USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 914 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 127 THR OG1 : rot -42:sc= 0.97 USER MOD Set 1.2: A 137 ASN :FLIP amide:sc= 0.717 F(o=1,f=1.7) USER MOD Set 2.1: A 50 THR OG1 : rot -54:sc= 1.08 USER MOD Set 2.2: A 101 THR OG1 : rot -14:sc= 2.17 USER MOD Set 3.1: A 77 THR OG1 : rot 180:sc= -0.134 USER MOD Set 3.2: A 79 HIS : no HD1:sc= -0.0313 X(o=-0.17,f=-0.23) USER MOD Set 4.1: A 75 MET CE :methyl 145:sc= 0 (180deg=-0.134) USER MOD Set 4.2: A 110 MET CE :methyl -145:sc= -0.38 (180deg=-1.75) USER MOD Single : A 29 THR OG1 : rot -52:sc= 0.194 USER MOD Single : A 31 GLN : amide:sc= 0.436 K(o=0.44,f=-6.9!) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 160:sc= 0.869 USER MOD Single : A 48 TYR OH : rot 180:sc=-0.00422 USER MOD Single : A 49 MET CE :methyl -138:sc= -0.193 (180deg=-0.608) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -2.11 K(o=-2.1,f=-4.8!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= 1.1 K(o=1.1,f=-0.0059) USER MOD Single : A 60 LYS NZ :NH3+ -161:sc= 1.18 (180deg=0.752) USER MOD Single : A 66 THR OG1 : rot 82:sc= 0.98 USER MOD Single : A 70 THR OG1 : rot 85:sc= 0.019 USER MOD Single : A 71 SER OG : rot -59:sc= 0.287 USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot -130:sc= -0.426 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0.137 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 MET CE :methyl 176:sc= 0 (180deg=-0.0418) USER MOD Single : A 93 THR OG1 : rot 59:sc= 0.618 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= 0.682 K(o=0.68,f=0) USER MOD Single : A 108 HIS : no HD1:sc= -2.02 K(o=-2,f=-5!) USER MOD Single : A 112 MET CE :methyl 178:sc= -0.0909 (180deg=-0.103) USER MOD Single : A 115 LYS NZ :NH3+ 151:sc= 2.48 (180deg=2.04) USER MOD Single : A 119 LYS NZ :NH3+ 179:sc= 1.19 (180deg=1.06) USER MOD Single : A 123 THR OG1 : rot 9:sc= 0.453 USER MOD Single : A 125 ASN : amide:sc= 0 K(o=0,f=-0.9) 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= -0.333 USER MOD Single : A 141 THR OG1 : rot 79:sc= 0.833 USER MOD Single : A 143 LYS NZ :NH3+ 162:sc= -0.257 (180deg=-0.75) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 369 N VAL A 28 -5.140 1.916 4.499 1.00 10.00 N ATOM 370 CA VAL A 28 -4.581 1.136 3.402 1.00 10.00 C ATOM 371 C VAL A 28 -3.051 1.258 3.319 1.00 10.00 C ATOM 372 O VAL A 28 -2.497 1.556 2.263 1.00 10.00 O ATOM 373 CB VAL A 28 -5.275 1.596 2.100 1.00 10.00 C ATOM 374 CG1 VAL A 28 -6.748 1.163 2.096 1.00 10.00 C ATOM 375 CG2 VAL A 28 -5.199 3.113 1.854 1.00 10.00 C ATOM 0 HA VAL A 28 -4.770 0.076 3.569 1.00 10.00 H new ATOM 0 HB VAL A 28 -4.727 1.113 1.291 1.00 10.00 H new ATOM 0 HG11 VAL A 28 -7.222 1.495 1.172 1.00 10.00 H new ATOM 0 HG12 VAL A 28 -6.808 0.077 2.165 1.00 10.00 H new ATOM 0 HG13 VAL A 28 -7.261 1.610 2.948 1.00 10.00 H new ATOM 0 HG21 VAL A 28 -5.708 3.356 0.922 1.00 10.00 H new ATOM 0 HG22 VAL A 28 -5.680 3.640 2.678 1.00 10.00 H new ATOM 0 HG23 VAL A 28 -4.155 3.419 1.788 1.00 10.00 H new ATOM 385 N THR A 29 -2.348 0.977 4.420 1.00 10.00 N ATOM 386 CA THR A 29 -0.891 1.026 4.470 1.00 10.00 C ATOM 387 C THR A 29 -0.380 0.209 5.663 1.00 10.00 C ATOM 388 O THR A 29 0.418 0.669 6.476 1.00 10.00 O ATOM 389 CB THR A 29 -0.455 2.506 4.462 1.00 10.00 C ATOM 390 OG1 THR A 29 0.949 2.668 4.471 1.00 10.00 O ATOM 391 CG2 THR A 29 -1.078 3.311 5.610 1.00 10.00 C ATOM 0 H THR A 29 -2.780 0.708 5.304 1.00 10.00 H new ATOM 0 HA THR A 29 -0.437 0.561 3.595 1.00 10.00 H new ATOM 0 HB THR A 29 -0.833 2.903 3.520 1.00 10.00 H new ATOM 0 HG1 THR A 29 1.334 2.144 5.204 1.00 10.00 H new ATOM 0 HG21 THR A 29 -0.737 4.345 5.556 1.00 10.00 H new ATOM 0 HG22 THR A 29 -2.164 3.282 5.527 1.00 10.00 H new ATOM 0 HG23 THR A 29 -0.775 2.879 6.564 1.00 10.00 H new ATOM 399 N VAL A 30 -0.792 -1.057 5.746 1.00 10.00 N ATOM 400 CA VAL A 30 -0.411 -1.912 6.867 1.00 10.00 C ATOM 401 C VAL A 30 0.959 -2.556 6.619 1.00 10.00 C ATOM 402 O VAL A 30 1.081 -3.773 6.506 1.00 10.00 O ATOM 403 CB VAL A 30 -1.561 -2.870 7.249 1.00 10.00 C ATOM 404 CG1 VAL A 30 -2.018 -3.807 6.122 1.00 10.00 C ATOM 405 CG2 VAL A 30 -1.241 -3.673 8.519 1.00 10.00 C ATOM 0 H VAL A 30 -1.387 -1.510 5.052 1.00 10.00 H new ATOM 0 HA VAL A 30 -0.263 -1.313 7.766 1.00 10.00 H new ATOM 0 HB VAL A 30 -2.405 -2.209 7.448 1.00 10.00 H new ATOM 0 HG11 VAL A 30 -2.828 -4.442 6.482 1.00 10.00 H new ATOM 0 HG12 VAL A 30 -2.370 -3.215 5.277 1.00 10.00 H new ATOM 0 HG13 VAL A 30 -1.182 -4.430 5.806 1.00 10.00 H new ATOM 0 HG21 VAL A 30 -2.076 -4.334 8.752 1.00 10.00 H new ATOM 0 HG22 VAL A 30 -0.342 -4.268 8.357 1.00 10.00 H new ATOM 0 HG23 VAL A 30 -1.078 -2.988 9.351 1.00 10.00 H new ATOM 415 N GLN A 31 2.006 -1.729 6.550 1.00 10.00 N ATOM 416 CA GLN A 31 3.388 -2.192 6.547 1.00 10.00 C ATOM 417 C GLN A 31 4.308 -1.080 7.068 1.00 10.00 C ATOM 418 O GLN A 31 4.008 0.098 6.885 1.00 10.00 O ATOM 419 CB GLN A 31 3.759 -2.631 5.122 1.00 10.00 C ATOM 420 CG GLN A 31 5.188 -3.167 4.961 1.00 10.00 C ATOM 421 CD GLN A 31 5.480 -4.355 5.872 1.00 10.00 C ATOM 422 OE1 GLN A 31 5.733 -4.182 7.061 1.00 10.00 O ATOM 423 NE2 GLN A 31 5.439 -5.570 5.332 1.00 10.00 N ATOM 0 H GLN A 31 1.913 -0.715 6.494 1.00 10.00 H new ATOM 0 HA GLN A 31 3.509 -3.049 7.210 1.00 10.00 H new ATOM 0 HB2 GLN A 31 3.059 -3.403 4.802 1.00 10.00 H new ATOM 0 HB3 GLN A 31 3.627 -1.783 4.450 1.00 10.00 H new ATOM 0 HG2 GLN A 31 5.345 -3.463 3.924 1.00 10.00 H new ATOM 0 HG3 GLN A 31 5.897 -2.368 5.175 1.00 10.00 H new ATOM 0 HE21 GLN A 31 5.226 -5.681 4.341 1.00 10.00 H new ATOM 0 HE22 GLN A 31 5.621 -6.391 5.909 1.00 10.00 H new ATOM 432 N GLY A 32 5.422 -1.457 7.704 1.00 10.00 N ATOM 433 CA GLY A 32 6.496 -0.554 8.105 1.00 10.00 C ATOM 434 C GLY A 32 7.595 -0.586 7.044 1.00 10.00 C ATOM 435 O GLY A 32 7.822 -1.625 6.426 1.00 10.00 O ATOM 0 H GLY A 32 5.603 -2.428 7.960 1.00 10.00 H new ATOM 0 HA2 GLY A 32 6.112 0.460 8.219 1.00 10.00 H new ATOM 0 HA3 GLY A 32 6.898 -0.854 9.073 1.00 10.00 H new ATOM 439 N ALA A 33 8.264 0.541 6.793 1.00 10.00 N ATOM 440 CA ALA A 33 9.198 0.633 5.681 1.00 10.00 C ATOM 441 C ALA A 33 10.564 0.057 6.054 1.00 10.00 C ATOM 442 O ALA A 33 10.907 -0.052 7.234 1.00 10.00 O ATOM 443 CB ALA A 33 9.293 2.089 5.214 1.00 10.00 C ATOM 0 H ALA A 33 8.174 1.395 7.344 1.00 10.00 H new ATOM 0 HA ALA A 33 8.828 0.031 4.851 1.00 10.00 H new ATOM 0 HB1 ALA A 33 9.992 2.159 4.381 1.00 10.00 H new ATOM 0 HB2 ALA A 33 8.310 2.433 4.892 1.00 10.00 H new ATOM 0 HB3 ALA A 33 9.644 2.713 6.036 1.00 10.00 H new ATOM 449 N THR A 34 11.369 -0.276 5.042 1.00 10.00 N ATOM 450 CA THR A 34 12.799 -0.495 5.178 1.00 10.00 C ATOM 451 C THR A 34 13.489 0.459 4.205 1.00 10.00 C ATOM 452 O THR A 34 12.989 0.628 3.095 1.00 10.00 O ATOM 453 CB THR A 34 13.119 -1.963 4.866 1.00 10.00 C ATOM 454 OG1 THR A 34 12.410 -2.788 5.767 1.00 10.00 O ATOM 455 CG2 THR A 34 14.608 -2.285 4.990 1.00 10.00 C ATOM 0 H THR A 34 11.031 -0.402 4.088 1.00 10.00 H new ATOM 0 HA THR A 34 13.150 -0.298 6.191 1.00 10.00 H new ATOM 0 HB THR A 34 12.824 -2.144 3.833 1.00 10.00 H new ATOM 0 HG1 THR A 34 12.607 -3.728 5.574 1.00 10.00 H new ATOM 0 HG21 THR A 34 14.773 -3.337 4.758 1.00 10.00 H new ATOM 0 HG22 THR A 34 15.173 -1.666 4.293 1.00 10.00 H new ATOM 0 HG23 THR A 34 14.941 -2.082 6.008 1.00 10.00 H new ATOM 463 N VAL A 35 14.610 1.076 4.597 1.00 10.00 N ATOM 464 CA VAL A 35 15.505 1.776 3.683 1.00 10.00 C ATOM 465 C VAL A 35 16.751 0.920 3.524 1.00 10.00 C ATOM 466 O VAL A 35 17.263 0.400 4.517 1.00 10.00 O ATOM 467 CB VAL A 35 15.824 3.198 4.178 1.00 10.00 C ATOM 468 CG1 VAL A 35 16.561 3.287 5.511 1.00 10.00 C ATOM 469 CG2 VAL A 35 16.626 3.965 3.117 1.00 10.00 C ATOM 0 H VAL A 35 14.920 1.101 5.569 1.00 10.00 H new ATOM 0 HA VAL A 35 15.029 1.913 2.712 1.00 10.00 H new ATOM 0 HB VAL A 35 14.845 3.647 4.348 1.00 10.00 H new ATOM 0 HG11 VAL A 35 16.734 4.334 5.762 1.00 10.00 H new ATOM 0 HG12 VAL A 35 15.959 2.821 6.291 1.00 10.00 H new ATOM 0 HG13 VAL A 35 17.518 2.770 5.433 1.00 10.00 H new ATOM 0 HG21 VAL A 35 16.844 4.969 3.481 1.00 10.00 H new ATOM 0 HG22 VAL A 35 17.560 3.440 2.917 1.00 10.00 H new ATOM 0 HG23 VAL A 35 16.044 4.031 2.198 1.00 10.00 H new ATOM 479 N ALA A 36 17.260 0.765 2.300 1.00 10.00 N ATOM 480 CA ALA A 36 18.368 -0.142 2.035 1.00 10.00 C ATOM 481 C ALA A 36 19.732 0.445 2.419 1.00 10.00 C ATOM 482 O ALA A 36 20.711 0.260 1.701 1.00 10.00 O ATOM 483 CB ALA A 36 18.316 -0.594 0.579 1.00 10.00 C ATOM 0 H ALA A 36 16.918 1.260 1.477 1.00 10.00 H new ATOM 0 HA ALA A 36 18.252 -1.015 2.678 1.00 10.00 H new ATOM 0 HB1 ALA A 36 19.145 -1.273 0.379 1.00 10.00 H new ATOM 0 HB2 ALA A 36 17.373 -1.107 0.391 1.00 10.00 H new ATOM 0 HB3 ALA A 36 18.393 0.275 -0.075 1.00 10.00 H new ATOM 489 N ALA A 37 19.792 1.124 3.568 1.00 10.00 N ATOM 490 CA ALA A 37 20.942 1.849 4.100 1.00 10.00 C ATOM 491 C ALA A 37 21.776 2.504 2.989 1.00 10.00 C ATOM 492 O ALA A 37 21.203 3.051 2.049 1.00 10.00 O ATOM 493 CB ALA A 37 21.743 0.920 5.022 1.00 10.00 C ATOM 0 H ALA A 37 18.985 1.184 4.189 1.00 10.00 H new ATOM 0 HA ALA A 37 20.598 2.688 4.705 1.00 10.00 H new ATOM 0 HB1 ALA A 37 22.603 1.457 5.422 1.00 10.00 H new ATOM 0 HB2 ALA A 37 21.109 0.588 5.844 1.00 10.00 H new ATOM 0 HB3 ALA A 37 22.087 0.054 4.456 1.00 10.00 H new ATOM 499 N VAL A 38 23.109 2.426 3.083 1.00 10.00 N ATOM 500 CA VAL A 38 24.003 2.627 1.953 1.00 10.00 C ATOM 501 C VAL A 38 24.354 1.225 1.444 1.00 10.00 C ATOM 502 O VAL A 38 25.074 0.505 2.139 1.00 10.00 O ATOM 503 CB VAL A 38 25.269 3.394 2.389 1.00 10.00 C ATOM 504 CG1 VAL A 38 26.285 3.503 1.246 1.00 10.00 C ATOM 505 CG2 VAL A 38 24.909 4.812 2.840 1.00 10.00 C ATOM 0 H VAL A 38 23.594 2.219 3.956 1.00 10.00 H new ATOM 0 HA VAL A 38 23.535 3.225 1.171 1.00 10.00 H new ATOM 0 HB VAL A 38 25.710 2.832 3.212 1.00 10.00 H new ATOM 0 HG11 VAL A 38 27.163 4.049 1.591 1.00 10.00 H new ATOM 0 HG12 VAL A 38 26.582 2.504 0.926 1.00 10.00 H new ATOM 0 HG13 VAL A 38 25.834 4.033 0.407 1.00 10.00 H new ATOM 0 HG21 VAL A 38 25.814 5.338 3.144 1.00 10.00 H new ATOM 0 HG22 VAL A 38 24.438 5.347 2.016 1.00 10.00 H new ATOM 0 HG23 VAL A 38 24.219 4.762 3.682 1.00 10.00 H new ATOM 515 N PRO A 39 23.853 0.800 0.276 1.00 10.00 N ATOM 516 CA PRO A 39 24.370 -0.377 -0.394 1.00 10.00 C ATOM 517 C PRO A 39 25.727 -0.002 -1.006 1.00 10.00 C ATOM 518 O PRO A 39 26.055 1.183 -1.075 1.00 10.00 O ATOM 519 CB PRO A 39 23.309 -0.716 -1.445 1.00 10.00 C ATOM 520 CG PRO A 39 22.683 0.632 -1.800 1.00 10.00 C ATOM 521 CD PRO A 39 22.910 1.511 -0.571 1.00 10.00 C ATOM 0 HA PRO A 39 24.541 -1.240 0.250 1.00 10.00 H new ATOM 0 HB2 PRO A 39 23.753 -1.191 -2.320 1.00 10.00 H new ATOM 0 HB3 PRO A 39 22.565 -1.408 -1.050 1.00 10.00 H new ATOM 0 HG2 PRO A 39 23.151 1.063 -2.685 1.00 10.00 H new ATOM 0 HG3 PRO A 39 21.620 0.528 -2.020 1.00 10.00 H new ATOM 0 HD2 PRO A 39 23.305 2.485 -0.859 1.00 10.00 H new ATOM 0 HD3 PRO A 39 21.973 1.690 -0.043 1.00 10.00 H new ATOM 529 N PRO A 40 26.544 -0.969 -1.449 1.00 10.00 N ATOM 530 CA PRO A 40 27.838 -0.697 -2.064 1.00 10.00 C ATOM 531 C PRO A 40 27.666 -0.108 -3.474 1.00 10.00 C ATOM 532 O PRO A 40 28.059 -0.720 -4.465 1.00 10.00 O ATOM 533 CB PRO A 40 28.566 -2.049 -2.055 1.00 10.00 C ATOM 534 CG PRO A 40 27.420 -3.059 -2.138 1.00 10.00 C ATOM 535 CD PRO A 40 26.340 -2.397 -1.286 1.00 10.00 C ATOM 0 HA PRO A 40 28.415 0.055 -1.526 1.00 10.00 H new ATOM 0 HB2 PRO A 40 29.250 -2.145 -2.898 1.00 10.00 H new ATOM 0 HB3 PRO A 40 29.157 -2.183 -1.149 1.00 10.00 H new ATOM 0 HG2 PRO A 40 27.089 -3.215 -3.165 1.00 10.00 H new ATOM 0 HG3 PRO A 40 27.708 -4.034 -1.744 1.00 10.00 H new ATOM 0 HD2 PRO A 40 25.344 -2.692 -1.615 1.00 10.00 H new ATOM 0 HD3 PRO A 40 26.430 -2.690 -0.240 1.00 10.00 H new ATOM 543 N SER A 41 27.083 1.092 -3.569 1.00 10.00 N ATOM 544 CA SER A 41 26.868 1.815 -4.812 1.00 10.00 C ATOM 545 C SER A 41 26.540 3.278 -4.488 1.00 10.00 C ATOM 546 O SER A 41 25.510 3.799 -4.909 1.00 10.00 O ATOM 547 CB SER A 41 25.764 1.134 -5.639 1.00 10.00 C ATOM 548 OG SER A 41 25.823 1.561 -6.988 1.00 10.00 O ATOM 0 H SER A 41 26.739 1.597 -2.752 1.00 10.00 H new ATOM 0 HA SER A 41 27.772 1.799 -5.421 1.00 10.00 H new ATOM 0 HB2 SER A 41 25.878 0.051 -5.588 1.00 10.00 H new ATOM 0 HB3 SER A 41 24.787 1.371 -5.218 1.00 10.00 H new ATOM 0 HG SER A 41 25.116 1.118 -7.502 1.00 10.00 H new ATOM 554 N ILE A 42 27.440 3.945 -3.752 1.00 10.00 N ATOM 555 CA ILE A 42 27.333 5.354 -3.390 1.00 10.00 C ATOM 556 C ILE A 42 26.212 5.520 -2.342 1.00 10.00 C ATOM 557 O ILE A 42 25.510 4.563 -2.026 1.00 10.00 O ATOM 558 CB ILE A 42 27.230 6.247 -4.657 1.00 10.00 C ATOM 559 CG1 ILE A 42 28.220 5.759 -5.744 1.00 10.00 C ATOM 560 CG2 ILE A 42 27.555 7.711 -4.327 1.00 10.00 C ATOM 561 CD1 ILE A 42 28.279 