USER MOD reduce.3.24.130724 H: found=0, std=0, add=938, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 937 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 127 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 137 ASN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Set 2.1: A 73 MET CE :methyl -160:sc= -0.0999 (180deg=-0.695) USER MOD Set 2.2: A 112 MET CE :methyl 176:sc= 0 (180deg=-0.0283) USER MOD Set 3.1: A 79 HIS : no HD1:sc= 0 X(o=1.1,f=0.81) USER MOD Set 3.2: A 80 SER OG : rot 2:sc= 1.09 USER MOD Set 4.1: A 52 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 99 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 48 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 108 HIS : no HD1:sc= -0.396 K(o=-0.4,f=-1.8) USER MOD Single : A 29 THR OG1 : rot 40:sc= 0.658 USER MOD Single : A 31 GLN : amide:sc= 0.0444 X(o=0.044,f=0.15) USER MOD Single : A 34 THR OG1 : rot -9:sc= 0.544 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 162:sc= 0.654 USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 31:sc= 0.384 USER MOD Single : A 53 ASN : amide:sc= -2.4! K(o=-2.4!,f=-0.14) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= -0.125 X(o=-0.13,f=-0.087) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot 85:sc= 1.22 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc=-0.00027 USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc=-0.00503 USER MOD Single : A 77 THR OG1 : rot 29:sc= 1.04 USER MOD Single : A 78 THR OG1 : rot -138:sc= 1.28 USER MOD Single : A 83 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 168:sc= 1.27 (180deg=1.19) USER MOD Single : A 88 MET CE :methyl -175:sc= 0 (180deg=-0.0286) USER MOD Single : A 93 THR OG1 : rot 148:sc= 0.331 USER MOD Single : A 101 THR OG1 : rot -174:sc= -0.42 USER MOD Single : A 103 GLN : amide:sc= 0.254 X(o=0.25,f=0) USER MOD Single : A 110 MET CE :methyl -174:sc= 0 (180deg=-0.0387) USER MOD Single : A 115 LYS NZ :NH3+ -151:sc= 0.42 (180deg=0.133) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 ASN : amide:sc=-0.00513 X(o=-0.0051,f=-0.00097) 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 180:sc= 0.0103 USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 369 N VAL A 28 -16.298 6.160 -4.260 1.00 4.04 N ATOM 370 CA VAL A 28 -15.098 5.349 -4.509 1.00 3.24 C ATOM 371 C VAL A 28 -14.410 5.074 -3.168 1.00 3.29 C ATOM 372 O VAL A 28 -14.172 6.004 -2.396 1.00 3.75 O ATOM 373 CB VAL A 28 -14.147 6.088 -5.492 1.00 2.86 C ATOM 374 CG1 VAL A 28 -12.686 5.613 -5.415 1.00 3.53 C ATOM 375 CG2 VAL A 28 -14.643 5.928 -6.941 1.00 2.77 C ATOM 0 HA VAL A 28 -15.371 4.400 -4.971 1.00 3.24 H new ATOM 0 HB VAL A 28 -14.166 7.134 -5.187 1.00 2.86 H new ATOM 0 HG11 VAL A 28 -12.083 6.174 -6.129 1.00 3.53 H new ATOM 0 HG12 VAL A 28 -12.302 5.778 -4.408 1.00 3.53 H new ATOM 0 HG13 VAL A 28 -12.636 4.551 -5.653 1.00 3.53 H new ATOM 0 HG21 VAL A 28 -13.967 6.451 -7.617 1.00 2.77 H new ATOM 0 HG22 VAL A 28 -14.670 4.870 -7.202 1.00 2.77 H new ATOM 0 HG23 VAL A 28 -15.644 6.350 -7.032 1.00 2.77 H new ATOM 385 N THR A 29 -14.033 3.809 -2.919 1.00 3.06 N ATOM 386 CA THR A 29 -13.134 3.426 -1.821 1.00 3.09 C ATOM 387 C THR A 29 -11.690 3.619 -2.273 1.00 2.32 C ATOM 388 O THR A 29 -11.055 2.700 -2.799 1.00 2.84 O ATOM 389 CB THR A 29 -13.399 2.009 -1.289 1.00 3.85 C ATOM 390 OG1 THR A 29 -13.198 1.059 -2.309 1.00 5.09 O ATOM 391 CG2 THR A 29 -14.821 1.849 -0.750 1.00 4.59 C ATOM 0 H THR A 29 -14.347 3.017 -3.480 1.00 3.06 H new ATOM 0 HA THR A 29 -13.332 4.079 -0.971 1.00 3.09 H new ATOM 0 HB THR A 29 -12.698 1.846 -0.470 1.00 3.85 H new ATOM 0 HG1 THR A 29 -12.418 1.314 -2.844 1.00 5.09 H new ATOM 0 HG21 THR A 29 -14.960 0.831 -0.386 1.00 4.59 H new ATOM 0 HG22 THR A 29 -14.982 2.552 0.067 1.00 4.59 H new ATOM 0 HG23 THR A 29 -15.537 2.050 -1.547 1.00 4.59 H new ATOM 399 N VAL A 30 -11.188 4.834 -2.087 1.00 2.10 N ATOM 400 CA VAL A 30 -9.788 5.186 -2.347 1.00 2.49 C ATOM 401 C VAL A 30 -8.966 4.810 -1.119 1.00 2.19 C ATOM 402 O VAL A 30 -9.405 4.983 0.015 1.00 2.49 O ATOM 403 CB VAL A 30 -9.588 6.650 -2.802 1.00 3.84 C ATOM 404 CG1 VAL A 30 -10.145 7.706 -1.838 1.00 4.72 C ATOM 405 CG2 VAL A 30 -8.106 6.949 -3.087 1.00 4.98 C ATOM 0 H VAL A 30 -11.746 5.617 -1.747 1.00 2.10 H new ATOM 0 HA VAL A 30 -9.432 4.613 -3.203 1.00 2.49 H new ATOM 0 HB VAL A 30 -10.173 6.730 -3.718 1.00 3.84 H new ATOM 0 HG11 VAL A 30 -9.958 8.701 -2.241 1.00 4.72 H new ATOM 0 HG12 VAL A 30 -11.218 7.559 -1.718 1.00 4.72 H new ATOM 0 HG13 VAL A 30 -9.655 7.609 -0.869 1.00 4.72 H new ATOM 0 HG21 VAL A 30 -7.999 7.986 -3.405 1.00 4.98 H new ATOM 0 HG22 VAL A 30 -7.521 6.784 -2.182 1.00 4.98 H new ATOM 0 HG23 VAL A 30 -7.747 6.289 -3.876 1.00 4.98 H new ATOM 415 N GLN A 31 -7.809 4.208 -1.381 1.00 2.17 N ATOM 416 CA GLN A 31 -7.013 3.458 -0.418 1.00 2.18 C ATOM 417 C GLN A 31 -6.758 4.183 0.916 1.00 2.14 C ATOM 418 O GLN A 31 -5.843 4.994 1.051 1.00 3.44 O ATOM 419 CB GLN A 31 -5.743 2.949 -1.126 1.00 2.59 C ATOM 420 CG GLN A 31 -4.772 4.012 -1.667 1.00 2.75 C ATOM 421 CD GLN A 31 -3.520 3.348 -2.222 1.00 2.86 C ATOM 422 OE1 GLN A 31 -2.514 3.222 -1.547 1.00 3.71 O ATOM 423 NE2 GLN A 31 -3.542 2.860 -3.441 1.00 2.64 N ATOM 0 H GLN A 31 -7.385 4.231 -2.308 1.00 2.17 H new ATOM 0 HA GLN A 31 -7.595 2.599 -0.085 1.00 2.18 H new ATOM 0 HB2 GLN A 31 -5.197 2.315 -0.428 1.00 2.59 H new ATOM 0 HB3 GLN A 31 -6.050 2.315 -1.958 1.00 2.59 H new ATOM 0 HG2 GLN A 31 -5.259 4.596 -2.448 1.00 2.75 H new ATOM 0 HG3 GLN A 31 -4.502 4.706 -0.871 1.00 2.75 H new ATOM 0 HE21 GLN A 31 -4.379 2.960 -4.015 1.00 2.64 H new ATOM 0 HE22 GLN A 31 -2.722 2.381 -3.814 1.00 2.64 H new ATOM 432 N GLY A 32 -7.556 3.843 1.938 1.00 1.38 N ATOM 433 CA GLY A 32 -7.371 4.304 3.321 1.00 1.52 C ATOM 434 C GLY A 32 -6.223 3.547 3.980 1.00 1.67 C ATOM 435 O GLY A 32 -6.450 2.755 4.895 1.00 2.98 O ATOM 0 H GLY A 32 -8.362 3.229 1.824 1.00 1.38 H new ATOM 0 HA2 GLY A 32 -7.163 5.374 3.331 1.00 1.52 H new ATOM 0 HA3 GLY A 32 -8.289 4.152 3.888 1.00 1.52 H new ATOM 439 N ALA A 33 -5.013 3.759 3.442 1.00 1.12 N ATOM 440 CA ALA A 33 -3.815 2.930 3.580 1.00 1.06 C ATOM 441 C ALA A 33 -3.607 2.414 5.011 1.00 0.99 C ATOM 442 O ALA A 33 -3.069 3.128 5.859 1.00 1.25 O ATOM 443 CB ALA A 33 -2.618 3.741 3.058 1.00 1.39 C ATOM 0 H ALA A 33 -4.837 4.576 2.857 1.00 1.12 H new ATOM 0 HA ALA A 33 -3.929 2.024 2.985 1.00 1.06 H new ATOM 0 HB1 ALA A 33 -1.709 3.147 3.149 1.00 1.39 H new ATOM 0 HB2 ALA A 33 -2.781 3.998 2.011 1.00 1.39 H new ATOM 0 HB3 ALA A 33 -2.514 4.655 3.644 1.00 1.39 H new ATOM 449 N THR A 34 -4.071 1.180 5.267 1.00 0.91 N ATOM 450 CA THR A 34 -4.145 0.618 6.614 1.00 0.87 C ATOM 451 C THR A 34 -2.861 -0.126 6.893 1.00 0.79 C ATOM 452 O THR A 34 -2.493 -1.026 6.147 1.00 0.94 O ATOM 453 CB THR A 34 -5.325 -0.348 6.772 1.00 1.04 C ATOM 454 OG1 THR A 34 -6.490 0.186 6.187 1.00 1.47 O ATOM 455 CG2 THR A 34 -5.630 -0.637 8.242 1.00 1.39 C ATOM 0 H THR A 34 -4.405 0.547 4.540 1.00 0.91 H new ATOM 0 HA THR A 34 -4.291 1.438 7.318 1.00 0.87 H new ATOM 0 HB THR A 34 -5.036 -1.273 6.272 1.00 1.04 H new ATOM 0 HG1 THR A 34 -6.328 1.117 5.927 1.00 1.47 H new ATOM 0 HG21 THR A 34 -6.472 -1.325 8.310 1.00 1.39 H new ATOM 0 HG22 THR A 34 -4.756 -1.086 8.714 1.00 1.39 H new ATOM 0 HG23 THR A 34 -5.880 0.294 8.752 1.00 1.39 H new ATOM 463 N VAL A 35 -2.205 0.212 7.992 1.00 0.66 N ATOM 464 CA VAL A 35 -1.047 -0.560 8.489 1.00 0.60 C ATOM 465 C VAL A 35 -1.558 -1.736 9.316 1.00 0.61 C ATOM 466 O VAL A 35 -2.571 -1.600 10.005 1.00 0.68 O ATOM 467 CB VAL A 35 -0.069 0.247 9.371 1.00 0.66 C ATOM 468 CG1 VAL A 35 1.346 -0.364 9.347 1.00 0.73 C ATOM 469 CG2 VAL A 35 0.051 1.721 8.949 1.00 1.01 C ATOM 0 H VAL A 35 -2.447 1.018 8.568 1.00 0.66 H new ATOM 0 HA VAL A 35 -0.494 -0.873 7.603 1.00 0.60 H new ATOM 0 HB VAL A 35 -0.492 0.201 10.375 1.00 0.66 H new ATOM 0 HG11 VAL A 35 2.009 0.228 9.978 1.00 0.73 H new ATOM 0 HG12 VAL A 35 1.307 -1.387 9.721 1.00 0.73 H new ATOM 0 HG13 VAL A 35 1.724 -0.366 8.325 1.00 0.73 H new ATOM 0 HG21 VAL A 35 0.753 2.232 9.608 1.00 1.01 H new ATOM 0 HG22 VAL A 35 0.411 1.777 7.922 1.00 1.01 H new ATOM 0 HG23 VAL A 35 -0.926 2.200 9.018 1.00 1.01 H new ATOM 479 N ALA A 36 -0.829 -2.853 9.313 1.00 0.64 N ATOM 480 CA ALA A 36 -0.963 -3.870 10.348 1.00 0.78 C ATOM 481 C ALA A 36 -0.424 -3.368 11.699 1.00 0.87 C ATOM 482 O ALA A 36 0.779 -3.156 11.873 1.00 1.53 O ATOM 483 CB ALA A 36 -0.286 -5.174 9.908 1.00 0.95 C ATOM 0 H ALA A 36 -0.136 -3.074 8.598 1.00 0.64 H new ATOM 0 HA ALA A 36 -2.023 -4.079 10.491 1.00 0.78 H new ATOM 0 HB1 ALA A 36 -0.395 -5.923 10.692 1.00 0.95 H new ATOM 0 HB2 ALA A 36 -0.754 -5.536 8.993 1.00 0.95 H new ATOM 0 HB3 ALA A 36 0.773 -4.991 9.726 1.00 0.95 H new ATOM 489 N ALA A 37 -1.321 -3.228 12.669 1.00 0.76 N ATOM 490 CA ALA A 37 -0.987 -3.132 14.084 1.00 0.88 C ATOM 491 C ALA A 37 -0.221 -4.388 14.558 1.00 0.92 C ATOM 492 O ALA A 37 -0.522 -5.513 14.157 1.00 1.01 O ATOM 493 CB ALA A 37 -2.279 -2.905 14.878 1.00 1.07 C ATOM 0 H ALA A 37 -2.324 -3.177 12.488 1.00 0.76 H new ATOM 0 HA ALA A 37 -0.320 -2.287 14.254 1.00 0.88 H new ATOM 0 HB1 ALA A 37 -2.045 -2.831 15.940 1.00 1.07 H new ATOM 0 HB2 ALA A 37 -2.753 -1.981 14.546 1.00 1.07 H new ATOM 0 HB3 ALA A 37 -2.959 -3.741 14.714 1.00 1.07 H new ATOM 499 N VAL A 38 0.758 -4.197 15.440 1.00 1.02 N ATOM 500 CA VAL A 38 1.656 -5.244 15.974 1.00 1.10 C ATOM 501 C VAL A 38 1.969 -4.950 17.455 1.00 1.39 C ATOM 502 O VAL A 38 1.888 -3.782 17.848 1.00 1.63 O ATOM 503 CB VAL A 38 2.982 -5.333 15.174 1.00 1.07 C ATOM 504 CG1 VAL A 38 2.774 -6.062 13.836 1.00 2.17 C ATOM 505 CG2 VAL A 38 3.640 -3.962 14.924 1.00 1.98 C ATOM 0 H VAL A 38 0.964 -3.275 15.824 1.00 1.02 H new ATOM 0 HA VAL A 38 1.143 -6.201 15.879 1.00 1.10 H new ATOM 0 HB VAL A 38 3.665 -5.907 15.801 1.00 1.07 H new ATOM 0 HG11 VAL A 38 3.720 -6.110 13.297 1.00 2.17 H new ATOM 0 HG12 VAL A 38 2.413 -7.073 14.025 1.00 2.17 H new ATOM 0 HG13 VAL A 38 2.042 -5.521 13.237 1.00 2.17 H new ATOM 0 HG21 VAL A 38 4.562 -4.099 14.360 1.00 1.98 H new ATOM 0 HG22 VAL A 38 2.958 -3.329 14.356 1.00 1.98 H new ATOM 0 HG23 VAL A 38 3.866 -3.487 15.879 1.00 1.98 H new ATOM 515 N PRO A 39 2.281 -5.971 18.284 1.00 1.50 N ATOM 516 CA PRO A 39 2.576 -5.775 19.700 1.00 1.83 C ATOM 517 C PRO A 39 3.938 -5.081 19.920 1.00 1.87 C ATOM 518 O PRO A 39 4.714 -4.945 18.971 1.00 1.64 O ATOM 519 CB PRO A 39 2.520 -7.180 20.317 1.00 1.95 C ATOM 520 CG PRO A 39 2.879 -8.108 19.165 1.00 1.67 C ATOM 521 CD PRO A 39 2.307 -7.388 17.946 1.00 1.43 C ATOM 0 HA PRO A 39 1.858 -5.106 20.175 1.00 1.83 H new ATOM 0 HB2 PRO A 39 3.224 -7.280 21.143 1.00 1.95 H new ATOM 0 HB3 PRO A 39 1.529 -7.402 20.713 1.00 1.95 H new ATOM 0 HG2 PRO A 39 3.957 -8.248 19.081 1.00 1.67 H new ATOM 0 HG3 PRO A 39 2.438 -9.097 19.292 1.00 1.67 H new ATOM 0 HD2 PRO A 39 2.923 -7.566 17.064 1.00 1.43 H new ATOM 0 HD3 PRO A 39 1.306 -7.751 17.714 1.00 1.43 H new ATOM 529 N PRO A 40 4.239 -4.645 21.164 1.00 2.31 N ATOM 530 CA PRO A 40 5.560 -4.156 21.551 1.00 2.56 C ATOM 531 C PRO A 40 6.604 -5.277 21.515 1.00 2.61 C ATOM 532 O PRO A 40 6.253 -6.458 21.536 1.00 3.73 O ATOM 533 CB PRO A 40 5.394 -3.560 22.952 1.00 3.05 C ATOM 534 CG PRO A 40 4.229 -4.355 23.532 1.00 3.14 C ATOM 535 CD PRO A 40 3.340 -4.591 22.312 1.00 2.71 C ATOM 0 HA PRO A 40 5.928 -3.403 20.854 1.00 2.56 H new ATOM 0 HB2 PRO A 40 6.298 -3.677 23.549 1.00 3.05 H new ATOM 0 HB3 PRO A 40 5.174 -2.493 22.912 1.00 3.05 H new ATOM 0 HG2 PRO A 40 4.561 -5.293 23.978 1.00 3.14 H new ATOM 0 HG3 PRO A 40 3.708 -3.799 24.311 1.00 3.14 H new ATOM 0 HD2 PRO A 40 2.779 -5.520 22.412 1.00 2.71 H new ATOM 0 HD3 PRO A 40 2.611 -3.789 22.199 1.00 2.71 H new ATOM 543 N SER A 41 7.887 -4.896 21.451 1.00 2.09 N ATOM 544 CA SER A 41 9.046 -5.801 21.300 1.00 2.18 C ATOM 545 C SER A 41 9.191 -6.299 19.843 1.00 2.06 C ATOM 546 O SER A 41 9.715 -7.379 19.582 1.00 2.47 O ATOM 547 CB SER A 41 9.014 -6.941 22.337 1.00 2.41 C ATOM 548 OG SER A 41 10.315 -7.281 22.794 1.00 2.80 O ATOM 0 H SER A 41 8.161 -3.915 21.504 1.00 2.09 H new ATOM 0 HA SER A 41 9.950 -5.230 21.512 1.00 2.18 H new ATOM 0 HB2 SER A 41 8.398 -6.642 23.185 1.00 2.41 H new ATOM 0 HB3 SER A 41 8.544 -7.820 21.896 1.00 2.41 H new ATOM 0 HG SER A 41 10.252 -8.006 23.451 1.00 2.80 H new ATOM 554 N ILE A 42 8.678 -5.532 18.869 1.00 1.80 N ATOM 555 CA ILE A 42 8.624 -5.864 17.434 1.00 1.71 C ATOM 556 C ILE A 42 9.313 -4.783 16.577 1.00 1.68 C ATOM 557 O ILE A 42 9.487 -3.647 17.022 1.00 2.37 O ATOM 558 CB ILE A 42 7.146 -6.095 17.025 1.00 1.85 C ATOM 559 CG1 ILE A 42 6.478 -7.244 17.815 1.00 2.11 C ATOM 560 CG2 ILE A 42 6.937 -6.333 15.518 1.00 1.89 C ATOM 561 CD1 ILE A 42 7.031 -8.655 17.558 1.00 2.37 C ATOM 0 H ILE A 42 8.269 -4.619 19.069 1.00 1.80 H new ATOM 0 HA ILE A 42 9.180 -6.784 17.252 1.00 1.71 H new ATOM 0 HB ILE A 42 6.661 -5.153 17.282 1.00 1.85 H new ATOM 0 HG12 ILE A 42 6.572 -7.028 18.879 1.00 2.11 H new ATOM 0 