM 1034 N LEU A 74 9.593 11.062 -0.244 1.00 10.00 N ATOM 1035 CA LEU A 74 9.291 10.530 -1.564 1.00 10.00 C ATOM 1036 C LEU A 74 10.306 11.101 -2.561 1.00 10.00 C ATOM 1037 O LEU A 74 10.712 12.255 -2.432 1.00 10.00 O ATOM 1038 CB LEU A 74 7.849 10.909 -1.929 1.00 10.00 C ATOM 1039 CG LEU A 74 6.822 10.235 -0.998 1.00 10.00 C ATOM 1040 CD1 LEU A 74 6.287 11.210 0.058 1.00 10.00 C ATOM 1041 CD2 LEU A 74 5.657 9.681 -1.821 1.00 10.00 C ATOM 0 H LEU A 74 9.002 11.850 0.020 1.00 10.00 H new ATOM 0 HA LEU A 74 9.368 9.443 -1.585 1.00 10.00 H new ATOM 0 HB2 LEU A 74 7.733 11.991 -1.873 1.00 10.00 H new ATOM 0 HB3 LEU A 74 7.648 10.620 -2.961 1.00 10.00 H new ATOM 0 HG LEU A 74 7.330 9.422 -0.479 1.00 10.00 H new ATOM 0 HD11 LEU A 74 5.566 10.697 0.695 1.00 10.00 H new ATOM 0 HD12 LEU A 74 7.113 11.576 0.667 1.00 10.00 H new ATOM 0 HD13 LEU A 74 5.801 12.051 -0.436 1.00 10.00 H new ATOM 0 HD21 LEU A 74 4.935 9.206 -1.156 1.00 10.00 H new ATOM 0 HD22 LEU A 74 5.173 10.495 -2.360 1.00 10.00 H new ATOM 0 HD23 LEU A 74 6.032 8.946 -2.534 1.00 10.00 H new ATOM 1053 N MET A 75 10.770 10.278 -3.509 1.00 10.00 N ATOM 1054 CA MET A 75 11.870 10.616 -4.406 1.00 10.00 C ATOM 1055 C MET A 75 11.631 10.004 -5.785 1.00 10.00 C ATOM 1056 O MET A 75 11.006 8.952 -5.875 1.00 10.00 O ATOM 1057 CB MET A 75 13.179 10.104 -3.788 1.00 10.00 C ATOM 1058 CG MET A 75 14.386 10.890 -4.312 1.00 10.00 C ATOM 1059 SD MET A 75 15.701 11.320 -3.139 1.00 10.00 S ATOM 1060 CE MET A 75 14.782 11.958 -1.714 1.00 10.00 C ATOM 0 H MET A 75 10.384 9.348 -3.673 1.00 10.00 H new ATOM 0 HA MET A 75 11.935 11.697 -4.534 1.00 10.00 H new ATOM 0 HB2 MET A 75 13.129 10.190 -2.703 1.00 10.00 H new ATOM 0 HB3 MET A 75 13.303 9.046 -4.018 1.00 10.00 H new ATOM 0 HG2 MET A 75 14.835 10.312 -5.119 1.00 10.00 H new ATOM 0 HG3 MET A 75 14.015 11.816 -4.751 1.00 10.00 H new ATOM 0 HE1 MET A 75 15.456 12.522 -1.070 1.00 10.00 H new ATOM 0 HE2 MET A 75 13.980 12.610 -2.060 1.00 10.00 H new ATOM 0 HE3 MET A 75 14.356 11.126 -1.153 1.00 10.00 H new ATOM 1070 N THR A 76 12.108 10.652 -6.858 1.00 10.00 N ATOM 1071 CA THR A 76 11.676 10.298 -8.207 1.00 10.00 C ATOM 1072 C THR A 76 12.823 10.340 -9.222 1.00 10.00 C ATOM 1073 O THR A 76 13.358 11.405 -9.522 1.00 10.00 O ATOM 1074 CB THR A 76 10.453 11.149 -8.587 1.00 10.00 C ATOM 1075 OG1 THR A 76 9.801 10.579 -9.696 1.00 10.00 O ATOM 1076 CG2 THR A 76 10.788 12.609 -8.894 1.00 10.00 C ATOM 0 H THR A 76 12.785 11.414 -6.814 1.00 10.00 H new ATOM 0 HA THR A 76 11.360 9.255 -8.225 1.00 10.00 H new ATOM 0 HB THR A 76 9.803 11.153 -7.712 1.00 10.00 H new ATOM 0 HG1 THR A 76 9.545 9.657 -9.486 1.00 10.00 H new ATOM 0 HG21 THR A 76 9.875 13.145 -9.154 1.00 10.00 H new ATOM 0 HG22 THR A 76 11.243 13.070 -8.017 1.00 10.00 H new ATOM 0 HG23 THR A 76 11.485 12.654 -9.730 1.00 10.00 H new ATOM 1084 N THR A 77 13.247 9.192 -9.764 1.00 10.00 N ATOM 1085 CA THR A 77 14.222 9.190 -10.859 1.00 10.00 C ATOM 1086 C THR A 77 13.961 8.024 -11.818 1.00 10.00 C ATOM 1087 O THR A 77 14.875 7.342 -12.268 1.00 10.00 O ATOM 1088 CB THR A 77 15.652 9.181 -10.286 1.00 10.00 C ATOM 1089 OG1 THR A 77 15.681 9.979 -9.127 1.00 10.00 O ATOM 1090 CG2 THR A 77 16.679 9.749 -11.271 1.00 10.00 C ATOM 0 H THR A 77 12.936 8.267 -9.468 1.00 10.00 H new ATOM 0 HA THR A 77 14.111 10.102 -11.446 1.00 10.00 H new ATOM 0 HB THR A 77 15.913 8.144 -10.076 1.00 10.00 H new ATOM 0 HG1 THR A 77 15.715 9.404 -8.334 1.00 10.00 H new ATOM 0 HG21 THR A 77 17.671 9.720 -10.819 1.00 10.00 H new ATOM 0 HG22 THR A 77 16.678 9.151 -12.183 1.00 10.00 H new ATOM 0 HG23 THR A 77 16.420 10.780 -11.513 1.00 10.00 H new ATOM 1098 N THR A 78 12.702 7.904 -12.228 1.00 10.00 N ATOM 1099 CA THR A 78 12.232 6.983 -13.264 1.00 10.00 C ATOM 1100 C THR A 78 11.376 7.757 -14.263 1.00 10.00 C ATOM 1101 O THR A 78 10.181 7.950 -14.053 1.00 10.00 O ATOM 1102 CB THR A 78 11.507 5.784 -12.636 1.00 10.00 C ATOM 1103 OG1 THR A 78 12.489 5.033 -11.959 1.00 10.00 O ATOM 1104 CG2 THR A 78 10.880 4.858 -13.682 1.00 10.00 C ATOM 0 H THR A 78 11.949 8.467 -11.833 1.00 10.00 H new ATOM 0 HA THR A 78 13.075 6.562 -13.812 1.00 10.00 H new ATOM 0 HB THR A 78 10.710 6.158 -11.994 1.00 10.00 H new ATOM 0 HG1 THR A 78 12.113 4.677 -11.127 1.00 10.00 H new ATOM 0 HG21 THR A 78 10.381 4.028 -13.181 1.00 10.00 H new ATOM 0 HG22 THR A 78 10.153 5.416 -14.272 1.00 10.00 H new ATOM 0 HG23 THR A 78 11.659 4.470 -14.338 1.00 10.00 H new ATOM 1112 N HIS A 79 12.019 8.199 -15.346 1.00 10.00 N ATOM 1113 CA HIS A 79 11.543 9.226 -16.261 1.00 10.00 C ATOM 1114 C HIS A 79 10.332 8.726 -17.060 1.00 10.00 C ATOM 1115 O HIS A 79 10.502 8.245 -18.177 1.00 10.00 O ATOM 1116 CB HIS A 79 12.681 9.615 -17.226 1.00 10.00 C ATOM 1117 CG HIS A 79 13.957 10.205 -16.662 1.00 10.00 C ATOM 1118 ND1 HIS A 79 14.860 10.938 -17.435 1.00 10.00 N ATOM 1119 CD2 HIS A 79 14.522 9.969 -15.436 1.00 10.00 C ATOM 1120 CE1 HIS A 79 15.937 11.132 -16.663 1.00 10.00 C ATOM 1121 NE2 HIS A 79 15.763 10.561 -15.458 1.00 10.00 N ATOM 0 H HIS A 79 12.930 7.829 -15.618 1.00 10.00 H new ATOM 0 HA HIS A 79 11.235 10.097 -15.682 1.00 10.00 H new ATOM 0 HB2 HIS A 79 12.953 8.723 -17.790 1.00 10.00 H new ATOM 0 HB3 HIS A 79 12.275 10.332 -17.940 1.00 10.00 H new ATOM 0 HD2 HIS A 79 14.080 9.425 -14.614 1.00 10.00 H new ATOM 0 HE1 HIS A 79 16.822 11.672 -16.966 1.00 10.00 H new ATOM 0 HE2 HIS A 79 16.436 10.566 -14.692 1.00 10.00 H new ATOM 1129 N SER A 80 9.122 8.849 -16.505 1.00 10.00 N ATOM 1130 CA SER A 80 7.834 8.552 -17.135 1.00 10.00 C ATOM 1131 C SER A 80 6.785 8.448 -16.027 1.00 10.00 C ATOM 1132 O SER A 80 5.963 9.346 -15.852 1.00 10.00 O ATOM 1133 CB SER A 80 7.880 7.283 -18.013 1.00 10.00 C ATOM 1134 OG SER A 80 6.578 6.835 -18.338 1.00 10.00 O ATOM 0 H SER A 80 9.010 9.178 -15.546 1.00 10.00 H new ATOM 0 HA SER A 80 7.572 9.357 -17.822 1.00 10.00 H new ATOM 0 HB2 SER A 80 8.434 7.491 -18.928 1.00 10.00 H new ATOM 0 HB3 SER A 80 8.418 6.494 -17.487 1.00 10.00 H new ATOM 0 HG SER A 80 6.638 6.031 -18.896 1.00 10.00 H new ATOM 1140 N GLY A 81 6.833 7.358 -15.256 1.00 10.00 N ATOM 1141 CA GLY A 81 5.987 7.193 -14.086 1.00 10.00 C ATOM 1142 C GLY A 81 6.402 8.188 -13.006 1.00 10.00 C ATOM 1143 O GLY A 81 5.554 8.802 -12.362 1.00 10.00 O ATOM 0 H GLY A 81 7.459 6.572 -15.430 1.00 10.00 H new ATOM 0 HA2 GLY A 81 4.943 7.349 -14.356 1.00 10.00 H new ATOM 0 HA3 GLY A 81 6.069 6.174 -13.707 1.00 10.00 H new ATOM 1147 N GLY A 82 7.716 8.344 -12.831 1.00 10.00 N ATOM 1148 CA GLY A 82 8.326 9.381 -12.025 1.00 10.00 C ATOM 1149 C GLY A 82 8.938 10.435 -12.946 1.00 10.00 C ATOM 1150 O GLY A 82 8.729 10.400 -14.162 1.00 10.00 O ATOM 0 H GLY A 82 8.401 7.725 -13.266 1.00 10.00 H new ATOM 0 HA2 GLY A 82 7.581 9.838 -11.373 1.00 10.00 H new ATOM 0 HA3 GLY A 82 9.094 8.953 -11.380 1.00 10.00 H new ATOM 1154 N MET A 83 9.712 11.361 -12.374 1.00 10.00 N ATOM 1155 CA MET A 83 10.458 12.363 -13.123 1.00 10.00 C ATOM 1156 C MET A 83 11.950 12.005 -13.103 1.00 10.00 C ATOM 1157 O MET A 83 12.306 10.843 -13.299 1.00 10.00 O ATOM 1158 CB MET A 83 10.109 13.768 -12.598 1.00 10.00 C ATOM 1159 CG MET A 83 10.336 14.851 -13.666 1.00 10.00 C ATOM 1160 SD MET A 83 10.187 16.562 -13.090 1.00 10.00 S ATOM 1161 CE MET A 83 8.452 16.603 -12.590 1.00 10.00 C ATOM 0 H MET A 83 9.837 11.433 -11.364 1.00 10.00 H new ATOM 0 HA MET A 83 10.175 12.374 -14.176 1.00 10.00 H new ATOM 0 HB2 MET A 83 9.068 13.787 -12.277 1.00 10.00 H new ATOM 0 HB3 MET A 83 10.717 13.990 -11.721 1.00 10.00 H new ATOM 0 HG2 MET A 83 11.331 14.715 -14.090 1.00 10.00 H new ATOM 0 HG3 MET A 83 9.621 14.695 -14.474 1.00 10.00 H new ATOM 0 HE1 MET A 83 8.182 17.617 -12.295 1.00 10.00 H new ATOM 0 HE2 MET A 83 7.825 16.289 -13.425 1.00 10.00 H new ATOM 0 HE3 MET A 83 8.300 15.928 -11.748 1.00 10.00 H new ATOM 1171 N ALA A 84 12.826 12.993 -12.896 1.00 10.00 N ATOM 1172 CA ALA A 84 