6.644 -6.992 1.00 10.00 C ATOM 0 H ILE A 42 28.283 3.502 -3.385 1.00 10.00 H new ATOM 0 HA ILE A 42 28.241 5.712 -2.904 1.00 10.00 H new ATOM 0 HB ILE A 42 26.206 6.176 -5.024 1.00 10.00 H new ATOM 0 HG12 ILE A 42 29.218 5.700 -5.309 1.00 10.00 H new ATOM 0 HG13 ILE A 42 27.942 4.748 -6.043 1.00 10.00 H new ATOM 0 HG21 ILE A 42 27.475 8.314 -5.231 1.00 10.00 H new ATOM 0 HG22 ILE A 42 26.851 8.081 -3.581 1.00 10.00 H new ATOM 0 HG23 ILE A 42 28.569 7.779 -3.934 1.00 10.00 H new ATOM 0 HD11 ILE A 42 28.997 6.228 -7.699 1.00 10.00 H new ATOM 0 HD12 ILE A 42 27.294 6.685 -7.456 1.00 10.00 H new ATOM 0 HD13 ILE A 42 28.589 7.650 -6.710 1.00 10.00 H new ATOM 573 N ARG A 43 26.081 6.705 -1.731 1.00 10.00 N ATOM 574 CA ARG A 43 25.033 7.018 -0.757 1.00 10.00 C ATOM 575 C ARG A 43 23.651 6.536 -1.200 1.00 10.00 C ATOM 576 O ARG A 43 22.849 6.080 -0.390 1.00 10.00 O ATOM 577 CB ARG A 43 25.001 8.528 -0.473 1.00 10.00 C ATOM 578 CG ARG A 43 24.648 9.386 -1.692 1.00 10.00 C ATOM 579 CD ARG A 43 25.274 10.783 -1.646 1.00 10.00 C ATOM 580 NE ARG A 43 24.954 11.536 -0.418 1.00 10.00 N ATOM 581 CZ ARG A 43 25.452 12.754 -0.145 1.00 10.00 C ATOM 582 NH1 ARG A 43 26.193 13.394 -1.056 1.00 10.00 N ATOM 583 NH2 ARG A 43 25.210 13.319 1.039 1.00 10.00 N ATOM 0 H ARG A 43 26.714 7.486 -1.905 1.00 10.00 H new ATOM 0 HA ARG A 43 25.281 6.479 0.157 1.00 10.00 H new ATOM 0 HB2 ARG A 43 24.276 8.723 0.317 1.00 10.00 H new ATOM 0 HB3 ARG A 43 25.976 8.837 -0.095 1.00 10.00 H new ATOM 0 HG2 ARG A 43 24.980 8.876 -2.596 1.00 10.00 H new ATOM 0 HG3 ARG A 43 23.564 9.482 -1.759 1.00 10.00 H new ATOM 0 HD2 ARG A 43 26.357 10.689 -1.733 1.00 10.00 H new ATOM 0 HD3 ARG A 43 24.933 11.353 -2.510 1.00 10.00 H new ATOM 0 HE ARG A 43 24.322 11.110 0.259 1.00 10.00 H new ATOM 0 HH11 ARG A 43 26.380 12.958 -1.959 1.00 10.00 H new ATOM 0 HH12 ARG A 43 26.571 14.318 -0.848 1.00 10.00 H new ATOM 0 HH21 ARG A 43 24.649 12.827 1.734 1.00 10.00 H new ATOM 0 HH22 ARG A 43 25.586 14.243 1.249 1.00 10.00 H new ATOM 597 N ASP A 44 23.379 6.729 -2.485 1.00 10.00 N ATOM 598 CA ASP A 44 22.126 6.485 -3.154 1.00 10.00 C ATOM 599 C ASP A 44 21.598 5.082 -2.882 1.00 10.00 C ATOM 600 O ASP A 44 22.350 4.117 -2.768 1.00 10.00 O ATOM 601 CB ASP A 44 22.380 6.780 -4.628 1.00 10.00 C ATOM 602 CG ASP A 44 22.780 8.245 -4.743 1.00 10.00 C ATOM 603 OD1 ASP A 44 21.894 9.090 -4.484 1.00 10.00 O ATOM 604 OD2 ASP A 44 23.991 8.492 -4.917 1.00 10.00 O ATOM 0 H ASP A 44 24.087 7.087 -3.126 1.00 10.00 H new ATOM 0 HA ASP A 44 21.330 7.129 -2.780 1.00 10.00 H new ATOM 0 HB2 ASP A 44 23.169 6.136 -5.017 1.00 10.00 H new ATOM 0 HB3 ASP A 44 21.486 6.580 -5.218 1.00 10.00 H new ATOM 609 N THR A 45 20.280 4.990 -2.717 1.00 10.00 N ATOM 610 CA THR A 45 19.635 3.822 -2.147 1.00 10.00 C ATOM 611 C THR A 45 18.149 3.834 -2.497 1.00 10.00 C ATOM 612 O THR A 45 17.701 4.687 -3.265 1.00 10.00 O ATOM 613 CB THR A 45 19.888 3.789 -0.629 1.00 10.00 C ATOM 614 OG1 THR A 45 19.472 2.564 -0.064 1.00 10.00 O ATOM 615 CG2 THR A 45 19.174 4.924 0.108 1.00 10.00 C ATOM 0 H THR A 45 19.630 5.732 -2.979 1.00 10.00 H new ATOM 0 HA THR A 45 20.056 2.908 -2.567 1.00 10.00 H new ATOM 0 HB THR A 45 20.964 3.911 -0.508 1.00 10.00 H new ATOM 0 HG1 THR A 45 19.921 2.432 0.797 1.00 10.00 H new ATOM 0 HG21 THR A 45 19.385 4.855 1.175 1.00 10.00 H new ATOM 0 HG22 THR A 45 19.528 5.883 -0.270 1.00 10.00 H new ATOM 0 HG23 THR A 45 18.099 4.844 -0.055 1.00 10.00 H new ATOM 623 N ALA A 46 17.384 2.906 -1.915 1.00 10.00 N ATOM 624 CA ALA A 46 15.957 2.776 -2.145 1.00 10.00 C ATOM 625 C ALA A 46 15.231 2.277 -0.898 1.00 10.00 C ATOM 626 O ALA A 46 15.846 1.690 -0.005 1.00 10.00 O ATOM 627 CB ALA A 46 15.697 1.872 -3.354 1.00 10.00 C ATOM 0 H ALA A 46 17.753 2.216 -1.261 1.00 10.00 H new ATOM 0 HA ALA A 46 15.553 3.764 -2.367 1.00 10.00 H new ATOM 0 HB1 ALA A 46 14.623 1.782 -3.517 1.00 10.00 H new ATOM 0 HB2 ALA A 46 16.163 2.305 -4.239 1.00 10.00 H new ATOM 0 HB3 ALA A 46 16.120 0.885 -3.168 1.00 10.00 H new ATOM 633 N ALA A 47 13.920 2.529 -0.848 1.00 10.00 N ATOM 634 CA ALA A 47 13.009 1.997 0.148 1.00 10.00 C ATOM 635 C ALA A 47 12.421 0.684 -0.359 1.00 10.00 C ATOM 636 O ALA A 47 12.182 0.536 -1.558 1.00 10.00 O ATOM 637 CB ALA A 47 11.893 2.997 0.442 1.00 10.00 C ATOM 0 H ALA A 47 13.455 3.131 -1.528 1.00 10.00 H new ATOM 0 HA ALA A 47 13.556 1.817 1.073 1.00 10.00 H new ATOM 0 HB1 ALA A 47 11.220 2.581 1.191 1.00 10.00 H new ATOM 0 HB2 ALA A 47 12.325 3.924 0.818 1.00 10.00 H new ATOM 0 HB3 ALA A 47 11.337 3.201 -0.473 1.00 10.00 H new ATOM 643 N TYR A 48 12.208 -0.264 0.555 1.00 10.00 N ATOM 644 CA TYR A 48 11.660 -1.578 0.294 1.00 10.00 C ATOM 645 C TYR A 48 10.521 -1.699 1.306 1.00 10.00 C ATOM 646 O TYR A 48 10.753 -1.525 2.505 1.00 10.00 O ATOM 647 CB TYR A 48 12.711 -2.683 0.507 1.00 10.00 C ATOM 648 CG TYR A 48 13.867 -2.790 -0.483 1.00 10.00 C ATOM 649 CD1 TYR A 48 14.697 -1.686 -0.767 1.00 10.00 C ATOM 650 CD2 TYR A 48 14.257 -4.065 -0.941 1.00 10.00 C ATOM 651 CE1 TYR A 48 15.848 -1.846 -1.554 1.00 10.00 C ATOM 652 CE2 TYR A 48 15.498 -4.242 -1.578 1.00 10.00 C ATOM 653 CZ TYR A 48 16.318 -3.133 -1.839 1.00 10.00 C ATOM 654 OH TYR A 48 17.585 -3.291 -2.313 1.00 10.00 O ATOM 0 H TYR A 48 12.426 -0.121 1.541 1.00 10.00 H new ATOM 0 HA TYR A 48 11.328 -1.695 -0.738 1.00 10.00 H new ATOM 0 HB2 TYR A 48 13.137 -2.547 1.501 1.00 10.00 H new ATOM 0 HB3 TYR A 48 12.189 -3.640 0.512 1.00 10.00 H new ATOM 0 HD1 TYR A 48 14.445 -0.711 -0.376 1.00 10.00 H new ATOM 0 HD2 TYR A 48 13.599 -4.910 -0.802 1.00 10.00 H new ATOM 0 HE1 TYR A 48 16.368 -0.981 -1.938 1.00 10.00 H new ATOM 0 HE2 TYR A 48 15.820 -5.232 -1.867 1.00 10.00 H new ATOM 0 HH TYR A 48 17.763 -4.243 -2.461 1.00 10.00 H new ATOM 664 N MET A 49 9.287 -1.867 0.830 1.00 10.00 N ATOM 665 CA MET A 49 8.090 -1.945 1.657 1.00 10.00 C ATOM 666 C MET A 49 6.978 -2.596 0.840 1.00 10.00 C ATOM 667 O MET A 49 7.218 -3.039 -0.281 1.00 10.00 O ATOM 668 CB MET A 49 7.712 -0.578 2.256 1.00 10.00 C ATOM 669 CG MET A 49 7.049 0.386 1.269 1.00 10.00 C ATOM 670 SD MET A 49 6.797 2.074 1.877 1.00 10.00 S ATOM 671 CE MET A 49 8.484 2.713 1.787 1.00 10.00 C ATOM 0 H MET A 49 9.091 -1.954 -0.167 1.00 10.00 H new ATOM 0 HA MET A 49 8.276 -2.573 2.528 1.00 10.00 H new ATOM 0 HB2 MET A 49 7.037 -0.738 3.097 1.00 10.00 H new ATOM 0 HB3 MET A 49 8.612 -0.109 2.654 1.00 10.00 H new ATOM 0 HG2 MET A 49 7.659 0.431 0.367 1.00 10.00 H new ATOM 0 HG3 MET A 49 6.082 -0.026 0.980 1.00 10.00 H new ATOM 0 HE1 MET A 49 8.699 3.301 2.680 1.00 10.00 H new ATOM 0 HE2 MET A 49 9.185 1.881 1.723 1.00 10.00 H new ATOM 0 HE3 MET A 49 8.588 3.344 0.904 1.00 10.00 H new ATOM 681 N THR A 50 5.768 -2.640 1.389 1.00 10.00 N ATOM 682 CA THR A 50 4.568 -3.107 0.728 1.00 10.00 C ATOM 683 C THR A 50 3.468 -2.069 0.951 1.00 10.00 C ATOM 684 O THR A 50 3.309 -1.612 2.080 1.00 10.00 O ATOM 685 CB THR A 50 4.201 -4.463 1.334 1.00 10.00 C ATOM 686 OG1 THR A 50 5.316 -5.332 1.314 1.00 10.00 O ATOM 687 CG2 THR A 50 3.055 -5.102 0.567 1.00 10.00 C ATOM 0 H THR A 50 5.597 -2.337 2.348 1.00 10.00 H new ATOM 0 HA THR A 50 4.708 -3.231 -0.346 1.00 10.00 H new ATOM 0 HB THR A 50 3.891 -4.295 2.366 1.00 10.00 H new ATOM 0 HG1 THR A 50 5.667 -5.393 0.401 1.00 10.00 H new ATOM 0 HG21 THR A 50 2.810 -6.065 1.014 1.00 10.00 H new ATOM 0 HG22 THR A 50 2.182 -4.451 0.608 1.00 10.00 H new ATOM 0 HG23 THR A 50 3.350 -5.249 -0.472 1.00 10.00 H new ATOM 695 N LEU A 51 2.690 -1.712 -0.077 1.00 10.00 N ATOM 696 CA LEU A 51 1.395 -1.077 0.142 1.00 10.00 C ATOM 697 C LEU A 51 0.413 -2.221 0.076 1.00 10.00 C ATOM 698 O LEU A 51 0.380 -2.912 -0.935 1.00 10.00 O ATOM 699 CB LEU A 51 1.041 -0.072 -0.961 1.00 10.00 C ATOM 700 CG LEU A 51 1.456 1.364 -0.608 1.00 10.00 C ATOM 701 CD1 LEU A 51 2.932 1.472 -0.205 1.00 10.00 C ATOM 702 CD2 LEU A 51 1.184 2.303 -1.785 1.00 10.00 C ATOM 0 H LEU A 51 2.935 -1.852 -1.057 1.00 10.00 H new ATOM 0 HA LEU A 51 1.389 -0.524 1.081 1.00 10.00 H new ATOM 0 HB2 LEU A 51 1.530 -0.370 -1.889 1.00 10.00 H new ATOM 0 HB3 LEU A 51 -0.033 -0.101 -1.143 1.00 10.00 H new ATOM 0 HG LEU A 51 0.855 1.657 0.253 1.00 10.00 H new ATOM 0 HD11 LEU A 51 3.169 2.509 0.034 1.00 10.00 H new ATOM 0 HD12 LEU A 51 3.117 0.847 0.669 1.00 10.00 H new ATOM 0 HD13 LEU A 51 3.560 1.137 -1.030 1.00 10.00 H new ATOM 0 HD21 LEU A 51 1.484 3.317 -1.519 1.00 10.00 H new ATOM 0 HD22 LEU A 51 1.754 1.973 -2.653 1.00 10.00 H new ATOM 0 HD23 LEU A 51 0.120 2.290 -2.023 1.00 10.00 H new ATOM 714 N THR A 52 -0.337 -2.427 1.157 1.00 10.00 N ATOM 715 CA THR A 52 -1.318 -3.487 1.286 1.00 10.00 C ATOM 716 C THR A 52 -2.697 -2.835 1.291 1.00 10.00 C ATOM 717 O THR A 52 -3.285 -2.623 2.353 1.00 10.00 O ATOM 718 CB THR A 52 -1.013 -4.279 2.565 1.00 10.00 C ATOM 719 OG1 THR A 52 0.336 -4.698 2.550 1.00 10.00 O ATOM 720 CG2 THR A 52 -1.891 -5.526 2.676 1.00 10.00 C ATOM 0 H THR A 52 -0.272 -1.840 1.989 1.00 10.00 H new ATOM 0 HA THR A 52 -1.286 -4.197 0.460 1.00 10.00 H new ATOM 0 HB THR A 52 -1.213 -3.624 3.413 1.00 10.00 H new ATOM 0 HG1 THR A 52 0.531 -5.202 3.367 1.00 10.00 H new ATOM 0 HG21 THR A 52 -1.648 -6.062 3.593 1.00 10.00 H new ATOM 0 HG22 THR A 52 -2.940 -5.232 2.695 1.00 10.00 H new ATOM 0 HG23 THR A 52 -1.712 -6.175 1.818 1.00 10.00 H new ATOM 728 N ASN A 53 -3.209 -2.479 0.109 1.00 10.00 N ATOM 729 CA ASN A 53 -4.433 -1.694 0.046 1.00 10.00 C ATOM 730 C ASN A 53 -5.655 -2.597 0.210 1.00 10.00 C ATOM 731 O ASN A 53 -6.184 -3.139 -0.759 1.00 10.00 O ATOM 732 CB ASN A 53 -4.517 -0.913 -1.265 1.00 10.00 C ATOM 733 CG ASN A 53 -5.617 0.142 -1.198 1.00 10.00 C ATOM 734 OD1 ASN A 53 -6.740 -0.137 -0.796 1.00 10.00 O ATOM 735 ND2 ASN A 53 -5.280 1.380 -1.532 1.00 10.00 N ATOM 0 H ASN A 53 -2.802 -2.718 -0.795 1.00 10.00 H new ATOM 0 HA ASN A 53 -4.417 -0.976 0.866 1.00 10.00 H new ATOM 0 HB2 ASN A 53 -3.560 -0.434 -1.470 1.00 10.00 H new ATOM 0 HB3 ASN A 53 -4.714 -1.598 -2.090 1.00 10.00 H new ATOM 0 HD21 ASN A 53 -5.964 2.133 -1.458 1.00 10.00 H new ATOM 0 HD22 ASN A 53 -4.336 1.580 -1.863 1.00 10.00 H new ATOM 742 N LYS A 54 -6.132 -2.747 1.446 1.00 10.00 N ATOM 743 CA LYS A 54 -7.294 -3.581 1.727 1.00 10.00 C ATOM 744 C LYS A 54 -8.590 -2.801 1.475 1.00 10.00 C ATOM 745 O LYS A 54 -9.446 -2.728 2.354 1.00 10.00 O ATOM 746 CB LYS A 54 -7.209 -4.091 3.175 1.00 10.00 C ATOM 747 CG LYS A 54 -6.093 -5.131 3.368 1.00 10.00 C ATOM 748 CD LYS A 54 -6.512 -6.559 2.977 1.00 10.00 C ATOM 749 CE LYS A 54 -7.477 -7.173 4.009 1.00 10.00 C ATOM 750 NZ LYS A 54 -7.809 -8.580 3.702 1.00 10.00 N ATOM 0 H LYS A 54 -5.728 -2.299 2.269 1.00 10.00 H new ATOM 0 HA LYS A 54 -7.302 -4.440 1.056 1.00 10.00 H new ATOM 0 HB2 LYS A 54 -7.036 -3.248 3.844 1.00 10.00 H new ATOM 0 HB3 LYS A 54 -8.165 -4.532 3.458 1.00 10.00 H new ATOM 0 HG2 LYS A 54 -5.228 -4.839 2.773 1.00 10.00 H new ATOM 0 HG3 LYS A 54 -5.779 -5.126 4.412 1.00 10.00 H new ATOM 0 HD2 LYS A 54 -6.989 -6.543 1.997 1.00 10.00 H new ATOM 0 HD3 LYS A 54 -5.625 -7.187 2.889 1.00 10.00 H new ATOM 0 HE2 LYS A 54 -7.028 -7.116 5.001 1.00 10.00 H new ATOM 0 HE3 LYS A 54 -8.394 -6.585 4.040 1.00 10.00 H new ATOM 0 HZ1 LYS A 54 -8.460 -8.948 4.424 1.00 10.00 H new ATOM 0 HZ2 LYS A 54 -8.262 -8.634 2.767 1.00 10.00 H new ATOM 0 HZ3 LYS A 54 -6.939 -9.149 3.698 1.00 10.00 H new ATOM 764 N SER A 55 -8.773 -2.283 0.257 1.00 10.00 N ATOM 765 CA SER A 55 -10.047 -1.767 -0.224 1.00 10.00 C ATOM 766 C SER A 55 -9.935 -1.466 -1.714 1.00 10.00 C ATOM 767 O SER A 55 -8.850 -1.239 -2.238 1.00 10.00 O ATOM 768 CB SER A 55 -10.477 -0.501 0.528 1.00 10.00 C ATOM 769 OG SER A 55 -11.822 -0.199 0.210 1.00 10.00 O ATOM 0 H SER A 55 -8.023 -2.212 -0.431 1.00 10.00 H new ATOM 0 HA SER A 55 -10.807 -2.528 -0.045 1.00 10.00 H new ATOM 0 HB2 SER A 55 -10.370 -0.649 1.603 1.00 10.00 H new ATOM 0 HB3 SER A 55 -9.831 0.334 0.256 1.00 10.00 H new ATOM 0 HG SER A 55 -12.098 0.609 0.691 1.00 10.00 H new ATOM 775 N ASP A 56 -11.067 -1.425 -2.404 1.00 10.00 N ATOM 776 CA ASP A 56 -11.126 -1.085 -3.816 1.00 10.00 C ATOM 777 C ASP A 56 -11.122 0.441 -3.942 1.00 10.00 C ATOM 778 O ASP A 56 -12.096 1.030 -4.409 1.00 10.00 O ATOM 779 CB ASP A 56 -12.367 -1.733 -4.447 1.00 10.00 C ATOM 780 CG ASP A 56 -12.205 -3.237 -4.605 1.00 10.00 C ATOM 781 OD1 ASP A 56 -12.302 -3.967 -3.594 1.00 10.00 O ATOM 782 OD2 ASP A 56 -11.912 -3.675 -5.738 1.00 10.00 O ATOM 0 H ASP A 56 -11.978 -1.629 -1.993 1.00 10.00 H new ATOM 0 HA ASP A 56 -10.261 -1.470 -4.357 1.00 10.00 H new ATOM 0 HB2 ASP A 56 -13.239 -1.525 -3.827 1.00 10.00 H new ATOM 0 HB3 ASP A 56 -12.554 -1.284 -5.422 1.00 10.00 H new ATOM 787 N GLN A 57 -10.048 1.096 -3.482 1.00 10.00 N ATOM 788 CA GLN A 57 -9.959 2.553 -3.397 1.00 10.00 C ATOM 789 C GLN A 57 -8.606 3.055 -3.926 1.00 10.00 C ATOM 790 O GLN A 57 -7.580 2.714 -3.340 1.00 10.00 O ATOM 791 CB GLN A 57 -10.149 2.988 -1.937 1.00 10.00 C ATOM 792 CG GLN A 57 -11.553 2.697 -1.391 1.00 10.00 C ATOM 793 CD GLN A 57 -12.623 3.616 -1.976 1.00 10.00 C ATOM 794 OE1 GLN A 57 -12.930 4.655 -1.402 1.00 10.00 O ATOM 795 NE2 GLN A 57 -13.212 3.251 -3.110 1.00 10.00 N ATOM 0 H GLN A 57 -9.208 0.619 -3.155 1.00 10.00 H new ATOM 0 HA GLN A 57 -10.743 2.989 -4.016 1.00 10.00 H new ATOM 0 HB2 GLN A 57 -9.413 2.478 -1.315 1.00 10.00 H new ATOM 0 HB3 GLN A 57 -9.950 4.057 -1.855 1.00 10.00 H new ATOM 0 HG2 GLN A 57 -11.814 1.661 -1.608 1.00 10.00 H new ATOM 0 HG3 GLN A 57 -11.544 2.803 -0.306 1.00 10.00 H new ATOM 0 HE21 GLN A 57 -12.940 2.382 -3.569 1.00 10.00 H new ATOM 0 HE22 GLN A 57 -13.936 3.840 -3.521 1.00 10.00 H new ATOM 804 N PRO A 58 -8.579 3.862 -5.006 1.00 10.00 N ATOM 805 CA PRO A 58 -7.349 4.422 -5.550 1.00 10.00 C ATOM 806 C PRO A 58 -6.843 5.562 -4.659 1.00 10.00 C ATOM 807 O PRO A 58 -7.568 6.530 -4.438 1.00 10.00 O ATOM 808 CB PRO A 58 -7.727 4.946 -6.940 1.00 10.00 C ATOM 809 CG PRO A 58 -9.200 5.323 -6.795 1.00 10.00 C ATOM 810 CD PRO A 58 -9.731 4.309 -5.780 1.00 10.00 C ATOM 0 HA PRO A 58 -6.548 3.684 -5.600 1.00 10.00 H new ATOM 0 HB2 PRO A 58 -7.119 5.806 -7.223 1.00 10.00 H new ATOM 0 HB3 PRO A 58 -7.582 4.186 -7.708 1.00 10.00 H new ATOM 0 HG2 PRO A 58 -9.319 6.346 -6.439 1.00 10.00 H new ATOM 0 HG3 PRO A 58 -9.728 5.253 -7.746 1.00 10.00 H new ATOM 0 HD2 PRO A 58 -10.481 4.763 -5.133 1.00 10.00 H new ATOM 0 HD3 PRO A 58 -10.210 3.470 -6.284 1.00 10.00 H new ATOM 818 N ILE A 59 -5.607 5.457 -4.161 1.00 10.00 N ATOM 819 CA ILE A 59 -4.971 6.500 -3.335 1.00 10.00 C ATOM 820 C ILE A 59 -3.552 6.760 -3.860 1.00 10.00 C ATOM 821 O ILE A 59 -2.666 5.935 -3.660 1.00 10.00 O ATOM 822 CB ILE A 59 -4.967 6.135 -1.827 1.00 10.00 C ATOM 823 CG1 ILE A 59 -6.350 6.251 -1.146 1.00 10.00 C ATOM 824 CG2 ILE A 59 -4.038 7.088 -1.048 1.00 10.00 C ATOM 825 CD1 ILE A 59 -7.268 5.042 -1.323 1.00 10.00 C ATOM 0 H ILE A 59 -5.012 4.643 -4.318 1.00 10.00 H new ATOM 0 HA ILE A 59 -5.558 7.415 -3.418 1.00 10.00 H new ATOM 0 HB ILE A 59 -4.637 5.096 -1.798 1.00 10.00 H new ATOM 0 HG12 ILE A 59 -6.199 6.419 -0.080 1.00 10.00 H new ATOM 0 HG13 ILE A 59 -6.857 7.132 -1.538 1.00 10.00 H new ATOM 0 HG21 ILE A 59 -4.045 6.820 0.009 1.00 10.00 H new ATOM 0 HG22 ILE A 59 -3.023 7.005 -1.437 1.00 10.00 H new ATOM 0 HG23 ILE A 59 -4.388 8.114 -1.165 1.00 10.00 H new ATOM 0 HD11 ILE A 59 -8.212 5.223 -0.808 1.00 10.00 H new ATOM 0 HD12 ILE A 59 -7.458 4.882 -2.384 1.00 10.00 H new ATOM 0 HD13 ILE A 59 -6.790 4.157 -0.903 1.00 10.00 H new ATOM 837 N LYS A 60 -3.308 7.889 -4.533 1.00 10.00 N ATOM 838 CA LYS A 60 -2.047 8.125 -5.226 1.00 10.00 C ATOM 839 C LYS A 60 -1.028 8.818 -4.319 1.00 10.00 C ATOM 840 O LYS A 60 -1.280 9.911 -3.803 1.00 10.00 O ATOM 841 CB LYS A 60 -2.289 8.837 -6.564 1.00 10.00 C ATOM 842 CG LYS A 60 -2.677 10.317 -6.480 1.00 10.00 C ATOM 843 CD LYS A 60 -3.926 10.667 -7.309 1.00 10.00 C ATOM 844 CE LYS A 60 -5.061 10.529 -6.285 1.00 10.00 C ATOM 845 NZ LYS A 60 -6.420 10.959 -6.642 1.00 10.00 N ATOM 0 H LYS A 60 -3.976 8.656 -4.610 1.00 10.00 H new ATOM 0 HA LYS A 60 -1.594 7.166 -5.475 1.00 10.00 H new ATOM 0 HB2 LYS A 60 -1.384 8.753 -7.166 1.00 10.00 H new ATOM 0 HB3 LYS A 60 -3.077 8.306 -7.098 1.00 10.00 H new ATOM 0 HG2 LYS A 60 -2.856 10.580 -5.437 1.00 10.00 H new ATOM 0 HG3 LYS A 60 -1.840 10.925 -6.823 1.00 10.00 H new ATOM 0 HD2 LYS A 60 -3.871 11.676 -7.718 1.00 10.00 H new ATOM 0 HD3 LYS A 60 -4.056 9.988 -8.152 1.00 10.00 H new ATOM 0 HE2 LYS A 60 -5.116 9.478 -6.000 1.00 10.00 H new ATOM 0 HE3 LYS A 60 -4.766 11.086 -5.395 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 -6.977 11.103 -5.776 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 -6.373 11.851 -7.176 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 -6.873 10.228 -7.228 1.00 10.00 H new ATOM 859 N LEU A 61 0.131 8.186 -4.111 1.00 10.00 N ATOM 860 CA LEU A 61 1.096 8.657 -3.130 1.00 10.00 C ATOM 861 C LEU A 61 2.244 9.384 -3.826 1.00 10.00 C ATOM 862 O LEU A 61 2.793 8.868 -4.794 1.00 10.00 O ATOM 863 CB LEU A 61 1.427 7.560 -2.103 1.00 10.00 C ATOM 864 CG LEU A 61 2.660 6.657 -2.259 1.00 10.00 C ATOM 865 CD1 LEU A 61 2.639 5.826 -3.546 1.00 10.00 C ATOM 866 CD2 LEU A 61 3.977 7.418 -2.056 1.00 10.00 C ATOM 0 H LEU A 61 0.418 7.346 -4.613 1.00 10.00 H new ATOM 0 HA LEU A 61 0.676 9.433 -2.490 1.00 10.00 H new ATOM 0 HB2 LEU A 61 1.515 8.050 -1.134 1.00 10.00 H new ATOM 0 HB3 LEU A 61 0.559 6.903 -2.051 1.00 10.00 H new ATOM 0 HG LEU A 61 2.604 5.932 -1.447 1.00 10.00 H new ATOM 0 HD11 LEU A 61 3.537 5.210 -3.596 1.00 10.00 H new ATOM 0 HD12 LEU A 61 1.758 5.184 -3.550 1.00 10.00 H new ATOM 0 HD13 LEU A 61 2.607 6.492 -4.408 1.00 10.00 H new ATOM 0 HD21 LEU A 61 4.816 6.733 -2.177 1.00 10.00 H new ATOM 0 HD22 LEU A 61 4.052 8.218 -2.793 1.00 10.00 H new ATOM 0 HD23 LEU A 61 4.000 7.845 -1.053 1.00 10.00 H new ATOM 878 N VAL A 62 2.557 10.611 -3.386 1.00 10.00 N ATOM 879 CA VAL A 62 3.581 11.460 -3.987 1.00 10.00 C ATOM 880 C VAL A 62 4.296 12.241 -2.881 1.00 10.00 C ATOM 881 O VAL A 62 4.365 13.468 -2.877 1.00 10.00 O ATOM 882 CB VAL A 62 2.981 12.317 -5.123 1.00 10.00 C ATOM 883 CG1 VAL A 62 1.800 13.197 -4.703 1.00 10.00 C ATOM 884 CG2 VAL A 62 4.037 13.145 -5.869 1.00 10.00 C ATOM 0 H VAL A 62 2.094 11.044 -2.587 1.00 10.00 H new ATOM 0 HA VAL A 62 4.350 10.864 -4.479 1.00 10.00 H new ATOM 0 HB VAL A 62 2.578 11.578 -5.816 1.00 10.00 H new ATOM 0 HG11 VAL A 62 1.444 13.763 -5.564 1.00 10.00 H new ATOM 0 HG12 VAL A 62 0.995 12.568 -4.323 1.00 10.00 H new ATOM 0 HG13 VAL A 62 2.120 13.887 -3.923 1.00 10.00 H new ATOM 0 HG21 VAL A 62 3.555 13.726 -6.655 1.00 10.00 H new ATOM 0 HG22 VAL A 62 4.531 13.820 -5.170 1.00 10.00 H new ATOM 0 HG23 VAL A 62 4.776 12.478 -6.312 1.00 10.00 H new ATOM 894 N GLY A 63 4.861 11.503 -1.926 1.00 10.00 N ATOM 895 CA GLY A 63 5.803 12.048 -0.974 1.00 10.00 C ATOM 896 C GLY A 63 6.614 10.912 -0.378 1.00 10.00 C ATOM 897 O GLY A 63 6.125 9.787 -0.315 1.00 10.00 O ATOM 0 H GLY A 63 4.672 10.509 -1.798 1.00 10.00 H new ATOM 0 HA2 GLY A 63 6.462 12.765 -1.464 1.00 10.00 H new ATOM 0 HA3 GLY A 63 5.275 12.587 -0.187 1.00 10.00 H new ATOM 901 N ALA A 64 7.833 11.217 0.062 1.00 10.00 N ATOM 902 CA ALA A 64 8.667 10.351 0.879 1.00 10.00 C ATOM 903 C ALA A 64 9.679 11.243 1.601 1.00 10.00 C ATOM 904 O ALA A 64 10.880 11.160 1.354 1.00 10.00 O ATOM 905 CB ALA A 64 9.330 9.294 -0.010 1.00 10.00 C ATOM 0 H ALA A 64 8.280 12.109 -0.151 1.00 10.00 H new ATOM 0 HA ALA A 64 8.088 9.807 1.625 1.00 10.00 H new ATOM 0 HB1 ALA A 64 9.956 8.644 0.602 1.00 10.00 H new ATOM 0 HB2 ALA A 64 8.561 8.699 -0.502 1.00 10.00 H new ATOM 0 HB3 ALA A 64 9.946 9.786 -0.763 1.00 10.00 H new ATOM 911 N ALA A 65 9.189 12.155 2.445 1.00 10.00 N ATOM 912 CA ALA A 65 10.034 13.155 3.085 1.00 10.00 C ATOM 913 C ALA A 65 10.645 12.542 4.340 1.00 10.00 C ATOM 914 O ALA A 65 9.964 11.810 5.051 1.00 10.00 O ATOM 915 CB ALA A 65 9.208 14.400 3.415 1.00 10.00 C ATOM 0 H ALA A 65 8.203 12.218 2.699 1.00 10.00 H new ATOM 0 HA ALA A 65 10.837 13.462 2.415 1.00 10.00 H new ATOM 0 HB1 ALA A 65 9.846 15.143 3.893 1.00 10.00 H new ATOM 0 HB2 ALA A 65 8.793 14.815 2.497 1.00 10.00 H new ATOM 0 HB3 ALA A 65 8.396 14.130 4.091 1.00 10.00 H new ATOM 921 N THR A 66 11.925 12.798 4.618 1.00 10.00 N ATOM 922 CA THR A 66 12.616 12.133 5.712 1.00 10.00 C ATOM 923 C THR A 66 13.963 12.819 5.965 1.00 10.00 C ATOM 924 O THR A 66 14.576 13.349 5.024 1.00 10.00 O ATOM 925 CB THR A 66 12.792 10.638 5.364 1.00 10.00 C ATOM 926 OG1 THR A 66 13.551 9.967 6.346 1.00 10.00 O ATOM 927 CG2 THR A 66 13.429 10.421 3.987 1.00 10.00 C ATOM 0 H THR A 66 12.499 13.461 4.098 1.00 10.00 H new ATOM 0 HA THR A 66 12.031 12.204 6.629 1.00 10.00 H new ATOM 0 HB THR A 66 11.786 10.218 5.337 1.00 10.00 H new ATOM 0 HG1 THR A 66 12.971 9.720 7.096 1.00 10.00 H new ATOM 0 HG21 THR A 66 13.528 9.352 3.796 1.00 10.00 H new ATOM 0 HG22 THR A 66 12.798 10.870 3.220 1.00 10.00 H new ATOM 0 HG23 THR A 66 14.414 10.886 3.965 1.00 10.00 H new ATOM 935 N PRO A 67 14.486 12.795 7.202 1.00 10.00 N ATOM 936 CA PRO A 67 15.870 13.138 7.477 1.00 10.00 C ATOM 937 C PRO A 67 16.788 11.987 7.027 1.00 10.00 C ATOM 938 O PRO A 67 17.587 11.477 7.806 1.00 10.00 O ATOM 939 CB PRO A 67 15.916 13.422 8.982 1.00 10.00 C ATOM 940 CG PRO A 67 14.847 12.486 9.540 1.00 10.00 C ATOM 941 CD PRO A 67 13.791 12.445 8.433 1.00 10.00 C ATOM 0 HA PRO A 67 16.227 14.011 6.930 1.00 10.00 H new ATOM 0 HB2 PRO A 67 16.899 13.209 9.403 1.00 10.00 H new ATOM 0 HB3 PRO A 67 15.694 14.466 9.203 1.00 10.00 H new ATOM 0 HG2 PRO A 67 15.250 11.495 9.746 1.00 10.00 H new ATOM 0 HG3 PRO A 67 14.433 12.863 10.475 1.00 10.00 H new ATOM 0 HD2 PRO A 67 13.341 11.455 8.359 1.00 10.00 H new ATOM 0 HD3 PRO A 67 12.983 13.147 8.638 1.00 10.00 H new ATOM 949 N LEU A 68 16.693 11.609 5.745 1.00 10.00 N ATOM 950 CA LEU A 68 17.574 10.672 5.062 1.00 10.00 C ATOM 951 C LEU A 68 17.901 11.250 3.684 1.00 10.00 C ATOM 952 O LEU A 68 18.937 11.886 3.511 1.00 10.00 O ATOM 953 CB LEU A 68 16.903 9.292 4.944 1.00 10.00 C ATOM 954 CG LEU A 68 17.017 8.429 6.206 1.00 10.00 C ATOM 955 CD1 LEU A 68 16.060 7.239 6.075 1.00 10.00 C ATOM 956 CD2 LEU A 68 18.445 7.902 6.376 1.00 10.00 C ATOM 0 H LEU A 68 15.962 11.970 5.133 1.00 10.00 H new ATOM 0 HA LEU A 68 18.495 10.533 5.628 1.00 10.00 H new ATOM 0 HB2 LEU A 68 15.848 9.432 4.707 1.00 10.00 H new ATOM 0 HB3 LEU A 68 17.349 8.754 4.108 1.00 10.00 H new ATOM 0 HG LEU A 68 16.763 9.036 7.075 1.00 10.00 H new ATOM 0 HD11 LEU A 68 16.130 6.616 6.966 1.00 10.00 H new ATOM 0 HD12 LEU A 68 15.039 7.604 5.967 1.00 10.00 H new ATOM 0 HD13 LEU A 68 16.330 6.650 5.198 1.00 10.00 H new ATOM 0 HD21 LEU A 68 18.503 7.292 7.278 1.00 10.00 H new ATOM 0 HD22 LEU A 68 18.715 7.297 5.511 1.00 10.00 H new ATOM 0 HD23 LEU A 68 19.135 8.742 6.461 1.00 10.00 H new ATOM 968 N ALA A 69 17.007 11.058 2.713 1.00 10.00 N ATOM 969 CA ALA A 69 17.222 11.430 1.322 1.00 10.00 C ATOM 970 C ALA A 69 17.159 12.939 1.127 1.00 10.00 C ATOM 971 O ALA A 69 16.262 13.594 1.660 1.00 10.00 O ATOM 972 CB ALA A 69 16.142 10.773 0.464 1.00 10.00 C ATOM 0 H ALA A 69 16.096 10.631 2.879 1.00 10.00 H new ATOM 0 HA ALA A 69 18.215 11.091 1.027 1.00 10.00 H new ATOM 0 HB1 ALA A 69 16.292 11.044 -0.581 1.00 10.00 H new ATOM 0 HB2 ALA A 69 16.202 9.690 0.570 1.00 10.00 H new ATOM 0 HB3 ALA A 69 15.160 11.115 0.790 1.00 10.00 H new ATOM 978 N THR A 70 18.079 13.493 0.343 1.00 10.00 N ATOM 979 CA THR A 70 17.911 14.795 -0.289 1.00 10.00 C ATOM 980 C THR A 70 17.066 14.640 -1.561 1.00 10.00 C ATOM 981 O THR A 70 16.323 15.554 -1.907 1.00 10.00 O ATOM 982 CB THR A 70 19.290 15.415 -0.566 1.00 10.00 C ATOM 983 OG1 THR A 70 19.959 15.607 0.665 1.00 10.00 O ATOM 984 CG2 THR A 70 19.201 16.771 -1.275 1.00 10.00 C ATOM 0 H THR A 70 18.970 13.046 0.127 1.00 10.00 H new ATOM 0 HA THR A 70 17.378 15.477 0.374 1.00 10.00 H new ATOM 0 HB THR A 70 19.827 14.728 -1.221 1.00 10.00 H new ATOM 0 HG1 THR A 70 20.414 14.778 0.923 1.00 10.00 H new ATOM 0 HG21 THR A 70 20.205 17.160 -1.444 1.00 10.00 H new ATOM 0 HG22 THR A 70 18.693 16.649 -2.232 1.00 10.00 H new ATOM 0 HG23 THR A 70 18.641 17.470 -0.654 1.00 10.00 H new ATOM 992 N SER A 71 17.158 13.491 -2.245 1.00 10.00 N ATOM 993 CA SER A 71 16.486 13.228 -3.514 1.00 10.00 C ATOM 994 C SER A 71 15.527 12.030 -3.405 1.00 10.00 C ATOM 995 O SER A 71 15.816 10.976 -3.970 1.00 10.00 O ATOM 996 CB SER A 71 17.563 12.990 -4.584 1.00 10.00 C ATOM 997 OG SER A 71 16.972 12.654 -5.824 1.00 10.00 O ATOM 0 H SER A 71 17.717 12.703 -1.918 1.00 10.00 H new ATOM 0 HA SER A 71 15.874 14.086 -3.792 1.00 10.00 H new ATOM 0 HB2 SER A 71 18.174 13.886 -4.698 1.00 10.00 H new ATOM 0 HB3 SER A 71 18.229 12.189 -4.264 1.00 10.00 H new ATOM 0 HG SER A 71 16.423 11.849 -5.717 1.00 10.00 H new ATOM 1003 N PRO A 72 14.380 12.163 -2.720 1.00 10.00 N ATOM 1004 CA PRO A 72 13.368 11.118 -2.661 1.00 10.00 C ATOM 1005 C PRO A 72 12.555 11.062 -3.958 1.00 10.00 C ATOM 1006 O PRO A 72 11.597 11.813 -4.129 1.00 10.00 O ATOM 1007 CB PRO A 72 12.504 11.489 -1.451 1.00 10.00 C ATOM 1008 CG PRO A 72 12.577 13.016 -1.415 1.00 10.00 C ATOM 1009 CD PRO A 72 13.997 13.303 -1.901 1.00 10.00 C ATOM 0 HA PRO A 72 13.799 10.122 -2.556 1.00 10.00 H new ATOM 0 HB2 PRO A 72 11.478 11.139 -1.568 1.00 10.00 H new ATOM 0 HB3 PRO A 72 12.889 11.047 -0.532 1.00 10.00 H new ATOM 0 HG2 PRO A 72 11.829 13.471 -2.064 1.00 10.00 H new ATOM 0 HG3 PRO A 72 12.408 13.405 -0.411 1.00 10.00 H new ATOM 0 HD2 PRO A 72 14.032 14.227 -2.478 1.00 10.00 H new ATOM 0 HD3 PRO A 72 14.680 13.426 -1.060 1.00 10.00 H new ATOM 1017 N MET A 73 12.925 10.154 -4.865 