HG13 ILE A 42 5.413 -7.246 17.583 1.00 2.11 H new ATOM 0 HG21 ILE A 42 5.877 -6.486 15.317 1.00 1.89 H new ATOM 0 HG22 ILE A 42 7.291 -5.466 14.960 1.00 1.89 H new ATOM 0 HG23 ILE A 42 7.496 -7.216 15.208 1.00 1.89 H new ATOM 0 HD11 ILE A 42 6.485 -9.376 18.167 1.00 2.37 H new ATOM 0 HD12 ILE A 42 6.912 -8.906 16.504 1.00 2.37 H new ATOM 0 HD13 ILE A 42 8.088 -8.685 17.821 1.00 2.37 H new ATOM 573 N ARG A 43 9.714 -5.170 15.357 1.00 1.30 N ATOM 574 CA ARG A 43 10.503 -4.400 14.371 1.00 1.36 C ATOM 575 C ARG A 43 10.115 -4.692 12.898 1.00 1.23 C ATOM 576 O ARG A 43 10.861 -4.345 11.984 1.00 1.43 O ATOM 577 CB ARG A 43 11.999 -4.678 14.614 1.00 1.84 C ATOM 578 CG ARG A 43 12.356 -6.179 14.598 1.00 2.86 C ATOM 579 CD ARG A 43 13.875 -6.341 14.586 1.00 3.42 C ATOM 580 NE ARG A 43 14.311 -7.720 14.862 1.00 4.25 N ATOM 581 CZ ARG A 43 15.576 -8.076 15.060 1.00 4.71 C ATOM 582 NH1 ARG A 43 16.563 -7.220 14.894 1.00 4.68 N ATOM 583 NH2 ARG A 43 15.866 -9.319 15.361 1.00 5.60 N ATOM 0 H ARG A 43 9.480 -6.098 15.003 1.00 1.30 H new ATOM 0 HA ARG A 43 10.281 -3.343 14.520 1.00 1.36 H new ATOM 0 HB2 ARG A 43 12.584 -4.165 13.851 1.00 1.84 H new ATOM 0 HB3 ARG A 43 12.288 -4.254 15.576 1.00 1.84 H new ATOM 0 HG2 ARG A 43 11.934 -6.674 15.473 1.00 2.86 H new ATOM 0 HG3 ARG A 43 11.922 -6.658 13.720 1.00 2.86 H new ATOM 0 HD2 ARG A 43 14.260 -6.032 13.614 1.00 3.42 H new ATOM 0 HD3 ARG A 43 14.312 -5.673 15.328 1.00 3.42 H new ATOM 0 HE ARG A 43 13.597 -8.448 14.904 1.00 4.25 H new ATOM 0 HH11 ARG A 43 16.364 -6.261 14.608 1.00 4.68 H new ATOM 0 HH12 ARG A 43 17.526 -7.516 15.052 1.00 4.68 H new ATOM 0 HH21 ARG A 43 15.121 -10.011 15.443 1.00 5.60 H new ATOM 0 HH22 ARG A 43 16.836 -9.594 15.513 1.00 5.60 H new ATOM 597 N ASP A 44 8.934 -5.267 12.665 1.00 1.08 N ATOM 598 CA ASP A 44 8.401 -5.605 11.343 1.00 1.06 C ATOM 599 C ASP A 44 6.879 -5.399 11.326 1.00 0.98 C ATOM 600 O ASP A 44 6.226 -5.551 12.360 1.00 1.24 O ATOM 601 CB ASP A 44 8.729 -7.070 11.007 1.00 1.26 C ATOM 602 CG ASP A 44 10.223 -7.292 10.762 1.00 1.39 C ATOM 603 OD1 ASP A 44 10.734 -6.827 9.722 1.00 1.91 O ATOM 604 OD2 ASP A 44 10.902 -7.910 11.618 1.00 2.33 O ATOM 0 H ASP A 44 8.298 -5.520 13.421 1.00 1.08 H new ATOM 0 HA ASP A 44 8.859 -4.955 10.598 1.00 1.06 H new ATOM 0 HB2 ASP A 44 8.399 -7.710 11.825 1.00 1.26 H new ATOM 0 HB3 ASP A 44 8.170 -7.371 10.121 1.00 1.26 H new ATOM 609 N THR A 45 6.337 -5.087 10.143 1.00 0.86 N ATOM 610 CA THR A 45 4.907 -4.981 9.808 1.00 0.76 C ATOM 611 C THR A 45 4.727 -4.731 8.298 1.00 0.65 C ATOM 612 O THR A 45 5.695 -4.778 7.536 1.00 0.83 O ATOM 613 CB THR A 45 4.127 -4.017 10.728 1.00 1.01 C ATOM 614 OG1 THR A 45 2.769 -4.292 10.509 1.00 2.40 O ATOM 615 CG2 THR A 45 4.394 -2.530 10.479 1.00 1.24 C ATOM 0 H THR A 45 6.926 -4.887 9.335 1.00 0.86 H new ATOM 0 HA THR A 45 4.437 -5.942 10.018 1.00 0.76 H new ATOM 0 HB THR A 45 4.451 -4.186 11.755 1.00 1.01 H new ATOM 0 HG1 THR A 45 2.238 -3.929 11.249 1.00 2.40 H new ATOM 0 HG21 THR A 45 3.802 -1.933 11.172 1.00 1.24 H new ATOM 0 HG22 THR A 45 5.453 -2.320 10.632 1.00 1.24 H new ATOM 0 HG23 THR A 45 4.118 -2.277 9.455 1.00 1.24 H new ATOM 623 N ALA A 46 3.492 -4.489 7.854 1.00 0.80 N ATOM 624 CA ALA A 46 3.050 -4.342 6.466 1.00 0.93 C ATOM 625 C ALA A 46 1.777 -3.482 6.370 1.00 0.77 C ATOM 626 O ALA A 46 1.157 -3.229 7.398 1.00 0.81 O ATOM 627 CB ALA A 46 2.867 -5.755 5.887 1.00 1.20 C ATOM 0 H ALA A 46 2.715 -4.383 8.506 1.00 0.80 H new ATOM 0 HA ALA A 46 3.796 -3.809 5.876 1.00 0.93 H new ATOM 0 HB1 ALA A 46 2.537 -5.684 4.851 1.00 1.20 H new ATOM 0 HB2 ALA A 46 3.815 -6.291 5.930 1.00 1.20 H new ATOM 0 HB3 ALA A 46 2.119 -6.293 6.470 1.00 1.20 H new ATOM 633 N ALA A 47 1.393 -3.042 5.169 1.00 0.78 N ATOM 634 CA ALA A 47 0.179 -2.267 4.929 1.00 0.71 C ATOM 635 C ALA A 47 -0.689 -2.894 3.832 1.00 0.77 C ATOM 636 O ALA A 47 -0.212 -3.393 2.813 1.00 0.95 O ATOM 637 CB ALA A 47 0.517 -0.796 4.669 1.00 0.81 C ATOM 0 H ALA A 47 1.930 -3.220 4.320 1.00 0.78 H new ATOM 0 HA ALA A 47 -0.430 -2.293 5.833 1.00 0.71 H new ATOM 0 HB1 ALA A 47 -0.402 -0.237 4.493 1.00 0.81 H new ATOM 0 HB2 ALA A 47 1.033 -0.382 5.536 1.00 0.81 H new ATOM 0 HB3 ALA A 47 1.161 -0.720 3.793 1.00 0.81 H new ATOM 643 N TYR A 48 -1.994 -2.852 4.070 1.00 0.87 N ATOM 644 CA TYR A 48 -3.049 -3.661 3.466 1.00 1.18 C ATOM 645 C TYR A 48 -4.160 -2.723 2.963 1.00 1.31 C ATOM 646 O TYR A 48 -4.889 -2.139 3.767 1.00 1.85 O ATOM 647 CB TYR A 48 -3.648 -4.598 4.551 1.00 1.61 C ATOM 648 CG TYR A 48 -2.707 -5.590 5.216 1.00 1.84 C ATOM 649 CD1 TYR A 48 -1.700 -5.139 6.091 1.00 3.14 C ATOM 650 CD2 TYR A 48 -2.876 -6.976 5.019 1.00 2.54 C ATOM 651 CE1 TYR A 48 -0.789 -6.044 6.660 1.00 3.98 C ATOM 652 CE2 TYR A 48 -2.005 -7.889 5.645 1.00 3.29 C ATOM 653 CZ TYR A 48 -0.934 -7.425 6.442 1.00 3.72 C ATOM 654 OH TYR A 48 -0.039 -8.293 6.990 1.00 4.83 O ATOM 0 H TYR A 48 -2.376 -2.194 4.750 1.00 0.87 H new ATOM 0 HA TYR A 48 -2.645 -4.249 2.642 1.00 1.18 H new ATOM 0 HB2 TYR A 48 -4.085 -3.974 5.331 1.00 1.61 H new ATOM 0 HB3 TYR A 48 -4.464 -5.160 4.097 1.00 1.61 H new ATOM 0 HD1 TYR A 48 -1.628 -4.088 6.327 1.00 3.14 H new ATOM 0 HD2 TYR A 48 -3.674 -7.338 4.388 1.00 2.54 H new ATOM 0 HE1 TYR A 48 0.026 -5.678 7.267 1.00 3.98 H new ATOM 0 HE2 TYR A 48 -2.157 -8.950 5.515 1.00 3.29 H new ATOM 0 HH TYR A 48 -0.281 -9.210 6.745 1.00 4.83 H new ATOM 664 N MET A 49 -4.332 -2.562 1.646 1.00 1.06 N ATOM 665 CA MET A 49 -5.362 -1.654 1.117 1.00 1.37 C ATOM 666 C MET A 49 -5.860 -1.971 -0.300 1.00 1.12 C ATOM 667 O MET A 49 -5.240 -2.705 -1.067 1.00 1.12 O ATOM 668 CB MET A 49 -4.907 -0.183 1.267 1.00 1.95 C ATOM 669 CG MET A 49 -3.526 0.135 0.668 1.00 2.14 C ATOM 670 SD MET A 49 -2.140 -0.049 1.818 1.00 3.76 S ATOM 671 CE MET A 49 -0.908 0.938 0.934 1.00 4.57 C ATOM 0 H MET A 49 -3.781 -3.040 0.933 1.00 1.06 H new ATOM 0 HA MET A 49 -6.246 -1.822 1.733 1.00 1.37 H new ATOM 0 HB2 MET A 49 -5.648 0.461 0.794 1.00 1.95 H new ATOM 0 HB3 MET A 49 -4.894 0.071 2.327 1.00 1.95 H new ATOM 0 HG2 MET A 49 -3.358 -0.517 -0.189 1.00 2.14 H new ATOM 0 HG3 MET A 49 -3.535 1.158 0.293 1.00 2.14 H new ATOM 0 HE1 MET A 49 0.026 0.943 1.496 1.00 4.57 H new ATOM 0 HE2 MET A 49 -0.736 0.507 -0.052 1.00 4.57 H new ATOM 0 HE3 MET A 49 -1.271 1.960 0.825 1.00 4.57 H new ATOM 681 N THR A 50 -7.001 -1.369 -0.627 1.00 1.18 N ATOM 682 CA THR A 50 -7.677 -1.404 -1.921 1.00 1.09 C ATOM 683 C THR A 50 -7.734 -0.003 -2.499 1.00 1.45 C ATOM 684 O THR A 50 -8.079 0.924 -1.774 1.00 1.78 O ATOM 685 CB THR A 50 -9.121 -1.876 -1.727 1.00 1.33 C ATOM 686 OG1 THR A 50 -9.705 -1.150 -0.671 1.00 2.79 O ATOM 687 CG2 THR A 50 -9.229 -3.363 -1.398 1.00 1.79 C ATOM 0 H THR A 50 -7.513 -0.805 0.052 1.00 1.18 H new ATOM 0 HA THR A 50 -7.133 -2.076 -2.585 1.00 1.09 H new ATOM 0 HB THR A 50 -9.637 -1.707 -2.672 1.00 1.33 H new ATOM 0 HG1 THR A 50 -9.307 -0.255 -0.630 1.00 2.79 H new ATOM 0 HG21 THR A 50 -10.278 -3.633 -1.273 1.00 1.79 H new ATOM 0 HG22 THR A 50 -8.798 -3.948 -2.211 1.00 1.79 H new ATOM 0 HG23 THR A 50 -8.688 -3.572 -0.475 1.00 1.79 H new ATOM 695 N LEU A 51 -7.548 0.145 -3.807 1.00 1.63 N ATOM 696 CA LEU A 51 -8.241 1.195 -4.565 1.00 1.71 C ATOM 697 C LEU A 51 -9.439 0.552 -5.290 1.00 1.57 C ATOM 698 O LEU A 51 -9.656 -0.654 -5.158 1.00 1.94 O ATOM 699 CB LEU A 51 -7.244 1.917 -5.504 1.00 2.10 C ATOM 700 CG LEU A 51 -7.248 3.453 -5.344 1.00 2.89 C ATOM 701 CD1 LEU A 51 -6.068 4.076 -6.101 1.00 4.07 C ATOM 702 CD2 LEU A 51 -8.549 4.097 -5.843 1.00 3.28 C ATOM 0 H LEU A 51 -6.929 -0.442 -4.366 1.00 1.63 H new ATOM 0 HA LEU A 51 -8.636 1.972 -3.910 1.00 1.71 H new ATOM 0 HB2 LEU A 51 -6.239 1.542 -5.311 1.00 2.10 H new ATOM 0 HB3 LEU A 51 -7.484 1.667 -6.537 1.00 2.10 H new ATOM 0 HG LEU A 51 -7.160 3.649 -4.275 1.00 2.89 H new ATOM 0 HD11 LEU A 51 -6.087 5.159 -5.977 1.00 4.07 H new ATOM 0 HD12 LEU A 51 -5.132 3.682 -5.704 1.00 4.07 H new ATOM 0 HD13 LEU A 51 -6.145 3.831 -7.160 1.00 4.07 H new ATOM 0 HD21 LEU A 51 -8.496 5.177 -5.706 1.00 3.28 H new ATOM 0 HD22 LEU A 51 -8.684 3.871 -6.901 1.00 3.28 H new ATOM 0 HD23 LEU A 51 -9.392 3.700 -5.277 1.00 3.28 H new ATOM 714 N THR A 52 -10.207 1.349 -6.039 1.00 1.95 N ATOM 715 CA THR A 52 -11.379 0.948 -6.823 1.00 2.10 C ATOM 716 C THR A 52 -11.769 2.098 -7.739 1.00 2.21 C ATOM 717 O THR A 52 -11.499 3.255 -7.418 1.00 2.74 O ATOM 718 CB THR A 52 -12.528 0.480 -5.907 1.00 2.28 C ATOM 719 OG1 THR A 52 -13.305 -0.469 -6.592 1.00 2.69 O ATOM 720 CG2 THR A 52 -13.465 1.589 -5.429 1.00 2.60 C ATOM 0 H THR A 52 -10.017 2.348 -6.119 1.00 1.95 H new ATOM 0 HA THR A 52 -11.140 0.087 -7.447 1.00 2.10 H new ATOM 0 HB THR A 52 -12.042 0.072 -5.020 1.00 2.28 H new ATOM 0 HG1 THR A 52 -14.036 -0.772 -6.014 1.00 2.69 H new ATOM 0 HG21 THR A 52 -14.239 1.162 -4.792 1.00 2.60 H new ATOM 0 HG22 THR A 52 -12.896 2.327 -4.864 1.00 2.60 H new ATOM 0 HG23 THR A 52 -13.929 2.070 -6.290 1.00 2.60 H new ATOM 728 N ASN A 53 -12.432 1.771 -8.843 1.00 1.88 N ATOM 729 CA ASN A 53 -13.015 2.753 -9.751 1.00 1.93 C ATOM 730 C ASN A 53 -14.511 2.467 -9.933 1.00 2.01 C ATOM 731 O ASN A 53 -14.885 1.326 -10.195 1.00 2.17 O ATOM 732 CB ASN A 53 -12.321 2.654 -11.113 1.00 1.99 C ATOM 733 CG ASN A 53 -10.826 2.933 -11.095 1.00 2.63 C ATOM 734 OD1 ASN A 53 -10.286 3.646 -10.266 1.00 3.78 O ATOM 735 ND2 ASN A 53 -10.143 2.369 -12.070 1.00 2.82 N ATOM 0 H ASN A 53 -12.582 0.806 -9.136 1.00 1.88 H new ATOM 0 HA ASN A 53 -12.882 3.752 -9.335 1.00 1.93 H new ATOM 0 HB2 ASN A 53 -12.484 1.654 -11.515 1.00 1.99 H new ATOM 0 HB3 ASN A 53 -12.798 3.355 -11.799 1.00 1.99 H new ATOM 0 HD21 ASN A 53 -9.138 2.524 -12.145 1.00 2.82 H new ATOM 0 HD22 ASN A 53 -10.619 1.777 -12.750 1.00 2.82 H new ATOM 742 N LYS A 54 -15.370 3.491 -9.852 1.00 2.08 N ATOM 743 CA LYS A 54 -16.794 3.402 -10.237 1.00 2.31 C ATOM 744 C LYS A 54 -17.203 4.465 -11.289 1.00 2.32 C ATOM 745 O LYS A 54 -18.388 4.733 -11.500 1.00 2.49 O ATOM 746 CB LYS A 54 -17.683 3.409 -8.971 1.00 2.64 C ATOM 747 CG LYS A 54 -18.873 2.454 -9.171 1.00 3.06 C ATOM 748 CD LYS A 54 -19.875 2.458 -8.010 1.00 3.57 C ATOM 749 CE LYS A 54 -20.947 1.403 -8.315 1.00 4.36 C ATOM 750 NZ LYS A 54 -22.123 1.517 -7.430 1.00 4.78 N ATOM 0 H LYS A 54 -15.099 4.415 -9.515 1.00 2.08 H new ATOM 0 HA LYS A 54 -16.953 2.451 -10.745 1.00 2.31 H new ATOM 0 HB2 LYS A 54 -17.100 3.102 -8.103 1.00 2.64 H new ATOM 0 HB3 LYS A 54 -18.043 4.419 -8.773 1.00 2.64 H new ATOM 0 HG2 LYS A 54 -19.394 2.726 -10.089 1.00 3.06 H new ATOM 0 HG3 LYS A 54 -18.494 1.441 -9.308 1.00 3.06 H new ATOM 0 HD2 LYS A 54 -19.372 2.231 -7.070 1.00 3.57 H new ATOM 0 HD3 LYS A 54 -20.328 3.443 -7.900 1.00 3.57 H new ATOM 0 HE2 LYS A 54 -21.266 1.504 -9.352 1.00 4.36 H new ATOM 0 HE3 LYS A 54 -20.513 0.409 -8.210 1.00 4.36 H new ATOM 0 HZ1 LYS A 54 -22.816 0.782 -7.678 1.00 4.78 H new ATOM 0 HZ2 LYS A 54 -21.826 1.394 -6.441 1.00 4.78 H new ATOM 0 HZ3 LYS A 54 -22.556 2.455 -7.547 1.00 4.78 H new ATOM 764 N SER A 55 -16.206 5.026 -11.969 1.00 2.44 N ATOM 765 CA SER A 55 -16.305 5.981 -13.070 1.00 2.66 C ATOM 766 C SER A 55 -15.080 5.782 -13.988 1.00 2.67 C ATOM 767 O SER A 55 -14.207 4.953 -13.720 1.00 2.92 O ATOM 768 CB SER A 55 -16.376 7.433 -12.549 1.00 2.96 C ATOM 769 OG SER A 55 -17.513 7.696 -11.747 1.00 3.02 O ATOM 0 H SER A 55 -15.234 4.808 -11.748 1.00 2.44 H new ATOM 0 HA SER A 55 -17.224 5.803 -13.629 1.00 2.66 H new ATOM 0 HB2 SER A 55 -15.477 7.646 -11.970 1.00 2.96 H new ATOM 0 HB3 SER A 55 -16.377 8.115 -13.399 1.00 2.96 H new ATOM 0 HG SER A 55 -17.495 8.630 -11.450 1.00 3.02 H new ATOM 775 N ASP A 56 -14.995 6.554 -15.074 1.00 2.81 N ATOM 776 CA ASP A 56 -14.110 6.419 -16.246 1.00 2.85 C ATOM 777 C ASP A 56 -12.628 6.796 -16.004 1.00 2.70 C ATOM 778 O ASP A 56 -12.029 7.523 -16.795 1.00 3.16 O ATOM 779 CB ASP A 56 -14.740 7.288 -17.366 1.00 3.57 C ATOM 780 CG ASP A 56 -14.800 8.792 -17.010 1.00 5.37 C ATOM 781 OD1 ASP A 56 -15.523 9.131 -16.035 1.00 6.09 O ATOM 782 OD2 ASP A 56 -14.120 9.603 -17.681 1.00 6.74 O ATOM 0 H ASP A 56 -15.600 7.369 -15.169 1.00 2.81 H new ATOM 0 HA ASP A 56 -14.052 5.364 -16.516 1.00 2.85 H new ATOM 0 HB2 ASP A 56 -14.164 7.161 -18.283 1.00 3.57 H new ATOM 0 HB3 ASP A 56 -15.749 6.929 -17.571 1.00 3.57 H new ATOM 787 N GLN A 57 -12.050 6.359 -14.885 1.00 2.32 N ATOM 788 CA GLN A 57 -10.788 6.887 -14.362 1.00 2.46 C ATOM 789 C GLN A 57 -9.676 5.818 -14.316 1.00 2.34 C ATOM 790 O GLN A 57 -9.404 5.269 -13.248 1.00 2.54 O ATOM 791 CB GLN A 57 -11.079 7.509 -12.978 1.00 2.71 C ATOM 792 CG GLN A 57 -12.132 8.638 -13.022 1.00 2.81 C ATOM 793 CD GLN A 57 -11.742 9.756 -13.984 1.00 3.90 C ATOM 794 OE1 GLN A 57 -10.622 10.242 -13.968 1.00 4.66 O ATOM 795 NE2 GLN A 57 -12.603 10.182 -14.886 1.00 4.77 N ATOM 0 H GLN A 57 -12.450 5.619 -14.308 1.00 2.32 H new ATOM 0 HA GLN A 57 -10.400 7.654 -15.032 1.00 2.46 H new ATOM 0 HB2 GLN A 57 -11.424 6.727 -12.302 1.00 2.71 H new ATOM 0 HB3 GLN A 57 -10.151 7.903 -12.563 1.00 2.71 