14.253 12.902 -13.154 1.00 10.00 C ATOM 1173 C ALA A 84 14.978 13.731 -12.100 1.00 10.00 C ATOM 1174 O ALA A 84 15.776 14.608 -12.423 1.00 10.00 O ATOM 1175 CB ALA A 84 14.526 13.436 -14.565 1.00 10.00 C ATOM 0 H ALA A 84 12.545 13.904 -12.533 1.00 10.00 H new ATOM 0 HA ALA A 84 14.607 11.873 -13.099 1.00 10.00 H new ATOM 0 HB1 ALA A 84 15.594 13.376 -14.777 1.00 10.00 H new ATOM 0 HB2 ALA A 84 13.977 12.838 -15.293 1.00 10.00 H new ATOM 0 HB3 ALA A 84 14.202 14.475 -14.630 1.00 10.00 H new ATOM 1181 N GLY A 85 14.652 13.488 -10.832 1.00 10.00 N ATOM 1182 CA GLY A 85 15.130 14.286 -9.724 1.00 10.00 C ATOM 1183 C GLY A 85 15.221 13.415 -8.482 1.00 10.00 C ATOM 1184 O GLY A 85 14.255 13.328 -7.723 1.00 10.00 O ATOM 0 H GLY A 85 14.041 12.721 -10.551 1.00 10.00 H new ATOM 0 HA2 GLY A 85 16.107 14.708 -9.959 1.00 10.00 H new ATOM 0 HA3 GLY A 85 14.456 15.124 -9.546 1.00 10.00 H new ATOM 1188 N MET A 86 16.381 12.788 -8.254 1.00 10.00 N ATOM 1189 CA MET A 86 16.627 11.960 -7.077 1.00 10.00 C ATOM 1190 C MET A 86 16.842 12.900 -5.874 1.00 10.00 C ATOM 1191 O MET A 86 17.910 12.953 -5.270 1.00 10.00 O ATOM 1192 CB MET A 86 17.864 11.082 -7.323 1.00 10.00 C ATOM 1193 CG MET A 86 17.974 9.792 -6.491 1.00 10.00 C ATOM 1194 SD MET A 86 18.369 9.926 -4.714 1.00 10.00 S ATOM 1195 CE MET A 86 19.130 8.319 -4.384 1.00 10.00 C ATOM 0 H MET A 86 17.178 12.844 -8.888 1.00 10.00 H new ATOM 0 HA MET A 86 15.783 11.301 -6.875 1.00 10.00 H new ATOM 0 HB2 MET A 86 17.883 10.809 -8.378 1.00 10.00 H new ATOM 0 HB3 MET A 86 18.752 11.685 -7.134 1.00 10.00 H new ATOM 0 HG2 MET A 86 17.027 9.260 -6.580 1.00 10.00 H new ATOM 0 HG3 MET A 86 18.737 9.165 -6.953 1.00 10.00 H new ATOM 0 HE1 MET A 86 19.684 8.364 -3.446 1.00 10.00 H new ATOM 0 HE2 MET A 86 18.354 7.557 -4.311 1.00 10.00 H new ATOM 0 HE3 MET A 86 19.812 8.066 -5.196 1.00 10.00 H new ATOM 1205 N LYS A 87 15.832 13.706 -5.573 1.00 10.00 N ATOM 1206 CA LYS A 87 15.850 14.807 -4.627 1.00 10.00 C ATOM 1207 C LYS A 87 14.496 14.847 -3.928 1.00 10.00 C ATOM 1208 O LYS A 87 13.564 14.163 -4.348 1.00 10.00 O ATOM 1209 CB LYS A 87 16.137 16.118 -5.380 1.00 10.00 C ATOM 1210 CG LYS A 87 14.963 16.535 -6.284 1.00 10.00 C ATOM 1211 CD LYS A 87 15.376 17.513 -7.390 1.00 10.00 C ATOM 1212 CE LYS A 87 15.863 18.853 -6.817 1.00 10.00 C ATOM 1213 NZ LYS A 87 16.173 19.832 -7.880 1.00 10.00 N ATOM 0 H LYS A 87 14.919 13.598 -6.015 1.00 10.00 H new ATOM 0 HA LYS A 87 16.632 14.676 -3.879 1.00 10.00 H new ATOM 0 HB2 LYS A 87 16.340 16.912 -4.661 1.00 10.00 H new ATOM 0 HB3 LYS A 87 17.036 15.999 -5.985 1.00 10.00 H new ATOM 0 HG2 LYS A 87 14.527 15.645 -6.738 1.00 10.00 H new ATOM 0 HG3 LYS A 87 14.186 16.994 -5.673 1.00 10.00 H new ATOM 0 HD2 LYS A 87 16.167 17.067 -7.992 1.00 10.00 H new ATOM 0 HD3 LYS A 87 14.530 17.688 -8.054 1.00 10.00 H new ATOM 0 HE2 LYS A 87 15.099 19.264 -6.158 1.00 10.00 H new ATOM 0 HE3 LYS A 87 16.752 18.685 -6.209 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 16.498 20.721 -7.449 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 16.921 19.452 -8.495 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 15.319 20.013 -8.445 1.00 10.00 H new ATOM 1227 N MET A 88 14.359 15.676 -2.894 1.00 10.00 N ATOM 1228 CA MET A 88 13.166 15.681 -2.063 1.00 10.00 C ATOM 1229 C MET A 88 12.051 16.495 -2.730 1.00 10.00 C ATOM 1230 O MET A 88 11.668 17.570 -2.276 1.00 10.00 O ATOM 1231 CB MET A 88 13.533 16.177 -0.661 1.00 10.00 C ATOM 1232 CG MET A 88 12.489 15.684 0.343 1.00 10.00 C ATOM 1233 SD MET A 88 12.616 16.383 2.013 1.00 10.00 S ATOM 1234 CE MET A 88 14.363 16.100 2.384 1.00 10.00 C ATOM 0 H MET A 88 15.067 16.355 -2.614 1.00 10.00 H new ATOM 0 HA MET A 88 12.771 14.671 -1.955 1.00 10.00 H new ATOM 0 HB2 MET A 88 14.522 15.813 -0.382 1.00 10.00 H new ATOM 0 HB3 MET A 88 13.579 17.266 -0.649 1.00 10.00 H new ATOM 0 HG2 MET A 88 11.498 15.908 -0.051 1.00 10.00 H new ATOM 0 HG3 MET A 88 12.565 14.599 0.416 1.00 10.00 H new ATOM 0 HE1 MET A 88 14.547 16.296 3.440 1.00 10.00 H new ATOM 0 HE2 MET A 88 14.620 15.066 2.157 1.00 10.00 H new ATOM 0 HE3 MET A 88 14.976 16.768 1.779 1.00 10.00 H new ATOM 1244 N VAL A 89 11.532 15.949 -3.827 1.00 10.00 N ATOM 1245 CA VAL A 89 10.301 16.394 -4.461 1.00 10.00 C ATOM 1246 C VAL A 89 9.119 16.191 -3.497 1.00 10.00 C ATOM 1247 O VAL A 89 9.241 15.426 -2.541 1.00 10.00 O ATOM 1248 CB VAL A 89 10.099 15.609 -5.773 1.00 10.00 C ATOM 1249 CG1 VAL A 89 11.131 16.031 -6.824 1.00 10.00 C ATOM 1250 CG2 VAL A 89 10.182 14.089 -5.569 1.00 10.00 C ATOM 0 H VAL A 89 11.970 15.164 -4.310 1.00 10.00 H new ATOM 0 HA VAL A 89 10.360 17.456 -4.698 1.00 10.00 H new ATOM 0 HB VAL A 89 9.094 15.849 -6.121 1.00 10.00 H new ATOM 0 HG11 VAL A 89 10.969 15.464 -7.741 1.00 10.00 H new ATOM 0 HG12 VAL A 89 11.024 17.096 -7.032 1.00 10.00 H new ATOM 0 HG13 VAL A 89 12.135 15.834 -6.448 1.00 10.00 H new ATOM 0 HG21 VAL A 89 10.033 13.585 -6.524 1.00 10.00 H new ATOM 0 HG22 VAL A 89 11.162 13.828 -5.170 1.00 10.00 H new ATOM 0 HG23 VAL A 89 9.410 13.773 -4.868 1.00 10.00 H new ATOM 1260 N PRO A 90 7.956 16.823 -3.743 1.00 10.00 N ATOM 1261 CA PRO A 90 6.738 16.540 -2.998 1.00 10.00 C ATOM 1262 C PRO A 90 6.397 15.044 -2.968 1.00 10.00 C ATOM 1263 O PRO A 90 5.891 14.564 -1.957 1.00 10.00 O ATOM 1264 CB PRO A 90 5.635 17.407 -3.607 1.00 10.00 C ATOM 1265 CG PRO A 90 6.407 18.533 -4.295 1.00 10.00 C ATOM 1266 CD PRO A 90 7.713 17.866 -4.728 1.00 10.00 C ATOM 0 HA PRO A 90 6.864 16.792 -1.945 1.00 10.00 H new ATOM 0 HB2 PRO A 90 5.028 16.845 -4.316 1.00 10.00 H new ATOM 0 HB3 PRO A 90 4.959 17.792 -2.843 1.00 10.00 H new ATOM 0 HG2 PRO A 90 5.858 18.931 -5.149 1.00 10.00 H new ATOM 0 HG3 PRO A 90 6.589 19.366 -3.616 1.00 10.00 H new ATOM 0 HD2 PRO A 90 7.627 17.448 -5.731 1.00 10.00 H new ATOM 0 HD3 PRO A 90 8.533 18.584 -4.751 1.00 10.00 H new ATOM 1274 N TRP A 91 6.653 14.328 -4.073 1.00 10.00 N ATOM 1275 CA TRP A 91 6.136 13.007 -4.393 1.00 10.00 C ATOM 1276 C TRP A 91 6.516 12.609 -5.823 1.00 10.00 C ATOM 1277 O TRP A 91 7.439 13.182 -6.396 1.00 10.00 O ATOM 1278 CB TRP A 91 4.620 12.982 -4.219 1.00 10.00 C ATOM 1279 CG TRP A 91 3.766 13.743 -5.176 1.00 10.00 C ATOM 1280 CD1 TRP A 91 2.457 13.485 -5.302 1.00 10.00 C ATOM 1281 CD2 TRP A 91 4.010 14.922 -6.006 1.00 10.00 C ATOM 1282 NE1 TRP A 91 1.849 14.497 -6.002 1.00 10.00 N ATOM 1283 CE2 TRP A 91 2.751 15.478 -6.342 1.00 10.00 C ATOM 1284 CE3 TRP A 91 5.137 15.603 -6.506 1.00 10.00 C ATOM 1285 CZ2 TRP A 91 2.629 16.737 -6.933 1.00 10.00 C ATOM 1286 CZ3 TRP A 91 5.028 16.815 -7.210 1.00 10.00 C ATOM 1287 CH2 TRP A 91 3.773 17.418 -7.370 1.00 10.00 C ATOM 0 H TRP A 91 7.265 14.686 -4.806 1.00 10.00 H new ATOM 0 HA TRP A 91 6.581 12.285 -3.709 1.00 10.00 H new ATOM 0 HB2 TRP A 91 4.303 11.940 -4.253 1.00 10.00 H new ATOM 0 HB3 TRP A 91 4.398 13.350 -3.217 1.00 10.00 H new ATOM 0 HD1 TRP A 91 1.956 12.612 -4.911 1.00 10.00 H new ATOM 0 HE1 TRP A 91 0.857 14.519 -6.239 1.00 10.00 H new ATOM 0 HE3 TRP A 91 6.117 15.180 -6.343 1.00 10.00 H new ATOM 0 HZ2 TRP A 91 1.654 17.186 -7.053 1.00 10.00 H new ATOM 0 HZ3 TRP A 91 5.909 17.280 -7.626 1.00 10.00 H new ATOM 0 HH2 TRP A 91 3.689 18.394 -7.824 1.00 10.00 H new ATOM 1298 N LEU A 92 5.747 11.698 -6.424 1.00 10.00 N ATOM 1299 CA LEU A 92 5.701 11.441 -7.849 1.00 10.00 C ATOM 1300 C LEU A 92 4.223 11.476 -8.254 1.00 10.00 C ATOM 1301 O LEU A 92 3.381 10.874 -7.586 1.00 10.00 O ATOM 1302 CB LEU A 92 6.369 10.098 -8.187 1.00 10.00 C ATOM 1303 CG LEU A 92 6.055 8.959 -7.197 1.00 10.00 C ATOM 1304 CD1 LEU A 92 5.976 7.628 -7.948 1.00 10.00 C ATOM 1305 CD2 LEU A 92 7.117 8.849 -6.093 1.00 10.00 C ATOM 0 H LEU A 92 5.113 11.096 -5.898 1.00 10.00 H new ATOM 0 HA LEU A 92 6.258 12.194 -8.407 1.00 10.00 H new ATOM 0 HB2 LEU A 92 6.055 9.792 -9.185 1.00 10.00 H new ATOM 0 HB3 LEU A 92 7.449 10.243 -8.223 1.00 10.00 H new ATOM 