1.00 10.00 N ATOM 1018 CA MET A 73 12.274 9.968 -6.158 1.00 10.00 C ATOM 1019 C MET A 73 11.416 8.703 -6.136 1.00 10.00 C ATOM 1020 O MET A 73 11.912 7.638 -5.795 1.00 10.00 O ATOM 1021 CB MET A 73 13.368 9.821 -7.215 1.00 10.00 C ATOM 1022 CG MET A 73 13.958 11.170 -7.638 1.00 10.00 C ATOM 1023 SD MET A 73 12.851 12.173 -8.662 1.00 10.00 S ATOM 1024 CE MET A 73 13.932 13.574 -9.019 1.00 10.00 C ATOM 0 H MET A 73 13.705 9.514 -4.714 1.00 10.00 H new ATOM 0 HA MET A 73 11.632 10.820 -6.381 1.00 10.00 H new ATOM 0 HB2 MET A 73 14.163 9.186 -6.825 1.00 10.00 H new ATOM 0 HB3 MET A 73 12.958 9.317 -8.090 1.00 10.00 H new ATOM 0 HG2 MET A 73 14.221 11.736 -6.744 1.00 10.00 H new ATOM 0 HG3 MET A 73 14.883 10.994 -8.187 1.00 10.00 H new ATOM 0 HE1 MET A 73 13.402 14.292 -9.645 1.00 10.00 H new ATOM 0 HE2 MET A 73 14.226 14.054 -8.085 1.00 10.00 H new ATOM 0 HE3 MET A 73 14.821 13.223 -9.543 1.00 10.00 H new ATOM 1034 N LEU A 74 10.148 8.790 -6.532 1.00 10.00 N ATOM 1035 CA LEU A 74 9.248 7.642 -6.648 1.00 10.00 C ATOM 1036 C LEU A 74 9.437 6.959 -8.009 1.00 10.00 C ATOM 1037 O LEU A 74 9.700 7.631 -9.006 1.00 10.00 O ATOM 1038 CB LEU A 74 7.802 8.139 -6.450 1.00 10.00 C ATOM 1039 CG LEU A 74 7.456 8.223 -4.957 1.00 10.00 C ATOM 1040 CD1 LEU A 74 6.393 9.295 -4.728 1.00 10.00 C ATOM 1041 CD2 LEU A 74 6.908 6.873 -4.475 1.00 10.00 C ATOM 0 H LEU A 74 9.709 9.675 -6.786 1.00 10.00 H new ATOM 0 HA LEU A 74 9.473 6.898 -5.884 1.00 10.00 H new ATOM 0 HB2 LEU A 74 7.683 9.119 -6.912 1.00 10.00 H new ATOM 0 HB3 LEU A 74 7.108 7.464 -6.952 1.00 10.00 H new ATOM 0 HG LEU A 74 8.359 8.477 -4.402 1.00 10.00 H new ATOM 0 HD11 LEU A 74 6.153 9.348 -3.666 1.00 10.00 H new ATOM 0 HD12 LEU A 74 6.772 10.260 -5.063 1.00 10.00 H new ATOM 0 HD13 LEU A 74 5.494 9.042 -5.291 1.00 10.00 H new ATOM 0 HD21 LEU A 74 6.664 6.937 -3.415 1.00 10.00 H new ATOM 0 HD22 LEU A 74 6.010 6.622 -5.040 1.00 10.00 H new ATOM 0 HD23 LEU A 74 7.661 6.099 -4.628 1.00 10.00 H new ATOM 1053 N MET A 75 9.305 5.628 -8.053 1.00 10.00 N ATOM 1054 CA MET A 75 9.300 4.830 -9.274 1.00 10.00 C ATOM 1055 C MET A 75 8.252 3.731 -9.217 1.00 10.00 C ATOM 1056 O MET A 75 7.787 3.330 -8.152 1.00 10.00 O ATOM 1057 CB MET A 75 10.650 4.138 -9.533 1.00 10.00 C ATOM 1058 CG MET A 75 11.425 4.719 -10.720 1.00 10.00 C ATOM 1059 SD MET A 75 12.850 5.701 -10.238 1.00 10.00 S ATOM 1060 CE MET A 75 13.519 6.151 -11.856 1.00 10.00 C ATOM 0 H MET A 75 9.196 5.064 -7.210 1.00 10.00 H new ATOM 0 HA MET A 75 9.084 5.538 -10.074 1.00 10.00 H new ATOM 0 HB2 MET A 75 11.265 4.215 -8.637 1.00 10.00 H new ATOM 0 HB3 MET A 75 10.476 3.077 -9.709 1.00 10.00 H new ATOM 0 HG2 MET A 75 11.757 3.902 -11.361 1.00 10.00 H new ATOM 0 HG3 MET A 75 10.752 5.337 -11.314 1.00 10.00 H new ATOM 0 HE1 MET A 75 13.940 7.155 -11.809 1.00 10.00 H new ATOM 0 HE2 MET A 75 14.299 5.443 -12.137 1.00 10.00 H new ATOM 0 HE3 MET A 75 12.722 6.126 -12.599 1.00 10.00 H new ATOM 1070 N THR A 76 7.987 3.217 -10.415 1.00 10.00 N ATOM 1071 CA THR A 76 7.048 2.190 -10.783 1.00 10.00 C ATOM 1072 C THR A 76 7.762 0.856 -11.007 1.00 10.00 C ATOM 1073 O THR A 76 8.987 0.814 -11.131 1.00 10.00 O ATOM 1074 CB THR A 76 6.468 2.708 -12.095 1.00 10.00 C ATOM 1075 OG1 THR A 76 6.020 4.031 -11.927 1.00 10.00 O ATOM 1076 CG2 THR A 76 5.302 1.896 -12.602 1.00 10.00 C ATOM 0 H THR A 76 8.488 3.557 -11.236 1.00 10.00 H new ATOM 0 HA THR A 76 6.295 2.005 -10.017 1.00 10.00 H new ATOM 0 HB THR A 76 7.274 2.637 -12.825 1.00 10.00 H new ATOM 0 HG1 THR A 76 5.106 4.113 -12.270 1.00 10.00 H new ATOM 0 HG21 THR A 76 4.941 2.322 -13.538 1.00 10.00 H new ATOM 0 HG22 THR A 76 5.621 0.868 -12.771 1.00 10.00 H new ATOM 0 HG23 THR A 76 4.500 1.910 -11.864 1.00 10.00 H new ATOM 1084 N THR A 77 7.000 -0.242 -11.033 1.00 10.00 N ATOM 1085 CA THR A 77 7.483 -1.573 -11.395 1.00 10.00 C ATOM 1086 C THR A 77 7.231 -1.916 -12.859 1.00 10.00 C ATOM 1087 O THR A 77 6.579 -1.179 -13.601 1.00 10.00 O ATOM 1088 CB THR A 77 6.943 -2.662 -10.447 1.00 10.00 C ATOM 1089 OG1 THR A 77 7.618 -3.886 -10.665 1.00 10.00 O ATOM 1090 CG2 THR A 77 5.436 -2.863 -10.550 1.00 10.00 C ATOM 0 H THR A 77 6.008 -0.227 -10.797 1.00 10.00 H new ATOM 0 HA THR A 77 8.566 -1.547 -11.270 1.00 10.00 H new ATOM 0 HB THR A 77 7.139 -2.310 -9.434 1.00 10.00 H new ATOM 0 HG1 THR A 77 7.265 -4.567 -10.055 1.00 10.00 H new ATOM 0 HG21 THR A 77 5.125 -3.643 -9.856 1.00 10.00 H new ATOM 0 HG22 THR A 77 4.927 -1.932 -10.301 1.00 10.00 H new ATOM 0 HG23 THR A 77 5.177 -3.158 -11.567 1.00 10.00 H new ATOM 1098 N THR A 78 7.765 -3.066 -13.266 1.00 10.00 N ATOM 1099 CA THR A 78 7.685 -3.559 -14.625 1.00 10.00 C ATOM 1100 C THR A 78 6.562 -4.595 -14.714 1.00 10.00 C ATOM 1101 O THR A 78 6.794 -5.715 -15.156 1.00 10.00 O ATOM 1102 CB THR A 78 9.059 -4.097 -15.057 1.00 10.00 C ATOM 1103 OG1 THR A 78 10.057 -3.168 -14.674 1.00 10.00 O ATOM 1104 CG2 THR A 78 9.141 -4.275 -16.578 1.00 10.00 C ATOM 0 H THR A 78 8.275 -3.689 -12.640 1.00 10.00 H new ATOM 0 HA THR A 78 7.435 -2.760 -15.323 1.00 10.00 H new ATOM 0 HB THR A 78 9.206 -5.065 -14.578 1.00 10.00 H new ATOM 0 HG1 THR A 78 10.937 -3.504 -14.944 1.00 10.00 H new ATOM 0 HG21 THR A 78 10.126 -4.657 -16.847 1.00 10.00 H new ATOM 0 HG22 THR A 78 8.377 -4.981 -16.903 1.00 10.00 H new ATOM 0 HG23 THR A 78 8.979 -3.314 -17.066 1.00 10.00 H new ATOM 1112 N HIS A 79 5.348 -4.193 -14.316 1.00 10.00 N ATOM 1113 CA HIS A 79 4.092 -4.937 -14.388 1.00 10.00 C ATOM 1114 C HIS A 79 3.031 -4.135 -13.625 1.00 10.00 C ATOM 1115 O HIS A 79 3.288 -2.998 -13.221 1.00 10.00 O ATOM 1116 CB HIS A 79 4.189 -6.378 -13.834 1.00 10.00 C ATOM 1117 CG HIS A 79 4.262 -6.467 -12.332 1.00 10.00 C ATOM 1118 ND1 HIS A 79 3.205 -6.856 -11.507 1.00 10.00 N ATOM 1119 CD2 HIS A 79 5.349 -6.157 -11.568 1.00 10.00 C ATOM 1120 CE1 HIS A 79 3.678 -6.754 -10.256 1.00 10.00 C ATOM 1121 NE2 HIS A 79 4.959 -6.346 -10.261 1.00 10.00 N ATOM 0 H HIS A 79 5.212 -3.269 -13.905 1.00 10.00 H new ATOM 0 HA HIS A 79 3.825 -5.054 -15.438 1.00 10.00 H new ATOM 0 HB2 HIS A 79 3.323 -6.945 -14.177 1.00 10.00 H new ATOM 0 HB3 HIS A 79 5.072 -6.858 -14.257 1.00 10.00 H new ATOM 0 HD2 HIS A 79 6.317 -5.830 -11.917 1.00 10.00 H new ATOM 0 HE1 HIS A 79 3.107 -6.970 -9.365 1.00 10.00 H new ATOM 0 HE2 HIS A 79 5.543 -6.201 -9.437 1.00 10.00 H new ATOM 1129 N SER A 80 1.872 -4.762 -13.417 1.00 10.00 N ATOM 1130 CA SER A 80 0.732 -4.332 -12.627 1.00 10.00 C ATOM 1131 C SER A 80 1.085 -3.796 -11.232 1.00 10.00 C ATOM 1132 O SER A 80 2.219 -3.885 -10.761 1.00 10.00 O ATOM 1133 CB SER A 80 -0.180 -5.558 -12.498 1.00 10.00 C ATOM 1134 OG SER A 80 -0.217 -6.249 -13.737 1.00 10.00 O ATOM 0 H SER A 80 1.698 -5.673 -13.842 1.00 10.00 H new ATOM 0 HA SER A 80 0.258 -3.490 -13.133 1.00 10.00 H new ATOM 0 HB2 SER A 80 0.187 -6.218 -11.712 1.00 10.00 H new ATOM 0 HB3 SER A 80 -1.185 -5.249 -12.211 1.00 10.00 H new ATOM 0 HG SER A 80 -0.798 -7.034 -13.656 1.00 10.00 H new ATOM 1140 N GLY A 81 0.085 -3.231 -10.546 1.00 10.00 N ATOM 1141 CA GLY A 81 0.291 -2.486 -9.313 1.00 10.00 C ATOM 1142 C GLY A 81 0.888 -1.131 -9.678 1.00 10.00 C ATOM 1143 O GLY A 81 0.235 -0.098 -9.542 1.00 10.00 O ATOM 0 H GLY A 81 -0.891 -3.282 -10.837 1.00 10.00 H new ATOM 0 HA2 GLY A 81 -0.653 -2.357 -8.783 1.00 10.00 H new ATOM 0 HA3 GLY A 81 0.959 -3.030 -8.646 1.00 10.00 H new ATOM 1147 N GLY A 82 2.111 -1.171 -10.208 1.00 10.00 N ATOM 1148 CA GLY A 82 2.636 -0.130 -11.072 1.00 10.00 C ATOM 1149 C GLY A 82 2.058 -0.264 -12.485 1.00 10.00 C ATOM 1150 O GLY A 82 0.904 -0.656 -12.653 1.00 10.00 O ATOM 0 H GLY A 82 2.765 -1.936 -10.044 1.00 10.00 H new ATOM 0 HA2 GLY A 82 2.389 0.850 -10.663 1.00 10.00 H new ATOM 0 HA3 GLY A 82 3.723 -0.194 -11.110 1.00 10.00 H new ATOM 1154 N MET A 83 2.863 0.090 -13.494 1.00 10.00 N ATOM 1155 CA MET A 83 2.473 0.127 -14.896 1.00 10.00 C ATOM 1156 C MET A 83 3.252 -0.933 -15.683 1.00 10.00 C ATOM 1157 O MET A 83 2.725 -2.010 -15.948 1.00 10.00 O ATOM 1158 CB MET A 83 2.692 1.541 -15.465 1.00 10.00 C ATOM 1159 CG MET A 83 1.858 2.605 -14.742 1.00 10.00 C ATOM 1160 SD MET A 83 2.142 4.289 -15.347 1.00 10.00 S ATOM 1161 CE MET A 83 1.031 5.213 -14.263 1.00 10.00 C ATOM 0 H MET A 83 3.834 0.366 -13.345 1.00 10.00 H new ATOM 0 HA MET A 83 1.412 -0.106 -14.989 1.00 10.00 H new ATOM 0 HB2 MET A 83 3.748 1.799 -15.389 1.00 10.00 H new ATOM 0 HB3 MET A 83 2.439 1.545 -16.525 1.00 10.00 H new ATOM 0 HG2 MET A 83 0.801 2.362 -14.852 1.00 10.00 H new ATOM 0 HG3 MET A 83 2.084 2.568 -13.676 1.00 10.00 H new ATOM 0 HE1 MET A 83 1.086 6.274 -14.505 1.00 10.00 H new ATOM 0 HE2 MET A 83 0.009 4.861 -14.404 1.00 10.00 H new ATOM 0 HE3 MET A 83 1.327 5.062 -13.225 1.00 10.00 H new ATOM 1171 N ALA A 84 4.491 -0.615 -16.085 1.00 10.00 N ATOM 1172 CA ALA A 84 5.311 -1.426 -16.974 1.00 10.00 C ATOM 1173 C ALA A 84 6.640 -0.707 -17.238 1.00 10.00 C ATOM 1174 O ALA A 84 7.031 -0.537 -18.391 1.00 10.00 O ATOM 1175 CB ALA A 84 4.582 -1.713 -18.299 1.00 10.00 C ATOM 0 H ALA A 84 4.957 0.242 -15.787 1.00 10.00 H new ATOM 0 HA ALA A 84 5.505 -2.384 -16.492 1.00 10.00 H new ATOM 0 HB1 ALA A 84 5.220 -2.320 -18.941 1.00 10.00 H new ATOM 0 HB2 ALA A 84 3.655 -2.250 -18.096 1.00 10.00 H new ATOM 0 HB3 ALA A 84 4.354 -0.772 -18.800 1.00 10.00 H new ATOM 1181 N GLY A 85 7.347 -0.286 -16.184 1.00 10.00 N ATOM 1182 CA GLY A 85 8.737 0.128 -16.328 1.00 10.00 C ATOM 1183 C GLY A 85 9.200 1.121 -15.265 1.00 10.00 C ATOM 1184 O GLY A 85 8.436 1.980 -14.829 1.00 10.00 O ATOM 0 H GLY A 85 6.980 -0.225 -15.234 1.00 10.00 H new ATOM 0 HA2 GLY A 85 9.375 -0.755 -16.289 1.00 10.00 H new ATOM 0 HA3 GLY A 85 8.872 0.575 -17.313 1.00 10.00 H new ATOM 1188 N MET A 86 10.483 1.042 -14.895 1.00 10.00 N ATOM 1189 CA MET A 86 11.125 1.821 -13.835 1.00 10.00 C ATOM 1190 C MET A 86 11.455 3.249 -14.289 1.00 10.00 C ATOM 1191 O MET A 86 12.531 3.772 -14.013 1.00 10.00 O ATOM 1192 CB MET A 86 12.379 1.040 -13.408 1.00 10.00 C ATOM 1193 CG MET A 86 12.936 1.358 -12.015 1.00 10.00 C ATOM 1194 SD MET A 86 14.352 2.490 -11.849 1.00 10.00 S ATOM 1195 CE MET A 86 15.585 1.348 -11.177 1.00 10.00 C ATOM 0 H MET A 86 11.132 0.401 -15.350 1.00 10.00 H new ATOM 0 HA MET A 86 10.450 1.946 -12.988 1.00 10.00 H new ATOM 0 HB2 MET A 86 12.150 -0.025 -13.450 1.00 10.00 H new ATOM 0 HB3 MET A 86 13.164 1.226 -14.141 1.00 10.00 H new ATOM 0 HG2 MET A 86 12.118 1.770 -11.423 1.00 10.00 H new ATOM 0 HG3 MET A 86 13.219 0.412 -11.553 1.00 10.00 H new ATOM 0 HE1 MET A 86 16.522 1.880 -11.013 1.00 10.00 H new ATOM 0 HE2 MET A 86 15.228 0.942 -10.230 1.00 10.00 H new ATOM 0 HE3 MET A 86 15.749 0.533 -11.882 1.00 10.00 H new ATOM 1205 N LYS A 87 10.518 3.891 -14.982 1.00 10.00 N ATOM 1206 CA LYS A 87 10.704 5.219 -15.549 1.00 10.00 C ATOM 1207 C LYS A 87 10.440 6.283 -14.480 1.00 10.00 C ATOM 1208 O LYS A 87 9.726 6.020 -13.513 1.00 10.00 O ATOM 1209 CB LYS A 87 9.793 5.375 -16.777 1.00 10.00 C ATOM 1210 CG LYS A 87 8.300 5.407 -16.411 1.00 10.00 C ATOM 1211 CD LYS A 87 7.394 5.029 -17.590 1.00 10.00 C ATOM 1212 CE LYS A 87 7.545 6.001 -18.770 1.00 10.00 C ATOM 1213 NZ LYS A 87 6.621 5.676 -19.878 1.00 10.00 N ATOM 0 H LYS A 87 9.596 3.496 -15.167 1.00 10.00 H new ATOM 0 HA LYS A 87 11.733 5.352 -15.882 1.00 10.00 H new ATOM 0 HB2 LYS A 87 10.053 6.294 -17.302 1.00 10.00 H new ATOM 0 HB3 LYS A 87 9.976 4.551 -17.466 1.00 10.00 H new ATOM 0 HG2 LYS A 87 8.118 4.721 -15.584 1.00 10.00 H new ATOM 0 HG3 LYS A 87 8.037 6.405 -16.061 1.00 10.00 H new ATOM 0 HD2 LYS A 87 7.633 4.018 -17.921 1.00 10.00 H new ATOM 0 HD3 LYS A 87 6.355 5.019 -17.260 1.00 10.00 H new ATOM 0 HE2 LYS A 87 7.357 7.019 -18.428 1.00 10.00 H new ATOM 0 HE3 LYS A 87 8.572 5.972 -19.134 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 6.756 6.356 -20.653 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 6.817 4.715 -20.223 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 5.639 5.729 -19.538 1.00 10.00 H new ATOM 1227 N MET A 88 10.981 7.494 -14.656 1.00 10.00 N ATOM 1228 CA MET A 88 10.877 8.558 -13.661 1.00 10.00 C ATOM 1229 C MET A 88 9.518 9.250 -13.798 1.00 10.00 C ATOM 1230 O MET A 88 9.400 10.386 -14.251 1.00 10.00 O ATOM 1231 CB MET A 88 12.073 9.513 -13.794 1.00 10.00 C ATOM 1232 CG MET A 88 12.145 10.493 -12.612 1.00 10.00 C ATOM 1233 SD MET A 88 13.640 11.514 -12.524 1.00 10.00 S ATOM 1234 CE MET A 88 13.498 12.461 -14.055 1.00 10.00 C ATOM 0 H MET A 88 11.502 7.760 -15.492 1.00 10.00 H new ATOM 0 HA MET A 88 10.922 8.151 -12.651 1.00 10.00 H new ATOM 0 HB2 MET A 88 12.996 8.936 -13.847 1.00 10.00 H new ATOM 0 HB3 MET A 88 11.992 10.071 -14.727 1.00 10.00 H new ATOM 0 HG2 MET A 88 11.279 11.153 -12.659 1.00 10.00 H new ATOM 0 HG3 MET A 88 12.062 9.923 -11.686 1.00 10.00 H new ATOM 0 HE1 MET A 88 14.309 13.187 -14.110 1.00 10.00 