H new ATOM 0 HG2 GLN A 57 -13.094 8.223 -13.322 1.00 2.81 H new ATOM 0 HG3 GLN A 57 -12.261 9.051 -12.022 1.00 2.81 H new ATOM 0 HE21 GLN A 57 -13.544 9.790 -14.918 1.00 4.77 H new ATOM 0 HE22 GLN A 57 -12.328 10.904 -15.552 1.00 4.77 H new ATOM 804 N PRO A 58 -9.011 5.505 -15.451 1.00 2.25 N ATOM 805 CA PRO A 58 -7.900 4.560 -15.510 1.00 2.48 C ATOM 806 C PRO A 58 -6.605 5.230 -15.017 1.00 2.87 C ATOM 807 O PRO A 58 -5.761 5.657 -15.804 1.00 3.87 O ATOM 808 CB PRO A 58 -7.833 4.107 -16.970 1.00 2.53 C ATOM 809 CG PRO A 58 -8.269 5.362 -17.730 1.00 2.40 C ATOM 810 CD PRO A 58 -9.314 5.981 -16.797 1.00 2.17 C ATOM 0 HA PRO A 58 -8.036 3.697 -14.859 1.00 2.48 H new ATOM 0 HB2 PRO A 58 -6.828 3.792 -17.251 1.00 2.53 H new ATOM 0 HB3 PRO A 58 -8.497 3.265 -17.164 1.00 2.53 H new ATOM 0 HG2 PRO A 58 -7.433 6.039 -17.906 1.00 2.40 H new ATOM 0 HG3 PRO A 58 -8.692 5.118 -18.705 1.00 2.40 H new ATOM 0 HD2 PRO A 58 -9.275 7.069 -16.840 1.00 2.17 H new ATOM 0 HD3 PRO A 58 -10.321 5.686 -17.094 1.00 2.17 H new ATOM 818 N ILE A 59 -6.467 5.356 -13.695 1.00 2.20 N ATOM 819 CA ILE A 59 -5.353 6.072 -13.048 1.00 2.38 C ATOM 820 C ILE A 59 -4.119 5.177 -12.895 1.00 2.40 C ATOM 821 O ILE A 59 -4.148 4.146 -12.219 1.00 2.47 O ATOM 822 CB ILE A 59 -5.793 6.655 -11.683 1.00 2.48 C ATOM 823 CG1 ILE A 59 -7.021 7.593 -11.786 1.00 2.81 C ATOM 824 CG2 ILE A 59 -4.629 7.394 -10.991 1.00 2.97 C ATOM 825 CD1 ILE A 59 -6.888 8.764 -12.772 1.00 4.10 C ATOM 0 H ILE A 59 -7.132 4.960 -13.031 1.00 2.20 H new ATOM 0 HA ILE A 59 -5.072 6.901 -13.697 1.00 2.38 H new ATOM 0 HB ILE A 59 -6.090 5.798 -11.078 1.00 2.48 H new ATOM 0 HG12 ILE A 59 -7.887 6.997 -12.074 1.00 2.81 H new ATOM 0 HG13 ILE A 59 -7.229 7.998 -10.796 1.00 2.81 H new ATOM 0 HG21 ILE A 59 -4.968 7.792 -10.035 1.00 2.97 H new ATOM 0 HG22 ILE A 59 -3.806 6.700 -10.823 1.00 2.97 H new ATOM 0 HG23 ILE A 59 -4.289 8.213 -11.625 1.00 2.97 H new ATOM 0 HD11 ILE A 59 -7.805 9.354 -12.762 1.00 4.10 H new ATOM 0 HD12 ILE A 59 -6.048 9.394 -12.478 1.00 4.10 H new ATOM 0 HD13 ILE A 59 -6.717 8.376 -13.776 1.00 4.10 H new ATOM 837 N LYS A 60 -2.989 5.610 -13.458 1.00 2.72 N ATOM 838 CA LYS A 60 -1.715 4.890 -13.380 1.00 2.94 C ATOM 839 C LYS A 60 -1.014 5.168 -12.030 1.00 2.58 C ATOM 840 O LYS A 60 -0.188 6.082 -11.923 1.00 2.94 O ATOM 841 CB LYS A 60 -0.838 5.219 -14.612 1.00 3.57 C ATOM 842 CG LYS A 60 -1.348 4.711 -15.981 1.00 5.22 C ATOM 843 CD LYS A 60 -2.351 5.647 -16.683 1.00 4.96 C ATOM 844 CE LYS A 60 -2.834 5.128 -18.050 1.00 6.60 C ATOM 845 NZ LYS A 60 -1.860 5.390 -19.141 1.00 7.43 N ATOM 0 H LYS A 60 -2.932 6.480 -13.987 1.00 2.72 H new ATOM 0 HA LYS A 60 -1.898 3.816 -13.409 1.00 2.94 H new ATOM 0 HB2 LYS A 60 -0.726 6.302 -14.671 1.00 3.57 H new ATOM 0 HB3 LYS A 60 0.156 4.804 -14.443 1.00 3.57 H new ATOM 0 HG2 LYS A 60 -0.492 4.559 -16.639 1.00 5.22 H new ATOM 0 HG3 LYS A 60 -1.818 3.738 -15.840 1.00 5.22 H new ATOM 0 HD2 LYS A 60 -3.215 5.791 -16.034 1.00 4.96 H new ATOM 0 HD3 LYS A 60 -1.888 6.624 -16.819 1.00 4.96 H new ATOM 0 HE2 LYS A 60 -3.017 4.056 -17.982 1.00 6.60 H new ATOM 0 HE3 LYS A 60 -3.785 5.599 -18.297 1.00 6.60 H new ATOM 0 HZ1 LYS A 60 -2.235 5.020 -20.038 1.00 7.43 H new ATOM 0 HZ2 LYS A 60 -1.703 6.414 -19.227 1.00 7.43 H new ATOM 0 HZ3 LYS A 60 -0.959 4.919 -18.923 1.00 7.43 H new ATOM 859 N LEU A 61 -1.367 4.438 -10.964 1.00 2.22 N ATOM 860 CA LEU A 61 -0.721 4.531 -9.639 1.00 2.18 C ATOM 861 C LEU A 61 0.497 3.608 -9.576 1.00 2.01 C ATOM 862 O LEU A 61 0.369 2.468 -9.986 1.00 2.48 O ATOM 863 CB LEU A 61 -1.721 4.142 -8.524 1.00 2.76 C ATOM 864 CG LEU A 61 -1.845 5.165 -7.366 1.00 2.82 C ATOM 865 CD1 LEU A 61 -0.500 5.551 -6.734 1.00 3.56 C ATOM 866 CD2 LEU A 61 -2.600 6.410 -7.842 1.00 3.02 C ATOM 0 H LEU A 61 -2.122 3.753 -10.994 1.00 2.22 H new ATOM 0 HA LEU A 61 -0.399 5.561 -9.487 1.00 2.18 H new ATOM 0 HB2 LEU A 61 -2.705 4.003 -8.972 1.00 2.76 H new ATOM 0 HB3 LEU A 61 -1.421 3.180 -8.108 1.00 2.76 H new ATOM 0 HG LEU A 61 -2.411 4.671 -6.576 1.00 2.82 H new ATOM 0 HD11 LEU A 61 -0.668 6.270 -5.932 1.00 3.56 H new ATOM 0 HD12 LEU A 61 -0.020 4.660 -6.329 1.00 3.56 H new ATOM 0 HD13 LEU A 61 0.144 5.997 -7.492 1.00 3.56 H new ATOM 0 HD21 LEU A 61 -2.682 7.122 -7.021 1.00 3.02 H new ATOM 0 HD22 LEU A 61 -2.059 6.870 -8.669 1.00 3.02 H new ATOM 0 HD23 LEU A 61 -3.598 6.125 -8.176 1.00 3.02 H new ATOM 878 N VAL A 62 1.631 4.043 -9.019 1.00 1.57 N ATOM 879 CA VAL A 62 2.880 3.243 -8.978 1.00 1.47 C ATOM 880 C VAL A 62 3.211 2.650 -7.595 1.00 1.55 C ATOM 881 O VAL A 62 4.016 1.728 -7.506 1.00 2.18 O ATOM 882 CB VAL A 62 4.098 4.042 -9.519 1.00 1.62 C ATOM 883 CG1 VAL A 62 3.771 4.713 -10.869 1.00 2.50 C ATOM 884 CG2 VAL A 62 4.614 5.100 -8.531 1.00 1.88 C ATOM 0 H VAL A 62 1.719 4.960 -8.581 1.00 1.57 H new ATOM 0 HA VAL A 62 2.682 2.398 -9.638 1.00 1.47 H new ATOM 0 HB VAL A 62 4.892 3.309 -9.659 1.00 1.62 H new ATOM 0 HG11 VAL A 62 4.643 5.264 -11.222 1.00 2.50 H new ATOM 0 HG12 VAL A 62 3.504 3.949 -11.600 1.00 2.50 H new ATOM 0 HG13 VAL A 62 2.935 5.400 -10.741 1.00 2.50 H new ATOM 0 HG21 VAL A 62 5.465 5.622 -8.969 1.00 1.88 H new ATOM 0 HG22 VAL A 62 3.820 5.815 -8.316 1.00 1.88 H new ATOM 0 HG23 VAL A 62 4.924 4.614 -7.606 1.00 1.88 H new ATOM 894 N GLY A 63 2.615 3.157 -6.506 1.00 1.42 N ATOM 895 CA GLY A 63 2.959 2.744 -5.135 1.00 1.78 C ATOM 896 C GLY A 63 2.608 3.698 -4.003 1.00 1.10 C ATOM 897 O GLY A 63 2.101 4.792 -4.226 1.00 0.93 O ATOM 0 H GLY A 63 1.881 3.864 -6.549 1.00 1.42 H new ATOM 0 HA2 GLY A 63 2.466 1.792 -4.937 1.00 1.78 H new ATOM 0 HA3 GLY A 63 4.033 2.560 -5.099 1.00 1.78 H new ATOM 901 N ALA A 64 2.898 3.236 -2.783 1.00 1.18 N ATOM 902 CA ALA A 64 2.678 3.927 -1.515 1.00 0.91 C ATOM 903 C ALA A 64 3.955 3.821 -0.653 1.00 0.98 C ATOM 904 O ALA A 64 4.301 2.738 -0.184 1.00 1.44 O ATOM 905 CB ALA A 64 1.462 3.276 -0.833 1.00 1.23 C ATOM 0 H ALA A 64 3.317 2.316 -2.649 1.00 1.18 H new ATOM 0 HA ALA A 64 2.472 4.987 -1.662 1.00 0.91 H new ATOM 0 HB1 ALA A 64 1.271 3.771 0.119 1.00 1.23 H new ATOM 0 HB2 ALA A 64 0.587 3.376 -1.476 1.00 1.23 H new ATOM 0 HB3 ALA A 64 1.665 2.219 -0.659 1.00 1.23 H new ATOM 911 N ALA A 65 4.656 4.942 -0.470 1.00 0.94 N ATOM 912 CA ALA A 65 5.904 5.050 0.286 1.00 1.13 C ATOM 913 C ALA A 65 5.677 5.598 1.708 1.00 0.96 C ATOM 914 O ALA A 65 4.660 6.245 1.984 1.00 0.96 O ATOM 915 CB ALA A 65 6.867 5.941 -0.514 1.00 1.55 C ATOM 0 H ALA A 65 4.357 5.835 -0.861 1.00 0.94 H new ATOM 0 HA ALA A 65 6.334 4.057 0.418 1.00 1.13 H new ATOM 0 HB1 ALA A 65 7.808 6.039 0.028 1.00 1.55 H new ATOM 0 HB2 ALA A 65 7.055 5.490 -1.489 1.00 1.55 H new ATOM 0 HB3 ALA A 65 6.423 6.927 -0.650 1.00 1.55 H new ATOM 921 N THR A 66 6.650 5.383 2.603 1.00 0.97 N ATOM 922 CA THR A 66 6.609 5.846 4.000 1.00 1.06 C ATOM 923 C THR A 66 8.012 5.862 4.619 1.00 1.21 C ATOM 924 O THR A 66 8.790 4.959 4.317 1.00 1.15 O ATOM 925 CB THR A 66 5.627 5.009 4.835 1.00 1.10 C ATOM 926 OG1 THR A 66 5.549 5.583 6.116 1.00 1.51 O ATOM 927 CG2 THR A 66 6.018 3.542 5.013 1.00 1.13 C ATOM 0 H THR A 66 7.504 4.874 2.374 1.00 0.97 H new ATOM 0 HA THR A 66 6.242 6.872 4.002 1.00 1.06 H new ATOM 0 HB THR A 66 4.683 5.017 4.290 1.00 1.10 H new ATOM 0 HG1 THR A 66 4.886 6.305 6.111 1.00 1.51 H new ATOM 0 HG21 THR A 66 5.264 3.035 5.616 1.00 1.13 H new ATOM 0 HG22 THR A 66 6.085 3.062 4.037 1.00 1.13 H new ATOM 0 HG23 THR A 66 6.984 3.481 5.514 1.00 1.13 H new ATOM 935 N PRO A 67 8.351 6.852 5.475 1.00 1.48 N ATOM 936 CA PRO A 67 9.605 6.917 6.228 1.00 1.63 C ATOM 937 C PRO A 67 9.567 6.126 7.555 1.00 1.56 C ATOM 938 O PRO A 67 10.491 6.253 8.362 1.00 1.75 O ATOM 939 CB PRO A 67 9.818 8.418 6.472 1.00 2.03 C ATOM 940 CG PRO A 67 8.390 8.920 6.681 1.00 2.10 C ATOM 941 CD PRO A 67 7.601 8.088 5.673 1.00 1.74 C ATOM 0 HA PRO A 67 10.422 6.454 5.674 1.00 1.63 H new ATOM 0 HB2 PRO A 67 10.446 8.603 7.344 1.00 2.03 H new ATOM 0 HB3 PRO A 67 10.300 8.904 5.623 1.00 2.03 H new ATOM 0 HG2 PRO A 67 8.046 8.755 7.702 1.00 2.10 H new ATOM 0 HG3 PRO A 67 8.302 9.988 6.484 1.00 2.10 H new ATOM 0 HD2 PRO A 67 6.598 7.877 6.045 1.00 1.74 H new ATOM 0 HD3 PRO A 67 7.486 8.626 4.732 1.00 1.74 H new ATOM 949 N LEU A 68 8.499 5.358 7.839 1.00 1.43 N ATOM 950 CA LEU A 68 8.368 4.627 9.109 1.00 1.52 C ATOM 951 C LEU A 68 9.435 3.538 9.330 1.00 1.23 C ATOM 952 O LEU A 68 9.755 3.256 10.483 1.00 1.41 O ATOM 953 CB LEU A 68 6.959 4.010 9.225 1.00 1.87 C ATOM 954 CG LEU A 68 6.042 4.777 10.194 1.00 2.61 C ATOM 955 CD1 LEU A 68 5.688 6.180 9.670 1.00 2.70 C ATOM 956 CD2 LEU A 68 4.782 3.943 10.447 1.00 4.49 C ATOM 0 H LEU A 68 7.713 5.229 7.202 1.00 1.43 H new ATOM 0 HA LEU A 68 8.528 5.368 9.892 1.00 1.52 H new ATOM 0 HB2 LEU A 68 6.497 3.987 8.238 1.00 1.87 H new ATOM 0 HB3 LEU A 68 7.048 2.976 9.560 1.00 1.87 H new ATOM 0 HG LEU A 68 6.574 4.930 11.133 1.00 2.61 H new ATOM 0 HD11 LEU A 68 5.039 6.683 10.387 1.00 2.70 H new ATOM 0 HD12 LEU A 68 6.601 6.760 9.537 1.00 2.70 H new ATOM 0 HD13 LEU A 68 5.172 6.092 8.714 1.00 2.70 H new ATOM 0 HD21 LEU A 68 4.124 4.477 11.133 1.00 4.49 H new ATOM 0 HD22 LEU A 68 4.263 3.773 9.504 1.00 4.49 H new ATOM 0 HD23 LEU A 68 5.062 2.985 10.885 1.00 4.49 H new ATOM 968 N ALA A 69 9.976 2.939 8.264 1.00 1.11 N ATOM 969 CA ALA A 69 10.993 1.893 8.345 1.00 1.24 C ATOM 970 C ALA A 69 12.304 2.335 7.690 1.00 1.18 C ATOM 971 O ALA A 69 12.302 3.203 6.817 1.00 1.34 O ATOM 972 CB ALA A 69 10.435 0.617 7.710 1.00 1.61 C ATOM 0 H ALA A 69 9.713 3.173 7.307 1.00 1.11 H new ATOM 0 HA ALA A 69 11.230 1.694 9.390 1.00 1.24 H new ATOM 0 HB1 ALA A 69 11.184 -0.173 7.763 1.00 1.61 H new ATOM 0 HB2 ALA A 69 9.539 0.305 8.247 1.00 1.61 H new ATOM 0 HB3 ALA A 69 10.184 0.809 6.667 1.00 1.61 H new ATOM 978 N THR A 70 13.408 1.697 8.094 1.00 1.16 N ATOM 979 CA THR A 70 14.734 1.877 7.488 1.00 1.18 C ATOM 980 C THR A 70 14.808 1.220 6.104 1.00 1.13 C ATOM 981 O THR A 70 15.558 1.696 5.257 1.00 1.23 O ATOM 982 CB THR A 70 15.801 1.356 8.462 1.00 1.35 C ATOM 983 OG1 THR A 70 15.616 2.012 9.702 1.00 1.74 O ATOM 984 CG2 THR A 70 17.240 1.622 8.017 1.00 1.77 C ATOM 0 H THR A 70 13.406 1.029 8.865 1.00 1.16 H new ATOM 0 HA THR A 70 14.924 2.936 7.316 1.00 1.18 H new ATOM 0 HB THR A 70 15.673 0.275 8.516 1.00 1.35 H new ATOM 0 HG1 THR A 70 16.286 1.695 10.343 1.00 1.74 H new ATOM 0 HG21 THR A 70 17.930 1.223 8.760 1.00 1.77 H new ATOM 0 HG22 THR A 70 17.420 1.137 7.057 1.00 1.77 H new ATOM 0 HG23 THR A 70 17.397 2.696 7.916 1.00 1.77 H new ATOM 992 N SER A 71 13.977 0.208 5.826 1.00 1.07 N ATOM 993 CA SER A 71 13.801 -0.369 4.490 1.00 1.10 C ATOM 994 C SER A 71 12.304 -0.564 4.139 1.00 1.01 C ATOM 995 O SER A 71 11.786 -1.681 4.263 1.00 0.90 O ATOM 996 CB SER A 71 14.574 -1.699 4.411 1.00 1.24 C ATOM 997 OG SER A 71 14.206 -2.431 3.248 1.00 1.81 O ATOM 0 H SER A 71 13.398 -0.240 6.537 1.00 1.07 H new ATOM 0 HA SER A 71 14.202 0.325 3.751 1.00 1.10 H new ATOM 0 HB2 SER A 71 15.646 -1.501 4.397 1.00 1.24 H new ATOM 0 HB3 SER A 71 14.371 -2.296 5.300 1.00 1.24 H new ATOM 0 HG SER A 71 14.710 -3.271 3.217 1.00 1.81 H new ATOM 1003 N PRO A 72 11.594 0.472 3.640 1.00 1.18 N ATOM 1004 CA PRO A 72 10.277 0.281 3.049 1.00 1.16 C ATOM 1005 C PRO A 72 10.427 -0.477 1.720 1.00 1.15 C ATOM 1006 O PRO A 72 11.248 -0.122 0.872 1.00 1.39 O ATOM 1007 CB PRO A 72 9.690 1.685 2.881 1.00 1.42 C ATOM 1008 CG PRO A 72 10.926 2.560 2.688 1.00 1.61 C ATOM 1009 CD PRO A 72 11.998 1.867 3.531 1.00 1.46 C ATOM 0 HA PRO A 72 9.607 -0.320 3.664 1.00 1.16 H new ATOM 0 HB2 PRO A 72 9.019 1.741 2.024 1.00 1.42 H new ATOM 0 HB3 PRO A 72 9.115 1.988 3.756 1.00 1.42 H new ATOM 0 HG2 PRO A 72 11.216 2.616 1.639 1.00 1.61 H new ATOM 0 HG3 PRO A 72 10.750 3.581 3.025 1.00 1.61 H new ATOM 0 HD2 PRO A 72 12.978 1.952 3.061 1.00 1.46 H new ATOM 0 HD3 PRO A 72 12.076 2.327 4.516 1.00 1.46 H new ATOM 1017 N MET A 73 9.638 -1.541 1.553 1.00 1.01 N ATOM 1018 CA MET A 73 9.732 -2.506 0.453 1.00 1.11 C ATOM 1019 C MET A 73 8.325 -2.899 -0.003 1.00 1.01 C ATOM 1020 O MET A 73 7.419 -2.918 0.823 1.00 1.34 O ATOM 1021 CB MET A 73 10.509 -3.717 0.980 1.00 1.25 C ATOM 1022 CG MET A 73 10.895 -4.718 -0.113 1.00 1.47 C ATOM 1023 SD MET A 73 11.932 -6.071 0.494 1.00 1.74 S ATOM 1024 CE MET A 73 13.424 -5.139 0.927 1.00 3.01 C ATOM 0 H MET A 73 8.886 -1.763 2.206 1.00 1.01 H new ATOM 0 HA MET A 73 10.248 -2.085 -0.410 1.00 1.11 H new ATOM 0 HB2 MET A 73 11.414 -3.369 1.479 1.00 1.25 H new ATOM 0 HB3 MET A 73 9.906 -4.226 1.732 1.00 1.25 H new ATOM 0 HG2 MET A 73 9.988 -5.133 -0.553 1.00 1.47 H new ATOM 0 HG3 MET A 73 11.424 -4.192 -0.908 1.00 1.47 H new ATOM 0 HE1 MET A 73 14.275 -5.818 0.979 1.00 3.01 H new ATOM 0 HE2 MET A 73 13.611 -4.379 0.168 1.00 3.01 H new ATOM 0 HE3 MET A 73 13.284 -4.658 1.895 1.00 3.01 H new ATOM 1034 N LEU A 74 8.114 -3.173 -1.295 1.00 0.83 N ATOM 1035 CA LEU A 74 6.772 -3.263 -1.867 1.00 0.89 C ATOM 1036 C LEU A 74 6.615 -4.461 -2.800 1.00 0.94 C ATOM 1037 O LEU A 74 7.481 -4.745 -3.621 1.00 1.07 O ATOM 1038 CB LEU A 74 6.320 -1.928 -2.504 1.00 1.11 C ATOM 1039 CG LEU A 74 7.385 -0.826 -2.736 1.00 1.39 C ATOM 1040 CD1 LEU A 74 8.361 -1.186 -3.868 1.00 2.07 C ATOM 1041 CD2 LEU A 74 6.726 0.527 -3.052 1.00 2.66 C ATOM 0 H LEU A 74 8.864 -3.337 -1.967 1.00 0.83 H new ATOM 0 HA LEU A 74 6.087 -3.446 -1.039 1.00 0.89 H new ATOM 0 HB2 LEU A 74 5.864 -2.157 -3.467 1.00 1.11 H new ATOM 0 HB3 LEU A 74 5.538 -1.507 -1.873 1.00 1.11 H new ATOM 0 HG LEU A 74 7.949 -0.749 -1.807 1.00 1.39 H new ATOM 0 HD11 LEU A 74 9.087 -0.383 -3.991 1.00 2.07 H new ATOM 0 HD12 LEU A 74 8.882 -2.111 -3.619 1.00 2.07 H new ATOM 0 HD13 LEU A 74 7.807 -1.320 -4.797 1.00 2.07 H new ATOM 0 HD21 LEU A 74 7.498 1.280 -3.210 1.00 2.66 H new ATOM 0 HD22 LEU A 74 6.120 0.435 -3.953 1.00 2.66 H new ATOM 0 HD23 LEU A 74 6.092 0.827 -2.217 1.00 2.66 H new ATOM 1053 N MET A 75 5.495 -5.175 -2.655 1.00 1.04 N ATOM 1054 CA MET A 75 5.165 -6.366 -3.436 1.00 1.25 C ATOM 1055 C MET A 75 3.666 -6.414 -3.765 1.00 1.36 C ATOM 1056 O MET A 75 2.849 -5.843 -3.044 1.00 1.79 O ATOM 1057 CB MET A 75 5.561 -7.635 -2.655 1.00 1.49 C ATOM 1058 CG MET A 75 7.053 -7.674 -2.288 1.00 1.96 C ATOM 1059 SD MET A 75 7.576 -9.183 -1.438 1.00 2.15 S ATOM 1060 CE MET A 75 9.335 -8.790 -1.243 1.00 3.33 C ATOM 0 H MET A 75 4.776 -4.933 -1.973 1.00 1.04 H new ATOM 0 HA MET A 75 5.724 -6.321 -4.371 1.00 1.25 H new ATOM 0 HB2 MET A 75 4.967 -7.694 -1.743 1.00 1.49 H new ATOM 0 HB3 MET A 75 5.316 -8.513 -3.252 1.00 1.49 H new ATOM 0 HG2 MET A 75 7.641 -7.562 -3.199 1.00 1.96 H new ATOM 0 HG3 MET A 75 7.281 -6.817 -1.654 1.00 1.96 H new ATOM 0 HE1 MET A 75 9.837 -9.612 -0.732 1.00 3.33 H new ATOM 0 HE2 MET A 75 9.786 -8.643 -2.224 1.00 3.33 H new ATOM 0 HE3 MET A 75 9.441 -7.878 -0.655 1.00 3.33 H new ATOM 1070 N THR A 76 3.330 -7.118 -4.849 1.00 1.28 N ATOM 1071 CA THR A 76 1.977 -7.592 -5.189 1.00 1.33 C ATOM 1072 C THR A 76 2.098 -8.838 -6.063 1.00 1.46 C ATOM 1073 O THR A 76 3.206 -9.188 -6.478 1.00 1.77 O ATOM 1074 CB THR A 76 1.136 -6.491 -5.855 1.00 1.54 C ATOM 1075 OG1 THR A 76 -0.214 -6.879 -5.745 1.00 2.52 O ATOM 1076 CG2 THR A 76 1.453 -6.279 -7.339 1.00 2.07 C ATOM 0 H THR A 76 4.022 -7.388 -5.548 1.00 1.28 H new ATOM 0 HA THR A 76 1.445 -7.854 -4.274 1.00 1.33 H new ATOM 0 HB THR A 76 1.361 -5.551 -5.351 1.00 1.54 H new ATOM 0 HG1 THR A 76 -0.785 -6.198 -6.159 1.00 2.52 H new ATOM 0 HG21 THR A 76 0.819 -5.487 -7.737 1.00 2.07 H new ATOM 0 HG22 THR A 76 2.500 -5.997 -7.451 1.00 2.07 H new ATOM 0 HG23 THR A 76 1.266 -7.203 -7.887 1.00 2.07 H new ATOM 1084 N THR A 77 0.971 -9.482 -6.379 1.00 1.50 N ATOM 1085 CA THR A 77 0.839 -10.569 -7.358 1.00 1.70 C ATOM 1086 C THR A 77 -0.629 -10.681 -7.746 1.00 1.89 C ATOM 1087 O THR A 77 -1.487 -10.693 -6.865 1.00 2.69 O ATOM 1088 CB THR A 77 1.385 -11.893 -6.795 1.00 1.72 C ATOM 1089 OG1 THR A 77 2.778 -11.828 -6.937 1.00 2.36 O ATOM 1090 CG2 THR A 77 0.933 -13.162 -7.525 1.00 3.02 C ATOM 0 H THR A 77 0.081 -9.249 -5.938 1.00 1.50 H new ATOM 0 HA THR A 77 1.432 -10.348 -8.245 1.00 1.70 H new ATOM 0 HB THR A 77 1.013 -11.978 -5.774 1.00 1.72 H new ATOM 0 HG1 THR A 77 3.068 -10.893 -6.890 1.00 2.36 H new ATOM 0 HG21 THR A 77 1.376 -14.035 -7.046 1.00 3.02 H new ATOM 0 HG22 THR A 77 -0.154 -13.238 -7.484 1.00 3.02 H new ATOM 0 HG23 THR A 77 1.254 -13.117 -8.566 1.00 3.02 H new ATOM 1098 N THR A 78 -0.890 -10.784 -9.054 1.00 2.05 N ATOM 1099 CA THR A 78 -2.203 -11.060 -9.664 1.00 2.17 C ATOM 1100 C THR A 78 -2.077 -11.276 -11.172 1.00 2.36 C ATOM 1101 O THR A 78 -1.176 -10.735 -11.810 1.00 3.50 O ATOM 1102 CB THR A 78 -3.255 -9.985 -9.328 1.00 3.92 C ATOM 1103 OG1 THR A 78 -4.489 -10.480 -9.779 1.00 4.63 O ATOM 1104 CG2 THR A 78 -3.021 -8.621 -9.977 1.00 5.40 C ATOM 0 H THR A 78 -0.157 -10.672 -9.754 1.00 2.05 H new ATOM 0 HA THR A 78 -2.566 -11.988 -9.221 1.00 2.17 H new ATOM 0 HB THR A 78 -3.207 -9.809 -8.253 1.00 3.92 H new ATOM 0 HG1 THR A 78 -4.993 -9.759 -10.210 1.00 4.63 H new ATOM 0 HG21 THR A 78 -3.814 -7.935 -9.679 1.00 5.40 H new ATOM 0 HG22 THR A 78 -2.058 -8.225 -9.654 1.00 5.40 H new ATOM 0 HG23 THR A 78 -3.023 -8.729 -11.062 1.00 5.40 H new ATOM 1112 N HIS A 79 -3.009 -12.032 -11.749 1.00 2.46 N ATOM 1113 CA HIS A 79 -3.167 -12.266 -13.194 1.00 3.72 C ATOM 1114 C HIS A 79 -4.578 -11.847 -13.686 1.00 4.12 C ATOM 1115 O HIS A 79 -5.110 -12.352 -14.677 1.00 5.64 O ATOM 1116 CB HIS A 79 -2.846 -13.745 -13.492 1.00 4.96 C ATOM 1117 CG HIS A 79 -3.829 -14.743 -12.924 1.00 4.99 C ATOM 1118 ND1 HIS A 79 -4.958 -15.212 -13.557 1.00 6.12 N ATOM 1119 CD2 HIS A 79 -3.776 -15.357 -11.700 1.00 4.72 C ATOM 1120 CE1 HIS A 79 -5.579 -16.068 -12.728 1.00 6.20 C ATOM 1121 NE2 HIS A 79 -4.897 -16.195 -11.580 1.00 5.48 N ATOM 0 H HIS A 79 -3.712 -12.525 -11.199 1.00 2.46 H new ATOM 0 HA HIS A 79 -2.467 -11.641 -13.749 1.00 3.72 H new ATOM 0 HB2 HIS A 79 -2.799 -13.880 -14.573 1.00 4.96 H new ATOM 0 HB3 HIS A 79 -1.855 -13.971 -13.099 1.00 4.96 H new ATOM 0 HD2 HIS A 79 -3.005 -15.220 -10.956 1.00 4.72 H new ATOM 0 HE1 HIS A 79 -6.501 -16.583 -12.955 1.00 6.20 H new ATOM 0 HE2 HIS A 79 -5.142 -16.781 -10.782 1.00 5.48 H new ATOM 1129 N SER A 80 -5.238 -10.966 -12.932 1.00 3.12 N ATOM 1130 CA SER A 80 -6.665 -10.611 -13.001 1.00 3.53 C ATOM 1131 C SER A 80 -6.940 -9.399 -12.094 1.00 2.66 C ATOM 1132 O SER A 80 -6.063 -8.976 -11.340 1.00 3.55 O ATOM 1133 CB SER A 80 -7.544 -11.817 -12.617 1.00 4.80 C ATOM 1134 OG SER A 80 -7.478 -12.818 -13.614 1.00 6.60 O ATOM 0 H SER A 80 -4.757 -10.441 -12.202 1.00 3.12 H new ATOM 0 HA SER A 80 -6.920 -10.338 -14.025 1.00 3.53 H new ATOM 0 HB2 SER A 80 -7.214 -12.225 -11.662 1.00 4.80 H new ATOM 0 HB3 SER A 80 -8.577 -11.494 -12.486 1.00 4.80 H new ATOM 0 HG SER A 80 -6.856 -12.538 -14.318 1.00 6.60 H new ATOM 1140 N GLY A 81 -8.132 -8.801 -12.177 1.00 2.51 N ATOM 1141 CA GLY A 81 -8.366 -7.406 -11.755 1.00 3.27 C ATOM 1142 C GLY A 81 -8.213 -6.427 -12.927 1.00 3.52 C ATOM 1143 O GLY A 81 -7.935 -5.244 -12.742 1.00 4.76 O ATOM 0 H GLY A 81 -8.965 -9.265 -12.538 1.00 2.51 H new ATOM 0 HA2 GLY A 81 -9.367 -7.316 -11.334 1.00 3.27 H new ATOM 0 HA3 GLY A 81 -7.663 -7.142 -10.965 1.00 3.27 H new ATOM 1147 N GLY A 82 -8.349 -6.932 -14.161 1.00 3.07 N ATOM 1148 CA GLY A 82 -8.234 -6.182 -15.417 1.00 3.63 C ATOM 1149 C GLY A 82 -6.811 -6.163 -15.966 1.00 3.38 C ATOM 1150 O GLY A 82 -6.643 -6.088 -17.181 1.00 3.74 O ATOM 0 H GLY A 82 -8.551 -7.920 -14.317 1.00 3.07 H new ATOM 0 HA2 GLY A 82 -8.899 -6.622 -16.160 1.00 3.63 H new ATOM 0 HA3 GLY A 82 -8.570 -5.158 -15.255 1.00 3.63 H new ATOM 1154 N MET A 83 -5.801 -6.283 -15.096 1.00 2.93 N ATOM 1155 CA MET A 83 -4.385 -6.301 -15.473 1.00 2.76 C ATOM 1156 C MET A 83 -3.538 -7.022 -14.409 1.00 2.68 C ATOM 1157 O MET A 83 -3.915 -7.072 -13.237 1.00 2.78 O ATOM 1158 CB MET A 83 -3.917 -4.847 -15.702 1.00 3.03 C ATOM 1159 CG MET A 83 -2.561 -4.708 -16.404 1.00 3.37 C ATOM 1160 SD MET A 83 -2.176 -2.994 -16.851 1.00 4.59 S ATOM 1161 CE MET A 83 -0.710 -3.283 -17.869 1.00 5.05 C ATOM 0 H MET A 83 -5.950 -6.372 -14.091 1.00 2.93 H new ATOM 0 HA MET A 83 -4.254 -6.862 -16.398 1.00 2.76 H new ATOM 0 HB2 MET A 83 -4.671 -4.327 -16.293 1.00 3.03 H new ATOM 0 HB3 MET A 83 -3.864 -4.342 -14.738 1.00 3.03 H new ATOM 0 HG2 MET A 83 -1.778 -5.094 -15.751 1.00 3.37 H new ATOM 0 HG3 MET A 83 -2.558 -5.323 -17.304 1.00 3.37 H new ATOM 0 HE1 MET A 83 -0.329 -2.330 -18.237 1.00 5.05 H new ATOM 0 HE2 MET A 83 0.057 -3.774 -17.271 1.00 5.05 H new ATOM 0 HE3 MET A 83 -0.973 -3.919 -18.714 1.00 5.05 H new ATOM 1171 N ALA A 84 -2.401 -7.601 -14.805 1.00 2.70 N ATOM 1172 CA ALA A 84 -1.481 -8.264 -13.888 1.00 2.79 C ATOM 1173 C ALA A 84 -0.757 -7.279 -12.945 1.00 3.63 C ATOM 1174 O ALA A 84 -0.701 -6.076 -13.198 1.00 4.65 O ATOM 1175 CB ALA A 84 -0.498 -9.111 -14.707 1.00 3.48 C ATOM 0 H ALA A 84 -2.095 -7.621 -15.778 1.00 2.70 H new ATOM 0 HA ALA A 84 -2.055 -8.912 -13.226 1.00 2.79 H new ATOM 0 HB1 ALA A 84 0.197 -9.614 -14.035 1.00 3.48 H new ATOM 0 HB2 ALA A 84 -1.050 -9.855 -15.281 1.00 3.48 H new ATOM 0 HB3 ALA A 84 0.058 -8.467 -15.388 1.00 3.48 H new ATOM 1181 N GLY A 85 -0.182 -7.816 -11.867 1.00 3.49 N ATOM 1182 CA GLY A 85 0.610 -7.101 -10.867 1.00 4.56 C ATOM 1183 C GLY A 85 1.918 -7.843 -10.601 1.00 3.64 C ATOM 1184 O GLY A 85 1.907 -9.058 -10.413 1.00 2.87 O ATOM 0 H GLY A 85 -0.261 -8.811 -11.658 1.00 3.49 H new ATOM 0 HA2 GLY A 85 0.821 -6.090 -11.215 1.00 4.56 H new ATOM 0 HA3 GLY A 85 0.042 -7.007 -9.942 1.00 4.56 H new ATOM 1188 N MET A 86 3.031 -7.109 -10.582 1.00 4.26 N ATOM 1189 CA MET A 86 4.407 -7.637 -10.600 1.00 3.90 C ATOM 1190 C MET A 86 5.119 -7.517 -9.240 1.00 3.21 C ATOM 1191 O MET A 86 5.400 -6.416 -8.756 1.00 4.35 O ATOM 1192 CB MET A 86 5.194 -6.882 -11.688 1.00 5.90 C ATOM 1193 CG MET A 86 6.646 -7.358 -11.861 1.00 5.95 C ATOM 1194 SD MET A 86 6.800 -9.001 -12.600 1.00 5.81 S ATOM 1195 CE MET A 86 8.576 -9.269 -12.372 1.00 6.54 C ATOM 0 H MET A 86 3.004 -6.090 -10.552 1.00 4.26 H new ATOM 0 HA MET A 86 4.361 -8.704 -10.818 1.00 3.90 H new ATOM 0 HB2 MET A 86 4.672 -6.990 -12.639 1.00 5.90 H new ATOM 0 HB3 MET A 86 5.198 -5.819 -11.446 1.00 5.90 H new ATOM 0 HG2 MET A 86 7.181 -6.640 -12.483 1.00 5.95 H new ATOM 0 HG3 MET A 86 7.134 -7.362 -10.887 1.00 5.95 H new ATOM 0 HE1 MET A 86 8.851 -10.244 -12.774 1.00 6.54 H new ATOM 0 HE2 MET A 86 9.132 -8.491 -12.895 1.00 6.54 H new ATOM 0 HE3 MET A 86 8.816 -9.234 -11.309 1.00 6.54 H new ATOM 1205 N LYS A 87 5.525 -8.641 -8.642 1.00 1.94 N ATOM 1206 CA LYS A 87 6.328 -8.651 -7.411 1.00 1.83 C ATOM 1207 C LYS A 87 7.692 -7.966 -7.657 1.00 1.19 C ATOM 1208 O LYS A 87 8.456 -8.414 -8.511 1.00 1.88 O ATOM 1209 CB LYS A 87 6.424 -10.092 -6.862 1.00 2.98 C ATOM 1210 CG LYS A 87 7.154 -10.176 -5.506 1.00 4.05 C ATOM 1211 CD LYS A 87 6.496 -11.122 -4.487 1.00 5.85 C ATOM 1212 CE LYS A 87 6.243 -12.549 -4.988 1.00 6.69 C ATOM 1213 NZ LYS A 87 5.746 -13.405 -3.888 1.00 8.34 N ATOM 0 H LYS A 87 5.307 -9.572 -8.997 1.00 1.94 H new ATOM 0 HA LYS A 87 5.844 -8.064 -6.631 1.00 1.83 H new ATOM 0 HB2 LYS A 87 5.419 -10.500 -6.753 1.00 2.98 H new ATOM 0 HB3 LYS A 87 6.945 -10.717 -7.588 1.00 2.98 H new ATOM 0 HG2 LYS A 87 8.179 -10.504 -5.679 1.00 4.05 H new ATOM 0 HG3 LYS A 87 7.208 -9.177 -5.074 1.00 4.05 H new ATOM 0 HD2 LYS A 87 7.129 -11.172 -3.601 1.00 5.85 H new ATOM 0 HD3 LYS A 87 5.545 -10.690 -4.176 1.00 5.85 H new ATOM 0 HE2 LYS A 87 5.516 -12.532 -5.800 1.00 6.69 H new ATOM 0 HE3 LYS A 87 7.164 -12.967 -5.394 1.00 6.69 H new ATOM 0 HZ1 LYS A 87 5.389 -14.300 -4.279 1.00 8.34 H new ATOM 0 HZ2 LYS A 87 6.522 -13.602 -3.224 1.00 8.34 H new ATOM 0 HZ3 LYS A 87 4.977 -12.915 -3.387 1.00 8.34 H new ATOM 1227 N MET A 88 7.906 -6.849 -6.939 1.00 1.79 N ATOM 1228 CA MET A 88 8.925 -5.800 -7.011 1.00 2.04 C ATOM 1229 C MET A 88 8.241 -4.428 -6.874 1.00 2.08 C ATOM 1230 O MET A 88 8.777 -3.526 -6.239 1.00 3.61 O ATOM 1231 CB MET A 88 9.792 -5.883 -8.281 1.00 2.62 C ATOM 1232 CG MET A 88 10.784 -4.734 -8.268 1.00 3.46 C ATOM 1233 SD MET A 88 11.943 -4.670 -9.658 1.00 4.29 S ATOM 1234 CE MET A 88 12.985 -6.108 -9.308 1.00 4.54 C ATOM 0 H MET A 88 7.262 -6.636 -6.177 1.00 1.79 H new ATOM 0 HA MET A 88 9.620 -5.946 -6.184 1.00 2.04 H new ATOM 0 HB2 MET A 88 10.319 -6.837 -8.318 1.00 2.62 H new ATOM 0 HB3 MET A 88 9.165 -5.831 -9.171 1.00 2.62 H new ATOM 0 HG2 MET A 88 10.226 -3.798 -8.243 1.00 3.46 H new ATOM 0 HG3 MET A 88 11.359 -4.787 -7.343 1.00 3.46 H new ATOM 0 HE1 MET A 88 13.802 -6.149 -10.029 1.00 4.54 H new ATOM 0 HE2 MET A 88 13.393 -6.025 -8.301 1.00 4.54 H new ATOM 0 HE3 MET A 88 12.388 -7.017 -9.384 1.00 4.54 H new ATOM 1244 N VAL A 89 7.049 -4.282 -7.468 1.00 1.30 N ATOM 1245 CA VAL A 89 6.193 -3.088 -7.363 1.00 1.19 C ATOM 1246 C VAL A 89 4.857 -3.460 -6.707 1.00 1.46 C ATOM 1247 O VAL A 89 4.481 -4.631 -6.739 1.00 2.39 O ATOM 1248 CB VAL A 89 5.950 -2.404 -8.733 1.00 1.79 C ATOM 1249 CG1 VAL A 89 7.254 -1.784 -9.264 1.00 2.21 C ATOM 1250 CG2 VAL A 89 5.353 -3.341 -9.796 1.00 3.64 C ATOM 0 H VAL A 89 6.640 -5.011 -8.052 1.00 1.30 H new ATOM 0 HA VAL A 89 6.720 -2.365 -6.740 1.00 1.19 H new ATOM 0 HB VAL A 89 5.209 -1.626 -8.549 1.00 1.79 H new ATOM 0 HG11 VAL A 89 7.065 -1.308 -10.226 1.00 2.21 H new ATOM 0 HG12 VAL A 89 7.617 -1.039 -8.556 1.00 2.21 H new ATOM 0 HG13 VAL A 89 8.005 -2.565 -9.386 1.00 2.21 H new ATOM 0 HG21 VAL A 89 5.211 -2.792 -10.727 1.00 3.64 H new ATOM 0 HG22 VAL A 89 6.032 -4.176 -9.967 1.00 3.64 H new ATOM 0 HG23 VAL A 89 4.392 -3.720 -9.448 1.00 3.64 H new ATOM 1260 N PRO A 90 4.128 -2.513 -6.093 1.00 1.22 N ATOM 1261 CA PRO A 90 2.791 -2.744 -5.553 1.00 1.82 C ATOM 1262 C PRO A 90 1.703 -2.458 -6.603 1.00 2.11 C ATOM 1263 O PRO A 90 0.705 -3.166 -6.618 1.00 3.71 O ATOM 1264 CB PRO A 90 2.689 -1.780 -4.371 1.00 1.97 C ATOM 1265 CG PRO A 90 3.494 -0.584 -4.868 1.00 1.52 C ATOM 1266 CD PRO A 90 4.582 -1.173 -5.761 1.00 1.25 C ATOM 0 HA PRO A 90 2.640 -3.782 -5.256 