0 HG LEU A 92 5.099 9.189 -6.727 1.00 10.00 H new ATOM 0 HD11 LEU A 92 5.754 6.826 -7.244 1.00 10.00 H new ATOM 0 HD12 LEU A 92 5.188 7.680 -8.699 1.00 10.00 H new ATOM 0 HD13 LEU A 92 6.930 7.429 -8.436 1.00 10.00 H new ATOM 0 HD21 LEU A 92 6.857 8.034 -5.418 1.00 10.00 H new ATOM 0 HD22 LEU A 92 8.090 8.651 -6.543 1.00 10.00 H new ATOM 0 HD23 LEU A 92 7.159 9.784 -5.534 1.00 10.00 H new ATOM 1317 N THR A 93 3.900 12.216 -9.318 1.00 10.00 N ATOM 1318 CA THR A 93 2.566 12.252 -9.902 1.00 10.00 C ATOM 1319 C THR A 93 2.547 11.256 -11.056 1.00 10.00 C ATOM 1320 O THR A 93 3.130 11.530 -12.099 1.00 10.00 O ATOM 1321 CB THR A 93 2.242 13.678 -10.368 1.00 10.00 C ATOM 1322 OG1 THR A 93 2.218 14.522 -9.238 1.00 10.00 O ATOM 1323 CG2 THR A 93 0.877 13.775 -11.059 1.00 10.00 C ATOM 0 H THR A 93 4.571 12.814 -9.801 1.00 10.00 H new ATOM 0 HA THR A 93 1.803 11.975 -9.175 1.00 10.00 H new ATOM 0 HB THR A 93 3.007 13.972 -11.087 1.00 10.00 H new ATOM 0 HG1 THR A 93 2.220 13.978 -8.423 1.00 10.00 H new ATOM 0 HG21 THR A 93 0.698 14.805 -11.368 1.00 10.00 H new ATOM 0 HG22 THR A 93 0.865 13.126 -11.935 1.00 10.00 H new ATOM 0 HG23 THR A 93 0.095 13.463 -10.366 1.00 10.00 H new ATOM 1331 N ILE A 94 1.890 10.111 -10.861 1.00 10.00 N ATOM 1332 CA ILE A 94 1.853 9.024 -11.831 1.00 10.00 C ATOM 1333 C ILE A 94 0.727 9.303 -12.833 1.00 10.00 C ATOM 1334 O ILE A 94 -0.449 9.260 -12.462 1.00 10.00 O ATOM 1335 CB ILE A 94 1.723 7.666 -11.110 1.00 10.00 C ATOM 1336 CG1 ILE A 94 0.442 7.519 -10.272 1.00 10.00 C ATOM 1337 CG2 ILE A 94 2.944 7.478 -10.207 1.00 10.00 C ATOM 1338 CD1 ILE A 94 0.430 6.313 -9.331 1.00 10.00 C ATOM 0 H ILE A 94 1.362 9.914 -10.011 1.00 10.00 H new ATOM 0 HA ILE A 94 2.785 8.968 -12.394 1.00 10.00 H new ATOM 0 HB ILE A 94 1.666 6.900 -11.883 1.00 10.00 H new ATOM 0 HG12 ILE A 94 0.304 8.425 -9.682 1.00 10.00 H new ATOM 0 HG13 ILE A 94 -0.411 7.445 -10.947 1.00 10.00 H new ATOM 0 HG21 ILE A 94 2.869 6.522 -9.689 1.00 10.00 H new ATOM 0 HG22 ILE A 94 3.850 7.493 -10.813 1.00 10.00 H new ATOM 0 HG23 ILE A 94 2.983 8.285 -9.476 1.00 10.00 H new ATOM 0 HD11 ILE A 94 -0.511 6.290 -8.781 1.00 10.00 H new ATOM 0 HD12 ILE A 94 0.533 5.397 -9.912 1.00 10.00 H new ATOM 0 HD13 ILE A 94 1.259 6.392 -8.628 1.00 10.00 H new ATOM 1350 N PRO A 95 1.029 9.637 -14.095 1.00 10.00 N ATOM 1351 CA PRO A 95 0.024 10.167 -14.997 1.00 10.00 C ATOM 1352 C PRO A 95 -0.698 9.032 -15.728 1.00 10.00 C ATOM 1353 O PRO A 95 -0.773 9.022 -16.955 1.00 10.00 O ATOM 1354 CB PRO A 95 0.822 11.024 -15.965 1.00 10.00 C ATOM 1355 CG PRO A 95 2.114 10.222 -16.134 1.00 10.00 C ATOM 1356 CD PRO A 95 2.344 9.670 -14.725 1.00 10.00 C ATOM 0 HA PRO A 95 -0.754 10.732 -14.484 1.00 10.00 H new ATOM 0 HB2 PRO A 95 0.301 11.157 -16.913 1.00 10.00 H new ATOM 0 HB3 PRO A 95 1.012 12.019 -15.563 1.00 10.00 H new ATOM 0 HG2 PRO A 95 2.004 9.425 -16.870 1.00 10.00 H new ATOM 0 HG3 PRO A 95 2.942 10.850 -16.465 1.00 10.00 H new ATOM 0 HD2 PRO A 95 2.786 8.674 -14.762 1.00 10.00 H new ATOM 0 HD3 PRO A 95 3.031 10.303 -14.164 1.00 10.00 H new ATOM 1364 N ALA A 96 -1.211 8.059 -14.975 1.00 10.00 N ATOM 1365 CA ALA A 96 -1.641 6.780 -15.510 1.00 10.00 C ATOM 1366 C ALA A 96 -0.456 6.001 -16.089 1.00 10.00 C ATOM 1367 O ALA A 96 0.635 6.532 -16.280 1.00 10.00 O ATOM 1368 CB ALA A 96 -2.761 6.963 -16.533 1.00 10.00 C ATOM 0 H ALA A 96 -1.338 8.144 -13.967 1.00 10.00 H new ATOM 0 HA ALA A 96 -2.047 6.186 -14.691 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -3.065 5.990 -16.918 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -3.614 7.447 -16.056 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -2.405 7.584 -17.355 1.00 10.00 H new ATOM 1374 N ARG A 97 -0.660 4.699 -16.300 1.00 10.00 N ATOM 1375 CA ARG A 97 0.339 3.746 -16.790 1.00 10.00 C ATOM 1376 C ARG A 97 1.651 3.802 -15.996 1.00 10.00 C ATOM 1377 O ARG A 97 2.688 3.320 -16.451 1.00 10.00 O ATOM 1378 CB ARG A 97 0.572 3.930 -18.298 1.00 10.00 C ATOM 1379 CG ARG A 97 -0.618 3.478 -19.154 1.00 10.00 C ATOM 1380 CD ARG A 97 -1.908 4.244 -18.861 1.00 10.00 C ATOM 1381 NE ARG A 97 -2.881 4.124 -19.959 1.00 10.00 N ATOM 1382 CZ ARG A 97 -2.901 4.839 -21.092 1.00 10.00 C ATOM 1383 NH1 ARG A 97 -1.937 5.730 -21.348 1.00 10.00 N ATOM 1384 NH2 ARG A 97 -3.897 4.643 -21.956 1.00 10.00 N ATOM 0 H ARG A 97 -1.565 4.261 -16.127 1.00 10.00 H new ATOM 0 HA ARG A 97 -0.064 2.746 -16.630 1.00 10.00 H new ATOM 0 HB2 ARG A 97 0.779 4.981 -18.501 1.00 10.00 H new ATOM 0 HB3 ARG A 97 1.458 3.368 -18.593 1.00 10.00 H new ATOM 0 HG2 ARG A 97 -0.364 3.599 -20.207 1.00 10.00 H new ATOM 0 HG3 ARG A 97 -0.791 2.415 -18.988 1.00 10.00 H new ATOM 0 HD2 ARG A 97 -2.352 3.867 -17.940 1.00 10.00 H new ATOM 0 HD3 ARG A 97 -1.676 5.296 -18.696 1.00 10.00 H new ATOM 0 HE ARG A 97 -3.615 3.425 -19.846 1.00 10.00 H new ATOM 0 HH11 ARG A 97 -1.180 5.869 -20.679 1.00 10.00 H new ATOM 0 HH12 ARG A 97 -1.959 6.271 -22.213 1.00 10.00 H new ATOM 0 HH21 ARG A 97 -4.625 3.959 -21.749 1.00 10.00 H new ATOM 0 HH22 ARG A 97 -3.931 5.177 -22.824 1.00 10.00 H new ATOM 1398 N GLY A 98 1.598 4.341 -14.778 1.00 10.00 N ATOM 1399 CA GLY A 98 2.706 4.416 -13.860 1.00 10.00 C ATOM 1400 C GLY A 98 3.017 3.036 -13.295 1.00 10.00 C ATOM 1401 O GLY A 98 2.780 2.758 -12.125 1.00 10.00 O ATOM 0 H GLY A 98 0.743 4.750 -14.401 1.00 10.00 H new ATOM 0 HA2 GLY A 98 3.583 4.814 -14.370 1.00 10.00 H new ATOM 0 HA3 GLY A 98 2.469 5.104 -13.048 1.00 10.00 H new ATOM 1405 N THR A 99 3.541 2.151 -14.134 1.00 10.00 N ATOM 1406 CA THR A 99 4.067 0.871 -13.698 1.00 10.00 C ATOM 1407 C THR A 99 5.510 1.099 -13.249 1.00 10.00 C ATOM 1408 O THR A 99 6.442 0.516 -13.801 1.00 10.00 O ATOM 1409 CB THR A 99 3.836 -0.186 -14.792 1.00 10.00 C ATOM 1410 OG1 THR A 99 4.186 -1.475 -14.333 1.00 10.00 O ATOM 1411 CG2 THR A 99 4.539 0.118 -16.118 1.00 10.00 C ATOM 0 H THR A 99 3.612 2.305 -15.140 1.00 10.00 H new ATOM 0 HA THR A 99 3.548 0.456 -12.834 1.00 10.00 H new ATOM 0 HB THR A 99 2.767 -0.152 -15.004 1.00 10.00 H new ATOM 0 HG1 THR A 99 4.029 -2.130 -15.045 1.00 10.00 H new ATOM 0 HG21 THR A 99 4.325 -0.676 -16.834 1.00 10.00 H new ATOM 0 HG22 THR A 99 4.179 1.069 -16.511 1.00 10.00 H new ATOM 0 HG23 THR A 99 5.615 0.178 -15.954 1.00 10.00 H new ATOM 1419 N LEU A 100 5.709 1.998 -12.273 1.00 10.00 N ATOM 1420 CA LEU A 100 7.065 2.342 -11.857 1.00 10.00 C ATOM 1421 C LEU A 100 7.482 1.494 -10.665 1.00 10.00 C ATOM 1422 O LEU A 100 6.640 0.958 -9.948 1.00 10.00 O ATOM 1423 CB LEU A 100 7.333 3.854 -11.768 1.00 10.00 C ATOM 1424 CG LEU A 100 6.762 4.708 -10.628 1.00 10.00 C ATOM 1425 CD1 LEU A 100 5.255 4.912 -10.741 1.00 10.00 C ATOM 1426 CD2 LEU A 100 7.140 4.201 -9.236 1.00 10.00 C ATOM 0 H LEU A 100 4.966 2.485 -11.772 1.00 10.00 H new ATOM 0 HA LEU A 100 7.755 2.070 -12.656 1.00 10.00 H new ATOM 0 HB2 LEU A 100 8.415 3.982 -11.747 1.00 10.00 H new ATOM 0 HB3 LEU A 100 6.978 4.293 -12.700 1.00 10.00 H new ATOM 0 HG LEU A 100 7.238 5.681 -10.749 1.00 10.00 H new ATOM 0 HD11 LEU A 100 4.907 5.523 -9.908 1.00 10.00 H new ATOM 0 HD12 LEU A 100 5.025 5.415 -11.681 1.00 10.00 H new ATOM 0 HD13 LEU A 100 4.754 3.944 -10.715 1.00 10.00 H new ATOM 0 HD21 LEU A 100 6.702 4.853 -8.480 1.00 10.00 H new ATOM 0 HD22 LEU A 100 6.763 3.187 -9.103 1.00 10.00 H new ATOM 0 HD23 LEU A 100 8.225 4.201 -9.131 1.00 10.00 H new ATOM 1438 N THR A 101 8.790 1.321 -10.499 1.00 10.00 N ATOM 1439 CA THR A 101 9.377 0.321 -9.633 1.00 10.00 C ATOM 1440 C THR A 101 10.325 1.064 -8.701 1.00 10.00 C ATOM 1441 O THR A 101 11.243 1.749 -9.151 1.00 10.00 O ATOM 1442 CB THR A 101 9.999 -0.808 -10.475 1.00 10.00 C ATOM 1443 OG1 THR A 101 10.250 -1.943 -9.677 1.00 10.00 O ATOM 1444 CG2 THR A 101 11.287 -0.423 -11.207 1.00 10.00 C ATOM 0 H THR A 101 9.485 1.892 -10.980 1.00 10.00 H new ATOM 0 HA THR A 101 8.651 -0.200 -9.009 1.00 10.00 H new ATOM 0 HB THR A 101 9.255 -1.025 -11.242 1.00 10.00 H new ATOM 0 HG1 THR A 101 9.404 -2.285 -9.319 1.00 10.00 H new ATOM 0 HG21 THR A 101 11.653 -1.279 -11.774 1.00 10.00 H new ATOM 0 HG22 THR A 101 11.085 0.404 -11.888 1.00 10.00 H new ATOM 0 HG23 THR A 101 12.041 -0.119 -10.481 1.00 10.00 H new ATOM 1452 N LEU A 102 10.018 1.009 -7.409 1.00 10.00 N ATOM 1453 CA LEU A 102 10.669 1.805 -6.396 1.00 10.00 C ATOM 1454 C LEU A 102 11.951 1.072 -6.028 1.00 10.00 C ATOM 1455 O LEU A 102 11.905 -0.130 -5.771 1.00 10.00 O ATOM 1456 CB LEU A 102 9.752 1.983 -5.178 1.00 10.00 C ATOM 1457 CG LEU A 102 8.639 3.023 -5.409 1.00 10.00 C ATOM 1458 CD1 LEU A 102 7.527 2.524 -6.332 1.00 10.00 C ATOM 1459 CD2 LEU A 102 8.011 3.416 -4.066 1.00 10.00 C ATOM 0 H LEU A 102 9.293 0.394 -7.038 1.00 10.00 H new ATOM 0 HA LEU A 102 10.894 2.807 -6.760 1.00 10.00 H new ATOM 0 HB2 LEU A 102 9.299 1.024 -4.928 1.00 10.00 H new ATOM 0 HB3 LEU A 102 10.352 2.286 -4.320 1.00 10.00 H new ATOM 0 HG LEU A 102 9.114 3.877 -5.892 1.00 10.00 H new ATOM 0 HD11 LEU A 102 6.776 3.305 -6.452 1.00 10.00 H new ATOM 0 HD12 LEU A 102 7.948 2.272 -7.305 1.00 10.00 H new ATOM 0 HD13 LEU A 102 7.063 1.639 -5.897 1.00 10.00 H new ATOM 0 HD21 LEU A 102 7.224 4.152 -4.234 1.00 10.00 H new ATOM 0 HD22 LEU A 102 7.586 2.532 -3.591 1.00 10.00 H new ATOM 0 HD23 LEU A 102 8.776 3.844 -3.418 1.00 10.00 H new ATOM 1471 N GLN A 103 13.085 1.772 -6.056 1.00 10.00 N ATOM 1472 CA GLN A 103 14.402 1.180 -5.889 1.00 10.00 C ATOM 1473 C GLN A 103 15.373 2.240 -5.381 1.00 10.00 C ATOM 1474 O GLN A 103 15.097 3.435 -5.472 1.00 10.00 O ATOM 1475 CB GLN A 103 14.863 0.621 -7.241 1.00 10.00 C ATOM 1476 CG GLN A 103 15.165 1.759 -8.226 1.00 10.00 C ATOM 1477 CD GLN A 103 15.016 1.306 -9.669 1.00 10.00 C ATOM 1478 OE1 GLN A 103 15.897 0.649 -10.213 1.00 10.00 O ATOM 1479 NE2 GLN A 103 13.906 1.655 -10.305 1.00 10.00 N ATOM 0 H GLN A 103 13.109 2.782 -6.198 1.00 10.00 H new ATOM 0 HA GLN A 103 14.368 0.370 -5.161 1.00 10.00 H new ATOM 0 HB2 GLN A 103 15.754 0.008 -7.102 1.00 10.00 H new ATOM 0 HB3 GLN A 103 14.091 -0.028 -7.654 1.00 10.00 H new ATOM 0 HG2 GLN A 103 14.491 2.594 -8.035 1.00 10.00 H new ATOM 0 HG3 GLN A 103 16.179 2.123 -8.062 1.00 10.00 H new ATOM 0 HE21 GLN A 103 13.193 2.202 -9.823 1.00 10.00 H new ATOM 0 HE22 GLN A 103 13.766 1.376 -11.276 1.00 10.00 H new ATOM 1488 N ARG A 104 16.546 1.831 -4.896 1.00 10.00 N ATOM 1489 CA ARG A 104 17.559 2.806 -4.511 1.00 10.00 C ATOM 1490 C ARG A 104 18.092 3.545 -5.743 1.00 10.00 C ATOM 1491 O ARG A 104 19.090 3.134 -6.328 1.00 10.00 O ATOM 1492 CB ARG A 104 18.675 2.183 -3.665 1.00 10.00 C ATOM 1493 CG ARG A 104 19.766 3.226 -3.376 1.00 10.00 C ATOM 1494 CD ARG A 104 20.183 3.278 -1.907 1.00 10.00 C ATOM 1495 NE ARG A 104 20.934 2.078 -1.492 1.00 10.00 N ATOM 1496 CZ ARG A 104 21.885 2.076 -0.539 1.00 10.00 C ATOM 1497 NH1 ARG A 104 22.083 3.169 0.201 1.00 10.00 N ATOM 1498 NH2 ARG A 104 22.647 0.999 -0.319 1.00 10.00 N ATOM 0 H ARG A 104 16.812 0.855 -4.764 1.00 10.00 H new ATOM 0 HA ARG A 104 17.084 3.546 -3.867 1.00 10.00 H new ATOM 0 HB2 ARG A 104 18.264 1.806 -2.728 1.00 10.00 H new ATOM 0 HB3 ARG A 104 19.106 1.330 -4.190 1.00 10.00 H new ATOM 0 HG2 ARG A 104 20.641 3.004 -3.987 1.00 10.00 H new ATOM 0 HG3 ARG A 104 19.407 4.210 -3.679 1.00 10.00 H new ATOM 0 HD2 ARG A 104 20.796 4.163 -1.737 1.00 10.00 H new ATOM 0 HD3 ARG A 104 19.295 3.381 -1.284 1.00 10.00 H new ATOM 0 HE ARG A 104 20.720 1.195 -1.956 1.00 10.00 H new ATOM 0 HH11 ARG A 104 21.515 4.001 0.043 1.00 10.00 H new ATOM 0 HH12 ARG A 104 22.802 3.172 0.924 1.00 10.00 H new ATOM 0 HH21 ARG A 104 22.513 0.157 -0.879 1.00 10.00 H new ATOM 0 HH22 ARG A 104 23.362 1.020 0.408 1.00 10.00 H new ATOM 1512 N ASP A 105 17.415 4.654 -6.056 1.00 10.00 N ATOM 1513 CA ASP A 105 17.707 5.727 -7.000 1.00 10.00 C ATOM 1514 C ASP A 105 16.465 5.965 -7.844 1.00 10.00 C ATOM 1515 O ASP A 105 15.773 6.966 -7.659 1.00 10.00 O ATOM 1516 CB ASP A 105 18.957 5.517 -7.862 1.00 10.00 C ATOM 1517 CG ASP A 105 19.186 6.747 -8.726 1.00 10.00 C ATOM 1518 OD1 ASP A 105 18.492 6.855 -9.758 1.00 10.00 O ATOM 1519 OD2 ASP A 105 20.018 7.578 -8.306 1.00 10.00 O ATOM 0 H ASP A 105 16.529 4.840 -5.586 1.00 10.00 H new ATOM 0 HA ASP A 105 17.957 6.614 -6.418 1.00 10.00 H new ATOM 0 HB2 ASP A 105 19.825 5.338 -7.227 1.00 10.00 H new ATOM 0 HB3 ASP A 105 18.835 4.635 -8.491 1.00 10.00 H new ATOM 1524 N GLY A 106 16.163 5.001 -8.714 1.00 10.00 N ATOM 1525 CA GLY A 106 15.202 5.114 -9.795 1.00 10.00 C ATOM 1526 C GLY A 106 13.766 5.136 -9.297 1.00 10.00 C ATOM 1527 O GLY A 106 13.013 4.186 -9.508 1.00 10.00 O ATOM 0 H GLY A 106 16.605 4.082 -8.677 1.00 10.00 H new ATOM 0 HA2 GLY A 106 15.401 6.024 -10.360 1.00 10.00 H new ATOM 0 HA3 GLY A 106 15.332 4.278 -10.482 1.00 10.00 H new ATOM 1531 N ASP A 107 13.404 6.255 -8.666 1.00 10.00 N ATOM 1532 CA ASP A 107 12.140 6.495 -7.995 1.00 10.00 C ATOM 1533 C ASP A 107 12.009 5.594 -6.772 1.00 10.00 C ATOM 1534 O ASP A 107 12.492 4.464 -6.781 1.00 10.00 O ATOM 1535 CB ASP A 107 10.974 6.403 -8.985 1.00 10.00 C ATOM 1536 CG ASP A 107 9.704 7.010 -8.424 1.00 10.00 C ATOM 1537 OD1 ASP A 107 9.139 6.388 -7.502 1.00 10.00 O ATOM 1538 OD2 ASP A 107 9.333 8.090 -8.938 1.00 10.00 O ATOM 0 H ASP A 107 14.027 7.061 -8.611 1.00 10.00 H new ATOM 0 HA ASP A 107 12.110 7.515 -7.612 1.00 10.00 H new ATOM 0 HB2 ASP A 107 11.242 6.914 -9.910 1.00 10.00 H new ATOM 0 HB3 ASP A 107 10.795 5.358 -9.239 1.00 10.00 H new ATOM 1543 N HIS A 108 11.498 6.132 -5.664 1.00 10.00 N ATOM 1544 CA HIS A 108 11.389 5.411 -4.407 1.00 10.00 C ATOM 1545 C HIS A 108 10.751 6.288 -3.333 1.00 10.00 C ATOM 1546 O HIS A 108 10.488 7.470 -3.548 1.00 10.00 O ATOM 1547 CB HIS A 108 12.763 4.914 -3.919 1.00 10.00 C ATOM 1548 CG HIS A 108 13.864 5.953 -3.933 1.00 10.00 C ATOM 1549 ND1 HIS A 108 14.507 6.479 -5.035 1.00 10.00 N ATOM 1550 CD2 HIS A 108 14.460 6.485 -2.824 1.00 10.00 C ATOM 1551 CE1 HIS A 108 15.460 7.304 -4.582 1.00 10.00 C ATOM 1552 NE2 HIS A 108 15.475 7.363 -3.238 1.00 10.00 N ATOM 0 H HIS A 108 11.147 7.089 -5.619 1.00 10.00 H new ATOM 0 HA HIS A 108 10.753 4.544 -4.587 1.00 10.00 H new ATOM 0 HB2 HIS A 108 12.655 4.535 -2.903 1.00 10.00 H new ATOM 0 HB3 HIS A 108 13.070 4.073 -4.541 1.00 10.00 H new ATOM 0 HD2 HIS A 108 14.195 6.267 -1.800 1.00 10.00 H new ATOM 0 HE1 HIS A 108 16.135 7.856 -5.219 1.00 10.00 H new ATOM 0 HE2 HIS A 108 16.090 7.924 -2.648 1.00 10.00 H new ATOM 1560 N VAL A 109 10.589 5.723 -2.135 1.00 10.00 N ATOM 1561 CA VAL A 109 10.476 6.498 -0.917 1.00 10.00 C ATOM 1562 C VAL A 109 11.705 6.151 -0.087 1.00 10.00 C ATOM 1563 O VAL A 109 11.980 4.969 0.122 1.00 10.00 O ATOM 1564 CB VAL A 109 9.177 6.170 -0.165 1.00 10.00 C ATOM 1565 CG1 VAL A 109 9.031 7.111 1.039 1.00 10.00 C ATOM 1566 CG2 VAL A 109 7.952 6.324 -1.075 1.00 10.00 C ATOM 0 H VAL A 109 10.534 4.715 -1.991 1.00 10.00 H new ATOM 0 HA VAL A 109 10.433 7.566 -1.128 1.00 10.00 H new ATOM 0 HB VAL A 109 9.231 5.134 0.169 1.00 10.00 H new ATOM 0 HG11 VAL A 109 8.109 6.879 1.573 1.00 10.00 H new ATOM 0 HG12 VAL A 109 9.881 6.980 1.708 1.00 10.00 H new ATOM 0 HG13 VAL A 109 8.999 8.144 0.692 1.00 10.00 H new ATOM 0 HG21 VAL A 109 7.049 6.085 -0.513 1.00 10.00 H new ATOM 0 HG22 VAL A 109 7.894 7.351 -1.436 1.00 10.00 H new ATOM 0 HG23 VAL A 109 8.042 5.646 -1.924 1.00 10.00 H new ATOM 1576 N MET A 110 12.425 7.172 0.378 1.00 10.00 N ATOM 1577 CA MET A 110 13.448 7.055 1.394 1.00 10.00 C ATOM 1578 C MET A 110 12.715 7.060 2.733 1.00 10.00 C ATOM 1579 O MET A 110 12.395 8.116 3.276 1.00 10.00 O ATOM 1580 CB MET A 110 14.463 8.205 1.297 1.00 10.00 C ATOM 1581 CG MET A 110 15.125 8.238 -0.080 1.00 10.00 C ATOM 1582 SD MET A 110 16.489 9.406 -0.297 1.00 10.00 S ATOM 1583 CE MET A 110 17.834 8.493 0.493 1.00 10.00 C ATOM 0 H MET A 110 12.302 8.127 0.042 1.00 10.00 H new ATOM 0 HA MET A 110 