H new ATOM 0 HE2 MET A 88 13.557 11.785 -14.908 1.00 10.00 H new ATOM 0 HE3 MET A 88 12.542 12.984 -14.072 1.00 10.00 H new ATOM 1244 N VAL A 89 8.485 8.508 -13.410 1.00 10.00 N ATOM 1245 CA VAL A 89 7.113 8.965 -13.271 1.00 10.00 C ATOM 1246 C VAL A 89 7.001 10.138 -12.281 1.00 10.00 C ATOM 1247 O VAL A 89 7.877 10.311 -11.436 1.00 10.00 O ATOM 1248 CB VAL A 89 6.252 7.785 -12.780 1.00 10.00 C ATOM 1249 CG1 VAL A 89 6.030 6.756 -13.891 1.00 10.00 C ATOM 1250 CG2 VAL A 89 6.870 7.095 -11.551 1.00 10.00 C ATOM 0 H VAL A 89 8.592 7.522 -13.173 1.00 10.00 H new ATOM 0 HA VAL A 89 6.763 9.321 -14.240 1.00 10.00 H new ATOM 0 HB VAL A 89 5.289 8.204 -12.489 1.00 10.00 H new ATOM 0 HG11 VAL A 89 5.419 5.937 -13.512 1.00 10.00 H new ATOM 0 HG12 VAL A 89 5.520 7.230 -14.730 1.00 10.00 H new ATOM 0 HG13 VAL A 89 6.992 6.367 -14.224 1.00 10.00 H new ATOM 0 HG21 VAL A 89 6.231 6.269 -11.238 1.00 10.00 H new ATOM 0 HG22 VAL A 89 7.858 6.713 -11.807 1.00 10.00 H new ATOM 0 HG23 VAL A 89 6.959 7.814 -10.737 1.00 10.00 H new ATOM 1260 N PRO A 90 5.889 10.898 -12.322 1.00 10.00 N ATOM 1261 CA PRO A 90 5.491 11.802 -11.250 1.00 10.00 C ATOM 1262 C PRO A 90 5.553 11.159 -9.858 1.00 10.00 C ATOM 1263 O PRO A 90 5.892 11.842 -8.895 1.00 10.00 O ATOM 1264 CB PRO A 90 4.102 12.332 -11.612 1.00 10.00 C ATOM 1265 CG PRO A 90 4.042 12.159 -13.129 1.00 10.00 C ATOM 1266 CD PRO A 90 4.908 10.927 -13.395 1.00 10.00 C ATOM 0 HA PRO A 90 6.199 12.627 -11.173 1.00 10.00 H new ATOM 0 HB2 PRO A 90 3.314 11.769 -11.112 1.00 10.00 H new ATOM 0 HB3 PRO A 90 3.982 13.376 -11.321 1.00 10.00 H new ATOM 0 HG2 PRO A 90 3.019 12.010 -13.474 1.00 10.00 H new ATOM 0 HG3 PRO A 90 4.428 13.037 -13.647 1.00 10.00 H new ATOM 0 HD2 PRO A 90 4.306 10.018 -13.400 1.00 10.00 H new ATOM 0 HD3 PRO A 90 5.394 10.993 -14.368 1.00 10.00 H new ATOM 1274 N TRP A 91 5.187 9.873 -9.744 1.00 10.00 N ATOM 1275 CA TRP A 91 4.809 9.219 -8.497 1.00 10.00 C ATOM 1276 C TRP A 91 4.284 7.806 -8.755 1.00 10.00 C ATOM 1277 O TRP A 91 4.490 7.280 -9.843 1.00 10.00 O ATOM 1278 CB TRP A 91 3.695 10.016 -7.836 1.00 10.00 C ATOM 1279 CG TRP A 91 2.323 9.927 -8.426 1.00 10.00 C ATOM 1280 CD1 TRP A 91 1.215 10.010 -7.676 1.00 10.00 C ATOM 1281 CD2 TRP A 91 1.851 9.888 -9.812 1.00 10.00 C ATOM 1282 NE1 TRP A 91 0.155 10.311 -8.499 1.00 10.00 N ATOM 1283 CE2 TRP A 91 0.538 10.407 -9.817 1.00 10.00 C ATOM 1284 CE3 TRP A 91 2.342 9.464 -11.064 1.00 10.00 C ATOM 1285 CZ2 TRP A 91 -0.117 10.763 -10.999 1.00 10.00 C ATOM 1286 CZ3 TRP A 91 1.634 9.686 -12.259 1.00 10.00 C ATOM 1287 CH2 TRP A 91 0.440 10.416 -12.236 1.00 10.00 C ATOM 0 H TRP A 91 5.147 9.246 -10.547 1.00 10.00 H new ATOM 0 HA TRP A 91 5.692 9.166 -7.860 1.00 10.00 H new ATOM 0 HB2 TRP A 91 3.632 9.701 -6.794 1.00 10.00 H new ATOM 0 HB3 TRP A 91 3.991 11.065 -7.834 1.00 10.00 H new ATOM 0 HD1 TRP A 91 1.163 9.865 -6.607 1.00 10.00 H new ATOM 0 HE1 TRP A 91 -0.801 10.447 -8.171 1.00 10.00 H new ATOM 0 HE3 TRP A 91 3.292 8.952 -11.107 1.00 10.00 H new ATOM 0 HZ2 TRP A 91 -1.051 11.304 -10.959 1.00 10.00 H new ATOM 0 HZ3 TRP A 91 2.011 9.294 -13.192 1.00 10.00 H new ATOM 0 HH2 TRP A 91 -0.044 10.707 -13.157 1.00 10.00 H new ATOM 1298 N LEU A 92 3.506 7.244 -7.819 1.00 10.00 N ATOM 1299 CA LEU A 92 2.683 6.073 -8.074 1.00 10.00 C ATOM 1300 C LEU A 92 1.214 6.379 -7.742 1.00 10.00 C ATOM 1301 O LEU A 92 0.860 6.601 -6.582 1.00 10.00 O ATOM 1302 CB LEU A 92 3.231 4.875 -7.282 1.00 10.00 C ATOM 1303 CG LEU A 92 3.126 3.536 -8.027 1.00 10.00 C ATOM 1304 CD1 LEU A 92 1.716 3.237 -8.540 1.00 10.00 C ATOM 1305 CD2 LEU A 92 4.119 3.444 -9.186 1.00 10.00 C ATOM 0 H LEU A 92 3.436 7.596 -6.864 1.00 10.00 H new ATOM 0 HA LEU A 92 2.722 5.810 -9.131 1.00 10.00 H new ATOM 0 HB2 LEU A 92 4.276 5.062 -7.036 1.00 10.00 H new ATOM 0 HB3 LEU A 92 2.691 4.798 -6.338 1.00 10.00 H new ATOM 0 HG LEU A 92 3.376 2.781 -7.282 1.00 10.00 H new ATOM 0 HD11 LEU A 92 1.713 2.277 -9.056 1.00 10.00 H new ATOM 0 HD12 LEU A 92 1.023 3.199 -7.699 1.00 10.00 H new ATOM 0 HD13 LEU A 92 1.406 4.021 -9.231 1.00 10.00 H new ATOM 0 HD21 LEU A 92 4.009 2.481 -9.684 1.00 10.00 H new ATOM 0 HD22 LEU A 92 3.922 4.245 -9.898 1.00 10.00 H new ATOM 0 HD23 LEU A 92 5.135 3.541 -8.803 1.00 10.00 H new ATOM 1317 N THR A 93 0.351 6.362 -8.766 1.00 10.00 N ATOM 1318 CA THR A 93 -1.085 6.192 -8.581 1.00 10.00 C ATOM 1319 C THR A 93 -1.361 4.702 -8.492 1.00 10.00 C ATOM 1320 O THR A 93 -1.373 4.021 -9.514 1.00 10.00 O ATOM 1321 CB THR A 93 -1.875 6.843 -9.725 1.00 10.00 C ATOM 1322 OG1 THR A 93 -1.656 8.234 -9.696 1.00 10.00 O ATOM 1323 CG2 THR A 93 -3.384 6.584 -9.640 1.00 10.00 C ATOM 0 H THR A 93 0.633 6.466 -9.741 1.00 10.00 H new ATOM 0 HA THR A 93 -1.410 6.688 -7.666 1.00 10.00 H new ATOM 0 HB THR A 93 -1.520 6.397 -10.654 1.00 10.00 H new ATOM 0 HG1 THR A 93 -0.698 8.416 -9.790 1.00 10.00 H new ATOM 0 HG21 THR A 93 -3.884 7.071 -10.477 1.00 10.00 H new ATOM 0 HG22 THR A 93 -3.572 5.511 -9.679 1.00 10.00 H new ATOM 0 HG23 THR A 93 -3.770 6.986 -8.703 1.00 10.00 H new ATOM 1331 N ILE A 94 -1.591 4.205 -7.278 1.00 10.00 N ATOM 1332 CA ILE A 94 -1.988 2.824 -7.074 1.00 10.00 C ATOM 1333 C ILE A 94 -3.499 2.779 -7.317 1.00 10.00 C ATOM 1334 O ILE A 94 -4.244 3.525 -6.676 1.00 10.00 O ATOM 1335 CB ILE A 94 -1.587 2.352 -5.663 1.00 10.00 C ATOM 1336 CG1 ILE A 94 -2.332 3.069 -4.530 1.00 10.00 C ATOM 1337 CG2 ILE A 94 -0.088 2.548 -5.434 1.00 10.00 C ATOM 1338 CD1 ILE A 94 -3.477 2.233 -3.970 1.00 10.00 C ATOM 0 H ILE A 94 -1.507 4.748 -6.418 1.00 10.00 H new ATOM 0 HA ILE A 94 -1.485 2.141 -7.758 1.00 10.00 H new ATOM 0 HB ILE A 94 -1.861 1.298 -5.631 1.00 10.00 H new ATOM 0 HG12 ILE A 94 -1.631 3.304 -3.729 1.00 10.00 H new ATOM 0 HG13 ILE A 94 -2.724 4.017 -4.899 1.00 10.00 H new ATOM 0 HG21 ILE A 94 0.174 2.209 -4.432 1.00 10.00 H new ATOM 0 HG22 ILE A 94 0.471 1.971 -6.171 1.00 10.00 H new ATOM 0 HG23 ILE A 94 0.161 3.604 -5.536 1.00 10.00 H new ATOM 0 HD11 ILE A 94 -3.973 2.784 -3.171 1.00 10.00 H new ATOM 0 HD12 ILE A 94 -4.194 2.020 -4.763 1.00 10.00 H new ATOM 0 HD13 ILE A 94 -3.084 1.296 -3.575 1.00 10.00 H new ATOM 1350 N PRO A 95 -3.988 1.996 -8.283 1.00 10.00 N ATOM 1351 CA PRO A 95 -5.407 1.960 -8.542 1.00 10.00 C ATOM 1352 C PRO A 95 -6.064 0.941 -7.612 1.00 10.00 C ATOM 1353 O PRO A 95 -5.554 -0.167 -7.445 1.00 10.00 O ATOM 1354 CB PRO A 95 -5.524 1.540 -9.995 1.00 10.00 C ATOM 1355 CG PRO A 95 -4.329 0.600 -10.184 1.00 10.00 C ATOM 1356 CD PRO A 95 -3.261 1.199 -9.261 1.00 10.00 C ATOM 0 HA PRO A 95 -5.902 2.915 -8.366 1.00 10.00 H new ATOM 0 HB2 PRO A 95 -6.469 1.035 -10.193 1.00 10.00 H new ATOM 0 HB3 PRO A 95 -5.473 2.396 -10.667 1.00 10.00 H new ATOM 0 HG2 PRO A 95 -4.574 -0.424 -9.904 1.00 10.00 H new ATOM 0 HG3 PRO A 95 -3.996 0.576 -11.222 1.00 10.00 H new ATOM 0 HD2 PRO A 95 -2.680 0.416 -8.774 1.00 10.00 H new ATOM 0 HD3 PRO A 95 -2.558 1.814 -9.823 1.00 10.00 H new ATOM 1364 N ALA A 96 -7.218 1.299 -7.043 1.00 10.00 N ATOM 1365 CA ALA A 96 -8.015 0.403 -6.225 1.00 10.00 C ATOM 1366 C ALA A 96 -7.154 -0.259 -5.138 1.00 10.00 C ATOM 1367 O ALA A 96 -6.305 0.378 -4.520 1.00 10.00 O ATOM 1368 CB ALA A 96 -8.755 -0.581 -7.146 1.00 10.00 C ATOM 0 H ALA A 96 -7.623 2.230 -7.143 1.00 10.00 H new ATOM 0 HA ALA A 96 -8.777 0.953 -5.673 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -9.358 -1.260 -6.543 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -9.403 -0.027 -7.825 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -8.030 -1.155 -7.723 1.00 10.00 H new ATOM 1374 N ARG A 97 -7.361 -1.555 -4.938 1.00 10.00 N ATOM 1375 CA ARG A 97 -6.648 -2.428 -4.026 1.00 10.00 C ATOM 1376 C ARG A 97 -5.201 -2.672 -4.466 1.00 10.00 C ATOM 1377 O ARG A 97 -4.781 -3.809 -4.690 1.00 10.00 O ATOM 1378 CB ARG A 97 -7.420 -3.742 -3.951 1.00 10.00 C ATOM 1379 CG ARG A 97 -7.602 -4.331 -5.362 1.00 10.00 C ATOM 1380 CD ARG A 97 -7.509 -5.853 -5.275 1.00 10.00 C ATOM 1381 NE ARG A 97 -8.540 -6.387 -4.363 1.00 10.00 N ATOM 1382 CZ ARG A 97 -9.836 -6.045 -4.464 1.00 10.00 C ATOM 1383 NH1 ARG A 97 -10.340 -5.747 -5.662 1.00 10.00 N ATOM 1384 NH2 ARG A 97 -10.596 -5.944 -3.372 1.00 10.00 N ATOM 0 H ARG A 97 -8.087 -2.056 -5.450 1.00 10.00 H new ATOM 0 HA ARG A 97 -6.588 -1.955 -3.046 1.00 10.00 H new ATOM 0 HB2 ARG A 97 -6.885 -4.451 -3.319 1.00 10.00 H new ATOM 0 HB3 ARG A 97 -8.393 -3.575 -3.490 1.00 10.00 H new ATOM 0 HG2 ARG A 97 -8.567 -4.035 -5.773 1.00 10.00 H new ATOM 0 HG3 ARG A 97 -6.836 -3.944 -6.034 1.00 10.00 H new ATOM 0 HD2 ARG A 97 -7.634 -6.287 -6.267 1.00 10.00 H new ATOM 0 HD3 ARG A 97 -6.519 -6.142 -4.922 1.00 10.00 H new ATOM 0 HE ARG A 97 -8.259 -7.039 -3.630 1.00 10.00 H new ATOM 0 HH11 ARG A 97 -9.744 -5.780 -6.489 1.00 10.00 H new ATOM 0 HH12 ARG A 97 -11.322 -5.486 -5.752 1.00 10.00 H new ATOM 0 HH21 ARG A 97 -10.194 -6.127 -2.452 1.00 10.00 H new ATOM 0 HH22 ARG A 97 -11.579 -5.684 -3.457 1.00 10.00 H new ATOM 1398 N GLY A 98 -4.418 -1.607 -4.580 1.00 10.00 N ATOM 1399 CA GLY A 98 -3.018 -1.707 -4.908 1.00 10.00 C ATOM 1400 C GLY A 98 -2.231 -2.384 -3.788 1.00 10.00 C ATOM 1401 O GLY A 98 -1.668 -1.734 -2.909 1.00 10.00 O ATOM 0 H GLY A 98 -4.745 -0.650 -4.445 1.00 10.00 H new ATOM 0 HA2 GLY A 98 -2.899 -2.273 -5.832 1.00 10.00 H new ATOM 0 HA3 GLY A 98 -2.613 -0.711 -5.089 1.00 10.00 H new ATOM 1405 N THR A 99 -2.188 -3.708 -3.852 1.00 10.00 N ATOM 1406 CA THR A 99 -1.262 -4.557 -3.134 1.00 10.00 C ATOM 1407 C THR A 99 0.005 -4.670 -3.973 1.00 10.00 C ATOM 1408 O THR A 99 0.294 -5.733 -4.520 1.00 10.00 O ATOM 1409 CB THR A 99 -1.918 -5.908 -2.815 1.00 10.00 C ATOM 1410 OG1 THR A 99 -3.179 -5.677 -2.216 1.00 10.00 O ATOM 1411 CG2 THR A 99 -1.074 -6.740 -1.843 1.00 10.00 C ATOM 0 H THR A 99 -2.832 -4.240 -4.437 1.00 10.00 H new ATOM 0 HA THR A 99 -0.990 -4.134 -2.167 1.00 10.00 H new ATOM 0 HB THR A 99 -2.014 -6.459 -3.751 1.00 10.00 H new ATOM 0 HG1 THR A 99 -3.606 -6.535 -2.011 1.00 10.00 H new ATOM 0 HG21 THR A 99 -1.575 -7.687 -1.645 1.00 10.00 H new ATOM 0 HG22 THR A 99 -0.096 -6.932 -2.283 1.00 10.00 H new ATOM 0 HG23 THR A 99 -0.950 -6.193 -0.908 1.00 10.00 H new ATOM 1419 N LEU A 100 0.733 -3.558 -4.106 1.00 10.00 N ATOM 1420 CA LEU A 100 2.030 -3.544 -4.769 1.00 10.00 C ATOM 1421 C LEU A 100 3.128 -3.491 -3.705 1.00 10.00 C ATOM 1422 O LEU A 100 2.835 -3.435 -2.507 1.00 10.00 O ATOM 1423 CB LEU A 100 2.102 -2.456 -5.848 1.00 10.00 C ATOM 1424 CG LEU A 100 2.343 -1.023 -5.365 1.00 10.00 C ATOM 1425 CD1 LEU A 100 2.696 -0.136 -6.564 1.00 10.00 C ATOM 1426 CD2 LEU A 100 1.120 -0.414 -4.691 1.00 10.00 C ATOM 0 H LEU A 100 0.437 -2.647 -3.756 1.00 10.00 H new ATOM 0 HA LEU A 100 2.188 -4.465 -5.330 1.00 10.00 H new ATOM 0 HB2 LEU A 100 2.899 -2.719 -6.544 1.00 10.00 H new ATOM 0 HB3 LEU A 100 1.169 -2.473 -6.411 1.00 10.00 H new ATOM 0 HG LEU A 100 3.153 -1.070 -4.637 1.00 10.00 H new ATOM 0 HD11 LEU A 100 2.868 0.885 -6.223 1.00 10.00 H new ATOM 0 HD12 LEU A 100 3.598 -0.515 -7.044 1.00 10.00 H new ATOM 0 HD13 LEU A 100 1.873 -0.146 -7.279 1.00 10.00 H new ATOM 0 HD21 LEU A 100 1.350 0.602 -4.369 1.00 10.00 H new ATOM 0 HD22 LEU A 100 0.289 -0.392 -5.396 1.00 10.00 H new ATOM 0 HD23 LEU A 100 0.845 -1.015 -3.825 1.00 10.00 H new ATOM 1438 N THR A 101 4.395 -3.564 -4.111 1.00 10.00 N ATOM 1439 CA THR A 101 5.483 -3.744 -3.170 1.00 10.00 C ATOM 1440 C THR A 101 6.784 -3.216 -3.755 1.00 10.00 C ATOM 1441 O THR A 101 7.166 -3.541 -4.878 1.00 10.00 O ATOM 1442 CB THR A 101 5.555 -5.199 -2.660 1.00 10.00 C ATOM 1443 OG1 THR A 101 6.119 -5.268 -1.362 1.00 10.00 O ATOM 1444 CG2 THR A 101 6.306 -6.147 -3.600 1.00 10.00 C ATOM 0 H THR A 101 4.686 -3.501 -5.086 1.00 10.00 H new ATOM 0 HA THR A 101 5.291 -3.147 -2.279 1.00 10.00 H new ATOM 0 HB THR A 101 4.519 -5.537 -2.626 1.00 10.00 H new ATOM 0 HG1 THR A 101 6.545 -4.413 -1.144 1.00 10.00 H new ATOM 0 HG21 THR A 101 6.315 -7.150 -3.174 1.00 10.00 H new ATOM 0 HG22 THR A 101 5.808 -6.168 -4.569 1.00 10.00 H new ATOM 0 HG23 THR A 101 7.331 -5.798 -3.726 1.00 10.00 H new ATOM 1452 N LEU A 102 7.446 -2.393 -2.948 1.00 10.00 N ATOM 1453 CA LEU A 102 8.564 -1.576 -3.325 1.00 10.00 C ATOM 1454 C LEU A 102 9.836 -2.423 -3.244 1.00 10.00 C ATOM 1455 O LEU A 102 10.076 -3.067 -2.223 1.00 10.00 O ATOM 1456 CB LEU A 102 8.595 -0.347 -2.406 1.00 10.00 C ATOM 1457 CG LEU A 102 7.530 0.705 -2.791 1.00 10.00 C ATOM 1458 CD1 LEU A 102 6.095 0.301 -2.427 1.00 10.00 C ATOM 1459 CD2 LEU A 102 7.833 2.060 -2.140 1.00 10.00 C ATOM 0 H LEU A 102 7.194 -2.282 -1.966 1.00 10.00 H new ATOM 0 HA LEU A 102 8.483 -1.215 -4.350 1.00 10.00 H new ATOM 0 HB2 LEU A 102 8.433 -0.663 -1.376 1.00 10.00 H new ATOM 0 HB3 LEU A 102 9.584 0.109 -2.448 1.00 10.00 H new ATOM 0 HG LEU A 102 7.588 0.777 -3.877 1.00 10.00 H new ATOM 0 HD11 LEU A 102 5.407 1.091 -2.729 1.00 10.00 H new ATOM 0 HD12 LEU A 102 5.835 -0.623 -2.943 1.00 10.00 H new ATOM 0 HD13 LEU A 102 6.022 0.148 -1.350 1.00 10.00 H new ATOM 0 HD21 LEU A 102 7.068 2.781 -2.428 1.00 10.00 H new ATOM 0 HD22 LEU A 102 7.838 1.950 -1.056 1.00 10.00 H new ATOM 0 HD23 LEU A 102 8.809 2.414 -2.473 1.00 10.00 H new ATOM 1471 N GLN A 103 10.608 -2.473 -4.334 1.00 10.00 N ATOM 1472 CA GLN A 103 11.746 -3.351 -4.549 1.00 10.00 C ATOM 1473 C GLN A 103 12.804 -2.609 -5.373 1.00 10.00 C ATOM 1474 O GLN A 103 12.474 -1.747 -6.185 1.00 10.00 O ATOM 1475 CB GLN A 103 11.305 -4.563 -5.381 1.00 10.00 C ATOM 1476 CG GLN A 103 10.103 -5.345 -4.837 1.00 10.00 C ATOM 1477 CD GLN A 103 9.429 -6.151 -5.941 1.00 10.00 C ATOM 1478 OE1 GLN A 103 9.396 -7.376 -5.892 1.00 10.00 O ATOM 1479 NE2 GLN A 103 8.892 -5.479 -6.957 1.00 10.00 N ATOM 0 H GLN A 103 10.439 -1.862 -5.133 1.00 10.00 H new ATOM 0 HA GLN A 103 12.141 -3.661 -3.581 1.00 10.00 H new ATOM 0 HB2 GLN A 103 11.066 -4.221 -6.388 1.00 10.00 H new ATOM 0 HB3 GLN A 103 12.150 -5.246 -5.468 1.00 10.00 H new ATOM 0 HG2 GLN A 103 10.430 -6.014 -4.042 1.00 10.00 H new ATOM 0 HG3 GLN A 103 9.385 -4.654 -4.396 1.00 10.00 H new ATOM 0 HE21 GLN A 103 8.933 -4.460 -6.973 1.00 10.00 H new ATOM 0 HE22 GLN A 103 8.439 -5.983 -7.719 1.00 10.00 H new ATOM 1488 N ARG A 104 14.070 -3.009 -5.238 1.00 10.00 N ATOM 1489 CA ARG A 104 15.191 -2.459 -6.005 1.00 10.00 C ATOM 1490 C ARG A 104 14.988 -2.575 -7.529 1.00 10.00 C ATOM 1491 O ARG A 104 15.571 -1.802 -8.296 1.00 10.00 O ATOM 1492 CB ARG A 104 16.493 -3.157 -5.562 1.00 10.00 C ATOM 1493 CG ARG A 104 17.757 -2.274 -5.619 1.00 10.00 C ATOM 1494 CD ARG A 104 18.730 -2.711 -6.720 1.00 10.00 C ATOM 1495 NE ARG A 104 18.147 -2.494 -8.045 1.00 10.00 N ATOM 1496 CZ ARG A 104 18.242 -3.378 -9.046 1.00 10.00 C ATOM 1497 NH1 ARG A 104 19.319 -4.150 -9.161 1.00 10.00 N ATOM 1498 NH2 ARG A 104 17.217 -3.460 -9.886 1.00 10.00 N ATOM 0 H ARG A 104 14.351 -3.737 -4.581 1.00 10.00 H new ATOM 0 HA ARG A 104 15.253 -1.391 -5.795 1.00 10.00 H new ATOM 0 HB2 ARG A 104 16.365 -3.517 -4.541 1.00 10.00 H new ATOM 0 HB3 ARG A 104 16.651 -4.033 -6.192 1.00 10.00 H new ATOM 0 HG2 ARG A 104 17.465 -1.238 -5.787 1.00 10.00 H new ATOM 0 HG3 ARG A 104 18.265 -2.309 -4.655 1.00 10.00 H new ATOM 0 HD2 ARG A 104 19.661 -2.152 -6.631 1.00 10.00 H new ATOM 0 HD3 ARG A 104 18.978 -3.765 -6.595 1.00 10.00 H new ATOM 0 HE ARG A 104 17.642 -1.624 -8.215 1.00 10.00 H new ATOM 0 HH11 ARG A 104 20.078 -4.070 -8.484 1.00 10.00 H new ATOM 0 HH12 ARG A 104 19.386 -4.822 -9.926 1.00 10.00 H new ATOM 0 HH21 ARG A 104 16.400 -2.863 -9.754 1.00 10.00 H new ATOM 0 HH22 ARG A 104 17.246 -4.120 -10.663 1.00 10.00 H new ATOM 1512 N ASP A 105 14.227 -3.572 -7.989 1.00 10.00 N ATOM 1513 CA ASP A 105 13.935 -3.772 -9.406 1.00 10.00 C ATOM 1514 C ASP A 105 12.856 -2.820 -9.889 1.00 10.00 C ATOM 1515 O ASP A 105 13.082 -2.041 -10.814 1.00 10.00 O ATOM 1516 CB ASP A 105 13.582 -5.238 -9.693 1.00 10.00 C ATOM 1517 CG ASP A 105 14.820 -6.118 -9.795 1.00 10.00 C ATOM 1518 OD1 ASP A 105 15.847 -5.650 -10.342 1.00 10.00 O ATOM 1519 OD2 ASP A 105 14.765 -7.278 -9.338 1.00 10.00 O ATOM 0 H ASP A 105 13.794 -4.267 -7.381 1.00 10.00 H new ATOM 0 HA ASP A 105 14.837 -3.540 -9.972 1.00 10.00 H new ATOM 0 HB2 ASP A 105 12.934 -5.616 -8.902 1.00 10.00 H new ATOM 0 HB3 ASP A 105 13.018 -5.299 -10.623 1.00 10.00 H new ATOM 1524 N GLY A 106 11.676 -2.904 -9.289 1.00 10.00 N ATOM 1525 CA GLY A 106 10.494 -2.257 -9.820 1.00 10.00 C ATOM 1526 C GLY A 106 9.524 -1.943 -8.688 1.00 10.00 C ATOM 1527 O GLY A 106 9.316 -2.795 -7.823 1.00 10.00 O ATOM 0 H GLY A 106 11.516 -3.421 -8.425 1.00 10.00 H new ATOM 0 HA2 GLY A 106 10.772 -1.339 -10.338 1.00 10.00 H new ATOM 0 HA3 GLY A 106 10.013 -2.904 -10.554 1.00 10.00 H new ATOM 1531 N ASP A 107 8.953 -0.726 -8.744 1.00 10.00 N ATOM 1532 CA ASP A 107 8.092 -0.062 -7.758 1.00 10.00 C ATOM 1533 C ASP A 107 8.972 0.285 -6.572 1.00 10.00 C ATOM 1534 O ASP A 107 9.667 -0.604 -6.104 1.00 10.00 O ATOM 1535 CB ASP A 107 6.858 -0.901 -7.382 1.00 10.00 C ATOM 1536 CG ASP A 107 6.106 -0.354 -6.183 1.00 10.00 C ATOM 1537 OD1 ASP A 107 6.138 0.880 -6.002 1.00 10.00 O ATOM 1538 OD2 ASP A 107 5.477 -1.188 -5.496 1.00 10.00 O ATOM 0 H ASP A 107 9.099 -0.130 -9.559 1.00 10.00 H new ATOM 0 HA ASP A 107 7.661 0.847 -8.177 1.00 10.00 H new ATOM 0 HB2 ASP A 107 6.183 -0.946 -8.237 1.00 10.00 H new ATOM 0 HB3 ASP A 107 7.172 -1.923 -7.170 1.00 10.00 H new ATOM 1543 N HIS A 108 9.112 1.553 -6.179 1.00 10.00 N ATOM 1544 CA HIS A 108 10.018 1.927 -5.090 1.00 10.00 C ATOM 1545 C HIS A 108 10.048 3.434 -4.873 1.00 10.00 C ATOM 1546 O HIS A 108 9.556 4.199 -5.698 1.00 10.00 O ATOM 1547 CB HIS A 108 11.453 1.396 -5.288 1.00 10.00 C ATOM 1548 CG HIS A 108 11.954 1.464 -6.705 1.00 10.00 C ATOM 1549 ND1 HIS A 108 11.696 0.553 -7.693 1.00 10.00 N ATOM 1550 CD2 HIS A 108 12.775 2.415 -7.231 1.00 10.00 C ATOM 1551 CE1 HIS A 108 12.383 0.925 -8.775 1.00 10.00 C ATOM 1552 NE2 HIS A 108 13.056 2.080 -8.567 1.00 10.00 N ATOM 0 H HIS A 108 8.611 2.337 -6.597 1.00 10.00 H new ATOM 0 HA HIS A 108 9.613 1.450 -4.198 1.00 10.00 H new ATOM 0 HB2 HIS A 108 12.129 1.965 -4.650 1.00 10.00 H new ATOM 0 HB3 HIS A 108 11.493 0.360 -4.951 1.00 10.00 H new ATOM 0 HD2 HIS A 108 13.148 3.283 -6.708 1.00 10.00 H new ATOM 0 HE1 HIS A 108 12.400 0.372 -9.703 1.00 10.00 H new ATOM 0 HE2 HIS A 108 13.637 2.593 -9.231 1.00 10.00 H new ATOM 1560 N VAL A 109 10.704 3.847 -3.784 1.00 10.00 N ATOM 1561 CA VAL A 109 11.265 5.178 -3.652 1.00 10.00 C ATOM 1562 C VAL A 109 12.773 4.986 -3.770 1.00 10.00 C ATOM 1563 O VAL A 109 13.332 4.219 -2.991 1.00 10.00 O ATOM 1564 CB VAL A 109 10.922 5.802 -2.286 1.00 10.00 C ATOM 1565 CG1 VAL A 109 11.394 7.261 -2.251 1.00 10.00 C ATOM 1566 CG2 VAL A 109 9.422 5.769 -1.982 1.00 10.00 C ATOM 0 H VAL A 109 10.857 3.255 -2.967 1.00 10.00 H new ATOM 0 HA VAL A 109 10.865 5.852 -4.410 1.00 10.00 H new ATOM 0 HB VAL A 109 11.433 5.206 -1.530 1.00 10.00 H new ATOM 0 HG11 VAL A 109 11.150 7.699 -1.283 1.00 10.00 H new ATOM 0 HG12 VAL A 109 12.473 7.298 -2.404 1.00 10.00 H new ATOM 0 HG13 VAL A 109 10.896 7.824 -3.040 1.00 10.00 H new ATOM 0 HG21 VAL A 109 9.238 6.221 -1.008 1.00 10.00 H new ATOM 0 HG22 VAL A 109 8.883 6.326 -2.748 1.00 10.00 H new ATOM 0 HG23 VAL A 109 9.075 4.736 -1.973 1.00 10.00 H new ATOM 1576 N MET A 110 13.433 5.676 -4.699 1.00 10.00 N ATOM 1577 CA MET A 110 14.868 5.876 -4.657 1.00 10.00 C ATOM 1578 C MET A 110 15.095 7.051 -3.708 1.00 10.00 C ATOM 1579 O MET A 110 14.967 8.217 -4.083 1.00 10.00 O ATOM 1580 CB MET A 110 15.452 6.113 -6.060 1.00 10.00 C ATOM 1581 CG MET A 110 15.010 5.002 -7.012 1.00 10.00 C ATOM 1582 SD MET A 110 15.906 4.772 -8.568 1.00 10.00 S ATOM 1583 CE MET A 110 15.966 6.480 -9.163 1.00 10.00 C ATOM 0 H MET A 110 12.979 6.111 -5.502 1.00 10.00 H new ATOM 0 HA MET A 110 15.389 4.989 -4.296 1.00 10.00 H new ATOM 0 HB2 MET A 110 15.122 7.080 -6.440 1.00 10.00 H new ATOM 0 HB3 MET A 110 16.540 6.145 -6.008 1.00 10.00 H new ATOM 0 HG2 MET A 110 15.056 4.061 -6.464 1.00 10.00 H new ATOM 0 HG3 MET A 110 13.963 5.177 -7.258 1.00 10.00 H new ATOM 0 HE1 MET A 110 15.885 6.490 -10.250 1.00 10.00 H new ATOM 0 HE2 MET A 110 15.139 7.044 -8.733 1.00 10.00 H new ATOM 0 HE3 MET A 110 16.910 6.936 -8.865 1.00 10.00 H new ATOM 1593 N LEU A 111 15.397 6.724 -2.453 1.00 10.00 N ATOM 1594 CA LEU A 111 15.691 7.674 -1.393 1.00 10.00 C ATOM 1595 C LEU A 111 17.138 8.121 -1.586 1.00 10.00 C ATOM 1596 O LEU A 111 18.020 7.766 -0.810 1.00 10.00 O ATOM 1597 CB LEU A 111 15.484 6.987 -0.027 1.00 10.00 C ATOM 1598 CG LEU A 111 14.013 6.861 0.399 1.00 10.00 C ATOM 1599 CD1 LEU A 111 13.934 6.021 1.677 1.00 10.00 C ATOM 1600 CD2 LEU A 111 13.380 8.230 0.685 1.00 10.00 C ATOM 0 H LEU A 111 15.444 5.754 -2.140 1.00 10.00 H new ATOM 0 HA LEU A 111 15.033 8.542 -1.425 1.00 10.00 H new ATOM 0 HB2 LEU A 111 15.927 5.992 -0.063 1.00 10.00 H new ATOM 0 HB3 LEU A 111 16.024 7.549 0.735 1.00 10.00 H new ATOM 0 HG LEU A 111 13.469 6.392 -0.421 1.00 10.00 H new ATOM 0 HD11 LEU A 111 12.893 5.927 1.987 1.00 10.00 H new ATOM 0 HD12 LEU A 111 14.348 5.030 1.488 1.00 10.00 H new ATOM 0 HD13 LEU A 111 14.505 6.507 2.468 1.00 10.00 H new ATOM 0 HD21 LEU A 111 12.340 8.095 0.983 1.00 10.00 H new ATOM 0 HD22 LEU A 111 13.927 8.723 1.489 1.00 10.00 H new ATOM 0 HD23 LEU A 111 13.423 8.846 -0.213 1.00 10.00 H new ATOM 1612 N MET A 112 17.384 8.879 -2.656 1.00 10.00 N ATOM 1613 CA MET A 112 18.733 9.184 -3.094 1.00 10.00 C ATOM 1614 C MET A 112 19.331 10.386 -2.380 1.00 10.00 C ATOM 1615 O MET A 112 18.639 11.161 -1.713 1.00 10.00 O ATOM 1616 CB MET A 112 18.752 9.357 -4.615 1.00 10.00 C ATOM 1617 CG MET A 112 18.882 7.972 -5.237 1.00 10.00 C ATOM 1618 SD MET A 112 18.863 7.895 -7.047 1.00 10.00 S ATOM 1619 CE MET A 112 20.289 8.915 -7.483 1.00 10.00 C ATOM 0 H MET A 112 16.654 9.293 -3.235 1.00 10.00 H new ATOM 0 HA MET A 112 19.370 8.342 -2.824 1.00 10.00 H new ATOM 0 HB2 MET A 112 17.839 9.845 -4.956 1.00 10.00 H new ATOM 0 HB3 MET A 112 19.585 9.992 -4.917 1.00 10.00 H new ATOM 0 HG2 MET A 112 19.813 7.526 -4.886 1.00 10.00 H new ATOM 0 HG3 MET A 112 18.069 7.351 -4.860 1.00 10.00 H new ATOM 0 HE1 MET A 112 20.413 8.923 -8.566 1.00 10.00 H new ATOM 0 HE2 MET A 112 20.130 9.933 -7.128 1.00 10.00 H new ATOM 0 HE3 MET A 112 21.185 8.505 -7.018 1.00 10.00 H new ATOM 1629 N GLY A 113 20.645 10.539 -2.544 1.00 10.00 N ATOM 1630 CA GLY A 113 21.388 11.632 -1.954 1.00 10.00 C ATOM 1631 C GLY A 113 21.199 11.637 -0.441 1.00 10.00 C ATOM 1632 O GLY A 113 20.717 12.620 0.112 1.00 10.00 O ATOM 0 H GLY A 113 21.219 9.900 -3.094 1.00 10.00 H new ATOM 0 HA2 GLY A 113 22.446 11.535 -2.196 1.00 10.00 H new ATOM 0 HA3 GLY A 113 21.051 12.580 -2.374 1.00 10.00 H new ATOM 1636 N LEU A 114 21.544 10.539 0.240 1.00 10.00 N ATOM 1637 CA LEU A 114 21.404 10.478 1.690 1.00 10.00 C ATOM 1638 C LEU A 114 22.284 11.555 2.323 1.00 10.00 C ATOM 1639 O LEU A 114 23.486 11.587 2.047 1.00 10.00 O ATOM 1640 CB LEU A 114 21.790 9.100 2.239 1.00 10.00 C ATOM 1641 CG LEU A 114 20.965 7.936 1.669 1.00 10.00 C ATOM 1642 CD1 LEU A 114 21.470 6.622 2.276 1.00 10.00 C ATOM 1643 CD2 LEU A 114 19.475 8.099 1.990 1.00 10.00 C ATOM 0 H LEU A 114 21.918 9.692 -0.188 1.00 10.00 H new ATOM 0 HA LEU A 114 20.358 10.651 1.942 1.00 10.00 H new ATOM 0 HB2 LEU A 114 22.844 8.920 2.027 1.00 10.00 H new ATOM 0 HB3 LEU A 114 21.680 9.111 3.323 1.00 10.00 H new ATOM 0 HG LEU A 114 21.082 7.928 0.585 1.00 10.00 H new ATOM 0 HD11 LEU A 114 20.890 5.790 1.877 1.00 10.00 H new ATOM 0 HD12 LEU A 114 22.522 6.485 2.024 1.00 10.00 H new ATOM 0 HD13 LEU A 114 21.358 6.655 3.360 1.00 10.00 H new ATOM 0 HD21 LEU A 114 18.919 7.259 1.573 1.00 10.00 H new ATOM 0 HD22 LEU A 114 19.336 8.125 3.071 1.00 10.00 H new ATOM 0 HD23 LEU A 114 19.109 9.029 1.555 1.00 10.00 H new ATOM 1655 N LYS A 115 21.700 12.449 3.128 1.00 10.00 N ATOM 1656 CA LYS A 115 22.438 13.534 3.763 1.00 10.00 C ATOM 1657 C LYS A 115 23.196 13.045 5.004 1.00 10.00 C ATOM 1658 O LYS A 115 24.421 13.122 5.046 1.00 10.00 O ATOM 1659 CB LYS A 115 21.546 14.767 4.008 1.00 10.00 C ATOM 1660 CG LYS A 115 20.215 14.553 4.749 1.00 10.00 C ATOM 1661 CD LYS A 115 19.010 15.020 3.911 1.00 10.00 C ATOM 1662 CE LYS A 115 17.723 14.811 4.725 1.00 10.00 C ATOM 1663 NZ LYS A 115 16.480 14.980 3.940 1.00 10.00 N ATOM 0 H LYS A 115 20.705 12.437 3.354 1.00 10.00 H new ATOM 0 HA LYS A 115 23.207 13.876 3.070 1.00 10.00 H new ATOM 0 HB2 LYS A 115 22.129 15.496 4.571 1.00 10.00 H new ATOM 0 HB3 LYS A 115 21.322 15.216 3.040 1.00 10.00 H new ATOM 0 HG2 LYS A 115 20.101 13.497 4.992 1.00 10.00 H new ATOM 0 HG3 LYS A 115 20.233 15.097 5.693 1.00 10.00 H new ATOM 0 HD2 LYS A 115 19.121 16.071 3.645 1.00 10.00 H new ATOM 0 HD3 LYS A 115 18.960 14.459 2.978 1.00 10.00 H new ATOM 0 HE2 LYS A 115 17.736 13.809 5.155 1.00 10.00 H new ATOM 0 HE3 LYS A 115 17.713 15.515 5.557 1.00 10.00 H new ATOM 0 HZ1 LYS A 115 15.729 14.386 4.346 1.00 10.00 H new ATOM 0 HZ2 LYS A 115 16.185 15.977 3.967 1.00 10.00 H new ATOM 0 HZ3 LYS A 115 16.651 14.696 2.954 1.00 10.00 H new ATOM 1677 N ARG A 116 22.476 12.551 6.013 1.00 10.00 N ATOM 1678 CA ARG A 116 23.073 12.056 7.251 1.00 10.00 C ATOM 1679 C ARG A 116 23.824 10.735 7.021 1.00 10.00 C ATOM 1680 O ARG A 116 23.487 10.004 6.091 1.00 10.00 O ATOM 1681 CB ARG A 116 21.983 11.875 8.322 1.00 10.00 C ATOM 1682 CG ARG A 116 20.837 10.953 7.872 1.00 10.00 C ATOM 1683 CD ARG A 116 20.192 10.241 9.068 1.00 10.00 C ATOM 1684 NE ARG A 116 21.101 9.233 9.637 1.00 10.00 N ATOM 1685 CZ ARG A 116 20.791 8.334 10.581 1.00 10.00 C ATOM 1686 NH1 ARG A 116 19.579 8.288 11.133 1.00 10.00 N ATOM 1687 NH2 ARG A 116 21.710 7.459 10.979 