1.00 1.82 H new ATOM 0 HB2 PRO A 90 1.656 -1.513 -4.150 1.00 1.97 H new ATOM 0 HB3 PRO A 90 3.110 -2.205 -3.460 1.00 1.97 H new ATOM 0 HG2 PRO A 90 2.864 0.111 -5.423 1.00 1.52 H new ATOM 0 HG3 PRO A 90 3.926 -0.028 -4.036 1.00 1.52 H new ATOM 0 HD2 PRO A 90 4.721 -0.572 -6.659 1.00 1.25 H new ATOM 0 HD3 PRO A 90 5.542 -1.200 -5.245 1.00 1.25 H new ATOM 1274 N TRP A 91 1.892 -1.451 -7.475 1.00 1.60 N ATOM 1275 CA TRP A 91 0.947 -1.026 -8.509 1.00 1.70 C ATOM 1276 C TRP A 91 1.631 -0.570 -9.813 1.00 2.59 C ATOM 1277 O TRP A 91 2.856 -0.498 -9.920 1.00 4.32 O ATOM 1278 CB TRP A 91 0.020 0.074 -7.963 1.00 3.22 C ATOM 1279 CG TRP A 91 -0.987 -0.358 -6.958 1.00 4.23 C ATOM 1280 CD1 TRP A 91 -1.968 -1.266 -7.179 1.00 3.39 C ATOM 1281 CD2 TRP A 91 -1.145 0.057 -5.587 1.00 6.39 C ATOM 1282 NE1 TRP A 91 -2.704 -1.441 -6.031 1.00 4.76 N ATOM 1283 CE2 TRP A 91 -2.255 -0.626 -5.002 1.00 6.71 C ATOM 1284 CE3 TRP A 91 -0.445 0.964 -4.752 1.00 8.20 C ATOM 1285 CZ2 TRP A 91 -2.651 -0.429 -3.685 1.00 8.71 C ATOM 1286 CZ3 TRP A 91 -0.788 1.118 -3.411 1.00 10.20 C ATOM 1287 CH2 TRP A 91 -1.886 0.430 -2.863 1.00 10.47 C ATOM 0 H TRP A 91 2.745 -0.892 -7.473 1.00 1.60 H new ATOM 0 HA TRP A 91 0.355 -1.903 -8.771 1.00 1.70 H new ATOM 0 HB2 TRP A 91 0.638 0.853 -7.516 1.00 3.22 H new ATOM 0 HB3 TRP A 91 -0.506 0.527 -8.803 1.00 3.22 H new ATOM 0 HD1 TRP A 91 -2.145 -1.775 -8.115 1.00 3.39 H new ATOM 0 HE1 TRP A 91 -3.485 -2.091 -5.946 1.00 4.76 H new ATOM 0 HE3 TRP A 91 0.368 1.545 -5.163 1.00 8.20 H new ATOM 0 HZ2 TRP A 91 -3.529 -0.924 -3.296 1.00 8.71 H new ATOM 0 HZ3 TRP A 91 -0.203 1.774 -2.783 1.00 10.20 H new ATOM 0 HH2 TRP A 91 -2.143 0.557 -1.822 1.00 10.47 H new ATOM 1298 N LEU A 92 0.786 -0.252 -10.797 1.00 2.89 N ATOM 1299 CA LEU A 92 1.116 0.338 -12.097 1.00 4.58 C ATOM 1300 C LEU A 92 -0.113 1.001 -12.745 1.00 4.08 C ATOM 1301 O LEU A 92 -0.050 2.158 -13.163 1.00 4.76 O ATOM 1302 CB LEU A 92 1.794 -0.712 -13.011 1.00 6.82 C ATOM 1303 CG LEU A 92 1.083 -2.089 -13.059 1.00 8.20 C ATOM 1304 CD1 LEU A 92 0.934 -2.574 -14.505 1.00 9.94 C ATOM 1305 CD2 LEU A 92 1.848 -3.158 -12.266 1.00 9.47 C ATOM 0 H LEU A 92 -0.217 -0.411 -10.700 1.00 2.89 H new ATOM 0 HA LEU A 92 1.838 1.140 -11.944 1.00 4.58 H new ATOM 0 HB2 LEU A 92 1.848 -0.311 -14.023 1.00 6.82 H new ATOM 0 HB3 LEU A 92 2.819 -0.860 -12.672 1.00 6.82 H new ATOM 0 HG LEU A 92 0.102 -1.947 -12.607 1.00 8.20 H new ATOM 0 HD11 LEU A 92 0.433 -3.542 -14.514 1.00 9.94 H new ATOM 0 HD12 LEU A 92 0.343 -1.854 -15.071 1.00 9.94 H new ATOM 0 HD13 LEU A 92 1.920 -2.672 -14.959 1.00 9.94 H new ATOM 0 HD21 LEU A 92 1.315 -4.107 -12.326 1.00 9.47 H new ATOM 0 HD22 LEU A 92 2.847 -3.276 -12.685 1.00 9.47 H new ATOM 0 HD23 LEU A 92 1.926 -2.851 -11.223 1.00 9.47 H new ATOM 1317 N THR A 93 -1.249 0.289 -12.752 1.00 3.41 N ATOM 1318 CA THR A 93 -2.514 0.689 -13.397 1.00 3.29 C ATOM 1319 C THR A 93 -3.709 0.343 -12.525 1.00 2.38 C ATOM 1320 O THR A 93 -3.852 -0.795 -12.096 1.00 2.64 O ATOM 1321 CB THR A 93 -2.679 -0.035 -14.745 1.00 4.67 C ATOM 1322 OG1 THR A 93 -1.495 0.052 -15.498 1.00 5.72 O ATOM 1323 CG2 THR A 93 -3.791 0.576 -15.600 1.00 5.06 C ATOM 0 H THR A 93 -1.317 -0.618 -12.291 1.00 3.41 H new ATOM 0 HA THR A 93 -2.474 1.768 -13.548 1.00 3.29 H new ATOM 0 HB THR A 93 -2.926 -1.069 -14.503 1.00 4.67 H new ATOM 0 HG1 THR A 93 -1.395 -0.755 -16.045 1.00 5.72 H new ATOM 0 HG21 THR A 93 -3.868 0.031 -16.541 1.00 5.06 H new ATOM 0 HG22 THR A 93 -4.738 0.512 -15.065 1.00 5.06 H new ATOM 0 HG23 THR A 93 -3.560 1.621 -15.805 1.00 5.06 H new ATOM 1331 N ILE A 94 -4.606 1.299 -12.300 1.00 1.93 N ATOM 1332 CA ILE A 94 -5.928 1.051 -11.707 1.00 1.76 C ATOM 1333 C ILE A 94 -6.970 1.244 -12.830 1.00 1.47 C ATOM 1334 O ILE A 94 -7.393 2.379 -13.065 1.00 1.85 O ATOM 1335 CB ILE A 94 -6.171 1.992 -10.498 1.00 2.55 C ATOM 1336 CG1 ILE A 94 -4.960 2.155 -9.541 1.00 4.41 C ATOM 1337 CG2 ILE A 94 -7.408 1.517 -9.712 1.00 3.11 C ATOM 1338 CD1 ILE A 94 -4.430 0.892 -8.847 1.00 5.78 C ATOM 0 H ILE A 94 -4.439 2.280 -12.525 1.00 1.93 H new ATOM 0 HA ILE A 94 -6.004 0.038 -11.312 1.00 1.76 H new ATOM 0 HB ILE A 94 -6.335 2.982 -10.923 1.00 2.55 H new ATOM 0 HG12 ILE A 94 -4.140 2.596 -10.108 1.00 4.41 H new ATOM 0 HG13 ILE A 94 -5.236 2.873 -8.768 1.00 4.41 H new ATOM 0 HG21 ILE A 94 -7.576 2.180 -8.863 1.00 3.11 H new ATOM 0 HG22 ILE A 94 -8.281 1.533 -10.364 1.00 3.11 H new ATOM 0 HG23 ILE A 94 -7.243 0.502 -9.352 1.00 3.11 H new ATOM 0 HD11 ILE A 94 -3.585 1.154 -8.210 1.00 5.78 H new ATOM 0 HD12 ILE A 94 -5.220 0.452 -8.239 1.00 5.78 H new ATOM 0 HD13 ILE A 94 -4.108 0.172 -9.599 1.00 5.78 H new ATOM 1350 N PRO A 95 -7.346 0.183 -13.578 1.00 1.52 N ATOM 1351 CA PRO A 95 -8.183 0.317 -14.766 1.00 1.83 C ATOM 1352 C PRO A 95 -9.667 0.437 -14.399 1.00 1.67 C ATOM 1353 O PRO A 95 -10.146 -0.247 -13.493 1.00 2.23 O ATOM 1354 CB PRO A 95 -7.894 -0.931 -15.603 1.00 2.50 C ATOM 1355 CG PRO A 95 -7.575 -1.989 -14.548 1.00 2.52 C ATOM 1356 CD PRO A 95 -6.852 -1.185 -13.469 1.00 1.97 C ATOM 0 HA PRO A 95 -7.958 1.227 -15.322 1.00 1.83 H new ATOM 0 HB2 PRO A 95 -8.752 -1.215 -16.212 1.00 2.50 H new ATOM 0 HB3 PRO A 95 -7.057 -0.775 -16.284 1.00 2.50 H new ATOM 0 HG2 PRO A 95 -8.479 -2.461 -14.163 1.00 2.52 H new ATOM 0 HG3 PRO A 95 -6.946 -2.784 -14.950 1.00 2.52 H new ATOM 0 HD2 PRO A 95 -7.054 -1.594 -12.479 1.00 1.97 H new ATOM 0 HD3 PRO A 95 -5.772 -1.221 -13.615 1.00 1.97 H new ATOM 1364 N ALA A 96 -10.394 1.321 -15.097 1.00 1.72 N ATOM 1365 CA ALA A 96 -11.820 1.617 -14.857 1.00 1.84 C ATOM 1366 C ALA A 96 -12.719 0.380 -14.921 1.00 1.83 C ATOM 1367 O ALA A 96 -13.538 0.159 -14.028 1.00 2.89 O ATOM 1368 CB ALA A 96 -12.250 2.720 -15.829 1.00 2.38 C ATOM 0 H ALA A 96 -10.000 1.865 -15.864 1.00 1.72 H new ATOM 0 HA ALA A 96 -11.940 1.969 -13.833 1.00 1.84 H new ATOM 0 HB1 ALA A 96 -13.302 2.956 -15.670 1.00 2.38 H new ATOM 0 HB2 ALA A 96 -11.648 3.612 -15.656 1.00 2.38 H new ATOM 0 HB3 ALA A 96 -12.106 2.378 -16.854 1.00 2.38 H new ATOM 1374 N ARG A 97 -12.480 -0.474 -15.915 1.00 2.11 N ATOM 1375 CA ARG A 97 -12.755 -1.900 -15.766 1.00 2.29 C ATOM 1376 C ARG A 97 -11.519 -2.663 -15.245 1.00 2.45 C ATOM 1377 O ARG A 97 -10.682 -3.127 -16.022 1.00 4.04 O ATOM 1378 CB ARG A 97 -13.283 -2.505 -17.080 1.00 2.52 C ATOM 1379 CG ARG A 97 -14.804 -2.330 -17.247 1.00 2.83 C ATOM 1380 CD ARG A 97 -15.298 -3.007 -18.535 1.00 3.34 C ATOM 1381 NE ARG A 97 -16.772 -3.012 -18.651 1.00 4.01 N ATOM 1382 CZ ARG A 97 -17.463 -3.324 -19.748 1.00 4.95 C ATOM 1383 NH1 ARG A 97 -16.888 -3.658 -20.880 1.00 5.46 N ATOM 1384 NH2 ARG A 97 -18.773 -3.298 -19.734 1.00 5.82 N ATOM 0 H ARG A 97 -12.100 -0.206 -16.823 1.00 2.11 H new ATOM 0 HA ARG A 97 -13.539 -2.009 -15.017 1.00 2.29 H new ATOM 0 HB2 ARG A 97 -12.773 -2.036 -17.922 1.00 2.52 H new ATOM 0 HB3 ARG A 97 -13.038 -3.567 -17.110 1.00 2.52 H new ATOM 0 HG2 ARG A 97 -15.319 -2.757 -16.387 1.00 2.83 H new ATOM 0 HG3 ARG A 97 -15.051 -1.269 -17.272 1.00 2.83 H new ATOM 0 HD2 ARG A 97 -14.872 -2.493 -19.397 1.00 3.34 H new ATOM 0 HD3 ARG A 97 -14.932 -4.033 -18.564 1.00 3.34 H new ATOM 0 HE ARG A 97 -17.306 -2.755 -17.821 1.00 4.01 H new ATOM 0 HH11 ARG A 97 -15.871 -3.687 -20.946 1.00 5.46 H new ATOM 0 HH12 ARG A 97 -17.459 -3.889 -21.693 1.00 5.46 H new ATOM 0 HH21 ARG A 97 -19.269 -3.038 -18.881 1.00 5.82 H new ATOM 0 HH22 ARG A 97 -19.297 -3.537 -20.576 1.00 5.82 H new ATOM 1398 N GLY A 98 -11.445 -2.859 -13.921 1.00 1.48 N ATOM 1399 CA GLY A 98 -10.770 -4.022 -13.334 1.00 1.59 C ATOM 1400 C GLY A 98 -10.461 -3.938 -11.836 1.00 1.64 C ATOM 1401 O GLY A 98 -10.758 -4.896 -11.122 1.00 2.79 O ATOM 0 H GLY A 98 -11.848 -2.222 -13.234 1.00 1.48 H new ATOM 0 HA2 GLY A 98 -11.390 -4.902 -13.507 1.00 1.59 H new ATOM 0 HA3 GLY A 98 -9.834 -4.181 -13.869 1.00 1.59 H new ATOM 1405 N THR A 99 -9.903 -2.798 -11.399 1.00 1.56 N ATOM 1406 CA THR A 99 -9.534 -2.470 -10.006 1.00 1.72 C ATOM 1407 C THR A 99 -8.366 -3.322 -9.505 1.00 1.46 C ATOM 1408 O THR A 99 -8.522 -4.485 -9.148 1.00 1.74 O ATOM 1409 CB THR A 99 -10.747 -2.572 -9.068 1.00 2.39 C ATOM 1410 OG1 THR A 99 -11.620 -1.520 -9.412 1.00 3.47 O ATOM 1411 CG2 THR A 99 -10.368 -2.426 -7.595 1.00 2.84 C ATOM 0 H THR A 99 -9.684 -2.036 -12.041 1.00 1.56 H new ATOM 0 HA THR A 99 -9.196 -1.434 -10.000 1.00 1.72 H new ATOM 0 HB THR A 99 -11.200 -3.556 -9.187 1.00 2.39 H new ATOM 0 HG1 THR A 99 -12.412 -1.550 -8.835 1.00 3.47 H new ATOM 0 HG21 THR A 99 -11.264 -2.506 -6.979 1.00 2.84 H new ATOM 0 HG22 THR A 99 -9.667 -3.214 -7.320 1.00 2.84 H new ATOM 0 HG23 THR A 99 -9.903 -1.454 -7.434 1.00 2.84 H new ATOM 1419 N LEU A 100 -7.193 -2.702 -9.394 1.00 1.59 N ATOM 1420 CA LEU A 100 -6.007 -3.303 -8.763 1.00 1.80 C ATOM 1421 C LEU A 100 -5.970 -3.046 -7.243 1.00 1.43 C ATOM 1422 O LEU A 100 -6.368 -1.978 -6.770 1.00 1.68 O ATOM 1423 CB LEU A 100 -4.731 -2.789 -9.461 1.00 2.82 C ATOM 1424 CG LEU A 100 -4.097 -3.724 -10.511 1.00 4.50 C ATOM 1425 CD1 LEU A 100 -3.462 -4.954 -9.850 1.00 5.49 C ATOM 1426 CD2 LEU A 100 -5.101 -4.156 -11.585 1.00 6.00 C ATOM 0 H LEU A 100 -7.032 -1.757 -9.742 1.00 1.59 H new ATOM 0 HA LEU A 100 -6.061 -4.385 -8.887 1.00 1.80 H new ATOM 0 HB2 LEU A 100 -4.965 -1.841 -9.945 1.00 2.82 H new ATOM 0 HB3 LEU A 100 -3.984 -2.580 -8.695 1.00 2.82 H new ATOM 0 HG LEU A 100 -3.313 -3.150 -11.005 1.00 4.50 H new ATOM 0 HD11 LEU A 100 -3.024 -5.593 -10.616 1.00 5.49 H new ATOM 0 HD12 LEU A 100 -2.684 -4.634 -9.157 1.00 5.49 H new ATOM 0 HD13 LEU A 100 -4.226 -5.510 -9.307 1.00 5.49 H new ATOM 0 HD21 LEU A 100 -4.608 -4.813 -12.301 1.00 6.00 H new ATOM 0 HD22 LEU A 100 -5.929 -4.687 -11.116 1.00 6.00 H new ATOM 0 HD23 LEU A 100 -5.481 -3.275 -12.103 1.00 6.00 H new ATOM 1438 N THR A 101 -5.441 -4.011 -6.479 1.00 1.24 N ATOM 1439 CA THR A 101 -5.488 -4.083 -5.005 1.00 1.26 C ATOM 1440 C THR A 101 -4.162 -4.572 -4.412 1.00 1.13 C ATOM 1441 O THR A 101 -3.283 -4.993 -5.159 1.00 1.77 O ATOM 1442 CB THR A 101 -6.675 -4.975 -4.605 1.00 2.14 C ATOM 1443 OG1 THR A 101 -6.898 -4.883 -3.227 1.00 3.49 O ATOM 1444 CG2 THR A 101 -6.482 -6.457 -4.946 1.00 2.52 C ATOM 0 H THR A 101 -4.944 -4.802 -6.888 1.00 1.24 H new ATOM 0 HA THR A 101 -5.635 -3.085 -4.593 1.00 1.26 H new ATOM 0 HB THR A 101 -7.523 -4.606 -5.182 1.00 2.14 H new ATOM 0 HG1 THR A 101 -7.592 -5.523 -2.965 1.00 3.49 H new ATOM 0 HG21 THR A 101 -7.361 -7.020 -4.633 1.00 2.52 H new ATOM 0 HG22 THR A 101 -6.344 -6.568 -6.022 1.00 2.52 H new ATOM 0 HG23 THR A 101 -5.603 -6.838 -4.426 1.00 2.52 H new ATOM 1452 N LEU A 102 -3.995 -4.495 -3.087 1.00 1.00 N ATOM 1453 CA LEU A 102 -2.747 -4.753 -2.379 1.00 1.38 C ATOM 1454 C LEU A 102 -3.038 -5.392 -1.007 1.00 1.11 C ATOM 1455 O LEU A 102 -3.238 -4.706 -0.005 1.00 1.17 O ATOM 1456 CB LEU A 102 -2.053 -3.384 -2.292 1.00 2.06 C ATOM 1457 CG LEU A 102 -0.620 -3.485 -1.789 1.00 3.16 C ATOM 1458 CD1 LEU A 102 0.308 -3.961 -2.918 1.00 4.11 C ATOM 1459 CD2 LEU A 102 -0.105 -2.143 -1.260 1.00 3.97 C ATOM 0 H LEU A 102 -4.758 -4.241 -2.459 1.00 1.00 H new ATOM 0 HA LEU A 102 -2.097 -5.468 -2.884 1.00 1.38 H new ATOM 0 HB2 LEU A 102 -2.056 -2.916 -3.276 1.00 2.06 H new ATOM 0 HB3 LEU A 102 -2.622 -2.734 -1.628 1.00 2.06 H new ATOM 0 HG LEU A 102 -0.618 -4.205 -0.970 1.00 3.16 H new ATOM 0 HD11 LEU A 102 1.330 -4.029 -2.545 1.00 4.11 H new ATOM 0 HD12 LEU A 102 -0.017 -4.941 -3.267 1.00 4.11 H new ATOM 0 HD13 LEU A 102 0.270 -3.251 -3.744 1.00 4.11 H new ATOM 0 HD21 LEU A 102 0.921 -2.259 -0.911 1.00 3.97 H new ATOM 0 HD22 LEU A 102 -0.135 -1.402 -2.058 1.00 3.97 H new ATOM 0 HD23 LEU A 102 -0.734 -1.812 -0.434 1.00 3.97 H new ATOM 1471 N GLN A 103 -3.105 -6.722 -0.958 1.00 1.00 N ATOM 1472 CA GLN A 103 -3.601 -7.516 0.181 1.00 0.98 C ATOM 1473 C GLN A 103 -2.775 -8.793 0.331 1.00 1.09 C ATOM 1474 O GLN A 103 -2.298 -9.318 -0.668 1.00 1.20 O ATOM 1475 CB GLN A 103 -5.063 -7.963 -0.050 1.00 1.21 C ATOM 1476 CG GLN A 103 -6.107 -6.862 -0.328 1.00 1.55 C ATOM 1477 CD GLN A 103 -6.483 -6.059 0.912 1.00 2.06 C ATOM 1478 OE1 GLN A 103 -7.602 -6.070 1.392 1.00 2.20 O ATOM 1479 NE2 GLN A 103 -5.554 -5.338 1.497 1.00 3.52 N ATOM 0 H GLN A 103 -2.805 -7.305 -1.739 1.00 1.00 H new ATOM 0 HA GLN A 103 -3.527 -6.886 1.067 1.00 0.98 H new ATOM 0 HB2 GLN A 103 -5.074 -8.657 -0.890 1.00 1.21 H new ATOM 0 HB3 GLN A 103 -5.387 -8.521 0.829 1.00 1.21 H new ATOM 0 HG2 GLN A 103 -5.716 -6.184 -1.087 1.00 1.55 H new ATOM 0 HG3 GLN A 103 -7.006 -7.320 -0.742 1.00 1.55 H new ATOM 0 HE21 GLN A 103 -4.610 -5.314 1.112 1.00 3.52 H new ATOM 0 HE22 GLN A 103 -5.777 -4.802 2.336 1.00 3.52 H new ATOM 1488 N ARG A 104 -2.739 -9.385 1.535 1.00 1.26 N ATOM 1489 CA ARG A 104 -2.166 -10.722 1.828 1.00 1.59 C ATOM 1490 C ARG A 104 -2.795 -11.918 1.080 1.00 1.87 C ATOM 1491 O ARG A 104 -2.492 -13.071 1.373 1.00 2.44 O ATOM 1492 CB ARG A 104 -2.200 -10.979 3.348 1.00 1.75 C ATOM 1493 CG ARG A 104 -3.637 -11.046 3.918 1.00 3.08 C ATOM 1494 CD ARG A 104 -3.715 -11.498 5.384 