14.027 6.140 1.271 1.00 10.00 H new ATOM 0 HB2 MET A 110 13.961 9.154 1.486 1.00 10.00 H new ATOM 0 HB3 MET A 110 15.225 8.088 2.068 1.00 10.00 H new ATOM 0 HG2 MET A 110 15.495 7.237 -0.304 1.00 10.00 H new ATOM 0 HG3 MET A 110 14.359 8.468 -0.821 1.00 10.00 H new ATOM 0 HE1 MET A 110 18.751 9.080 0.443 1.00 10.00 H new ATOM 0 HE2 MET A 110 17.581 8.303 1.536 1.00 10.00 H new ATOM 0 HE3 MET A 110 17.982 7.545 -0.023 1.00 10.00 H new ATOM 1593 N LEU A 111 12.417 5.870 3.248 1.00 10.00 N ATOM 1594 CA LEU A 111 11.801 5.671 4.549 1.00 10.00 C ATOM 1595 C LEU A 111 12.907 5.750 5.586 1.00 10.00 C ATOM 1596 O LEU A 111 13.236 4.767 6.245 1.00 10.00 O ATOM 1597 CB LEU A 111 11.085 4.318 4.558 1.00 10.00 C ATOM 1598 CG LEU A 111 9.756 4.443 3.804 1.00 10.00 C ATOM 1599 CD1 LEU A 111 9.586 3.276 2.839 1.00 10.00 C ATOM 1600 CD2 LEU A 111 8.596 4.491 4.797 1.00 10.00 C ATOM 0 H LEU A 111 12.604 4.997 2.756 1.00 10.00 H new ATOM 0 HA LEU A 111 11.053 6.431 4.775 1.00 10.00 H new ATOM 0 HB2 LEU A 111 11.712 3.559 4.090 1.00 10.00 H new ATOM 0 HB3 LEU A 111 10.906 3.995 5.584 1.00 10.00 H new ATOM 0 HG LEU A 111 9.761 5.368 3.227 1.00 10.00 H new ATOM 0 HD11 LEU A 111 8.638 3.377 2.310 1.00 10.00 H new ATOM 0 HD12 LEU A 111 10.405 3.276 2.120 1.00 10.00 H new ATOM 0 HD13 LEU A 111 9.593 2.339 3.396 1.00 10.00 H new ATOM 0 HD21 LEU A 111 7.655 4.580 4.254 1.00 10.00 H new ATOM 0 HD22 LEU A 111 8.587 3.577 5.391 1.00 10.00 H new ATOM 0 HD23 LEU A 111 8.717 5.351 5.456 1.00 10.00 H new ATOM 1612 N MET A 112 13.495 6.938 5.702 1.00 10.00 N ATOM 1613 CA MET A 112 14.648 7.146 6.547 1.00 10.00 C ATOM 1614 C MET A 112 14.206 7.413 7.985 1.00 10.00 C ATOM 1615 O MET A 112 13.017 7.406 8.322 1.00 10.00 O ATOM 1616 CB MET A 112 15.592 8.198 5.931 1.00 10.00 C ATOM 1617 CG MET A 112 14.957 9.524 5.499 1.00 10.00 C ATOM 1618 SD MET A 112 16.077 10.747 4.767 1.00 10.00 S ATOM 1619 CE MET A 112 17.086 11.197 6.198 1.00 10.00 C ATOM 0 H MET A 112 13.181 7.775 5.211 1.00 10.00 H new ATOM 0 HA MET A 112 15.252 6.240 6.602 1.00 10.00 H new ATOM 0 HB2 MET A 112 16.377 8.417 6.655 1.00 10.00 H new ATOM 0 HB3 MET A 112 16.076 7.753 5.061 1.00 10.00 H new ATOM 0 HG2 MET A 112 14.168 9.307 4.779 1.00 10.00 H new ATOM 0 HG3 MET A 112 14.479 9.975 6.369 1.00 10.00 H new ATOM 0 HE1 MET A 112 17.738 12.030 5.936 1.00 10.00 H new ATOM 0 HE2 MET A 112 16.437 11.490 7.023 1.00 10.00 H new ATOM 0 HE3 MET A 112 17.692 10.343 6.499 1.00 10.00 H new ATOM 1629 N GLY A 113 15.187 7.612 8.862 1.00 10.00 N ATOM 1630 CA GLY A 113 14.922 7.755 10.279 1.00 10.00 C ATOM 1631 C GLY A 113 14.476 6.412 10.864 1.00 10.00 C ATOM 1632 O GLY A 113 13.468 6.350 11.562 1.00 10.00 O ATOM 0 H GLY A 113 16.173 7.677 8.609 1.00 10.00 H new ATOM 0 HA2 GLY A 113 15.818 8.105 10.792 1.00 10.00 H new ATOM 0 HA3 GLY A 113 14.149 8.506 10.439 1.00 10.00 H new ATOM 1636 N LEU A 114 15.190 5.322 10.561 1.00 10.00 N ATOM 1637 CA LEU A 114 14.843 4.010 11.098 1.00 10.00 C ATOM 1638 C LEU A 114 15.061 4.013 12.612 1.00 10.00 C ATOM 1639 O LEU A 114 16.186 4.235 13.071 1.00 10.00 O ATOM 1640 CB LEU A 114 15.627 2.909 10.371 1.00 10.00 C ATOM 1641 CG LEU A 114 15.135 1.498 10.751 1.00 10.00 C ATOM 1642 CD1 LEU A 114 15.230 0.574 9.533 1.00 10.00 C ATOM 1643 CD2 LEU A 114 15.952 0.899 11.903 1.00 10.00 C ATOM 0 H LEU A 114 16.007 5.326 9.950 1.00 10.00 H new ATOM 0 HA LEU A 114 13.789 3.793 10.923 1.00 10.00 H new ATOM 0 HB2 LEU A 114 15.532 3.048 9.294 1.00 10.00 H new ATOM 0 HB3 LEU A 114 16.686 3.000 10.612 1.00 10.00 H new ATOM 0 HG LEU A 114 14.100 1.587 11.080 1.00 10.00 H new ATOM 0 HD11 LEU A 114 14.882 -0.423 9.804 1.00 10.00 H new ATOM 0 HD12 LEU A 114 14.610 0.968 8.728 1.00 10.00 H new ATOM 0 HD13 LEU A 114 16.266 0.518 9.199 1.00 10.00 H new ATOM 0 HD21 LEU A 114 15.573 -0.095 12.139 1.00 10.00 H new ATOM 0 HD22 LEU A 114 16.999 0.827 11.608 1.00 10.00 H new ATOM 0 HD23 LEU A 114 15.866 1.539 12.781 1.00 10.00 H new ATOM 1655 N LYS A 115 13.993 3.783 13.391 1.00 10.00 N ATOM 1656 CA LYS A 115 14.058 3.948 14.838 1.00 10.00 C ATOM 1657 C LYS A 115 15.144 3.064 15.447 1.00 10.00 C ATOM 1658 O LYS A 115 16.063 3.568 16.087 1.00 10.00 O ATOM 1659 CB LYS A 115 12.721 3.622 15.525 1.00 10.00 C ATOM 1660 CG LYS A 115 11.625 4.684 15.363 1.00 10.00 C ATOM 1661 CD LYS A 115 10.637 4.345 14.240 1.00 10.00 C ATOM 1662 CE LYS A 115 9.257 4.967 14.507 1.00 10.00 C ATOM 1663 NZ LYS A 115 8.496 4.204 15.514 1.00 10.00 N ATOM 0 H LYS A 115 13.083 3.484 13.040 1.00 10.00 H new ATOM 0 HA LYS A 115 14.293 4.998 15.009 1.00 10.00 H new ATOM 0 HB2 LYS A 115 12.349 2.677 15.130 1.00 10.00 H new ATOM 0 HB3 LYS A 115 12.905 3.473 16.589 1.00 10.00 H new ATOM 0 HG2 LYS A 115 11.081 4.786 16.302 1.00 10.00 H new ATOM 0 HG3 LYS A 115 12.087 5.649 15.156 1.00 10.00 H new ATOM 0 HD2 LYS A 115 11.025 4.709 13.289 1.00 10.00 H new ATOM 0 HD3 LYS A 115 10.540 3.263 14.152 1.00 10.00 H new ATOM 0 HE2 LYS A 115 9.382 5.995 14.848 1.00 10.00 H new ATOM 0 HE3 LYS A 115 8.690 5.006 13.577 1.00 10.00 H new ATOM 0 HZ1 LYS A 115 7.616 4.710 15.741 1.00 10.00 H new ATOM 0 HZ2 LYS A 115 8.267 3.263 15.136 1.00 10.00 H new ATOM 0 HZ3 LYS A 115 9.068 4.101 16.376 1.00 10.00 H new ATOM 1677 N ARG A 116 15.001 1.747 15.288 1.00 10.00 N ATOM 1678 CA ARG A 116 15.699 0.723 16.064 1.00 10.00 C ATOM 1679 C ARG A 116 15.569 -0.671 15.422 1.00 10.00 C ATOM 1680 O ARG A 116 16.597 -1.279 15.133 1.00 10.00 O ATOM 1681 CB ARG A 116 15.210 0.720 17.531 1.00 10.00 C ATOM 1682 CG ARG A 116 16.169 1.428 18.503 1.00 10.00 C ATOM 1683 CD ARG A 116 15.481 1.687 19.851 1.00 10.00 C ATOM 1684 NE ARG A 116 16.307 2.529 20.736 1.00 10.00 N ATOM 1685 CZ ARG A 116 17.223 2.098 21.621 1.00 10.00 C ATOM 1686 NH1 ARG A 116 17.512 0.795 21.705 1.00 10.00 N ATOM 1687 NH2 ARG A 116 17.848 2.976 22.415 1.00 10.00 N ATOM 0 H ARG A 116 14.372 1.351 14.589 1.00 10.00 H new ATOM 0 HA ARG A 116 16.760 0.973 16.063 1.00 10.00 H new ATOM 0 HB2 ARG A 116 14.234 1.203 17.581 1.00 10.00 H new ATOM 0 HB3 ARG A 116 15.072 -0.311 17.857 1.00 10.00 H new ATOM 0 HG2 ARG A 116 17.058 0.816 18.654 1.00 10.00 H new ATOM 0 HG3 ARG A 116 16.501 2.372 18.071 1.00 10.00 H new ATOM 0 HD2 ARG A 116 14.520 2.172 19.681 1.00 10.00 H new ATOM 0 HD3 ARG A 116 15.275 0.736 20.342 1.00 10.00 H new ATOM 0 HE ARG A 116 16.170 3.538 20.670 1.00 10.00 H new ATOM 0 HH11 ARG A 116 17.037 0.127 21.097 1.00 10.00 H new ATOM 0 HH12 ARG A 116 18.207 0.469 22.377 1.00 10.00 H new ATOM 0 HH21 ARG A 116 17.629 3.970 22.348 1.00 10.00 H new ATOM 0 HH22 ARG A 116 18.543 2.651 23.087 1.00 10.00 H new ATOM 1701 N PRO A 117 14.359 -1.233 15.229 1.00 10.00 N ATOM 1702 CA PRO A 117 14.223 -2.654 14.925 1.00 10.00 C ATOM 1703 C PRO A 117 14.515 -2.982 13.452 1.00 10.00 C ATOM 1704 O PRO A 117 13.625 -3.404 12.717 1.00 10.00 O ATOM 1705 CB PRO A 117 12.794 -3.015 15.356 1.00 10.00 C ATOM 1706 CG PRO A 117 12.028 -1.719 15.126 1.00 10.00 C ATOM 1707 CD PRO A 117 13.050 -0.664 15.538 1.00 10.00 C ATOM 0 HA PRO A 117 14.961 -3.252 15.460 1.00 10.00 H new ATOM 0 HB2 PRO A 117 12.388 -3.834 14.762 1.00 10.00 H new ATOM 0 HB3 PRO A 117 12.754 -3.327 16.399 1.00 10.00 H new ATOM 0 HG2 PRO A 117 11.722 -1.606 14.086 1.00 10.00 H new ATOM 0 HG3 PRO A 117 11.123 -1.668 15.731 1.00 10.00 H new ATOM 0 HD2 PRO A 117 12.891 0.267 14.995 1.00 10.00 H new ATOM 0 HD3 PRO A 117 12.966 -0.432 16.600 1.00 10.00 H new ATOM 1715 N LEU A 118 15.777 -2.873 13.022 1.00 10.00 N ATOM 1716 CA LEU A 118 16.211 -3.325 11.700 1.00 10.00 C ATOM 1717 C LEU A 118 16.295 -4.855 11.618 1.00 10.00 C ATOM 1718 O LEU A 118 17.332 -5.415 11.267 1.00 10.00 O ATOM 1719 CB LEU A 118 17.538 -2.661 11.299 1.00 10.00 C ATOM 1720 CG LEU A 118 18.697 -2.880 12.296 1.00 10.00 C ATOM 1721 CD1 LEU A 118 19.912 -3.525 11.615 1.00 10.00 C ATOM 1722 CD2 LEU A 118 19.145 -1.546 12.902 1.00 10.00 C