1.00 10.00 N ATOM 0 H ARG A 116 21.458 12.484 5.993 1.00 10.00 H new ATOM 0 HA ARG A 116 23.798 12.792 7.598 1.00 10.00 H new ATOM 0 HB2 ARG A 116 22.435 11.467 9.226 1.00 10.00 H new ATOM 0 HB3 ARG A 116 21.574 12.851 8.583 1.00 10.00 H new ATOM 0 HG2 ARG A 116 20.083 11.537 7.344 1.00 10.00 H new ATOM 0 HG3 ARG A 116 21.218 10.213 7.168 1.00 10.00 H new ATOM 0 HD2 ARG A 116 19.930 10.972 9.833 1.00 10.00 H new ATOM 0 HD3 ARG A 116 19.264 9.763 8.754 1.00 10.00 H new ATOM 0 HE ARG A 116 22.056 9.217 9.279 1.00 10.00 H new ATOM 0 HH11 ARG A 116 18.859 8.948 10.839 1.00 10.00 H new ATOM 0 HH12 ARG A 116 19.371 7.593 11.850 1.00 10.00 H new ATOM 0 HH21 ARG A 116 22.643 7.476 10.566 1.00 10.00 H new ATOM 0 HH22 ARG A 116 21.482 6.771 11.697 1.00 10.00 H new ATOM 1701 N PRO A 117 24.792 10.379 7.883 1.00 10.00 N ATOM 1702 CA PRO A 117 25.397 9.055 7.879 1.00 10.00 C ATOM 1703 C PRO A 117 24.391 8.009 8.376 1.00 10.00 C ATOM 1704 O PRO A 117 23.621 8.263 9.307 1.00 10.00 O ATOM 1705 CB PRO A 117 26.609 9.158 8.810 1.00 10.00 C ATOM 1706 CG PRO A 117 26.198 10.251 9.797 1.00 10.00 C ATOM 1707 CD PRO A 117 25.378 11.205 8.929 1.00 10.00 C ATOM 0 HA PRO A 117 25.697 8.740 6.880 1.00 10.00 H new ATOM 0 HB2 PRO A 117 26.810 8.214 9.316 1.00 10.00 H new ATOM 0 HB3 PRO A 117 27.514 9.427 8.265 1.00 10.00 H new ATOM 0 HG2 PRO A 117 25.610 9.850 10.622 1.00 10.00 H new ATOM 0 HG3 PRO A 117 27.065 10.747 10.234 1.00 10.00 H new ATOM 0 HD2 PRO A 117 24.605 11.701 9.515 1.00 10.00 H new ATOM 0 HD3 PRO A 117 26.007 11.987 8.504 1.00 10.00 H new ATOM 1715 N LEU A 118 24.373 6.838 7.737 1.00 10.00 N ATOM 1716 CA LEU A 118 23.450 5.747 8.018 1.00 10.00 C ATOM 1717 C LEU A 118 23.990 4.819 9.111 1.00 10.00 C ATOM 1718 O LEU A 118 25.073 5.036 9.650 1.00 10.00 O ATOM 1719 CB LEU A 118 23.214 4.996 6.701 1.00 10.00 C ATOM 1720 CG LEU A 118 22.180 5.680 5.794 1.00 10.00 C ATOM 1721 CD1 LEU A 118 20.760 5.308 6.222 1.00 10.00 C ATOM 1722 CD2 LEU A 118 22.295 7.206 5.700 1.00 10.00 C ATOM 0 H LEU A 118 25.025 6.620 6.984 1.00 10.00 H new ATOM 0 HA LEU A 118 22.508 6.139 8.401 1.00 10.00 H new ATOM 0 HB2 LEU A 118 24.159 4.910 6.164 1.00 10.00 H new ATOM 0 HB3 LEU A 118 22.880 3.982 6.923 1.00 10.00 H new ATOM 0 HG LEU A 118 22.403 5.302 4.796 1.00 10.00 H new ATOM 0 HD11 LEU A 118 20.042 5.802 5.568 1.00 10.00 H new ATOM 0 HD12 LEU A 118 20.630 4.228 6.153 1.00 10.00 H new ATOM 0 HD13 LEU A 118 20.594 5.628 7.251 1.00 10.00 H new ATOM 0 HD21 LEU A 118 21.520 7.589 5.036 1.00 10.00 H new ATOM 0 HD22 LEU A 118 22.171 7.642 6.691 1.00 10.00 H new ATOM 0 HD23 LEU A 118 23.275 7.473 5.306 1.00 10.00 H new ATOM 1734 N LYS A 119 23.206 3.790 9.449 1.00 10.00 N ATOM 1735 CA LYS A 119 23.504 2.827 10.496 1.00 10.00 C ATOM 1736 C LYS A 119 22.586 1.623 10.263 1.00 10.00 C ATOM 1737 O LYS A 119 21.404 1.665 10.601 1.00 10.00 O ATOM 1738 CB LYS A 119 23.273 3.491 11.863 1.00 10.00 C ATOM 1739 CG LYS A 119 23.459 2.542 13.065 1.00 10.00 C ATOM 1740 CD LYS A 119 24.801 2.753 13.783 1.00 10.00 C ATOM 1741 CE LYS A 119 24.703 3.765 14.938 1.00 10.00 C ATOM 1742 NZ LYS A 119 24.141 5.065 14.522 1.00 10.00 N ATOM 0 H LYS A 119 22.319 3.605 8.981 1.00 10.00 H new ATOM 0 HA LYS A 119 24.541 2.492 10.478 1.00 10.00 H new ATOM 0 HB2 LYS A 119 23.960 4.331 11.967 1.00 10.00 H new ATOM 0 HB3 LYS A 119 22.263 3.900 11.890 1.00 10.00 H new ATOM 0 HG2 LYS A 119 22.645 2.695 13.773 1.00 10.00 H new ATOM 0 HG3 LYS A 119 23.393 1.510 12.722 1.00 10.00 H new ATOM 0 HD2 LYS A 119 25.155 1.798 14.171 1.00 10.00 H new ATOM 0 HD3 LYS A 119 25.543 3.099 13.064 1.00 10.00 H new ATOM 0 HE2 LYS A 119 24.083 3.345 15.730 1.00 10.00 H new ATOM 0 HE3 LYS A 119 25.696 3.923 15.360 1.00 10.00 H new ATOM 0 HZ1 LYS A 119 24.084 5.698 15.345 1.00 10.00 H new ATOM 0 HZ2 LYS A 119 24.753 5.492 13.798 1.00 10.00 H new ATOM 0 HZ3 LYS A 119 23.189 4.922 14.129 1.00 10.00 H new ATOM 1756 N VAL A 120 23.120 0.556 9.665 1.00 10.00 N ATOM 1757 CA VAL A 120 22.387 -0.688 9.470 1.00 10.00 C ATOM 1758 C VAL A 120 21.883 -1.166 10.836 1.00 10.00 C ATOM 1759 O VAL A 120 22.695 -1.419 11.722 1.00 10.00 O ATOM 1760 CB VAL A 120 23.297 -1.733 8.794 1.00 10.00 C ATOM 1761 CG1 VAL A 120 22.567 -3.069 8.606 1.00 10.00 C ATOM 1762 CG2 VAL A 120 23.768 -1.243 7.417 1.00 10.00 C ATOM 0 H VAL A 120 24.074 0.534 9.304 1.00 10.00 H new ATOM 0 HA VAL A 120 21.531 -0.536 8.813 1.00 10.00 H new ATOM 0 HB VAL A 120 24.155 -1.875 9.451 1.00 10.00 H new ATOM 0 HG11 VAL A 120 23.235 -3.785 8.127 1.00 10.00 H new ATOM 0 HG12 VAL A 120 22.258 -3.455 9.578 1.00 10.00 H new ATOM 0 HG13 VAL A 120 21.688 -2.918 7.980 1.00 10.00 H new ATOM 0 HG21 VAL A 120 24.408 -1.998 6.961 1.00 10.00 H new ATOM 0 HG22 VAL A 120 22.903 -1.067 6.778 1.00 10.00 H new ATOM 0 HG23 VAL A 120 24.328 -0.315 7.533 1.00 10.00 H new ATOM 1772 N GLY A 121 20.561 -1.262 11.018 1.00 10.00 N ATOM 1773 CA GLY A 121 19.963 -1.668 12.283 1.00 10.00 C ATOM 1774 C GLY A 121 19.246 -0.512 12.973 1.00 10.00 C ATOM 1775 O GLY A 121 18.484 -0.751 13.905 1.00 10.00 O ATOM 0 H GLY A 121 19.879 -1.059 10.287 1.00 10.00 H new ATOM 0 HA2 GLY A 121 19.257 -2.479 12.106 1.00 10.00 H new ATOM 0 HA3 GLY A 121 20.739 -2.059 12.942 1.00 10.00 H new ATOM 1779 N GLU A 122 19.462 0.731 12.530 1.00 10.00 N ATOM 1780 CA GLU A 122 18.730 1.864 13.055 1.00 10.00 C ATOM 1781 C GLU A 122 17.343 1.871 12.425 1.00 10.00 C ATOM 1782 O GLU A 122 16.905 0.948 11.731 1.00 10.00 O ATOM 1783 CB GLU A 122 19.502 3.157 12.747 1.00 10.00 C ATOM 1784 CG GLU A 122 19.483 4.252 13.824 1.00 10.00 C ATOM 1785 CD GLU A 122 20.464 5.352 13.446 1.00 10.00 C ATOM 1786 OE1 GLU A 122 20.095 6.198 12.603 1.00 10.00 O ATOM 1787 OE2 GLU A 122 21.616 5.304 13.928 1.00 10.00 O ATOM 0 H GLU A 122 20.142 0.967 11.807 1.00 10.00 H new ATOM 0 HA GLU A 122 18.622 1.794 14.137 1.00 10.00 H new ATOM 0 HB2 GLU A 122 20.541 2.893 12.550 1.00 10.00 H new ATOM 0 HB3 GLU A 122 19.101 3.580 11.826 1.00 10.00 H new ATOM 0 HG2 GLU A 122 18.478 4.664 13.922 1.00 10.00 H new ATOM 0 HG3 GLU A 122 19.750 3.829 14.793 1.00 10.00 H new ATOM 1794 N THR A 123 16.655 2.969 12.660 1.00 10.00 N ATOM 1795 CA THR A 123 15.326 3.250 12.160 1.00 10.00 C ATOM 1796 C THR A 123 15.195 4.767 12.133 1.00 10.00 C ATOM 1797 O THR A 123 15.651 5.436 13.058 1.00 10.00 O ATOM 1798 CB THR A 123 14.273 2.568 13.050 1.00 10.00 C ATOM 1799 OG1 THR A 123 14.359 1.162 12.902 1.00 10.00 O ATOM 1800 CG2 THR A 123 12.841 2.972 12.691 1.00 10.00 C ATOM 0 H THR A 123 17.026 3.727 13.233 1.00 10.00 H new ATOM 0 HA THR A 123 15.163 2.853 11.158 1.00 10.00 H new ATOM 0 HB THR A 123 14.485 2.885 14.071 1.00 10.00 H new ATOM 0 HG1 THR A 123 15.157 0.936 12.379 1.00 10.00 H new ATOM 0 HG21 THR A 123 12.142 2.460 13.352 1.00 10.00 H new ATOM 0 HG22 THR A 123 12.727 4.050 12.807 1.00 10.00 H new ATOM 0 HG23 THR A 123 12.633 2.695 11.658 1.00 10.00 H new ATOM 1808 N VAL A 124 14.617 5.302 11.060 1.00 10.00 N ATOM 1809 CA VAL A 124 14.352 6.724 10.896 1.00 10.00 C ATOM 1810 C VAL A 124 12.888 6.867 10.495 1.00 10.00 C ATOM 1811 O VAL A 124 12.317 5.939 9.930 1.00 10.00 O ATOM 1812 CB VAL A 124 15.287 7.317 9.827 1.00 10.00 C ATOM 1813 CG1 VAL A 124 15.217 8.848 9.841 1.00 10.00 C ATOM 1814 CG2 VAL A 124 16.745 6.902 10.071 1.00 10.00 C ATOM 0 H VAL A 124 14.314 4.743 10.263 1.00 10.00 H new ATOM 0 HA VAL A 124 14.539 7.269 11.821 1.00 10.00 H new ATOM 0 HB VAL A 124 14.956 6.933 8.862 1.00 10.00 H new ATOM 0 HG11 VAL A 124 15.885 9.250 9.079 1.00 10.00 H new ATOM 0 HG12 VAL A 124 14.196 9.167 9.634 1.00 10.00 H new ATOM 0 HG13 VAL A 124 15.521 9.217 10.821 1.00 10.00 H new ATOM 0 HG21 VAL A 124 17.381 7.336 9.300 1.00 10.00 H new ATOM 0 HG22 VAL A 124 17.066 7.259 11.050 1.00 10.00 H new ATOM 0 HG23 VAL A 124 16.825 5.815 10.037 1.00 10.00 H new ATOM 1824 N ASN A 125 12.265 8.010 10.780 1.00 10.00 N ATOM 1825 CA ASN A 125 10.889 8.234 10.363 1.00 10.00 C ATOM 1826 C ASN A 125 10.862 8.654 8.893 1.00 10.00 C ATOM 1827 O ASN A 125 11.749 9.375 8.428 1.00 10.00 O ATOM 1828 CB ASN A 125 10.203 9.287 11.243 1.00 10.00 C ATOM 1829 CG ASN A 125 9.978 8.820 12.681 1.00 10.00 C ATOM 1830 OD1 ASN A 125 10.295 7.693 13.046 1.00 10.00 O ATOM 1831 ND2 ASN A 125 9.438 9.695 13.525 1.00 10.00 N ATOM 0 H ASN A 125 12.688 8.784 11.292 1.00 10.00 H new ATOM 0 HA ASN A 125 10.334 7.303 10.480 1.00 10.00 H new ATOM 0 HB2 ASN A 125 10.809 10.193 11.253 1.00 10.00 H new ATOM 0 HB3 ASN A 125 9.243 9.551 10.800 1.00 10.00 H new ATOM 0 HD21 ASN A 125 9.280 9.434 14.498 1.00 10.00 H new ATOM 0 HD22 ASN A 125 9.182 10.627 13.199 1.00 10.00 H new ATOM 1838 N ILE A 126 9.819 8.236 8.176 1.00 10.00 N ATOM 1839 CA ILE A 126 9.413 8.813 6.905 1.00 10.00 C ATOM 1840 C ILE A 126 8.122 9.575 7.161 1.00 10.00 C ATOM 1841 O ILE A 126 7.329 9.156 8.000 1.00 10.00 O ATOM 1842 CB ILE A 126 9.253 7.722 5.830 1.00 10.00 C ATOM 1843 CG1 ILE A 126 9.109 8.328 4.425 1.00 10.00 C ATOM 1844 CG2 ILE A 126 8.087 6.773 6.123 1.00 10.00 C ATOM 1845 CD1 ILE A 126 9.123 7.231 3.358 1.00 10.00 C ATOM 0 H ILE A 126 9.221 7.466 8.475 1.00 10.00 H new ATOM 0 HA ILE A 126 10.171 9.493 6.517 1.00 10.00 H new ATOM 0 HB ILE A 126 10.169 7.132 5.860 1.00 10.00 H new ATOM 0 HG12 ILE A 126 8.179 8.893 4.361 1.00 10.00 H new ATOM 0 HG13 ILE A 126 9.922 9.031 4.242 1.00 10.00 H new ATOM 0 HG21 ILE A 126 8.020 6.024 5.334 1.00 10.00 H new ATOM 0 HG22 ILE A 126 8.252 6.278 7.080 1.00 10.00 H new ATOM 0 HG23 ILE A 126 7.157 7.341 6.164 1.00 10.00 H new ATOM 0 HD11 ILE A 126 9.020 7.682 2.371 1.00 10.00 H new ATOM 0 HD12 ILE A 126 10.065 6.684 3.411 1.00 10.00 H new ATOM 0 HD13 ILE A 126 8.295 6.544 3.531 1.00 10.00 H new ATOM 1857 N THR A 127 7.928 10.682 6.447 1.00 10.00 N ATOM 1858 CA THR A 127 6.716 11.467 6.429 1.00 10.00 C ATOM 1859 C THR A 127 6.204 11.408 5.000 1.00 10.00 C ATOM 1860 O THR A 127 6.836 11.895 4.059 1.00 10.00 O ATOM 1861 CB THR A 127 6.944 12.896 6.921 1.00 10.00 C ATOM 1862 OG1 THR A 127 7.587 12.846 8.177 1.00 10.00 O ATOM 1863 CG2 THR A 127 5.592 13.600 7.091 1.00 10.00 C ATOM 0 H THR A 127 8.652 11.066 5.840 1.00 10.00 H new ATOM 0 HA THR A 127 5.974 11.066 7.119 1.00 10.00 H new ATOM 0 HB THR A 127 7.555 13.439 6.200 1.00 10.00 H new ATOM 0 HG1 THR A 127 7.180 12.143 8.725 1.00 10.00 H new ATOM 0 HG21 THR A 127 5.754 14.619 7.442 1.00 10.00 H new ATOM 0 HG22 THR A 127 5.072 13.624 6.134 1.00 10.00 H new ATOM 0 HG23 THR A 127 4.988 13.058 7.819 1.00 10.00 H new ATOM 1871 N LEU A 128 5.077 10.730 4.860 1.00 10.00 N ATOM 1872 CA LEU A 128 4.390 10.481 3.621 1.00 10.00 C ATOM 1873 C LEU A 128 3.349 11.588 3.449 1.00 10.00 C ATOM 1874 O LEU A 128 2.776 12.072 4.426 1.00 10.00 O ATOM 1875 CB LEU A 128 3.756 9.095 3.767 1.00 10.00 C ATOM 1876 CG LEU A 128 3.651 8.248 2.506 1.00 10.00 C ATOM 1877 CD1 LEU A 128 2.802 8.932 1.431 1.00 10.00 C ATOM 1878 CD2 LEU A 128 5.018 7.780 1.994 1.00 10.00 C ATOM 0 H LEU A 128 4.596 10.318 5.660 1.00 10.00 H new ATOM 0 HA LEU A 128 5.033 10.490 2.741 1.00 10.00 H new ATOM 0 HB2 LEU A 128 4.331 8.535 4.505 1.00 10.00 H new ATOM 0 HB3 LEU A 128 2.753 9.222 4.174 1.00 10.00 H new ATOM 0 HG LEU A 128 3.120 7.336 2.778 1.00 10.00 H new ATOM 0 HD11 LEU A 128 2.752 8.296 0.548 1.00 10.00 H new ATOM 0 HD12 LEU A 128 1.796 9.100 1.815 1.00 10.00 H new ATOM 0 HD13 LEU A 128 3.253 9.888 1.164 1.00 10.00 H new ATOM 0 HD21 LEU A 128 4.884 7.180 1.094 1.00 10.00 H new ATOM 0 HD22 LEU A 128 5.637 8.647 1.763 1.00 10.00 H new ATOM 0 HD23 LEU A 128 5.507 7.179 2.760 1.00 10.00 H new ATOM 1890 N LYS A 129 3.106 11.999 2.206 1.00 10.00 N ATOM 1891 CA LYS A 129 2.083 12.959 1.868 1.00 10.00 C ATOM 1892 C LYS A 129 1.503 12.536 0.517 1.00 10.00 C ATOM 1893 O LYS A 129 2.079 12.801 -0.535 1.00 10.00 O ATOM 1894 CB LYS A 129 2.631 14.399 1.904 1.00 10.00 C ATOM 1895 CG LYS A 129 3.966 14.614 1.177 1.00 10.00 C ATOM 1896 CD LYS A 129 4.393 16.084 1.275 1.00 10.00 C ATOM 1897 CE LYS A 129 5.697 16.312 0.496 1.00 10.00 C ATOM 1898 NZ LYS A 129 6.127 17.726 0.528 1.00 10.00 N ATOM 0 H LYS A 129 3.630 11.662 1.398 1.00 10.00 H new ATOM 0 HA LYS A 129 1.278 12.968 2.603 1.00 10.00 H new ATOM 0 HB2 LYS A 129 1.887 15.064 1.466 1.00 10.00 H new ATOM 0 HB3 LYS A 129 2.752 14.698 2.945 1.00 10.00 H new ATOM 0 HG2 LYS A 129 4.733 13.975 1.614 1.00 10.00 H new ATOM 0 HG3 LYS A 129 3.869 14.325 0.130 1.00 10.00 H new ATOM 0 HD2 LYS A 129 3.607 16.726 0.877 1.00 10.00 H new ATOM 0 HD3 LYS A 129 4.532 16.361 2.320 1.00 10.00 H new ATOM 0 HE2 LYS A 129 6.484 15.685 0.916 1.00 10.00 H new ATOM 0 HE3 LYS A 129 5.559 15.999 -0.539 1.00 10.00 H new ATOM 0 HZ1 LYS A 129 7.011 17.832 -0.010 1.00 10.00 H new ATOM 0 HZ2 LYS A 129 5.389 18.323 0.103 1.00 10.00 H new ATOM 0 HZ3 LYS A 129 6.285 18.019 1.513 1.00 10.00 H new ATOM 