1.00 3.68 C ATOM 1495 NE ARG A 104 -3.187 -12.854 5.569 1.00 3.90 N ATOM 1496 CZ ARG A 104 -3.183 -13.561 6.690 1.00 4.55 C ATOM 1497 NH1 ARG A 104 -3.743 -13.164 7.812 1.00 5.19 N ATOM 1498 NH2 ARG A 104 -2.526 -14.692 6.681 1.00 5.12 N ATOM 0 H ARG A 104 -3.121 -8.935 2.367 1.00 1.26 H new ATOM 0 HA ARG A 104 -1.146 -10.672 1.448 1.00 1.59 H new ATOM 0 HB2 ARG A 104 -1.685 -11.915 3.564 1.00 1.75 H new ATOM 0 HB3 ARG A 104 -1.650 -10.188 3.857 1.00 1.75 H new ATOM 0 HG2 ARG A 104 -4.097 -10.062 3.828 1.00 3.08 H new ATOM 0 HG3 ARG A 104 -4.226 -11.730 3.307 1.00 3.08 H new ATOM 0 HD2 ARG A 104 -3.154 -10.802 6.008 1.00 3.68 H new ATOM 0 HD3 ARG A 104 -4.751 -11.463 5.720 1.00 3.68 H new ATOM 0 HE ARG A 104 -2.780 -13.300 4.747 1.00 3.90 H new ATOM 0 HH11 ARG A 104 -4.217 -12.262 7.854 1.00 5.19 H new ATOM 0 HH12 ARG A 104 -3.703 -13.758 8.640 1.00 5.19 H new ATOM 0 HH21 ARG A 104 -2.045 -14.996 5.834 1.00 5.12 H new ATOM 0 HH22 ARG A 104 -2.495 -15.270 7.521 1.00 5.12 H new ATOM 1512 N ASP A 105 -3.723 -11.646 0.166 1.00 1.75 N ATOM 1513 CA ASP A 105 -4.349 -12.623 -0.742 1.00 2.06 C ATOM 1514 C ASP A 105 -3.706 -12.616 -2.157 1.00 1.85 C ATOM 1515 O ASP A 105 -4.071 -13.455 -2.982 1.00 2.11 O ATOM 1516 CB ASP A 105 -5.867 -12.340 -0.790 1.00 2.46 C ATOM 1517 CG ASP A 105 -6.702 -13.608 -1.039 1.00 3.12 C ATOM 1518 OD1 ASP A 105 -6.687 -14.511 -0.188 1.00 3.67 O ATOM 1519 OD2 ASP A 105 -7.449 -13.633 -2.062 1.00 4.18 O ATOM 0 H ASP A 105 -4.079 -10.701 0.026 1.00 1.75 H new ATOM 0 HA ASP A 105 -4.179 -13.629 -0.358 1.00 2.06 H new ATOM 0 HB2 ASP A 105 -6.177 -11.885 0.151 1.00 2.46 H new ATOM 0 HB3 ASP A 105 -6.072 -11.615 -1.578 1.00 2.46 H new ATOM 1524 N GLY A 106 -2.748 -11.704 -2.407 1.00 1.65 N ATOM 1525 CA GLY A 106 -1.849 -11.702 -3.568 1.00 1.66 C ATOM 1526 C GLY A 106 -0.421 -11.370 -3.144 1.00 2.04 C ATOM 1527 O GLY A 106 0.482 -12.149 -3.405 1.00 2.80 O ATOM 0 H GLY A 106 -2.575 -10.919 -1.779 1.00 1.65 H new ATOM 0 HA2 GLY A 106 -1.872 -12.678 -4.054 1.00 1.66 H new ATOM 0 HA3 GLY A 106 -2.195 -10.973 -4.301 1.00 1.66 H new ATOM 1531 N ASP A 107 -0.254 -10.247 -2.443 1.00 1.96 N ATOM 1532 CA ASP A 107 0.931 -9.705 -1.762 1.00 2.80 C ATOM 1533 C ASP A 107 0.727 -8.193 -1.532 1.00 1.86 C ATOM 1534 O ASP A 107 -0.253 -7.586 -1.977 1.00 1.67 O ATOM 1535 CB ASP A 107 2.294 -10.041 -2.431 1.00 4.37 C ATOM 1536 CG ASP A 107 3.019 -11.280 -1.871 1.00 6.20 C ATOM 1537 OD1 ASP A 107 2.867 -11.598 -0.671 1.00 7.03 O ATOM 1538 OD2 ASP A 107 3.822 -11.875 -2.636 1.00 7.19 O ATOM 0 H ASP A 107 -1.045 -9.614 -2.323 1.00 1.96 H new ATOM 0 HA ASP A 107 1.011 -10.215 -0.802 1.00 2.80 H new ATOM 0 HB2 ASP A 107 2.129 -10.190 -3.498 1.00 4.37 H new ATOM 0 HB3 ASP A 107 2.952 -9.178 -2.328 1.00 4.37 H new ATOM 1543 N HIS A 108 1.632 -7.562 -0.780 1.00 1.68 N ATOM 1544 CA HIS A 108 1.450 -6.204 -0.264 1.00 1.07 C ATOM 1545 C HIS A 108 2.762 -5.482 0.133 1.00 1.08 C ATOM 1546 O HIS A 108 3.835 -6.081 0.072 1.00 1.51 O ATOM 1547 CB HIS A 108 0.429 -6.279 0.885 1.00 1.24 C ATOM 1548 CG HIS A 108 0.885 -7.098 2.073 1.00 1.86 C ATOM 1549 ND1 HIS A 108 2.169 -7.480 2.403 1.00 2.18 N ATOM 1550 CD2 HIS A 108 0.051 -7.655 2.998 1.00 2.98 C ATOM 1551 CE1 HIS A 108 2.098 -8.252 3.499 1.00 2.83 C ATOM 1552 NE2 HIS A 108 0.818 -8.390 3.894 1.00 3.38 N ATOM 0 H HIS A 108 2.520 -7.984 -0.510 1.00 1.68 H new ATOM 0 HA HIS A 108 1.070 -5.573 -1.068 1.00 1.07 H new ATOM 0 HB2 HIS A 108 0.204 -5.267 1.222 1.00 1.24 H new ATOM 0 HB3 HIS A 108 -0.500 -6.702 0.503 1.00 1.24 H new ATOM 0 HD2 HIS A 108 -1.023 -7.544 3.029 1.00 2.98 H new ATOM 0 HE1 HIS A 108 2.947 -8.699 3.994 1.00 2.83 H new ATOM 0 HE2 HIS A 108 0.479 -8.927 4.692 1.00 3.38 H new ATOM 1560 N VAL A 109 2.675 -4.213 0.560 1.00 0.84 N ATOM 1561 CA VAL A 109 3.832 -3.375 0.950 1.00 0.77 C ATOM 1562 C VAL A 109 4.229 -3.644 2.414 1.00 0.76 C ATOM 1563 O VAL A 109 3.361 -3.853 3.258 1.00 0.83 O ATOM 1564 CB VAL A 109 3.560 -1.871 0.659 1.00 0.87 C ATOM 1565 CG1 VAL A 109 2.382 -1.323 1.469 1.00 2.02 C ATOM 1566 CG2 VAL A 109 4.766 -0.961 0.927 1.00 1.57 C ATOM 0 H VAL A 109 1.783 -3.726 0.648 1.00 0.84 H new ATOM 0 HA VAL A 109 4.689 -3.653 0.336 1.00 0.77 H new ATOM 0 HB VAL A 109 3.331 -1.852 -0.407 1.00 0.87 H new ATOM 0 HG11 VAL A 109 2.234 -0.270 1.229 1.00 2.02 H new ATOM 0 HG12 VAL A 109 1.479 -1.882 1.222 1.00 2.02 H new ATOM 0 HG13 VAL A 109 2.593 -1.427 2.533 1.00 2.02 H new ATOM 0 HG21 VAL A 109 4.500 0.072 0.701 1.00 1.57 H new ATOM 0 HG22 VAL A 109 5.056 -1.040 1.975 1.00 1.57 H new ATOM 0 HG23 VAL A 109 5.600 -1.267 0.295 1.00 1.57 H new ATOM 1576 N MET A 110 5.533 -3.642 2.713 1.00 0.88 N ATOM 1577 CA MET A 110 6.120 -4.116 3.974 1.00 0.80 C ATOM 1578 C MET A 110 7.135 -3.115 4.560 1.00 0.77 C ATOM 1579 O MET A 110 7.983 -2.554 3.865 1.00 0.88 O ATOM 1580 CB MET A 110 6.736 -5.511 3.802 1.00 0.87 C ATOM 1581 CG MET A 110 5.709 -6.511 3.241 1.00 1.89 C ATOM 1582 SD MET A 110 6.071 -8.267 3.514 1.00 1.94 S ATOM 1583 CE MET A 110 7.696 -8.378 2.722 1.00 3.78 C ATOM 0 H MET A 110 6.236 -3.297 2.059 1.00 0.88 H new ATOM 0 HA MET A 110 5.309 -4.193 4.698 1.00 0.80 H new ATOM 0 HB2 MET A 110 7.593 -5.452 3.131 1.00 0.87 H new ATOM 0 HB3 MET A 110 7.107 -5.868 4.763 1.00 0.87 H new ATOM 0 HG2 MET A 110 4.738 -6.289 3.683 1.00 1.89 H new ATOM 0 HG3 MET A 110 5.617 -6.343 2.168 1.00 1.89 H new ATOM 0 HE1 MET A 110 8.022 -9.418 2.704 1.00 3.78 H new ATOM 0 HE2 MET A 110 7.630 -8.001 1.702 1.00 3.78 H new ATOM 0 HE3 MET A 110 8.416 -7.782 3.283 1.00 3.78 H new ATOM 1593 N LEU A 111 7.029 -2.878 5.874 1.00 0.74 N ATOM 1594 CA LEU A 111 7.734 -1.844 6.633 1.00 0.79 C ATOM 1595 C LEU A 111 8.892 -2.490 7.404 1.00 0.77 C ATOM 1596 O LEU A 111 8.929 -2.448 8.632 1.00 0.98 O ATOM 1597 CB LEU A 111 6.737 -1.088 7.544 1.00 0.93 C ATOM 1598 CG LEU A 111 5.711 -0.161 6.846 1.00 1.09 C ATOM 1599 CD1 LEU A 111 4.549 -0.888 6.150 1.00 2.00 C ATOM 1600 CD2 LEU A 111 5.123 0.798 7.891 1.00 2.44 C ATOM 0 H LEU A 111 6.414 -3.436 6.467 1.00 0.74 H new ATOM 0 HA LEU A 111 8.166 -1.099 5.965 1.00 0.79 H new ATOM 0 HB2 LEU A 111 6.185 -1.825 8.128 1.00 0.93 H new ATOM 0 HB3 LEU A 111 7.311 -0.487 8.250 1.00 0.93 H new ATOM 0 HG LEU A 111 6.262 0.356 6.061 1.00 1.09 H new ATOM 0 HD11 LEU A 111 3.885 -0.156 5.691 1.00 2.00 H new ATOM 0 HD12 LEU A 111 4.944 -1.552 5.381 1.00 2.00 H new ATOM 0 HD13 LEU A 111 3.994 -1.472 6.884 1.00 2.00 H new ATOM 0 HD21 LEU A 111 4.398 1.457 7.413 1.00 2.44 H new ATOM 0 HD22 LEU A 111 4.629 0.224 8.675 1.00 2.44 H new ATOM 0 HD23 LEU A 111 5.923 1.395 8.328 1.00 2.44 H new ATOM 1612 N MET A 112 9.813 -3.124 6.670 1.00 0.73 N ATOM 1613 CA MET A 112 10.854 -3.989 7.234 1.00 0.83 C ATOM 1614 C MET A 112 12.000 -3.193 7.869 1.00 0.95 C ATOM 1615 O MET A 112 12.512 -2.236 7.285 1.00 1.04 O ATOM 1616 CB MET A 112 11.349 -4.942 6.138 1.00 0.99 C ATOM 1617 CG MET A 112 12.399 -5.935 6.657 1.00 1.18 C ATOM 1618 SD MET A 112 12.708 -7.361 5.580 1.00 2.20 S ATOM 1619 CE MET A 112 13.246 -6.518 4.070 1.00 3.10 C ATOM 0 H MET A 112 9.856 -3.049 5.654 1.00 0.73 H new ATOM 0 HA MET A 112 10.425 -4.571 8.050 1.00 0.83 H new ATOM 0 HB2 MET A 112 10.502 -5.493 5.730 1.00 0.99 H new ATOM 0 HB3 MET A 112 11.775 -4.361 5.320 1.00 0.99 H new ATOM 0 HG2 MET A 112 13.338 -5.402 6.806 1.00 1.18 H new ATOM 0 HG3 MET A 112 12.080 -6.299 7.634 1.00 1.18 H new ATOM 0 HE1 MET A 112 13.544 -7.258 3.327 1.00 3.10 H new ATOM 0 HE2 MET A 112 12.426 -5.918 3.676 1.00 3.10 H new ATOM 0 HE3 MET A 112 14.093 -5.870 4.297 1.00 3.10 H new ATOM 1629 N GLY A 113 12.409 -3.589 9.083 1.00 1.07 N ATOM 1630 CA GLY A 113 13.391 -2.830 9.861 1.00 1.23 C ATOM 1631 C GLY A 113 12.753 -1.563 10.424 1.00 1.28 C ATOM 1632 O GLY A 113 13.208 -0.456 10.146 1.00 1.50 O ATOM 0 H GLY A 113 12.072 -4.433 9.546 1.00 1.07 H new ATOM 0 HA2 GLY A 113 13.775 -3.445 10.675 1.00 1.23 H new ATOM 0 HA3 GLY A 113 14.241 -2.569 9.231 1.00 1.23 H new ATOM 1636 N LEU A 114 11.665 -1.723 11.171 1.00 1.37 N ATOM 1637 CA LEU A 114 10.934 -0.650 11.832 1.00 1.44 C ATOM 1638 C LEU A 114 11.746 -0.121 13.038 1.00 1.75 C ATOM 1639 O LEU A 114 12.575 -0.818 13.630 1.00 2.71 O ATOM 1640 CB LEU A 114 9.553 -1.230 12.216 1.00 1.70 C ATOM 1641 CG LEU A 114 8.429 -0.224 12.475 1.00 1.95 C ATOM 1642 CD1 LEU A 114 7.916 0.425 11.183 1.00 2.39 C ATOM 1643 CD2 LEU A 114 7.283 -0.887 13.242 1.00 2.76 C ATOM 0 H LEU A 114 11.253 -2.641 11.338 1.00 1.37 H new ATOM 0 HA LEU A 114 10.784 0.215 11.186 1.00 1.44 H new ATOM 0 HB2 LEU A 114 9.232 -1.900 11.418 1.00 1.70 H new ATOM 0 HB3 LEU A 114 9.677 -1.838 13.112 1.00 1.70 H new ATOM 0 HG LEU A 114 8.847 0.576 13.086 1.00 1.95 H new ATOM 0 HD11 LEU A 114 7.120 1.130 11.421 1.00 2.39 H new ATOM 0 HD12 LEU A 114 8.733 0.953 10.692 1.00 2.39 H new ATOM 0 HD13 LEU A 114 7.530 -0.346 10.517 1.00 2.39 H new ATOM 0 HD21 LEU A 114 6.493 -0.157 13.418 1.00 2.76 H new ATOM 0 HD22 LEU A 114 6.887 -1.718 12.658 1.00 2.76 H new ATOM 0 HD23 LEU A 114 7.652 -1.259 14.198 1.00 2.76 H new ATOM 1655 N LYS A 115 11.467 1.122 13.427 1.00 1.35 N ATOM 1656 CA LYS A 115 12.147 1.816 14.519 1.00 1.79 C ATOM 1657 C LYS A 115 11.474 1.635 15.897 1.00 2.35 C ATOM 1658 O LYS A 115 12.161 1.319 16.869 1.00 3.10 O ATOM 1659 CB LYS A 115 12.395 3.272 14.087 1.00 1.82 C ATOM 1660 CG LYS A 115 11.154 4.189 14.015 1.00 2.47 C ATOM 1661 CD LYS A 115 11.511 5.493 13.277 1.00 2.99 C ATOM 1662 CE LYS A 115 11.487 5.317 11.743 1.00 2.96 C ATOM 1663 NZ LYS A 115 12.033 6.484 10.999 1.00 3.79 N ATOM 0 H LYS A 115 10.745 1.688 12.981 1.00 1.35 H new ATOM 0 HA LYS A 115 13.117 1.352 14.697 1.00 1.79 H new ATOM 0 HB2 LYS A 115 13.109 3.717 14.780 1.00 1.82 H new ATOM 0 HB3 LYS A 115 12.869 3.261 13.105 1.00 1.82 H new ATOM 0 HG2 LYS A 115 10.342 3.678 13.497 1.00 2.47 H new ATOM 0 HG3 LYS A 115 10.799 4.415 15.020 1.00 2.47 H new ATOM 0 HD2 LYS A 115 10.808 6.275 13.563 1.00 2.99 H new ATOM 0 HD3 LYS A 115 12.501 5.826 13.588 1.00 2.99 H new ATOM 0 HE2 LYS A 115 12.060 4.428 11.479 1.00 2.96 H new ATOM 0 HE3 LYS A 115 10.460 5.141 11.422 1.00 2.96 H new ATOM 0 HZ1 LYS A 115 11.574 6.548 10.068 1.00 3.79 H new ATOM 0 HZ2 LYS A 115 11.849 7.355 11.536 1.00 3.79 H new ATOM 0 HZ3 LYS A 115 13.058 6.366 10.872 1.00 3.79 H new ATOM 1677 N ARG A 116 10.133 1.710 15.941 1.00 2.30 N ATOM 1678 CA ARG A 116 9.271 1.258 17.045 1.00 3.04 C ATOM 1679 C ARG A 116 7.872 0.857 16.516 1.00 2.28 C ATOM 1680 O ARG A 116 7.433 1.426 15.517 1.00 1.70 O ATOM 1681 CB ARG A 116 9.142 2.345 18.135 1.00 4.08 C ATOM 1682 CG ARG A 116 10.276 2.280 19.168 1.00 5.71 C ATOM 1683 CD ARG A 116 9.952 3.069 20.439 1.00 6.52 C ATOM 1684 NE ARG A 116 10.033 4.518 20.216 1.00 5.75 N ATOM 1685 CZ ARG A 116 9.852 5.461 21.127 1.00 6.16 C ATOM 1686 NH1 ARG A 116 9.352 5.206 22.320 1.00 7.23 N ATOM 1687 NH2 ARG A 116 10.189 6.686 20.803 1.00 6.00 N ATOM 0 H ARG A 116 9.595 2.107 15.170 1.00 2.30 H new ATOM 0 HA ARG A 116 9.739 0.382 17.495 1.00 3.04 H new ATOM 0 HB2 ARG A 116 9.140 3.328 17.664 1.00 4.08 H new ATOM 0 HB3 ARG A 116 8.185 2.233 18.644 1.00 4.08 H new ATOM 0 HG2 ARG A 116 10.468 1.239 19.428 1.00 5.71 H new ATOM 0 HG3 ARG A 116 11.191 2.671 18.724 1.00 5.71 H new ATOM 0 HD2 ARG A 116 8.951 2.809 20.783 1.00 6.52 H new ATOM 0 HD3 ARG A 116 10.645 2.784 21.231 1.00 6.52 H new ATOM 0 HE ARG A 116 10.249 4.827 19.268 1.00 5.75 H new ATOM 0 HH11 ARG A 116 9.089 4.253 22.569 1.00 7.23 H new ATOM 0 HH12 ARG A 116 9.229 5.962 22.993 1.00 7.23 H new ATOM 0 HH21 ARG A 116 10.574 6.882 19.879 1.00 6.00 H new ATOM 0 HH22 ARG A 116 10.066 7.443 21.475 1.00 6.00 H new ATOM 1701 N PRO A 117 7.194 -0.111 17.166 1.00 2.58 N ATOM 1702 CA PRO A 117 5.853 -0.565 16.805 1.00 2.24 C ATOM 1703 C PRO A 117 4.777 0.436 17.249 1.00 2.01 C ATOM 1704 O PRO A 117 5.032 1.322 18.068 1.00 2.47 O ATOM 1705 CB PRO A 117 5.694 -1.937 17.469 1.00 3.17 C ATOM 1706 CG PRO A 117 6.561 -1.820 18.721 1.00 3.92 C ATOM 1707 CD PRO A 117 7.693 -0.892 18.291 1.00 3.56 C ATOM 0 HA PRO A 117 5.727 -0.640 15.725 1.00 2.24 H new ATOM 0 HB2 PRO A 117 4.654 -2.146 17.718 1.00 3.17 H new ATOM 0 HB3 PRO A 117 6.034 -2.742 16.817 1.00 3.17 H new ATOM 0 HG2 PRO A 117 6.000 -1.406 19.559 1.00 3.92 H new ATOM 0 HG3 PRO A 117 6.939 -2.792 19.039 1.00 3.92 H new ATOM 0 HD2 PRO A 117 7.991 -0.240 19.112 1.00 3.56 H new ATOM 0 HD3 PRO A 117 8.574 -1.465 18.003 1.00 3.56 H new ATOM 1715 N LEU A 118 3.571 0.292 16.686 1.00 1.59 N ATOM 1716 CA LEU A 118 2.503 1.291 16.757 1.00 1.46 C ATOM 1717 C LEU A 118 1.342 0.844 17.667 1.00 1.58 C ATOM 1718 O LEU A 118 1.063 -0.353 17.804 1.00 1.72 O ATOM 1719 CB LEU A 118 1.959 1.574 15.338 1.00 1.42 C ATOM 1720 CG LEU A 118 2.998 1.855 14.230 1.00 1.54 C ATOM 1721 CD1 LEU A 118 2.257 2.125 12.913 1.00 2.05 C ATOM 1722 CD2 LEU A 118 3.927 3.034 14.559 1.00 2.33 C ATOM 0 H LEU A 118 3.307 -0.540 16.158 1.00 1.59 H new ATOM 0 HA LEU A 118 2.933 2.195 17.188 1.00 1.46 H new ATOM 0 HB2 