ATOM 0 H LEU A 118 16.526 -2.468 13.584 1.00 10.00 H new ATOM 0 HA LEU A 118 15.453 -3.013 10.981 1.00 10.00 H new ATOM 0 HB2 LEU A 118 17.839 -3.043 10.323 1.00 10.00 H new ATOM 0 HB3 LEU A 118 17.373 -1.590 11.185 1.00 10.00 H new ATOM 0 HG LEU A 118 18.323 -3.545 13.075 1.00 10.00 H new ATOM 0 HD11 LEU A 118 20.708 -3.664 12.347 1.00 10.00 H new ATOM 0 HD12 LEU A 118 19.626 -4.492 11.201 1.00 10.00 H new ATOM 0 HD13 LEU A 118 20.266 -2.877 10.813 1.00 10.00 H new ATOM 0 HD21 LEU A 118 19.962 -1.720 13.602 1.00 10.00 H new ATOM 0 HD22 LEU A 118 19.483 -0.881 12.108 1.00 10.00 H new ATOM 0 HD23 LEU A 118 18.308 -1.086 13.428 1.00 10.00 H new ATOM 1734 N LYS A 119 15.199 -5.553 11.913 1.00 10.00 N ATOM 1735 CA LYS A 119 15.170 -7.000 11.780 1.00 10.00 C ATOM 1736 C LYS A 119 15.120 -7.368 10.302 1.00 10.00 C ATOM 1737 O LYS A 119 14.041 -7.412 9.714 1.00 10.00 O ATOM 1738 CB LYS A 119 13.963 -7.621 12.487 1.00 10.00 C ATOM 1739 CG LYS A 119 14.069 -7.774 14.002 1.00 10.00 C ATOM 1740 CD LYS A 119 13.883 -6.432 14.721 1.00 10.00 C ATOM 1741 CE LYS A 119 13.153 -6.597 16.063 1.00 10.00 C ATOM 1742 NZ LYS A 119 11.720 -6.911 15.872 1.00 10.00 N ATOM 0 H LYS A 119 14.327 -5.139 12.243 1.00 10.00 H new ATOM 0 HA LYS A 119 16.072 -7.392 12.249 1.00 10.00 H new ATOM 0 HB2 LYS A 119 13.087 -7.012 12.266 1.00 10.00 H new ATOM 0 HB3 LYS A 119 13.784 -8.606 12.056 1.00 10.00 H new ATOM 0 HG2 LYS A 119 13.316 -8.481 14.350 1.00 10.00 H new ATOM 0 HG3 LYS A 119 15.042 -8.193 14.258 1.00 10.00 H new ATOM 0 HD2 LYS A 119 14.857 -5.974 14.892 1.00 10.00 H new ATOM 0 HD3 LYS A 119 13.319 -5.753 14.082 1.00 10.00 H new ATOM 0 HE2 LYS A 119 13.626 -7.392 16.639 1.00 10.00 H new ATOM 0 HE3 LYS A 119 13.250 -5.681 16.645 1.00 10.00 H new ATOM 0 HZ1 LYS A 119 11.243 -6.931 16.796 1.00 10.00 H new ATOM 0 HZ2 LYS A 119 11.282 -6.183 15.272 1.00 10.00 H new ATOM 0 HZ3 LYS A 119 11.626 -7.840 15.413 1.00 10.00 H new ATOM 1756 N VAL A 120 16.287 -7.660 9.729 1.00 10.00 N ATOM 1757 CA VAL A 120 16.433 -8.189 8.384 1.00 10.00 C ATOM 1758 C VAL A 120 15.646 -9.502 8.261 1.00 10.00 C ATOM 1759 O VAL A 120 16.195 -10.571 8.521 1.00 10.00 O ATOM 1760 CB VAL A 120 17.929 -8.379 8.063 1.00 10.00 C ATOM 1761 CG1 VAL A 120 18.119 -8.829 6.606 1.00 10.00 C ATOM 1762 CG2 VAL A 120 18.714 -7.083 8.311 1.00 10.00 C ATOM 0 H VAL A 120 17.179 -7.529 10.206 1.00 10.00 H new ATOM 0 HA VAL A 120 16.025 -7.488 7.656 1.00 10.00 H new ATOM 0 HB VAL A 120 18.314 -9.153 8.727 1.00 10.00 H new ATOM 0 HG11 VAL A 120 19.182 -8.957 6.400 1.00 10.00 H new ATOM 0 HG12 VAL A 120 17.602 -9.775 6.447 1.00 10.00 H new ATOM 0 HG13 VAL A 120 17.708 -8.074 5.936 1.00 10.00 H new ATOM 0 HG21 VAL A 120 19.766 -7.245 8.077 1.00 10.00 H new ATOM 0 HG22 VAL A 120 18.318 -6.291 7.676 1.00 10.00 H new ATOM 0 HG23 VAL A 120 18.615 -6.792 9.357 1.00 10.00 H new ATOM 1772 N GLY A 121 14.371 -9.425 7.872 1.00 10.00 N ATOM 1773 CA GLY A 121 13.495 -10.580 7.737 1.00 10.00 C ATOM 1774 C GLY A 121 12.127 -10.370 8.382 1.00 10.00 C ATOM 1775 O GLY A 121 11.235 -11.191 8.182 1.00 10.00 O ATOM 0 H GLY A 121 13.916 -8.542 7.640 1.00 10.00 H new ATOM 0 HA2 GLY A 121 13.361 -10.806 6.679 1.00 10.00 H new ATOM 0 HA3 GLY A 121 13.975 -11.448 8.190 1.00 10.00 H new ATOM 1779 N GLU A 122 11.942 -9.294 9.152 1.00 10.00 N ATOM 1780 CA GLU A 122 10.672 -9.003 9.782 1.00 10.00 C ATOM 1781 C GLU A 122 9.751 -8.393 8.742 1.00 10.00 C ATOM 1782 O GLU A 122 10.076 -8.252 7.563 1.00 10.00 O ATOM 1783 CB GLU A 122 10.917 -8.087 10.988 1.00 10.00 C ATOM 1784 CG GLU A 122 9.769 -7.823 11.975 1.00 10.00 C ATOM 1785 CD GLU A 122 10.337 -7.491 13.349 1.00 10.00 C ATOM 1786 OE1 GLU A 122 10.721 -8.435 14.074 1.00 10.00 O ATOM 1787 OE2 GLU A 122 10.469 -6.294 13.694 1.00 10.00 O ATOM 0 H GLU A 122 12.671 -8.609 9.349 1.00 10.00 H new ATOM 0 HA GLU A 122 10.187 -9.903 10.159 1.00 10.00 H new ATOM 0 HB2 GLU A 122 11.747 -8.507 11.556 1.00 10.00 H new ATOM 0 HB3 GLU A 122 11.249 -7.122 10.605 1.00 10.00 H new ATOM 0 HG2 GLU A 122 9.152 -6.999 11.617 1.00 10.00 H new ATOM 0 HG3 GLU A 122 9.124 -8.699 12.040 1.00 10.00 H new ATOM 1794 N THR A 123 8.567 -8.039 9.201 1.00 10.00 N ATOM 1795 CA THR A 123 7.531 -7.411 8.406 1.00 10.00 C ATOM 1796 C THR A 123 6.681 -6.532 9.315 1.00 10.00 C ATOM 1797 O THR A 123 6.289 -6.958 10.398 1.00 10.00 O ATOM 1798 CB THR A 123 6.734 -8.477 7.631 1.00 10.00 C ATOM 1799 OG1 THR A 123 7.543 -9.026 6.604 1.00 10.00 O ATOM 1800 CG2 THR A 123 5.479 -7.917 6.961 1.00 10.00 C ATOM 0 H THR A 123 8.290 -8.186 10.172 1.00 10.00 H new ATOM 0 HA THR A 123 7.959 -6.760 7.644 1.00 10.00 H new ATOM 0 HB THR A 123 6.436 -9.225 8.366 1.00 10.00 H new ATOM 0 HG1 THR A 123 8.488 -8.921 6.841 1.00 10.00 H new ATOM 0 HG21 THR A 123 4.962 -8.717 6.431 1.00 10.00 H new ATOM 0 HG22 THR A 123 4.818 -7.497 7.719 1.00 10.00 H new ATOM 0 HG23 THR A 123 5.761 -7.137 6.254 1.00 10.00 H new ATOM 1808 N VAL A 124 6.451 -5.293 8.879 1.00 10.00 N ATOM 1809 CA VAL A 124 5.748 -4.258 9.618 1.00 10.00 C ATOM 1810 C VAL A 124 4.746 -3.616 8.660 1.00 10.00 C ATOM 1811 O VAL A 124 5.056 -3.433 7.485 1.00 10.00 O ATOM 1812 CB VAL A 124 6.768 -3.223 10.129 1.00 10.00 C ATOM 1813 CG1 VAL A 124 6.074 -2.139 10.959 1.00 10.00 C ATOM 1814 CG2 VAL A 124 7.848 -3.881 11.000 1.00 10.00 C ATOM 0 H VAL A 124 6.765 -4.976 7.962 1.00 10.00 H new ATOM 0 HA VAL A 124 5.222 -4.666 10.481 1.00 10.00 H new ATOM 0 HB VAL A 124 7.234 -2.779 9.249 1.00 10.00 H new ATOM 0 HG11 VAL A 124 6.814 -1.419 11.309 1.00 10.00 H new ATOM 0 HG12 VAL A 124 5.334 -1.628 10.344 1.00 10.00 H new ATOM 0 HG13 VAL A 124 5.580 -2.597 11.816 1.00 10.00 H new ATOM 0 HG21 VAL A 124 8.551 -3.122 11.343 1.00 10.00 H new ATOM 0 HG22 VAL A 124 7.380 -4.358 11.861 1.00 10.00 H new ATOM 0 HG23 VAL A 124 8.381 -4.630 10.415 1.00 10.00 H new ATOM 1824 N ASN A 125 3.544 -3.271 9.127 1.00 10.00 N ATOM 1825 CA ASN A 125 2.588 -2.579 8.273 1.00 10.00 C ATOM 1826 C ASN A 125 3.089 -1.168 7.967 1.00 10.00 C ATOM 1827 O ASN A 125 3.399 -0.402 8.880 1.00 10.00 O ATOM 1828 CB ASN A 125 1.186 -2.545 8.892 1.00 10.00 C ATOM 1829 CG ASN A 125 0.547 -3.930 8.895 1.00 10.00 C ATOM 1830 OD1 ASN A 125 0.770 -4.709 9.815 1.00 10.00 O ATOM 1831 ND2 ASN A 125 -0.243 -4.264 7.877 1.00 10.00 N ATOM 0 H ASN A 125 3.217 -3.457 10.075 1.00 10.00 H new ATOM 0 HA ASN A 125 2.506 -3.135 7.339 1.00 10.00 H new ATOM 0 HB2 ASN A 125 1.246 -2.168 9.913 1.00 10.00 H new ATOM 0 HB3 ASN A 125 0.556 -1.853 8.333 1.00 10.00 H new ATOM 0 HD21 ASN A 125 -0.678 -5.186 7.851 1.00 10.00 H new ATOM 0 HD22 ASN A 125 -0.413 -3.598 7.123 1.00 10.00 H new ATOM 1838 N ILE A 126 3.134 -0.818 6.683 1.00 10.00 N ATOM 1839 CA ILE A 126 3.230 0.560 6.229 1.00 10.00 C ATOM 1840 C ILE A 126 1.810 1.123 6.256 1.00 10.00 C ATOM 1841 O ILE A 126 0.853 0.375 6.462 1.00 10.00 O ATOM 1842 CB ILE A 126 3.832 0.568 4.806 1.00 10.00 C ATOM 1843 CG1 ILE A 126 4.536 1.886 4.451 1.00 10.00 C ATOM 1844 CG2 ILE A 126 2.786 0.243 3.729 1.00 10.00 C ATOM 1845 CD1 ILE A 126 5.198 1.789 3.075 1.00 10.00 C ATOM 0 H ILE A 126 3.104 -1.496 5.922 1.00 10.00 H new ATOM 0 HA ILE A 126 3.876 1.172 6.859 1.00 10.00 H new ATOM 0 HB ILE A 126 4.584 -0.220 4.820 1.00 10.00 H new ATOM 0 HG12 ILE A 126 3.814 2.703 4.457 1.00 10.00 H new ATOM 0 HG13 ILE A 126 5.287 2.119 5.206 1.00 10.00 H new ATOM 0 HG21 ILE A 126 3.258 0.261 2.747 1.00 10.00 H new ATOM 0 HG22 ILE A 126 2.369 -0.747 3.914 1.00 10.00 H new ATOM 0 HG23 ILE A 126 1.988 0.984 3.762 1.00 10.00 H new ATOM 0 HD11 ILE A 126 5.691 2.732 2.841 1.00 10.00 H new ATOM 0 HD12 ILE A 126 5.935 0.986 3.082 1.00 10.00 H new ATOM 0 HD13 ILE A 126 4.440 1.580 2.320 1.00 10.00 H new ATOM 1857 N THR A 127 1.634 2.418 6.004 1.00 10.00 N ATOM 1858 CA THR A 127 0.353 2.960 5.591 1.00 10.00 C ATOM 1859 C THR A 127 0.579 4.096 4.594 1.00 10.00 C ATOM 1860 O THR A 