USER MOD reduce.3.24.130724 H: found=0, std=0, add=1026, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1029 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 518 CYS SG : rot 180:sc= -3! USER MOD Set 1.2: A 520 LYS NZ :NH3+ 156:sc= -0.382 (180deg=-1.96!) USER MOD Single : A 437 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 438 HIS : no HD1:sc= -0.688 X(o=-0.69,f=-0.8) USER MOD Single : A 439 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 440 HIS : no HD1:sc= -2.42! K(o=-2.4!,f=-1.3) USER MOD Single : A 441 HIS : no HD1:sc= -1.98! C(o=-2!,f=-3.4!) USER MOD Single : A 442 HIS : no HD1:sc= 0 X(o=0,f=-0.0089) USER MOD Single : A 443 HIS : no HD1:sc= -0.259 X(o=-0.26,f=-0.11) USER MOD Single : A 444 SER OG : rot 180:sc= 0 USER MOD Single : A 445 ASN : amide:sc= -0.354 K(o=-0.35,f=-2.7!) USER MOD Single : A 447 THR OG1 : rot 180:sc= 0 USER MOD Single : A 450 GLN : amide:sc= -0.179 X(o=-0.18,f=-0.17) USER MOD Single : A 453 SER OG : rot -109:sc= -1.79 USER MOD Single : A 458 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 461 SER OG : rot -25:sc= -5.73! USER MOD Single : A 462 THR OG1 : rot 180:sc= 0 USER MOD Single : A 469 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 470 GLN : amide:sc= -3.85! C(o=-3.9!,f=-8.2!) USER MOD Single : A 474 THR OG1 : rot 40:sc= -1.27 USER MOD Single : A 479 SER OG : rot 90:sc= -2.31 USER MOD Single : A 483 TYR OH : rot 180:sc= 0 USER MOD Single : A 491 THR OG1 : rot 180:sc= 0 USER MOD Single : A 493 CYS SG : rot -160:sc= -3.05 USER MOD Single : A 494 HIS : no HD1:sc= -2.16 K(o=-2.2,f=-3.9!) USER MOD Single : A 498 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 499 THR OG1 : rot 137:sc= 0.15 USER MOD Single : A 504 GLN : amide:sc= -0.0276 X(o=-0.028,f=-0.31) USER MOD Single : A 508 ASN : amide:sc= -1.51 K(o=-1.5,f=-2.2) USER MOD Single : A 510 TYR OH : rot 31:sc= 1.06 USER MOD Single : A 511 THR OG1 : rot 180:sc=-0.00066 USER MOD Single : A 514 ASN : amide:sc= -1.53 K(o=-1.5,f=0) USER MOD Single : A 515 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 516 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 517 HIS : no HD1:sc= -8.28! C(o=-8.3!,f=-7.4!) USER MOD Single : A 525 SER OG : rot 180:sc= 0 USER MOD Single : A 528 HIS : no HD1:sc= -0.51 X(o=-0.51,f=-0.26) USER MOD Single : A 530 GLN : amide:sc= -0.62 K(o=-0.62,f=-2.8!) USER MOD Single : A 532 TYR OH : rot 156:sc= -1.89! USER MOD Single : A 534 GLN : amide:sc= -0.062 K(o=-0.062,f=-1) USER MOD Single : A 535 LYS NZ :NH3+ -112:sc= 0.262! (180deg=-1.92!) USER MOD Single : A 541 GLN : amide:sc= -2.87 K(o=-2.9,f=-1.3) USER MOD Single : A 543 LYS NZ :NH3+ -101:sc= 1.27 (180deg=-0.4) USER MOD Single : A 545 ASN : amide:sc= 0.931 K(o=0.93,f=-0.033) USER MOD Single : A 546 GLN : amide:sc= -0.443 X(o=-0.44,f=0) USER MOD Single : A 550 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 551 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 554 THR OG1 : rot 180:sc= 0 USER MOD Single : A 556 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 559 THR OG1 : rot 180:sc= 0 USER MOD Single : A 560 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 437 133.310 -4.656 -32.711 1.00 0.00 N ATOM 2 CA MET A 437 133.230 -4.374 -31.252 1.00 0.00 C ATOM 3 C MET A 437 133.686 -2.952 -30.939 1.00 0.00 C ATOM 4 O MET A 437 134.883 -2.669 -30.902 1.00 0.00 O ATOM 5 CB MET A 437 134.113 -5.382 -30.512 1.00 0.00 C ATOM 6 CG MET A 437 133.330 -6.483 -29.817 1.00 0.00 C ATOM 7 SD MET A 437 134.038 -6.936 -28.222 1.00 0.00 S ATOM 8 CE MET A 437 134.626 -8.592 -28.566 1.00 0.00 C ATOM 0 HA MET A 437 132.194 -4.468 -30.927 1.00 0.00 H new ATOM 0 HB2 MET A 437 134.807 -5.833 -31.221 1.00 0.00 H new ATOM 0 HB3 MET A 437 134.713 -4.852 -29.772 