LEU A 118 1.358 0.719 15.029 1.00 1.42 H new ATOM 0 HB3 LEU A 118 1.288 2.431 15.398 1.00 1.42 H new ATOM 0 HG LEU A 118 3.635 0.975 14.145 1.00 1.54 H new ATOM 0 HD11 LEU A 118 2.981 2.325 12.123 1.00 2.05 H new ATOM 0 HD12 LEU A 118 1.660 1.253 12.646 1.00 2.05 H new ATOM 0 HD13 LEU A 118 1.604 2.989 13.034 1.00 2.05 H new ATOM 0 HD21 LEU A 118 4.633 3.180 13.742 1.00 2.33 H new ATOM 0 HD22 LEU A 118 3.334 3.939 14.692 1.00 2.33 H new ATOM 0 HD23 LEU A 118 4.474 2.821 15.477 1.00 2.33 H new ATOM 1734 N LYS A 119 0.580 1.822 18.170 1.00 1.73 N ATOM 1735 CA LYS A 119 -0.756 1.601 18.719 1.00 1.71 C ATOM 1736 C LYS A 119 -1.759 1.370 17.566 1.00 1.51 C ATOM 1737 O LYS A 119 -1.510 1.741 16.423 1.00 1.62 O ATOM 1738 CB LYS A 119 -1.120 2.799 19.633 1.00 1.89 C ATOM 1739 CG LYS A 119 -1.420 4.105 18.862 1.00 3.08 C ATOM 1740 CD LYS A 119 -0.905 5.398 19.523 1.00 4.29 C ATOM 1741 CE LYS A 119 -1.765 6.014 20.633 1.00 5.05 C ATOM 1742 NZ LYS A 119 -1.801 5.212 21.876 1.00 4.90 N ATOM 0 H LYS A 119 0.879 2.796 18.206 1.00 1.73 H new ATOM 0 HA LYS A 119 -0.791 0.703 19.336 1.00 1.71 H new ATOM 0 HB2 LYS A 119 -1.991 2.534 20.233 1.00 1.89 H new ATOM 0 HB3 LYS A 119 -0.298 2.978 20.326 1.00 1.89 H new ATOM 0 HG2 LYS A 119 -0.983 4.027 17.867 1.00 3.08 H new ATOM 0 HG3 LYS A 119 -2.499 4.189 18.731 1.00 3.08 H new ATOM 0 HD2 LYS A 119 0.083 5.195 19.936 1.00 4.29 H new ATOM 0 HD3 LYS A 119 -0.776 6.147 18.742 1.00 4.29 H new ATOM 0 HE2 LYS A 119 -1.384 7.009 20.865 1.00 5.05 H new ATOM 0 HE3 LYS A 119 -2.783 6.140 20.264 1.00 5.05 H new ATOM 0 HZ1 LYS A 119 -2.400 5.689 22.580 1.00 4.90 H new ATOM 0 HZ2 LYS A 119 -2.191 4.270 21.670 1.00 4.90 H new ATOM 0 HZ3 LYS A 119 -0.837 5.112 22.253 1.00 4.90 H new ATOM 1756 N VAL A 120 -2.941 0.843 17.870 1.00 1.62 N ATOM 1757 CA VAL A 120 -4.017 0.503 16.915 1.00 1.63 C ATOM 1758 C VAL A 120 -4.786 1.742 16.382 1.00 1.73 C ATOM 1759 O VAL A 120 -5.986 1.680 16.125 1.00 2.22 O ATOM 1760 CB VAL A 120 -4.908 -0.611 17.534 1.00 1.68 C ATOM 1761 CG1 VAL A 120 -5.825 -0.126 18.672 1.00 2.12 C ATOM 1762 CG2 VAL A 120 -5.677 -1.425 16.480 1.00 2.13 C ATOM 0 H VAL A 120 -3.198 0.627 18.833 1.00 1.62 H new ATOM 0 HA VAL A 120 -3.575 0.098 16.005 1.00 1.63 H new ATOM 0 HB VAL A 120 -4.198 -1.293 18.002 1.00 1.68 H new ATOM 0 HG11 VAL A 120 -6.412 -0.964 19.048 1.00 2.12 H new ATOM 0 HG12 VAL A 120 -5.218 0.283 19.479 1.00 2.12 H new ATOM 0 HG13 VAL A 120 -6.495 0.647 18.295 1.00 2.12 H new ATOM 0 HG21 VAL A 120 -6.280 -2.186 16.976 1.00 2.13 H new ATOM 0 HG22 VAL A 120 -6.328 -0.761 15.911 1.00 2.13 H new ATOM 0 HG23 VAL A 120 -4.970 -1.906 15.805 1.00 2.13 H new ATOM 1772 N GLY A 121 -4.103 2.887 16.243 1.00 1.95 N ATOM 1773 CA GLY A 121 -4.692 4.170 15.824 1.00 2.22 C ATOM 1774 C GLY A 121 -3.729 5.356 15.684 1.00 2.31 C ATOM 1775 O GLY A 121 -4.165 6.501 15.764 1.00 2.48 O ATOM 0 H GLY A 121 -3.101 2.950 16.423 1.00 1.95 H new ATOM 0 HA2 GLY A 121 -5.189 4.020 14.865 1.00 2.22 H new ATOM 0 HA3 GLY A 121 -5.464 4.441 16.544 1.00 2.22 H new ATOM 1779 N GLU A 122 -2.430 5.092 15.516 1.00 2.25 N ATOM 1780 CA GLU A 122 -1.390 6.085 15.230 1.00 2.29 C ATOM 1781 C GLU A 122 -1.706 6.870 13.940 1.00 2.03 C ATOM 1782 O GLU A 122 -2.294 6.324 12.992 1.00 1.95 O ATOM 1783 CB GLU A 122 -0.043 5.346 15.078 1.00 2.42 C ATOM 1784 CG GLU A 122 1.182 6.100 15.598 1.00 2.59 C ATOM 1785 CD GLU A 122 1.443 5.838 17.082 1.00 2.07 C ATOM 1786 OE1 GLU A 122 1.695 4.672 17.460 1.00 2.70 O ATOM 1787 OE2 GLU A 122 1.387 6.826 17.857 1.00 2.53 O ATOM 0 H GLU A 122 -2.059 4.144 15.578 1.00 2.25 H new ATOM 0 HA GLU A 122 -1.344 6.802 16.050 1.00 2.29 H new ATOM 0 HB2 GLU A 122 -0.110 4.392 15.601 1.00 2.42 H new ATOM 0 HB3 GLU A 122 0.111 5.121 14.023 1.00 2.42 H new ATOM 0 HG2 GLU A 122 2.058 5.806 15.021 1.00 2.59 H new ATOM 0 HG3 GLU A 122 1.041 7.169 15.440 1.00 2.59 H new ATOM 1794 N THR A 123 -1.240 8.128 13.883 1.00 2.20 N ATOM 1795 CA THR A 123 -1.160 8.929 12.652 1.00 2.29 C ATOM 1796 C THR A 123 0.156 8.578 11.959 1.00 1.83 C ATOM 1797 O THR A 123 1.222 8.711 12.559 1.00 2.01 O ATOM 1798 CB THR A 123 -1.208 10.436 12.958 1.00 3.06 C ATOM 1799 OG1 THR A 123 -2.357 10.734 13.715 1.00 3.41 O ATOM 1800 CG2 THR A 123 -1.271 11.279 11.683 1.00 3.58 C ATOM 0 H THR A 123 -0.902 8.626 14.707 1.00 2.20 H new ATOM 0 HA THR A 123 -2.013 8.703 12.012 1.00 2.29 H new ATOM 0 HB THR A 123 -0.296 10.675 13.504 1.00 3.06 H new ATOM 0 HG1 THR A 123 -2.381 11.694 13.908 1.00 3.41 H new ATOM 0 HG21 THR A 123 -1.303 12.336 11.947 1.00 3.58 H new ATOM 0 HG22 THR A 123 -0.388 11.084 11.074 1.00 3.58 H new ATOM 0 HG23 THR A 123 -2.166 11.018 11.118 1.00 3.58 H new ATOM 1808 N VAL A 124 0.087 8.132 10.703 1.00 1.35 N ATOM 1809 CA VAL A 124 1.196 7.520 9.955 1.00 1.04 C ATOM 1810 C VAL A 124 1.413 8.300 8.658 1.00 0.98 C ATOM 1811 O VAL A 124 0.457 8.660 7.969 1.00 1.01 O ATOM 1812 CB VAL A 124 0.890 6.028 9.660 1.00 1.05 C ATOM 1813 CG1 VAL A 124 1.918 5.393 8.709 1.00 2.11 C ATOM 1814 CG2 VAL A 124 0.825 5.219 10.970 1.00 2.10 C ATOM 0 H VAL A 124 -0.772 8.187 10.156 1.00 1.35 H new ATOM 0 HA VAL A 124 2.107 7.560 10.552 1.00 1.04 H new ATOM 0 HB VAL A 124 -0.080 6.000 9.163 1.00 1.05 H new ATOM 0 HG11 VAL A 124 1.657 4.349 8.536 1.00 2.11 H new ATOM 0 HG12 VAL A 124 1.916 5.930 7.760 1.00 2.11 H new ATOM 0 HG13 VAL A 124 2.911 5.450 9.156 1.00 2.11 H new ATOM 0 HG21 VAL A 124 0.609 4.175 10.743 1.00 2.10 H new ATOM 0 HG22 VAL A 124 1.782 5.288 11.488 1.00 2.10 H new ATOM 0 HG23 VAL A 124 0.038 5.621 11.608 1.00 2.10 H new ATOM 1824 N ASN A 125 2.677 8.561 8.327 1.00 1.05 N ATOM 1825 CA ASN A 125 3.047 9.247 7.091 1.00 1.10 C ATOM 1826 C ASN A 125 2.873 8.328 5.866 1.00 0.84 C ATOM 1827 O ASN A 125 3.434 7.229 5.865 1.00 1.07 O ATOM 1828 CB ASN A 125 4.538 9.637 7.158 1.00 1.73 C ATOM 1829 CG ASN A 125 4.908 10.874 7.954 1.00 2.40 C ATOM 1830 OD1 ASN A 125 5.586 11.745 7.435 1.00 3.42 O ATOM 1831 ND2 ASN A 125 4.557 10.987 9.220 1.00 2.57 N ATOM 0 H ASN A 125 3.474 8.302 8.909 1.00 1.05 H new ATOM 0 HA ASN A 125 2.402 10.120 6.990 1.00 1.10 H new ATOM 0 HB2 ASN A 125 5.087 8.793 7.575 1.00 1.73 H new ATOM 0 HB3 ASN A 125 4.895 9.776 6.137 1.00 1.73 H new ATOM 0 HD21 ASN A 125 4.852 11.800 9.761 1.00 2.57 H new ATOM 0 HD22 ASN A 125 3.990 10.261 9.659 1.00 2.57 H new ATOM 1838 N ILE A 126 2.250 8.775 4.764 1.00 0.87 N ATOM 1839 CA ILE A 126 2.207 8.007 3.495 1.00 0.88 C ATOM 1840 C ILE A 126 2.323 8.934 2.280 1.00 0.92 C ATOM 1841 O ILE A 126 1.767 10.028 2.279 1.00 0.94 O ATOM 1842 CB ILE A 126 0.963 7.076 3.463 1.00 0.84 C ATOM 1843 CG1 ILE A 126 1.071 5.914 2.452 1.00 1.77 C ATOM 1844 CG2 ILE A 126 -0.374 7.822 3.294 1.00 1.63 C ATOM 1845 CD1 ILE A 126 0.902 6.262 0.968 1.00 3.13 C ATOM 0 H ILE A 126 1.764 9.671 4.720 1.00 0.87 H new ATOM 0 HA ILE A 126 3.077 7.353 3.443 1.00 0.88 H new ATOM 0 HB ILE A 126 0.960 6.633 4.459 1.00 0.84 H new ATOM 0 HG12 ILE A 126 2.046 5.443 2.580 1.00 1.77 H new ATOM 0 HG13 ILE A 126 0.320 5.168 2.712 1.00 1.77 H new ATOM 0 HG21 ILE A 126 -1.193 7.103 3.281 1.00 1.63 H new ATOM 0 HG22 ILE A 126 -0.512 8.514 4.125 1.00 1.63 H new ATOM 0 HG23 ILE A 126 -0.365 8.378 2.356 1.00 1.63 H new ATOM 0 HD11 ILE A 126 1.001 5.357 0.369 1.00 3.13 H new ATOM 0 HD12 ILE A 126 -0.084 6.699 0.807 1.00 3.13 H new ATOM 0 HD13 ILE A 126 1.669 6.978 0.673 1.00 3.13 H new ATOM 1857 N THR A 127 3.074 8.531 1.256 1.00 1.02 N ATOM 1858 CA THR A 127 3.203 9.251 -0.014 1.00 1.16 C ATOM 1859 C THR A 127 2.808 8.302 -1.126 1.00 1.00 C ATOM 1860 O THR A 127 3.520 7.332 -1.373 1.00 1.10 O ATOM 1861 CB THR A 127 4.633 9.783 -0.173 1.00 1.47 C ATOM 1862 OG1 THR A 127 4.786 10.845 0.736 1.00 2.44 O ATOM 1863 CG2 THR A 127 4.898 10.372 -1.557 1.00 2.12 C ATOM 0 H THR A 127 3.624 7.673 1.286 1.00 1.02 H new ATOM 0 HA THR A 127 2.546 10.120 -0.046 1.00 1.16 H new ATOM 0 HB THR A 127 5.316 8.949 -0.009 1.00 1.47 H new ATOM 0 HG1 THR A 127 5.693 11.210 0.663 1.00 2.44 H new ATOM 0 HG21 THR A 127 5.926 10.732 -1.609 1.00 2.12 H new ATOM 0 HG22 THR A 127 4.744 9.604 -2.315 1.00 2.12 H new ATOM 0 HG23 THR A 127 4.214 11.201 -1.737 1.00 2.12 H new ATOM 1871 N LEU A 128 1.690 8.568 -1.814 1.00 1.06 N ATOM 1872 CA LEU A 128 1.262 7.797 -2.989 1.00 1.11 C ATOM 1873 C LEU A 128 1.106 8.745 -4.179 1.00 1.66 C ATOM 1874 O LEU A 128 0.278 9.647 -4.157 1.00 2.66 O ATOM 1875 CB LEU A 128 0.004 6.935 -2.722 1.00 1.50 C ATOM 1876 CG LEU A 128 -1.373 7.616 -2.532 1.00 1.63 C ATOM 1877 CD1 LEU A 128 -2.455 6.533 -2.448 1.00 2.87 C ATOM 1878 CD2 LEU A 128 -1.484 8.496 -1.279 1.00 2.12 C ATOM 0 H LEU A 128 1.054 9.327 -1.570 1.00 1.06 H new ATOM 0 HA LEU A 128 2.035 7.068 -3.230 1.00 1.11 H new ATOM 0 HB2 LEU A 128 -0.092 6.235 -3.552 1.00 1.50 H new ATOM 0 HB3 LEU A 128 0.200 6.344 -1.828 1.00 1.50 H new ATOM 0 HG LEU A 128 -1.501 8.274 -3.391 1.00 1.63 H new ATOM 0 HD11 LEU A 128 -3.430 7.002 -2.314 1.00 2.87 H new ATOM 0 HD12 LEU A 128 -2.457 5.949 -3.368 1.00 2.87 H new ATOM 0 HD13 LEU A 128 -2.249 5.877 -1.602 1.00 2.87 H new ATOM 0 HD21 LEU A 128 -2.482 8.932 -1.228 1.00 2.12 H new ATOM 0 HD22 LEU A 128 -1.307 7.889 -0.391 1.00 2.12 H new ATOM 0 HD23 LEU A 128 -0.742 9.293 -1.327 1.00 2.12 H new ATOM 1890 N LYS A 129 1.948 8.579 -5.206 1.00 1.32 N ATOM 1891 CA LYS A 129 1.971 9.443 -6.401 1.00 1.74 C ATOM 1892 C LYS A 129 1.570 8.646 -7.656 1.00 1.54 C ATOM 1893 O LYS A 129 2.213 7.652 -8.005 1.00 1.17 O ATOM 1894 CB LYS A 129 3.372 10.102 -6.495 1.00 2.10 C ATOM 1895 CG LYS A 129 3.459 11.150 -7.624 1.00 3.35 C ATOM 1896 CD LYS A 129 4.851 11.778 -7.825 1.00 3.69 C ATOM 1897 CE LYS A 129 5.314 12.674 -6.666 1.00 4.35 C ATOM 1898 NZ LYS A 129 6.590 13.354 -6.996 1.00 4.87 N ATOM 0 H LYS A 129 2.643 7.833 -5.235 1.00 1.32 H new ATOM 0 HA LYS A 129 1.233 10.241 -6.324 1.00 1.74 H new ATOM 0 HB2 LYS A 129 3.611 10.577 -5.544 1.00 2.10 H new ATOM 0 HB3 LYS A 129 4.123 9.330 -6.662 1.00 2.10 H new ATOM 0 HG2 LYS A 129 3.150 10.681 -8.558 1.00 3.35 H new ATOM 0 HG3 LYS A 129 2.745 11.946 -7.416 1.00 3.35 H new ATOM 0 HD2 LYS A 129 5.580 10.980 -7.965 1.00 3.69 H new ATOM 0 HD3 LYS A 129 4.842 12.366 -8.742 1.00 3.69 H new ATOM 0 HE2 LYS A 129 4.547 13.418 -6.448 1.00 4.35 H new ATOM 0 HE3 LYS A 129 5.440 12.073 -5.765 1.00 4.35 H new ATOM 0 HZ1 LYS A 129 6.881 13.953 -6.197 1.00 4.87 H new ATOM 0 HZ2 LYS A 129 7.325 12.642 -7.181 1.00 4.87 H new ATOM 0 HZ3 LYS A 129 6.460 13.945 -7.842 1.00 4.87 H new ATOM 1912 N ALA A 130 0.488 9.064 -8.312 1.00 2.24 N ATOM 1913 CA ALA A 130 0.146 8.672 -9.672 1.00 2.27 C ATOM 1914 C ALA A 130 1.197 9.198 -10.661 1.00 2.11 C ATOM 1915 O ALA A 130 1.609 10.350 -10.551 1.00 2.63 O ATOM 1916 CB ALA A 130 -1.233 9.252 -9.987 1.00 2.96 C ATOM 0 H ALA A 130 -0.191 9.702 -7.898 1.00 2.24 H new ATOM 0 HA ALA A 130 0.127 7.586 -9.764 1.00 2.27 H new ATOM 0 HB1 ALA A 130 -1.521 8.976 -11.002 1.00 2.96 H new ATOM 0 HB2 ALA A 130 -1.964 8.856 -9.282 1.00 2.96 H new ATOM 0 HB3 ALA A 130 -1.199 10.338 -9.902 1.00 2.96 H new ATOM 1922 N THR A 131 1.563 8.416 -11.683 1.00 1.78 N ATOM 1923 CA THR A 131 2.395 8.923 -12.798 1.00 1.94 C ATOM 1924 C THR A 131 1.583 9.767 -13.776 1.00 3.04 C ATOM 1925 O THR A 131 2.127 10.708 -14.347 1.00 3.76 O ATOM 1926 CB THR A 131 3.175 7.801 -13.496 1.00 1.65 C ATOM 1927 OG1 THR A 131 4.071 8.382 -14.412 1.00 2.31 O ATOM 1928 CG2 THR A 131 2.323 6.791 -14.263 1.00 2.42 C ATOM 0 H THR A 131 1.302 7.434 -11.768 1.00 1.78 H new ATOM 0 HA THR A 131 3.141 9.586 -12.361 1.00 1.94 H new ATOM 0 HB THR A 131 3.667 7.247 -12.696 1.00 1.65 H new ATOM 0 HG1 THR A 131 4.578 7.677 -14.865 1.00 2.31 H new ATOM 0 HG21 THR A 131 2.970 6.041 -14.718 1.00 2.42 H new ATOM 0 HG22 THR A 131 1.630 6.304 -13.577 1.00 2.42 H new ATOM 0 HG23 THR A 131 1.761 7.306 -15.042 1.00 2.42 H new ATOM 1936 N ASP A 132 0.288 9.463 -13.885 1.00 3.74 N ATOM 1937 CA ASP A 132 -0.737 10.176 -14.658 1.00 5.18 C ATOM 1938 C ASP A 132 -1.923 10.412 -13.696 1.00 6.12 C ATOM 1939 O ASP A 132 -2.750 9.524 -13.476 1.00 7.28 O ATOM 1940 CB ASP A 132 -1.103 9.326 -15.900 1.00 5.61 C ATOM 1941 CG ASP A 132 -1.484 10.151 -17.141 1.00 6.31 C ATOM 1942 OD1 ASP A 132 -2.620 10.662 -17.212 1.00 7.32 O ATOM 1943 OD2 ASP A 132 -0.639 10.194 -18.081 1.00 6.33 O ATOM 0 H ASP A 132 -0.102 8.654 -13.401 1.00 3.74 H new ATOM 0 HA ASP A 132 -0.402 11.141 -15.038 1.00 5.18 H new ATOM 0 HB2 ASP A 132 -0.257 8.685 -16.150 1.00 5.61 H new ATOM 0 HB3 ASP A 132 -1.935 8.670 -15.645 1.00 5.61 H new ATOM 1948 N GLY A 133 -1.931 11.570 -13.019 1.00 5.91 N ATOM 1949 CA GLY A 133 -2.810 11.893 -11.884 1.00 6.49 C ATOM 1950 C GLY A 133 -2.335 13.142 -11.131 1.00 6.26 C ATOM 1951 O GLY A 133 -2.141 14.149 -11.804 1.00 7.04 O ATOM 0 H GLY A 133 -1.301 12.337 -13.256 1.00 5.91 H new ATOM 0 HA2 GLY A 133 -3.826 12.051 -12.245 1.00 6.49 H new ATOM 0 HA3 GLY A 133 -2.844 11.046 -11.198 1.00 6.49 H new ATOM 1955 N ARG A 134 -2.197 13.074 -9.783 1.00 5.65 N ATOM 1956 