127 1.176 5.111 4.948 1.00 10.00 O ATOM 1861 CB THR A 127 -0.500 3.380 6.795 1.00 10.00 C ATOM 1862 OG1 THR A 127 -0.650 2.317 7.716 1.00 10.00 O ATOM 1863 CG2 THR A 127 -1.894 3.780 6.309 1.00 10.00 C ATOM 0 H THR A 127 2.375 3.114 6.081 1.00 10.00 H new ATOM 0 HA THR A 127 -0.221 2.182 5.087 1.00 10.00 H new ATOM 0 HB THR A 127 0.003 4.212 7.287 1.00 10.00 H new ATOM 0 HG1 THR A 127 -0.281 1.495 7.330 1.00 10.00 H new ATOM 0 HG21 THR A 127 -2.504 4.079 7.161 1.00 10.00 H new ATOM 0 HG22 THR A 127 -1.811 4.613 5.611 1.00 10.00 H new ATOM 0 HG23 THR A 127 -2.362 2.933 5.808 1.00 10.00 H new ATOM 1871 N LEU A 128 0.126 3.924 3.348 1.00 10.00 N ATOM 1872 CA LEU A 128 0.258 4.951 2.317 1.00 10.00 C ATOM 1873 C LEU A 128 -0.919 5.929 2.334 1.00 10.00 C ATOM 1874 O LEU A 128 -1.889 5.727 3.065 1.00 10.00 O ATOM 1875 CB LEU A 128 0.538 4.348 0.928 1.00 10.00 C ATOM 1876 CG LEU A 128 -0.340 3.183 0.456 1.00 10.00 C ATOM 1877 CD1 LEU A 128 -1.697 3.727 0.013 1.00 10.00 C ATOM 1878 CD2 LEU A 128 0.325 2.489 -0.738 1.00 10.00 C ATOM 0 H LEU A 128 -0.339 3.074 3.030 1.00 10.00 H new ATOM 0 HA LEU A 128 1.140 5.544 2.558 1.00 10.00 H new ATOM 0 HB2 LEU A 128 0.452 5.149 0.193 1.00 10.00 H new ATOM 0 HB3 LEU A 128 1.575 4.011 0.913 1.00 10.00 H new ATOM 0 HG LEU A 128 -0.467 2.472 1.272 1.00 10.00 H new ATOM 0 HD11 LEU A 128 -2.327 2.904 -0.324 1.00 10.00 H new ATOM 0 HD12 LEU A 128 -2.178 4.232 0.851 1.00 10.00 H new ATOM 0 HD13 LEU A 128 -1.556 4.434 -0.804 1.00 10.00 H new ATOM 0 HD21 LEU A 128 -0.300 1.661 -1.072 1.00 10.00 H new ATOM 0 HD22 LEU A 128 0.447 3.203 -1.552 1.00 10.00 H new ATOM 0 HD23 LEU A 128 1.302 2.108 -0.440 1.00 10.00 H new ATOM 1890 N LYS A 129 -0.839 6.997 1.531 1.00 10.00 N ATOM 1891 CA LYS A 129 -1.915 7.947 1.337 1.00 10.00 C ATOM 1892 C LYS A 129 -1.717 8.655 -0.002 1.00 10.00 C ATOM 1893 O LYS A 129 -0.822 9.481 -0.170 1.00 10.00 O ATOM 1894 CB LYS A 129 -2.015 8.931 2.511 1.00 10.00 C ATOM 1895 CG LYS A 129 -3.247 9.834 2.361 1.00 10.00 C ATOM 1896 CD LYS A 129 -3.554 10.536 3.689 1.00 10.00 C ATOM 1897 CE LYS A 129 -4.806 11.413 3.546 1.00 10.00 C ATOM 1898 NZ LYS A 129 -5.174 12.069 4.818 1.00 10.00 N ATOM 0 H LYS A 129 -0.002 7.220 0.992 1.00 10.00 H new ATOM 0 HA LYS A 129 -2.868 7.418 1.311 1.00 10.00 H new ATOM 0 HB2 LYS A 129 -2.074 8.380 3.449 1.00 10.00 H new ATOM 0 HB3 LYS A 129 -1.114 9.542 2.557 1.00 10.00 H new ATOM 0 HG2 LYS A 129 -3.071 10.575 1.582 1.00 10.00 H new ATOM 0 HG3 LYS A 129 -4.106 9.240 2.048 1.00 10.00 H new ATOM 0 HD2 LYS A 129 -3.707 9.795 4.474 1.00 10.00 H new ATOM 0 HD3 LYS A 129 -2.704 11.148 3.990 1.00 10.00 H new ATOM 0 HE2 LYS A 129 -4.631 12.173 2.784 1.00 10.00 H new ATOM 0 HE3 LYS A 129 -5.639 10.801 3.200 1.00 10.00 H new ATOM 0 HZ1 LYS A 129 -6.024 12.651 4.675 1.00 10.00 H new ATOM 0 HZ2 LYS A 129 -5.367 11.345 5.539 1.00 10.00 H new ATOM 0 HZ3 LYS A 129 -4.390 12.674 5.136 1.00 10.00 H new ATOM 1912 N ALA A 130 -2.580 8.340 -0.957 1.00 10.00 N ATOM 1913 CA ALA A 130 -2.802 9.173 -2.124 1.00 10.00 C ATOM 1914 C ALA A 130 -3.798 10.267 -1.770 1.00 10.00 C ATOM 1915 O ALA A 130 -4.890 9.984 -1.279 1.00 10.00 O ATOM 1916 CB ALA A 130 -3.291 8.325 -3.296 1.00 10.00 C ATOM 0 H ALA A 130 -3.148 7.493 -0.941 1.00 10.00 H new ATOM 0 HA ALA A 130 -1.866 9.640 -2.431 1.00 10.00 H new ATOM 0 HB1 ALA A 130 -3.453 8.964 -4.164 1.00 10.00 H new ATOM 0 HB2 ALA A 130 -2.543 7.570 -3.536 1.00 10.00 H new ATOM 0 HB3 ALA A 130 -4.227 7.836 -3.026 1.00 10.00 H new ATOM 1922 N THR A 131 -3.418 11.523 -2.020 1.00 10.00 N ATOM 1923 CA THR A 131 -4.249 12.684 -1.727 1.00 10.00 C ATOM 1924 C THR A 131 -5.295 12.842 -2.842 1.00 10.00 C ATOM 1925 O THR A 131 -5.296 13.812 -3.594 1.00 10.00 O ATOM 1926 CB THR A 131 -3.365 13.909 -1.415 1.00 10.00 C ATOM 1927 OG1 THR A 131 -4.133 14.915 -0.789 1.00 10.00 O ATOM 1928 CG2 THR A 131 -2.604 14.504 -2.606 1.00 10.00 C ATOM 0 H THR A 131 -2.517 11.760 -2.435 1.00 10.00 H new ATOM 0 HA THR A 131 -4.832 12.558 -0.815 1.00 10.00 H new ATOM 0 HB THR A 131 -2.592 13.528 -0.748 1.00 10.00 H new ATOM 0 HG1 THR A 131 -3.563 15.688 -0.594 1.00 10.00 H new ATOM 0 HG21 THR A 131 -2.016 15.359 -2.272 1.00 10.00 H new ATOM 0 HG22 THR A 131 -1.940 13.749 -3.027 1.00 10.00 H new ATOM 0 HG23 THR A 131 -3.314 14.828 -3.367 1.00 10.00 H new ATOM 1936 N ASP A 132 -6.150 11.819 -2.955 1.00 10.00 N ATOM 1937 CA ASP A 132 -7.237 11.666 -3.916 1.00 10.00 C ATOM 1938 C ASP A 132 -7.810 10.262 -3.728 1.00 10.00 C ATOM 1939 O ASP A 132 -8.952 10.086 -3.315 1.00 10.00 O ATOM 1940 CB ASP A 132 -6.756 11.848 -5.375 1.00 10.00 C ATOM 1941 CG ASP A 132 -7.215 13.165 -5.993 1.00 10.00 C ATOM 1942 OD1 ASP A 132 -8.416 13.475 -5.866 1.00 10.00 O ATOM 1943 OD2 ASP A 132 -6.363 13.826 -6.629 1.00 10.00 O ATOM 0 H ASP A 132 -6.091 11.018 -2.327 1.00 10.00 H new ATOM 0 HA ASP A 132 -7.989 12.435 -3.738 1.00 10.00 H new ATOM 0 HB2 ASP A 132 -5.667 11.800 -5.402 1.00 10.00 H new ATOM 0 HB3 ASP A 132 -7.126 11.020 -5.980 1.00 10.00 H new ATOM 1948 N GLY A 133 -6.988 9.256 -4.041 1.00 10.00 N ATOM 1949 CA GLY A 133 -7.429 7.876 -4.175 1.00 10.00 C ATOM 1950 C GLY A 133 -7.774 7.207 -2.844 1.00 10.00 C ATOM 1951 O GLY A 133 -8.947 6.970 -2.541 1.00 10.00 O ATOM 0 H GLY A 133 -5.990 9.384 -4.209 1.00 10.00 H new ATOM 0 HA2 GLY A 133 -8.304 7.845 -4.824 1.00 10.00 H new ATOM 0 HA3 GLY A 133 -6.646 7.300 -4.668 1.00 10.00 H new ATOM 1955 N ARG A 134 -6.749 6.767 -2.102 1.00 10.00 N ATOM 1956 CA ARG A 134 -6.945 6.032 -0.866 1.00 10.00 C ATOM 1957 C ARG A 134 -5.700 6.008 0.017 1.00 10.00 C ATOM 1958 O ARG A 134 -4.666 6.585 -0.313 1.00 10.00 O ATOM 1959 CB ARG A 134 -7.519 4.630 -1.157 1.00 10.00 C ATOM 1960 CG ARG A 134 -8.847 4.451 -0.410 1.00 10.00 C ATOM 1961 CD ARG A 134 -9.706 3.357 -1.051 1.00 10.00 C ATOM 1962 NE ARG A 134 -11.084 3.392 -0.537 1.00 10.00 N ATOM 1963 CZ ARG A 134 -12.008 4.313 -0.867 1.00 10.00 C ATOM 1964 NH1 ARG A 134 -11.694 5.330 -1.684 1.00 10.00 N ATOM 1965 NH2 ARG A 134 -13.246 4.213 -0.368 1.00 10.00 N ATOM 0 H ARG A 134 -5.770 6.914 -2.348 1.00 10.00 H new ATOM 0 HA ARG A 134 -7.687 6.568 -0.274 1.00 10.00 H new ATOM 0 HB2 ARG A 134 -7.674 4.505 -2.229 1.00 10.00 H new ATOM 0 HB3 ARG A 134 -6.809 3.864 -0.846 1.00 10.00 H new ATOM 0 HG2 ARG A 134 -8.649 4.197 0.631 1.00 10.00 H new ATOM 0 HG3 ARG A 134 -9.396 5.393 -0.409 1.00 10.00 H new ATOM 0 HD2 ARG A 134 -9.716 3.486 -2.133 1.00 10.00 H new ATOM 0 HD3 ARG A 134 -9.265 2.381 -0.850 1.00 10.00 H new ATOM 0 HE ARG A 134 -11.360 2.662 0.120 1.00 10.00 H new ATOM 0 HH11 ARG A 134 -10.749 5.409 -2.060 1.00 10.00 H new ATOM 0 HH12 ARG A 134 -12.400 6.024 -1.929 1.00 10.00 H new ATOM 0 HH21 ARG A 134 -13.483 3.443 0.257 1.00 10.00 H new ATOM 0 HH22 ARG A 134 -13.952 4.907 -0.613 1.00 10.00 H new ATOM 1979 N THR A 135 -5.846 5.300 1.133 1.00 10.00 N ATOM 1980 CA THR A 135 -4.895 4.976 2.167 1.00 10.00 C ATOM 1981 C THR A 135 -5.021 3.459 2.309 1.00 10.00 C ATOM 1982 O THR A 135 -6.121 2.932 2.135 1.00 10.00 O ATOM 1983 CB THR A 135 -5.288 5.745 3.441 1.00 10.00 C ATOM 1984 OG1 THR A 135 -4.786 7.060 3.333 1.00 10.00 O ATOM 1985 CG2 THR A 135 -4.752 5.144 4.739 1.00 10.00 C ATOM 0 H THR A 135 -6.755 4.892 1.351 1.00 10.00 H new ATOM 0 HA THR A 135 -3.862 5.253 1.956 1.00 10.00 H new ATOM 0 HB THR A 135 -6.375 5.702 3.503 1.00 10.00 H new ATOM 0 HG1 THR A 135 -3.809 7.032 3.260 1.00 10.00 H new ATOM 0 HG21 THR A 135 -5.078 5.751 5.583 1.00 10.00 H new ATOM 0 HG22 THR A 135 -5.132 4.129 4.854 1.00 10.00 H new ATOM 0 HG23 THR A 135 -3.663 5.122 4.707 1.00 10.00 H new ATOM 1993 N LEU A 136 -3.910 2.758 2.534 1.00 10.00 N ATOM 1994 CA LEU A 136 -3.840 1.303 2.496 1.00 10.00 C ATOM 1995 C LEU A 136 -2.643 0.910 3.357 1.00 10.00 C ATOM 1996 O LEU A 136 -1.688 1.684 3.425 1.00 10.00 O ATOM 1997 CB LEU A 136 -3.669 0.844 1.040 1.00 10.00 C ATOM 1998 CG LEU