1912 N ALA A 130 0.374 11.831 0.550 1.00 10.00 N ATOM 1913 CA ALA A 130 -0.338 11.434 -0.655 1.00 10.00 C ATOM 1914 C ALA A 130 -1.197 12.607 -1.108 1.00 10.00 C ATOM 1915 O ALA A 130 -1.748 13.308 -0.271 1.00 10.00 O ATOM 1916 CB ALA A 130 -1.198 10.203 -0.357 1.00 10.00 C ATOM 0 H ALA A 130 -0.070 11.521 1.414 1.00 10.00 H new ATOM 0 HA ALA A 130 0.360 11.172 -1.450 1.00 10.00 H new ATOM 0 HB1 ALA A 130 -1.732 9.905 -1.259 1.00 10.00 H new ATOM 0 HB2 ALA A 130 -0.559 9.384 -0.026 1.00 10.00 H new ATOM 0 HB3 ALA A 130 -1.916 10.442 0.427 1.00 10.00 H new ATOM 1922 N THR A 131 -1.337 12.863 -2.409 1.00 10.00 N ATOM 1923 CA THR A 131 -2.087 14.048 -2.828 1.00 10.00 C ATOM 1924 C THR A 131 -3.552 13.969 -2.363 1.00 10.00 C ATOM 1925 O THR A 131 -4.145 14.996 -2.022 1.00 10.00 O ATOM 1926 CB THR A 131 -1.881 14.363 -4.320 1.00 10.00 C ATOM 1927 OG1 THR A 131 -2.651 15.477 -4.717 1.00 10.00 O ATOM 1928 CG2 THR A 131 -2.236 13.191 -5.224 1.00 10.00 C ATOM 0 H THR A 131 -0.958 12.292 -3.165 1.00 10.00 H new ATOM 0 HA THR A 131 -1.680 14.922 -2.320 1.00 10.00 H new ATOM 0 HB THR A 131 -0.818 14.579 -4.430 1.00 10.00 H new ATOM 0 HG1 THR A 131 -2.500 15.656 -5.669 1.00 10.00 H new ATOM 0 HG21 THR A 131 -2.071 13.471 -6.264 1.00 10.00 H new ATOM 0 HG22 THR A 131 -1.608 12.336 -4.974 1.00 10.00 H new ATOM 0 HG23 THR A 131 -3.284 12.926 -5.081 1.00 10.00 H new ATOM 1936 N ASP A 132 -4.106 12.760 -2.225 1.00 10.00 N ATOM 1937 CA ASP A 132 -5.422 12.553 -1.626 1.00 10.00 C ATOM 1938 C ASP A 132 -5.408 12.947 -0.142 1.00 10.00 C ATOM 1939 O ASP A 132 -6.377 13.515 0.360 1.00 10.00 O ATOM 1940 CB ASP A 132 -5.872 11.091 -1.776 1.00 10.00 C ATOM 1941 CG ASP A 132 -5.844 10.585 -3.210 1.00 10.00 C ATOM 1942 OD1 ASP A 132 -6.729 10.971 -4.015 1.00 10.00 O ATOM 1943 OD2 ASP A 132 -4.878 9.851 -3.518 1.00 10.00 O ATOM 0 H ASP A 132 -3.651 11.898 -2.527 1.00 10.00 H new ATOM 0 HA ASP A 132 -6.132 13.189 -2.154 1.00 10.00 H new ATOM 0 HB2 ASP A 132 -5.229 10.458 -1.164 1.00 10.00 H new ATOM 0 HB3 ASP A 132 -6.884 10.990 -1.384 1.00 10.00 H new ATOM 1948 N GLY A 133 -4.297 12.680 0.555 1.00 10.00 N ATOM 1949 CA GLY A 133 -4.137 12.882 1.987 1.00 10.00 C ATOM 1950 C GLY A 133 -2.671 13.154 2.332 1.00 10.00 C ATOM 1951 O GLY A 133 -1.898 12.229 2.591 1.00 10.00 O ATOM 0 H GLY A 133 -3.458 12.304 0.114 1.00 10.00 H new ATOM 0 HA2 GLY A 133 -4.754 13.719 2.313 1.00 10.00 H new ATOM 0 HA3 GLY A 133 -4.485 12.001 2.525 1.00 10.00 H new ATOM 1955 N ARG A 134 -2.281 14.433 2.347 1.00 10.00 N ATOM 1956 CA ARG A 134 -0.897 14.851 2.542 1.00 10.00 C ATOM 1957 C ARG A 134 -0.521 14.802 4.031 1.00 10.00 C ATOM 1958 O ARG A 134 -0.005 15.777 4.575 1.00 10.00 O ATOM 1959 CB ARG A 134 -0.717 16.299 2.043 1.00 10.00 C ATOM 1960 CG ARG A 134 -0.764 16.481 0.523 1.00 10.00 C ATOM 1961 CD ARG A 134 -1.898 17.401 0.058 1.00 10.00 C ATOM 1962 NE ARG A 134 -3.161 16.681 -0.160 1.00 10.00 N ATOM 1963 CZ ARG A 134 -4.278 16.706 0.579 1.00 10.00 C ATOM 1964 NH1 ARG A 134 -4.307 17.313 1.770 1.00 10.00 N ATOM 1965 NH2 ARG A 134 -5.352 16.079 0.101 1.00 10.00 N ATOM 0 H ARG A 134 -2.928 15.212 2.222 1.00 10.00 H new ATOM 0 HA ARG A 134 -0.254 14.172 1.982 1.00 10.00 H new ATOM 0 HB2 ARG A 134 -1.494 16.919 2.490 1.00 10.00 H new ATOM 0 HB3 ARG A 134 0.239 16.675 2.407 1.00 10.00 H new ATOM 0 HG2 ARG A 134 0.188 16.889 0.183 1.00 10.00 H new ATOM 0 HG3 ARG A 134 -0.880 15.506 0.051 1.00 10.00 H new ATOM 0 HD2 ARG A 134 -2.054 18.183 0.802 1.00 10.00 H new ATOM 0 HD3 ARG A 134 -1.602 17.896 -0.867 1.00 10.00 H new ATOM 0 HE ARG A 134 -3.191 16.082 -0.985 1.00 10.00 H new ATOM 0 HH11 ARG A 134 -3.469 17.768 2.131 1.00 10.00 H new ATOM 0 HH12 ARG A 134 -5.168 17.321 2.318 1.00 10.00 H new ATOM 0 HH21 ARG A 134 -5.305 15.602 -0.799 1.00 10.00 H new ATOM 0 HH22 ARG A 134 -6.221 16.076 0.635 1.00 10.00 H new ATOM 1979 N THR A 135 -0.735 13.651 4.671 1.00 10.00 N ATOM 1980 CA THR A 135 -0.620 13.516 6.110 1.00 10.00 C ATOM 1981 C THR A 135 -0.375 12.056 6.504 1.00 10.00 C ATOM 1982 O THR A 135 -1.330 11.346 6.809 1.00 10.00 O ATOM 1983 CB THR A 135 -1.913 14.045 6.772 1.00 10.00 C ATOM 1984 OG1 THR A 135 -2.321 15.293 6.243 1.00 10.00 O ATOM 1985 CG2 THR A 135 -1.700 14.209 8.274 1.00 10.00 C ATOM 0 H THR A 135 -0.994 12.786 4.196 1.00 10.00 H new ATOM 0 HA THR A 135 0.233 14.100 6.456 1.00 10.00 H new ATOM 0 HB THR A 135 -2.693 13.312 6.565 1.00 10.00 H new ATOM 0 HG1 THR A 135 -3.142 15.585 6.691 1.00 10.00 H new ATOM 0 HG21 THR A 135 -2.616 14.582 8.733 1.00 10.00 H new ATOM 0 HG22 THR A 135 -1.441 13.245 8.712 1.00 10.00 H new ATOM 0 HG23 THR A 135 -0.891 14.917 8.452 1.00 10.00 H new ATOM 1993 N LEU A 136 0.879 11.598 6.552 1.00 10.00 N ATOM 1994 CA LEU A 136 1.210 10.314 7.161 1.00 10.00 C ATOM 1995 C LEU A 136 2.655 10.349 7.645 1.00 10.00 C ATOM 1996 O LEU A 136 3.466 11.107 7.116 1.00 10.00 O ATOM 1997 CB LEU A 136 1.014 9.182 6.143 1.00 10.00 C ATOM 1998 CG LEU A 136 -0.164 8.249 6.460 1.00 10.00 C ATOM 1999 CD1 LEU A 136 -0.454 7.375 5.234 1.00 10.00 C ATOM 2000 CD2 LEU A 136 0.145 7.348 7.663 1.00 10.00 C ATOM 0 H LEU A 136 1.681 12.102 6.174 1.00 10.00 H new ATOM 0 HA LEU A 136 0.550 10.130 8.009 1.00 10.00 H new ATOM 0 HB2 LEU A 136 0.862 9.618 5.156 1.00 10.00 H new ATOM 0 HB3 LEU A 136 1.928 8.591 6.093 1.00 10.00 H new ATOM 0 HG LEU A 136 -1.032 8.861 6.707 1.00 10.00 H new ATOM 0 HD11 LEU A 136 -1.289 6.709 5.451 1.00 10.00 H new ATOM 0 HD12 LEU A 136 -0.707 8.011 4.386 1.00 10.00 H new ATOM 0 HD13 LEU A 136 0.429 6.783 4.993 1.00 10.00 H new ATOM 0 HD21 LEU A 136 -0.709 6.700 7.861 1.00 10.00 H new ATOM 0 HD22 LEU A 136 1.021 6.737 7.445 1.00 10.00 H new ATOM 0 HD23 LEU A 136 0.343 7.966 8.539 1.00 10.00 H new ATOM 2012 N ASN A 137 2.995 9.511 8.626 1.00 10.00 N ATOM 2013 CA ASN A 137 4.352 9.359 9.118 1.00 10.00 C ATOM 2014 C ASN A 137 4.489 7.921 9.590 1.00 10.00 C ATOM 2015 O ASN A 137 3.540 7.386 10.159 1.00 10.00 O ATOM 2016 CB ASN A 137 4.650 10.369 10.229 1.00 10.00 C ATOM 2017 CG ASN A 137 6.090 10.268 10.727 1.00 10.00 C ATOM 2018 OD1 ASN A 137 6.979 11.151 10.277 1.00 10.00 O flip ATOM 2019 ND2 ASN A 137 6.408 9.410 11.542 1.00 10.00 N flip ATOM 0 H ASN A 137 2.320 8.913 9.103 1.00 10.00 H new ATOM 0 HA ASN A 137 5.082 9.563 8.335 1.00 10.00 H new ATOM 0 HB2 ASN A 137 4.464 11.378 9.860 1.00 10.00 H new ATOM 0 HB3 ASN A 137 3.967 10.203 11.062 1.00 10.00 H new ATOM 0 HD21 ASN A 137 5.714 8.742 11.876 1.00 10.00 H new ATOM 0 HD22 ASN A 137 7.367 9.364 11.887 1.00 10.00 H new ATOM 2026 N VAL A 138 5.605 7.275 9.252 1.00 10.00 N ATOM 2027 CA VAL A 138 5.795 5.841 9.409 1.00 10.00 C ATOM 2028 C VAL A 138 7.268 5.610 9.766 1.00 10.00 C ATOM 2029 O VAL A 138 8.092 6.504 9.576 1.00 10.00 O ATOM 2030 CB VAL A 138 5.380 5.120 8.102 1.00 10.00 C ATOM 2031 CG1 VAL A 138 5.371 3.591 8.251 1.00 10.00 C ATOM 2032 CG2 VAL A 138 4.003 5.551 7.577 1.00 10.00 C ATOM 0 H VAL A 138 6.416 7.748 8.854 1.00 10.00 H new ATOM 0 HA VAL A 138 5.172 5.432 10.205 1.00 10.00 H new ATOM 0 HB VAL A 138 6.143 5.419 7.383 1.00 10.00 H new ATOM 0 HG11 VAL A 138 5.073 3.135 7.307 1.00 10.00 H new ATOM 0 HG12 VAL A 138 6.369 3.246 8.522 1.00 10.00 H new ATOM 0 HG13 VAL A 138 4.664 3.306 9.030 1.00 10.00 H new ATOM 0 HG21 VAL A 138 3.777 5.007 6.660 1.00 10.00 H new ATOM 0 HG22 VAL A 138 3.243 5.331 8.327 1.00 10.00 H new ATOM 0 HG23 VAL A 138 4.011 6.621 7.371 1.00 10.00 H new ATOM 2042 N ALA A 139 7.611 4.427 10.280 1.00 10.00 N ATOM 2043 CA ALA A 139 8.989 4.041 10.554 1.00 10.00 C ATOM 2044 C ALA A 139 9.623 3.412 9.311 1.00 10.00 C ATOM 2045 O ALA A 139 8.989 2.600 8.633 1.00 10.00 O ATOM 2046 CB ALA A 139 9.014 3.058 11.727 1.00 10.00 C ATOM 0 H ALA A 139 6.930 3.706 10.519 1.00 10.00 H new ATOM 0 HA ALA A 139 9.568 4.927 10.817 1.00 10.00 H new ATOM 0 HB1 ALA A 139 10.043 2.766 11.935 1.00 10.00 H new ATOM 0 HB2 ALA A 139 8.586 3.533 12.609 1.00 10.00 H new ATOM 0 HB3 ALA A 139 8.431 2.173 11.473 1.00 10.00 H new ATOM 2052 N ALA A 140 10.877 3.781 9.034 1.00 10.00 N ATOM 2053 CA ALA A 140 11.737 3.202 8.016 1.00 10.00 C ATOM 2054 C ALA A 140 12.943 2.551 8.685 1.00 10.00 C ATOM 2055 O ALA A 140 13.776 3.234 9.280 1.00 10.00 O ATOM 2056 CB ALA A 140 12.204 4.274 7.039 1.00 10.00 C ATOM 0 H ALA A 140 11.338 4.533 9.546 1.00 10.00 H new ATOM 0 HA ALA A 140 11.175 2.451 7.462 1.00 10.00 H new ATOM 0 HB1 ALA A 140 12.847 3.823 6.284 1.00 10.00 H new ATOM 0 HB2 ALA A 140 11.339 4.727 6.555 1.00 10.00 H new ATOM 0 HB3 ALA A 140 12.761 5.040 7.578 1.00 10.00 H new ATOM 2062 N THR A 141 13.027 1.231 8.570 1.00 10.00 N ATOM 2063 CA THR A 141 14.029 0.395 9.208 1.00 10.00 C ATOM 2064 C THR A 141 15.291 0.418 8.344 1.00 10.00 C ATOM 2065 O THR A 141 15.218 0.142 7.150 1.00 10.00 O ATOM 2066 CB THR A 141 13.464 -1.032 9.331 1.00 10.00 C ATOM 2067 OG1 THR A 141 12.077 -1.003 9.620 1.00 10.00 O ATOM 2068 CG2 THR A 141 14.175 -1.794 10.451 1.00 10.00 C ATOM 0 H THR A 141 12.369 0.694 8.005 1.00 10.00 H new ATOM 0 HA THR A 141 14.279 0.758 10.205 1.00 10.00 H new ATOM 0 HB THR A 141 13.628 -1.533 8.377 1.00 10.00 H new ATOM 0 HG1 THR A 141 11.575 -0.818 8.799 1.00 10.00 H new ATOM 0 HG21 THR A 141 13.763 -2.801 10.524 1.00 10.00 H new ATOM 0 HG22 THR A 141 15.241 -1.853 10.231 1.00 10.00 H new ATOM 0 HG23 THR A 141 14.028 -1.272 11.397 1.00 10.00 H new ATOM 2076 N VAL A 142 16.455 0.767 8.887 1.00 10.00 N ATOM 2077 CA VAL A 142 17.632 0.947 8.053 1.00 10.00 C ATOM 2078 C VAL A 142 18.288 -0.420 7.846 1.00 10.00 C ATOM 2079 O VAL A 142 19.027 -0.879 8.717 1.00 10.00 O ATOM 2080 CB VAL A 142 18.577 1.950 8.729 1.00 10.00 C ATOM 2081 CG1 VAL A 142 19.834 2.156 7.882 1.00 10.00 C ATOM 2082 CG2 VAL A 142 17.905 3.312 8.949 1.00 10.00 C ATOM 0 H VAL A 142 16.604 0.928 9.883 1.00 10.00 H new ATOM 0 HA VAL A 142 17.371 1.352 7.075 1.00 10.00 H new ATOM 0 HB VAL A 142 18.841 1.529 9.699 1.00 10.00 H new ATOM 0 HG11 VAL A 142 20.493 2.870 8.376 1.00 10.00 H new ATOM 0 HG12 VAL A 142 20.353 1.205 7.764 1.00 10.00 H new ATOM 0 HG13 VAL A 142 19.553 2.540 6.901 1.00 10.00 H new ATOM 0 HG21 VAL A 142 18.609 3.992 9.430 1.00 10.00 H new ATOM 0 HG22 VAL A 142 17.599 3.726 7.988 1.00 10.00 H new ATOM 0 HG23 VAL A 142 17.029 3.187 9.586 1.00 10.00 H new ATOM 2092 N LYS A 143 18.019 -1.094 6.723 1.00 10.00 N ATOM 2093 CA LYS A 143 18.603 -2.393 6.409 1.00 10.00 C ATOM 2094 C LYS A 143 18.804 -2.552 4.896 1.00 10.00 C ATOM 2095 O LYS A 143 17.856 -2.879 4.183 1.00 10.00 O ATOM 2096 CB LYS A 143 17.701 -3.542 6.904 1.00 10.00 C ATOM 2097 CG LYS A 143 17.368 -3.585 8.403 1.00 10.00 C ATOM 2098 CD LYS A 143 18.552 -3.944 9.316 1.00 10.00 C ATOM 2099 CE LYS A 143 18.778 -5.452 9.528 1.00 10.00 C ATOM 2100 NZ LYS A 143 19.130 -6.183 8.292 1.00 10.00 N ATOM 0 H LYS A 143 17.384 -0.747 6.004 1.00 10.00 H new ATOM 0 HA LYS A 143 19.567 -2.440 6.916 1.00 10.00 H new ATOM 0 HB2 LYS A 143 16.762 -3.495 6.352 1.00 10.00 H new ATOM 0 HB3 LYS A 143 18.180 -4.484 6.638 1.00 10.00 H new ATOM 0 HG2 LYS A 143 16.978 -2.612 8.702 1.00 10.00 H new ATOM 0 HG3 LYS A 143 16.571 -4.311 8.563 1.00 10.00 H new ATOM 0 HD2 LYS A 143 19.460 -3.512 8.895 1.00 10.00 H new ATOM 0 HD3 LYS A 143 18.397 -3.475 10.288 1.00 10.00 H new ATOM 0 HE2 LYS A 143 19.573 -5.591 10.260 1.00 10.00 H new ATOM 0 HE3 LYS A 143 17.874 -5.889 9.952 1.00 10.00 H new ATOM 0 HZ1 LYS A 143 19.558 -7.098 8.540 1.00 10.00 H new ATOM 0 HZ2 LYS A 143 18.272 -6.344 7.727 1.00 10.00 H new ATOM 0 HZ3 LYS A 143 19.808 -5.622 7.738 1.00 10.00 H new ATOM 2114 N LYS A 144 20.042 -2.409 4.407 1.00 10.00 N ATOM 2115 CA LYS A 144 20.418 -2.924 3.096 1.00 10.00 C ATOM 2116 C LYS A 144 20.035 -4.407 2.976 1.00 10.00 C ATOM 2117 O LYS A 144 20.356 -5.202 3.858 1.00 10.00 O ATOM 2118 CB LYS A 144 21.899 -2.629 2.810 1.00 10.00 C ATOM 2119 CG LYS A 144 22.901 -3.371 3.704 1.00 10.00 C ATOM 2120 CD LYS A 144 24.299 -2.769 3.486 1.00 10.00 C ATOM 2121 CE LYS A 144 25.405 -3.580 4.177 1.00 10.00 C ATOM 2122 NZ LYS A 144 25.736 -4.806 3.426 1.00 10.00 N ATOM 0 H LYS A 144 20.798 -1.939 4.905 1.00 10.00 H new ATOM 0 HA LYS A 144 19.858 -2.408 2.316 1.00 10.00 H new ATOM 0 HB2 LYS A 144 22.108 -2.882 1.771 1.00 10.00 H new ATOM 0 HB3 LYS A 144 22.066 -1.557 2.917 1.00 10.00 H new ATOM 0 HG2 LYS A 144 22.611 -3.282 4.751 1.00 10.00 H new ATOM 0 HG3 LYS A 144 22.906 -4.434 3.464 1.00 10.00 H new ATOM 0 HD2 LYS A 144 24.506 -2.717 2.417 1.00 10.00 H new ATOM 0 HD3 LYS A 144 24.313 -1.747 3.864 1.00 10.00 H new ATOM 0 HE2 LYS A 144 26.298 -2.964 4.278 1.00 10.00 H new ATOM 0 HE3 LYS A 144 25.085 -3.846 5.184 1.00 10.00 H new ATOM 0 HZ1 LYS A 144 26.486 -5.326 3.924 1.00 10.00 H new ATOM 0 HZ2 LYS A 144 24.890 -5.406 3.351 1.00 10.00 H new ATOM 0 HZ3 LYS A 144 26.065 -4.551 2.473 1.00 10.00 H new