CA ARG A 134 -1.816 14.192 -8.854 1.00 5.68 C ATOM 1957 C ARG A 134 -1.779 13.944 -7.319 1.00 5.20 C ATOM 1958 O ARG A 134 -1.512 14.874 -6.561 1.00 4.89 O ATOM 1959 CB ARG A 134 -2.623 15.481 -9.167 1.00 6.52 C ATOM 1960 CG ARG A 134 -4.152 15.267 -9.091 1.00 8.57 C ATOM 1961 CD ARG A 134 -4.940 15.941 -10.232 1.00 9.92 C ATOM 1962 NE ARG A 134 -5.738 17.082 -9.759 1.00 11.24 N ATOM 1963 CZ ARG A 134 -6.729 17.671 -10.412 1.00 12.77 C ATOM 1964 NH1 ARG A 134 -7.077 17.341 -11.632 1.00 13.38 N ATOM 1965 NH2 ARG A 134 -7.482 18.550 -9.797 1.00 14.03 N ATOM 0 H ARG A 134 -2.354 12.200 -9.280 1.00 5.65 H new ATOM 0 HA ARG A 134 -0.757 14.296 -9.090 1.00 5.68 H new ATOM 0 HB2 ARG A 134 -2.335 16.263 -8.464 1.00 6.52 H new ATOM 0 HB3 ARG A 134 -2.360 15.835 -10.164 1.00 6.52 H new ATOM 0 HG2 ARG A 134 -4.359 14.197 -9.104 1.00 8.57 H new ATOM 0 HG3 ARG A 134 -4.515 15.651 -8.137 1.00 8.57 H new ATOM 0 HD2 ARG A 134 -4.245 16.280 -11.000 1.00 9.92 H new ATOM 0 HD3 ARG A 134 -5.598 15.208 -10.699 1.00 9.92 H new ATOM 0 HE ARG A 134 -5.506 17.456 -8.839 1.00 11.24 H new ATOM 0 HH11 ARG A 134 -6.577 16.599 -12.122 1.00 13.38 H new ATOM 0 HH12 ARG A 134 -7.848 17.826 -12.091 1.00 13.38 H new ATOM 0 HH21 ARG A 134 -7.304 18.779 -8.819 1.00 14.03 H new ATOM 0 HH22 ARG A 134 -8.246 19.006 -10.296 1.00 14.03 H new ATOM 1979 N THR A 135 -2.032 12.726 -6.824 1.00 5.59 N ATOM 1980 CA THR A 135 -1.889 12.359 -5.391 1.00 5.18 C ATOM 1981 C THR A 135 -0.422 12.452 -4.939 1.00 3.70 C ATOM 1982 O THR A 135 0.476 12.385 -5.778 1.00 3.73 O ATOM 1983 CB THR A 135 -2.513 10.977 -5.132 1.00 6.39 C ATOM 1984 OG1 THR A 135 -3.671 10.826 -5.921 1.00 7.86 O ATOM 1985 CG2 THR A 135 -2.954 10.796 -3.681 1.00 6.60 C ATOM 0 H THR A 135 -2.346 11.950 -7.407 1.00 5.59 H new ATOM 0 HA THR A 135 -2.438 13.077 -4.781 1.00 5.18 H new ATOM 0 HB THR A 135 -1.744 10.243 -5.374 1.00 6.39 H new ATOM 0 HG1 THR A 135 -4.066 9.945 -5.756 1.00 7.86 H new ATOM 0 HG21 THR A 135 -3.387 9.804 -3.553 1.00 6.60 H new ATOM 0 HG22 THR A 135 -2.092 10.903 -3.023 1.00 6.60 H new ATOM 0 HG23 THR A 135 -3.698 11.552 -3.430 1.00 6.60 H new ATOM 1993 N LEU A 136 -0.167 12.592 -3.629 1.00 3.14 N ATOM 1994 CA LEU A 136 1.173 12.759 -3.033 1.00 2.16 C ATOM 1995 C LEU A 136 1.222 12.421 -1.521 1.00 1.73 C ATOM 1996 O LEU A 136 0.786 11.343 -1.122 1.00 1.70 O ATOM 1997 CB LEU A 136 1.811 14.125 -3.427 1.00 2.87 C ATOM 1998 CG LEU A 136 1.135 15.434 -2.937 1.00 3.36 C ATOM 1999 CD1 LEU A 136 2.166 16.572 -3.002 1.00 4.11 C ATOM 2000 CD2 LEU A 136 -0.092 15.838 -3.764 1.00 4.22 C ATOM 0 H LEU A 136 -0.910 12.592 -2.930 1.00 3.14 H new ATOM 0 HA LEU A 136 1.821 12.002 -3.475 1.00 2.16 H new ATOM 0 HB2 LEU A 136 2.838 14.127 -3.062 1.00 2.87 H new ATOM 0 HB3 LEU A 136 1.859 14.165 -4.515 1.00 2.87 H new ATOM 0 HG LEU A 136 0.788 15.252 -1.920 1.00 3.36 H new ATOM 0 HD11 LEU A 136 1.706 17.499 -2.661 1.00 4.11 H new ATOM 0 HD12 LEU A 136 3.015 16.331 -2.362 1.00 4.11 H new ATOM 0 HD13 LEU A 136 2.509 16.694 -4.029 1.00 4.11 H new ATOM 0 HD21 LEU A 136 -0.512 16.761 -3.364 1.00 4.22 H new ATOM 0 HD22 LEU A 136 0.204 15.993 -4.802 1.00 4.22 H new ATOM 0 HD23 LEU A 136 -0.841 15.047 -3.715 1.00 4.22 H new ATOM 2012 N ASN A 137 1.805 13.292 -0.684 1.00 1.64 N ATOM 2013 CA ASN A 137 1.987 13.148 0.758 1.00 1.48 C ATOM 2014 C ASN A 137 0.649 13.341 1.489 1.00 1.36 C ATOM 2015 O ASN A 137 0.065 14.424 1.514 1.00 1.75 O ATOM 2016 CB ASN A 137 3.065 14.132 1.246 1.00 1.78 C ATOM 2017 CG ASN A 137 3.389 13.960 2.729 1.00 2.33 C ATOM 2018 OD1 ASN A 137 3.386 12.861 3.258 1.00 3.40 O ATOM 2019 ND2 ASN A 137 3.657 15.040 3.434 1.00 2.70 N ATOM 0 H ASN A 137 2.186 14.174 -1.026 1.00 1.64 H new ATOM 0 HA ASN A 137 2.331 12.139 0.985 1.00 1.48 H new ATOM 0 HB2 ASN A 137 3.973 13.990 0.661 1.00 1.78 H new ATOM 0 HB3 ASN A 137 2.727 15.153 1.068 1.00 1.78 H new ATOM 0 HD21 ASN A 137 3.864 14.961 4.430 1.00 2.70 H new ATOM 0 HD22 ASN A 137 3.658 15.955 2.984 1.00 2.70 H new ATOM 2026 N VAL A 138 0.186 12.248 2.070 1.00 1.09 N ATOM 2027 CA VAL A 138 -1.164 12.013 2.617 1.00 1.21 C ATOM 2028 C VAL A 138 -1.072 11.390 4.028 1.00 0.98 C ATOM 2029 O VAL A 138 -0.044 10.831 4.411 1.00 1.05 O ATOM 2030 CB VAL A 138 -1.949 11.116 1.619 1.00 1.55 C ATOM 2031 CG1 VAL A 138 -3.264 10.529 2.166 1.00 1.69 C ATOM 2032 CG2 VAL A 138 -2.301 11.903 0.340 1.00 2.00 C ATOM 0 H VAL A 138 0.782 11.429 2.187 1.00 1.09 H new ATOM 0 HA VAL A 138 -1.702 12.954 2.731 1.00 1.21 H new ATOM 0 HB VAL A 138 -1.271 10.286 1.422 1.00 1.55 H new ATOM 0 HG11 VAL A 138 -3.738 9.919 1.397 1.00 1.69 H new ATOM 0 HG12 VAL A 138 -3.052 9.912 3.039 1.00 1.69 H new ATOM 0 HG13 VAL A 138 -3.934 11.340 2.450 1.00 1.69 H new ATOM 0 HG21 VAL A 138 -2.850 11.257 -0.345 1.00 2.00 H new ATOM 0 HG22 VAL A 138 -2.918 12.763 0.600 1.00 2.00 H new ATOM 0 HG23 VAL A 138 -1.384 12.246 -0.140 1.00 2.00 H new ATOM 2042 N ALA A 139 -2.140 11.505 4.823 1.00 1.09 N ATOM 2043 CA ALA A 139 -2.250 10.875 6.140 1.00 1.15 C ATOM 2044 C ALA A 139 -2.816 9.440 6.059 1.00 1.15 C ATOM 2045 O ALA A 139 -3.956 9.230 5.640 1.00 1.44 O ATOM 2046 CB ALA A 139 -3.103 11.786 7.031 1.00 1.62 C ATOM 0 H ALA A 139 -2.965 12.047 4.565 1.00 1.09 H new ATOM 0 HA ALA A 139 -1.257 10.763 6.575 1.00 1.15 H new ATOM 0 HB1 ALA A 139 -3.201 11.339 8.020 1.00 1.62 H new ATOM 0 HB2 ALA A 139 -2.624 12.761 7.119 1.00 1.62 H new ATOM 0 HB3 ALA A 139 -4.092 11.906 6.588 1.00 1.62 H new ATOM 2052 N ALA A 140 -2.037 8.463 6.534 1.00 1.18 N ATOM 2053 CA ALA A 140 -2.440 7.079 6.774 1.00 1.14 C ATOM 2054 C ALA A 140 -2.735 6.844 8.262 1.00 1.13 C ATOM 2055 O ALA A 140 -2.224 7.560 9.134 1.00 1.26 O ATOM 2056 CB ALA A 140 -1.330 6.134 6.290 1.00 1.14 C ATOM 0 H ALA A 140 -1.059 8.627 6.773 1.00 1.18 H new ATOM 0 HA ALA A 140 -3.355 6.876 6.218 1.00 1.14 H new ATOM 0 HB1 ALA A 140 -1.628 5.101 6.468 1.00 1.14 H new ATOM 0 HB2 ALA A 140 -1.163 6.285 5.223 1.00 1.14 H new ATOM 0 HB3 ALA A 140 -0.410 6.345 6.835 1.00 1.14 H new ATOM 2062 N THR A 141 -3.515 5.794 8.528 1.00 1.10 N ATOM 2063 CA THR A 141 -3.962 5.368 9.860 1.00 1.16 C ATOM 2064 C THR A 141 -3.660 3.882 10.004 1.00 0.92 C ATOM 2065 O THR A 141 -3.919 3.103 9.091 1.00 1.01 O ATOM 2066 CB THR A 141 -5.475 5.591 10.032 1.00 1.48 C ATOM 2067 OG1 THR A 141 -5.896 6.815 9.463 1.00 1.69 O ATOM 2068 CG2 THR A 141 -5.849 5.616 11.515 1.00 1.68 C ATOM 0 H THR A 141 -3.870 5.188 7.788 1.00 1.10 H new ATOM 0 HA THR A 141 -3.442 5.953 10.619 1.00 1.16 H new ATOM 0 HB THR A 141 -5.969 4.764 9.521 1.00 1.48 H new ATOM 0 HG1 THR A 141 -6.862 6.920 9.591 1.00 1.69 H new ATOM 0 HG21 THR A 141 -6.923 5.775 11.617 1.00 1.68 H new ATOM 0 HG22 THR A 141 -5.577 4.666 11.975 1.00 1.68 H new ATOM 0 HG23 THR A 141 -5.314 6.425 12.012 1.00 1.68 H new ATOM 2076 N VAL A 142 -3.150 3.481 11.161 1.00 1.03 N ATOM 2077 CA VAL A 142 -3.023 2.058 11.535 1.00 0.91 C ATOM 2078 C VAL A 142 -4.304 1.571 12.231 1.00 1.12 C ATOM 2079 O VAL A 142 -4.814 2.259 13.112 1.00 1.54 O ATOM 2080 CB VAL A 142 -1.772 1.807 12.411 1.00 1.07 C ATOM 2081 CG1 VAL A 142 -1.622 2.811 13.544 1.00 2.73 C ATOM 2082 CG2 VAL A 142 -1.698 0.382 12.989 1.00 2.32 C ATOM 0 H VAL A 142 -2.809 4.125 11.875 1.00 1.03 H new ATOM 0 HA VAL A 142 -2.890 1.479 10.621 1.00 0.91 H new ATOM 0 HB VAL A 142 -0.942 1.937 11.716 1.00 1.07 H new ATOM 0 HG11 VAL A 142 -0.726 2.579 14.120 1.00 2.73 H new ATOM 0 HG12 VAL A 142 -1.538 3.816 13.131 1.00 2.73 H new ATOM 0 HG13 VAL A 142 -2.495 2.758 14.195 1.00 2.73 H new ATOM 0 HG21 VAL A 142 -0.795 0.280 13.591 1.00 2.32 H new ATOM 0 HG22 VAL A 142 -2.573 0.196 13.612 1.00 2.32 H new ATOM 0 HG23 VAL A 142 -1.673 -0.341 12.173 1.00 2.32 H new ATOM 2092 N LYS A 143 -4.799 0.373 11.877 1.00 1.09 N ATOM 2093 CA LYS A 143 -5.959 -0.258 12.536 1.00 1.34 C ATOM 2094 C LYS A 143 -6.082 -1.785 12.280 1.00 1.39 C ATOM 2095 O LYS A 143 -6.419 -2.230 11.180 1.00 2.00 O ATOM 2096 CB LYS A 143 -7.265 0.494 12.171 1.00 1.98 C ATOM 2097 CG LYS A 143 -8.382 0.183 13.186 1.00 2.45 C ATOM 2098 CD LYS A 143 -9.590 1.113 13.008 1.00 3.41 C ATOM 2099 CE LYS A 143 -10.585 0.903 14.159 1.00 4.24 C ATOM 2100 NZ LYS A 143 -11.694 1.885 14.133 1.00 5.17 N ATOM 0 H LYS A 143 -4.405 -0.189 11.122 1.00 1.09 H new ATOM 0 HA LYS A 143 -5.787 -0.169 13.609 1.00 1.34 H new ATOM 0 HB2 LYS A 143 -7.077 1.567 12.149 1.00 1.98 H new ATOM 0 HB3 LYS A 143 -7.587 0.206 11.170 1.00 1.98 H new ATOM 0 HG2 LYS A 143 -8.701 -0.853 13.070 1.00 2.45 H new ATOM 0 HG3 LYS A 143 -7.991 0.284 14.199 1.00 2.45 H new ATOM 0 HD2 LYS A 143 -9.260 2.152 12.986 1.00 3.41 H new ATOM 0 HD3 LYS A 143 -10.077 0.913 12.054 1.00 3.41 H new ATOM 0 HE2 LYS A 143 -10.995 -0.105 14.102 1.00 4.24 H new ATOM 0 HE3 LYS A 143 -10.058 0.979 15.110 1.00 4.24 H new ATOM 0 HZ1 LYS A 143 -12.338 1.702 14.929 1.00 5.17 H new ATOM 0 HZ2 LYS A 143 -11.308 2.847 14.214 1.00 5.17 H new ATOM 0 HZ3 LYS A 143 -12.216 1.796 13.238 1.00 5.17 H new ATOM 2114 N LYS A 144 -5.813 -2.579 13.328 1.00 1.45 N ATOM 2115 CA LYS A 144 -5.834 -4.052 13.300 1.00 1.69 C ATOM 2116 C LYS A 144 -4.971 -4.627 12.154 1.00 1.87 C ATOM 2117 O LYS A 144 -4.012 -3.973 11.758 1.00 3.40 O ATOM 2118 CB LYS A 144 -7.291 -4.580 13.365 1.00 3.07 C ATOM 2119 CG LYS A 144 -7.400 -5.823 14.276 1.00 3.33 C ATOM 2120 CD LYS A 144 -8.773 -6.515 14.215 1.00 4.61 C ATOM 2121 CE LYS A 144 -8.803 -7.593 13.119 1.00 5.82 C ATOM 2122 NZ LYS A 144 -10.141 -8.220 12.973 1.00 6.96 N ATOM 0 H LYS A 144 -5.568 -2.205 14.245 1.00 1.45 H new ATOM 0 HA LYS A 144 -5.349 -4.432 14.199 1.00 1.69 H new ATOM 0 HB2 LYS A 144 -7.948 -3.795 13.739 1.00 3.07 H new ATOM 0 HB3 LYS A 144 -7.634 -4.831 12.361 1.00 3.07 H new ATOM 0 HG2 LYS A 144 -6.629 -6.539 13.992 1.00 3.33 H new ATOM 0 HG3 LYS A 144 -7.197 -5.527 15.305 1.00 3.33 H new ATOM 0 HD2 LYS A 144 -8.998 -6.968 15.181 1.00 4.61 H new ATOM 0 HD3 LYS A 144 -9.549 -5.774 14.022 1.00 4.61 H new ATOM 0 HE2 LYS A 144 -8.508 -7.148 12.169 1.00 5.82 H new ATOM 0 HE3 LYS A 144 -8.068 -8.363 13.352 1.00 5.82 H new ATOM 0 HZ1 LYS A 144 -10.107 -8.939 12.222 1.00 6.96 H new ATOM 0 HZ2 LYS A 144 -10.414 -8.669 13.870 1.00 6.96 H new ATOM 0 HZ3 LYS A 144 -10.840 -7.492 12.724 1.00 6.96 H new ATOM 2136 N ASN A 145 -5.282 -5.838 11.655 1.00 1.81 N ATOM 2137 CA ASN A 145 -4.536 -6.642 10.652 1.00 2.80 C ATOM 2138 C ASN A 145 -3.106 -7.008 11.104 1.00 3.33 C ATOM 2139 O ASN A 145 -2.475 -6.231 11.806 1.00 4.85 O ATOM 2140 CB ASN A 145 -4.554 -5.964 9.270 1.00 4.13 C ATOM 2141 CG ASN A 145 -5.953 -6.014 8.672 1.00 4.90 C ATOM 2142 OD1 ASN A 145 -6.329 -6.993 8.044 1.00 5.13 O ATOM 2143 ND2 ASN A 145 -6.763 -4.998 8.908 1.00 5.85 N ATOM 0 H ASN A 145 -6.125 -6.323 11.962 1.00 1.81 H new ATOM 0 HA ASN A 145 -5.063 -7.592 10.563 1.00 2.80 H new ATOM 0 HB2 ASN A 145 -4.228 -4.928 9.362 1.00 4.13 H new ATOM 0 HB3 ASN A 145 -3.849 -6.462 8.604 1.00 4.13 H new ATOM 0 HD21 ASN A 145 -7.723 -5.021 8.564 1.00 5.85 H new ATOM 0 HD22 ASN A 145 -6.429 -4.191 9.434 1.00 5.85 H new ATOM 2150 N ILE A 146 -2.572 -8.194 10.766 1.00 3.10 N ATOM 2151 CA ILE A 146 -1.353 -8.730 11.407 1.00 3.94 C ATOM 2152 C ILE A 146 -0.869 -10.026 10.727 1.00 4.20 C ATOM 2153 O ILE A 146 -1.589 -11.022 10.656 1.00 4.43 O ATOM 2154 CB ILE A 146 -1.536 -8.860 12.955 1.00 4.34 C ATOM 2155 CG1 ILE A 146 -0.219 -9.244 13.650 1.00 6.10 C ATOM 2156 CG2 ILE A 146 -2.683 -9.811 13.350 1.00 4.58 C ATOM 2157 CD1 ILE A 146 -0.201 -8.999 15.163 1.00 7.73 C ATOM 0 H ILE A 146 -2.966 -8.804 10.050 1.00 3.10 H new ATOM 0 HA ILE A 146 -0.548 -8.010 11.260 1.00 3.94 H new ATOM 0 HB ILE A 146 -1.825 -7.871 13.310 1.00 4.34 H new ATOM 0 HG12 ILE A 146 -0.019 -10.299 13.464 1.00 6.10 H new ATOM 0 HG13 ILE A 146 0.595 -8.680 13.194 1.00 6.10 H new ATOM 0 HG21 ILE A 146 -2.759 -9.858 14.436 1.00 4.58 H new ATOM 0 HG22 ILE A 146 -3.621 -9.441 12.937 1.00 4.58 H new ATOM 0 HG23 ILE A 146 -2.481 -10.807 12.957 1.00 4.58 H new ATOM 0 HD11 ILE A 146 0.765 -9.298 15.569 1.00 7.73 H new ATOM 0 HD12 ILE A 146 -0.366 -7.940 15.362 1.00 7.73 H new ATOM 0 HD13 ILE A 146 -0.990 -9.584 15.636 1.00 7.73 H new ATOM 2169 N GLU A 147 0.377 -10.006 10.257 1.00 4.88 N ATOM 2170 CA GLU A 147 1.169 -11.172 9.803 1.00 6.09 C ATOM 2171 C GLU A 147 1.242 -12.295 10.868 1.00 6.10 C ATOM 2172 O GLU A 147 1.192 -13.474 10.513 1.00 7.36 O ATOM 2173 CB GLU A 147 2.587 -10.646 9.466 1.00 7.16 C ATOM 2174 CG GLU A 147 3.693 -11.682 9.173 1.00 8.42 C ATOM 2175 CD GLU A 147 3.677 -12.310 7.769 1.00 9.66 C ATOM 2176 OE1 GLU A 147 2.764 -12.012 6.945 1.00 9.72 O ATOM 2177 OE2 GLU A 147 4.637 -13.059 7.493 1.00 10.98 O ATOM 0 H GLU A 147 0.899 -9.134 10.174 1.00 4.88 H new ATOM 0 HA GLU A 147 0.690 -11.622 8.933 1.00 6.09 H new ATOM 0 HB2 GLU A 147 2.503 -9.992 8.598 1.00 7.16 H new ATOM 0 HB3 GLU A 147 2.921 -10.028 10.299 1.00 7.16 H new ATOM 0 HG2 GLU A 147 4.660 -11.203 9.324 1.00 8.42 H new ATOM 0 HG3 GLU A 147 3.616 -12.483 9.908 1.00 8.42 H new