A 136 -4.581 -0.320 0.621 1.00 10.00 C ATOM 1999 CD1 LEU A 136 -4.361 -0.611 -0.868 1.00 10.00 C ATOM 2000 CD2 LEU A 136 -4.332 -1.596 1.431 1.00 10.00 C ATOM 0 H LEU A 136 -3.016 3.198 2.752 1.00 10.00 H new ATOM 0 HA LEU A 136 -4.745 0.831 2.878 1.00 10.00 H new ATOM 0 HB2 LEU A 136 -3.859 1.692 0.382 1.00 10.00 H new ATOM 0 HB3 LEU A 136 -2.631 0.548 0.886 1.00 10.00 H new ATOM 0 HG LEU A 136 -5.610 -0.016 0.815 1.00 10.00 H new ATOM 0 HD11 LEU A 136 -5.003 -1.436 -1.176 1.00 10.00 H new ATOM 0 HD12 LEU A 136 -4.604 0.277 -1.452 1.00 10.00 H new ATOM 0 HD13 LEU A 136 -3.318 -0.881 -1.036 1.00 10.00 H new ATOM 0 HD21 LEU A 136 -5.006 -2.381 1.089 1.00 10.00 H new ATOM 0 HD22 LEU A 136 -3.300 -1.918 1.294 1.00 10.00 H new ATOM 0 HD23 LEU A 136 -4.513 -1.397 2.487 1.00 10.00 H new ATOM 2012 N ASN A 137 -2.711 -0.240 4.034 1.00 10.00 N ATOM 2013 CA ASN A 137 -1.941 -0.582 5.223 1.00 10.00 C ATOM 2014 C ASN A 137 -1.111 -1.837 4.967 1.00 10.00 C ATOM 2015 O ASN A 137 -1.249 -2.853 5.648 1.00 10.00 O ATOM 2016 CB ASN A 137 -2.893 -0.777 6.415 1.00 10.00 C ATOM 2017 CG ASN A 137 -3.891 -1.918 6.204 1.00 10.00 C ATOM 2018 OD1 ASN A 137 -4.358 -2.144 5.089 1.00 10.00 O ATOM 2019 ND2 ASN A 137 -4.243 -2.638 7.265 1.00 10.00 N ATOM 0 H ASN A 137 -3.338 -0.993 3.749 1.00 10.00 H new ATOM 0 HA ASN A 137 -1.254 0.231 5.460 1.00 10.00 H new ATOM 0 HB2 ASN A 137 -2.307 -0.976 7.312 1.00 10.00 H new ATOM 0 HB3 ASN A 137 -3.440 0.149 6.591 1.00 10.00 H new ATOM 0 HD21 ASN A 137 -4.915 -3.399 7.165 1.00 10.00 H new ATOM 0 HD22 ASN A 137 -3.841 -2.430 8.179 1.00 10.00 H new ATOM 2026 N VAL A 138 -0.235 -1.771 3.970 1.00 10.00 N ATOM 2027 CA VAL A 138 0.336 -2.957 3.351 1.00 10.00 C ATOM 2028 C VAL A 138 1.444 -3.519 4.251 1.00 10.00 C ATOM 2029 O VAL A 138 2.137 -2.770 4.935 1.00 10.00 O ATOM 2030 CB VAL A 138 0.885 -2.554 1.970 1.00 10.00 C ATOM 2031 CG1 VAL A 138 1.569 -3.720 1.240 1.00 10.00 C ATOM 2032 CG2 VAL A 138 -0.193 -1.956 1.058 1.00 10.00 C ATOM 0 H VAL A 138 0.098 -0.894 3.570 1.00 10.00 H new ATOM 0 HA VAL A 138 -0.416 -3.736 3.225 1.00 10.00 H new ATOM 0 HB VAL A 138 1.631 -1.788 2.180 1.00 10.00 H new ATOM 0 HG11 VAL A 138 1.937 -3.378 0.272 1.00 10.00 H new ATOM 0 HG12 VAL A 138 2.405 -4.083 1.838 1.00 10.00 H new ATOM 0 HG13 VAL A 138 0.852 -4.527 1.091 1.00 10.00 H new ATOM 0 HG21 VAL A 138 0.249 -1.690 0.098 1.00 10.00 H new ATOM 0 HG22 VAL A 138 -0.985 -2.689 0.902 1.00 10.00 H new ATOM 0 HG23 VAL A 138 -0.611 -1.064 1.525 1.00 10.00 H new ATOM 2042 N ALA A 139 1.625 -4.840 4.259 1.00 10.00 N ATOM 2043 CA ALA A 139 2.626 -5.485 5.096 1.00 10.00 C ATOM 2044 C ALA A 139 3.980 -5.379 4.397 1.00 10.00 C ATOM 2045 O ALA A 139 4.181 -5.994 3.353 1.00 10.00 O ATOM 2046 CB ALA A 139 2.221 -6.942 5.330 1.00 10.00 C ATOM 0 H ALA A 139 1.082 -5.487 3.687 1.00 10.00 H new ATOM 0 HA ALA A 139 2.699 -4.999 6.069 1.00 10.00 H new ATOM 0 HB1 ALA A 139 2.967 -7.431 5.957 1.00 10.00 H new ATOM 0 HB2 ALA A 139 1.252 -6.975 5.827 1.00 10.00 H new ATOM 0 HB3 ALA A 139 2.155 -7.460 4.373 1.00 10.00 H new ATOM 2052 N ALA A 140 4.884 -4.562 4.947 1.00 10.00 N ATOM 2053 CA ALA A 140 6.171 -4.250 4.350 1.00 10.00 C ATOM 2054 C ALA A 140 7.279 -5.059 5.015 1.00 10.00 C ATOM 2055 O ALA A 140 7.468 -4.955 6.227 1.00 10.00 O ATOM 2056 CB ALA A 140 6.456 -2.757 4.492 1.00 10.00 C ATOM 0 H ALA A 140 4.731 -4.093 5.840 1.00 10.00 H new ATOM 0 HA ALA A 140 6.140 -4.512 3.292 1.00 10.00 H new ATOM 0 HB1 ALA A 140 7.422 -2.527 4.043 1.00 10.00 H new ATOM 0 HB2 ALA A 140 5.676 -2.188 3.986 1.00 10.00 H new ATOM 0 HB3 ALA A 140 6.474 -2.489 5.548 1.00 10.00 H new ATOM 2062 N THR A 141 8.025 -5.844 4.235 1.00 10.00 N ATOM 2063 CA THR A 141 9.077 -6.707 4.762 1.00 10.00 C ATOM 2064 C THR A 141 10.371 -5.913 4.945 1.00 10.00 C ATOM 2065 O THR A 141 10.841 -5.249 4.021 1.00 10.00 O ATOM 2066 CB THR A 141 9.228 -7.950 3.878 1.00 10.00 C ATOM 2067 OG1 THR A 141 7.968 -8.585 3.803 1.00 10.00 O ATOM 2068 CG2 THR A 141 10.235 -8.968 4.426 1.00 10.00 C ATOM 0 H THR A 141 7.915 -5.897 3.222 1.00 10.00 H new ATOM 0 HA THR A 141 8.806 -7.070 5.753 1.00 10.00 H new ATOM 0 HB THR A 141 9.595 -7.617 2.907 1.00 10.00 H new ATOM 0 HG1 THR A 141 7.663 -8.814 4.706 1.00 10.00 H new ATOM 0 HG21 THR A 141 10.292 -9.822 3.752 1.00 10.00 H new ATOM 0 HG22 THR A 141 11.217 -8.502 4.505 1.00 10.00 H new ATOM 0 HG23 THR A 141 9.912 -9.305 5.411 1.00 10.00 H new ATOM 2076 N VAL A 142 10.941 -5.965 6.149 1.00 10.00 N ATOM 2077 CA VAL A 142 12.085 -5.173 6.554 1.00 10.00 C ATOM 2078 C VAL A 142 13.307 -6.018 6.229 1.00 10.00 C ATOM 2079 O VAL A 142 13.639 -6.925 6.980 1.00 10.00 O ATOM 2080 CB VAL A 142 11.970 -4.865 8.058 1.00 10.00 C ATOM 2081 CG1 VAL A 142 13.164 -4.047 8.566 1.00 10.00 C ATOM 2082 CG2 VAL A 142 10.677 -4.096 8.356 1.00 10.00 C ATOM 0 H VAL A 142 10.602 -6.582 6.887 1.00 10.00 H new ATOM 0 HA VAL A 142 12.149 -4.214 6.040 1.00 10.00 H new ATOM 0 HB VAL A 142 11.958 -5.824 8.577 1.00 10.00 H new ATOM 0 HG11 VAL A 142 13.044 -3.851 9.632 1.00 10.00 H new ATOM 0 HG12 VAL A 142 14.085 -4.607 8.401 1.00 10.00 H new ATOM 0 HG13 VAL A 142 13.213 -3.101 8.027 1.00 10.00 H new ATOM 0 HG21 VAL A 142 10.615 -3.888 9.424 1.00 10.00 H new ATOM 0 HG22 VAL A 142 10.677 -3.157 7.803 1.00 10.00 H new ATOM 0 HG23 VAL A 142 9.819 -4.696 8.053 1.00 10.00 H new ATOM 2092 N LYS A 143 13.948 -5.784 5.088 1.00 10.00 N ATOM 2093 CA LYS A 143 15.040 -6.618 4.622 1.00 10.00 C ATOM 2094 C LYS A 143 15.956 -5.835 3.679 1.00 10.00 C ATOM 2095 O LYS A 143 15.631 -5.644 2.505 1.00 10.00 O ATOM 2096 CB LYS A 143 14.485 -7.923 4.020 1.00 10.00 C ATOM 2097 CG LYS A 143 13.531 -7.707 2.833 1.00 10.00 C ATOM 2098 CD LYS A 143 14.212 -8.052 1.502 1.00 10.00 C ATOM 2099 CE LYS A 143 13.603 -7.266 0.333 1.00 10.00 C ATOM 2100 NZ LYS A 143 13.968 -5.831 0.369 1.00 10.00 N ATOM 0 H LYS A 143 13.722 -5.010 4.464 1.00 10.00 H new ATOM 0 HA LYS A 143 15.670 -6.911 5.462 1.00 10.00 H new ATOM 0 HB2 LYS A 143 15.319 -8.545 3.694 1.00 10.00 H new ATOM 0 HB3 LYS A 143 13.960 -8.476 4.799 1.00 10.00 H new ATOM 0 HG2 LYS A 143 12.642 -8.325 2.960 1.00 10.00 H new ATOM 0 HG3 LYS A 143 13.198 -6.669 2.815 1.00 10.00 H new ATOM 0 HD2 LYS A 143 15.278 -7.834 1.571 1.00 10.00 H new ATOM 0 HD3 LYS A 143 14.117 -9.121 1.311 1.00 10.00 H new ATOM 0 HE2 LYS A 143 13.939 -7.701 -0.608 1.00 10.00 H new ATOM 0 HE3 LYS A 143 12.518 -7.363 0.359 1.00 10.00 H new ATOM 0 HZ1 LYS A 143 13.120 -5.253 0.199 1.00 10.00 H new ATOM 0 HZ2 LYS A 143 14.366 -5.597 1.301 1.00 10.00 H new ATOM 0 HZ3 LYS A 143 14.675 -5.634 -0.368 1.00 10.00 H new ATOM 2114 N LYS A 144 17.108 -5.401 4.206 1.00 10.00 N ATOM 2115 CA LYS A 144 18.263 -4.973 3.429 1.00 10.00 C ATOM 2116 C LYS A 144 18.667 -6.063 2.437 1.00 10.00 C ATOM 2117 O LYS A 144 18.591 -5.872 1.226 1.00 10.00 O ATOM 2118 CB LYS A 144 19.425 -4.573 4.360 1.00 10.00 C ATOM 2119 CG LYS A 144 19.825 -5.551 5.482 1.00 10.00 C ATOM 2120 CD LYS A 144 21.161 -6.270 5.220 1.00 10.00 C ATOM 2121 CE LYS A 144 22.348 -5.590 5.918 1.00 10.00 C ATOM 2122 NZ LYS A 144 22.511 -4.179 5.519 1.00 10.00 N ATOM 0 H LYS A 144 17.260 -5.339 5.213 1.00 10.00 H new ATOM 0 HA LYS A 144 17.997 -4.088 2.851 1.00 10.00 H new ATOM 0 HB2 LYS A 144 20.304 -4.399 3.740 1.00 10.00 H new ATOM 0 HB3 LYS A 144 19.168 -3.620 4.824 1.00 10.00 H new ATOM 0 HG2 LYS A 144 19.894 -5.005 6.423 1.00 10.00 H new ATOM 0 HG3 LYS A 144 19.038 -6.295 5.602 1.00 10.00 H new ATOM 0 HD2 LYS A 144 21.086 -7.302 5.562 1.00 10.00 H new ATOM 0 HD3 LYS A 144 21.347 -6.303 4.146 1.00 10.00 H new ATOM 0 HE2 LYS A 144 22.209 -5.644 6.998 1.00 10.00 H new ATOM 0 HE3 LYS A 144 23.262 -6.137 5.687 1.00 10.00 H new ATOM 0 HZ1 LYS A 144 23.490 -3.878 5.701 1.00 10.00 H new ATOM 0 HZ2 LYS A 144 22.300 -4.078 4.506 1.00 10.00 H new ATOM 0 HZ3 LYS A 144 21.858 -3.585 6.069 1.00 10.00 H new