1.00 0.00 H new ATOM 0 HG2 MET A 437 132.300 -6.156 -29.674 1.00 0.00 H new ATOM 0 HG3 MET A 437 133.299 -7.363 -30.460 1.00 0.00 H new ATOM 0 HE1 MET A 437 135.091 -9.006 -27.671 1.00 0.00 H new ATOM 0 HE2 MET A 437 133.787 -9.221 -28.864 1.00 0.00 H new ATOM 0 HE3 MET A 437 135.358 -8.558 -29.373 1.00 0.00 H new ATOM 20 N HIS A 438 132.726 -2.059 -30.715 1.00 0.00 N ATOM 21 CA HIS A 438 133.039 -0.669 -30.406 1.00 0.00 C ATOM 22 C HIS A 438 131.954 -0.041 -29.536 1.00 0.00 C ATOM 23 O HIS A 438 132.110 0.075 -28.320 1.00 0.00 O ATOM 24 CB HIS A 438 133.206 0.141 -31.694 1.00 0.00 C ATOM 25 CG HIS A 438 132.574 -0.497 -32.893 1.00 0.00 C ATOM 26 ND1 HIS A 438 133.212 -1.443 -33.668 1.00 0.00 N ATOM 27 CD2 HIS A 438 131.352 -0.319 -33.452 1.00 0.00 C ATOM 28 CE1 HIS A 438 132.413 -1.816 -34.652 1.00 0.00 C ATOM 29 NE2 HIS A 438 131.279 -1.150 -34.542 1.00 0.00 N ATOM 0 H HIS A 438 131.729 -2.273 -30.742 1.00 0.00 H new ATOM 0 HA HIS A 438 133.977 -0.654 -29.851 1.00 0.00 H new ATOM 0 HB2 HIS A 438 132.772 1.131 -31.549 1.00 0.00 H new ATOM 0 HB3 HIS A 438 134.269 0.284 -31.888 1.00 0.00 H new ATOM 0 HD2 HIS A 438 130.580 0.352 -33.105 1.00 0.00 H new ATOM 0 HE1 HIS A 438 132.648 -2.542 -35.416 1.00 0.00 H new ATOM 0 HE2 HIS A 438 130.477 -1.239 -35.166 1.00 0.00 H new ATOM 38 N HIS A 439 130.861 0.374 -30.167 1.00 0.00 N ATOM 39 CA HIS A 439 129.755 1.001 -29.451 1.00 0.00 C ATOM 40 C HIS A 439 128.905 -0.035 -28.724 1.00 0.00 C ATOM 41 O HIS A 439 129.176 -1.233 -28.785 1.00 0.00 O ATOM 42 CB HIS A 439 128.883 1.801 -30.419 1.00 0.00 C ATOM 43 CG HIS A 439 129.395 3.184 -30.680 1.00 0.00 C ATOM 44 ND1 HIS A 439 129.265 4.218 -29.776 1.00 0.00 N ATOM 45 CD2 HIS A 439 130.039 3.702 -31.753 1.00 0.00 C ATOM 46 CE1 HIS A 439 129.807 5.313 -30.283 1.00 0.00 C ATOM 47 NE2 HIS A 439 130.284 5.026 -31.479 1.00 0.00 N ATOM 0 H HIS A 439 130.717 0.288 -31.173 1.00 0.00 H new ATOM 0 HA HIS A 439 130.180 1.675 -28.707 1.00 0.00 H new ATOM 0 HB2 HIS A 439 128.815 1.263 -31.364 1.00 0.00 H new ATOM 0 HB3 HIS A 439 127.872 1.866 -30.016 1.00 0.00 H new ATOM 0 HD2 HIS A 439 130.309 3.173 -32.655 1.00 0.00 H new ATOM 0 HE1 HIS A 439 129.851 6.278 -29.800 1.00 0.00 H new ATOM 0 HE2 HIS A 439 130.758 5.681 -32.100 1.00 0.00 H new ATOM 56 N HIS A 440 127.872 0.442 -28.034 1.00 0.00 N ATOM 57 CA HIS A 440 126.973 -0.433 -27.290 1.00 0.00 C ATOM 58 C HIS A 440 125.716 0.320 -26.863 1.00 0.00 C ATOM 59 O HIS A 440 125.665 0.894 -25.776 1.00 0.00 O ATOM 60 CB HIS A 440 127.680 -0.997 -26.056 1.00 0.00 C ATOM 61 CG HIS A 440 128.279 -2.351 -26.275 1.00 0.00 C ATOM 62 ND1 HIS A 440 127.571 -3.522 -26.110 1.00 0.00 N ATOM 63 CD2 HIS A 440 129.529 -2.719 -26.645 1.00 0.00 C ATOM 64 CE1 HIS A 440 128.359 -4.550 -26.368 1.00 0.00 C ATOM 65 NE2 HIS A 440 129.552 -4.090 -26.695 1.00 0.00 N ATOM 0 H HIS A 440 127.637 1.433 -27.975 1.00 0.00 H new ATOM 0 HA HIS A 440 126.684 -1.256 -27.944 1.00 0.00 H new ATOM 0 HB2 HIS A 440 128.466 -0.306 -25.751 1.00 0.00 H new ATOM 0 HB3 HIS A 440 126.967 -1.053 -25.233 1.00 0.00 H new ATOM 0 HD2 HIS A 440 130.354 -2.056 -26.861 1.00 0.00 H new ATOM 0 HE1 HIS A 440 128.075 -5.591 -26.320 1.00 0.00 H new ATOM 0 HE2 HIS A 440 130.360 -4.661 -26.944 1.00 0.00 H new ATOM 74 N HIS A 441 124.705 0.317 -27.726 1.00 0.00 N ATOM 75 CA HIS A 441 123.452 1.005 -27.433 1.00 0.00 C ATOM 76 C HIS A 441 122.249 0.132 -27.773 1.00 0.00 C ATOM 77 O HIS A 441 121.265 0.609 -28.339 1.00 0.00 O ATOM 78 CB HIS A 441 123.378 2.320 -28.209 1.00 0.00 C ATOM 79 CG HIS A 441 122.084 3.050 -28.024 1.00 0.00 C ATOM 80 ND1 HIS A 441 121.060 3.009 -28.945 1.00 0.00 N ATOM 81 CD2 HIS A 441 121.648 3.840 -27.014 1.00 0.00 C ATOM 82 CE1 HIS A 441 120.050 3.743 -28.512 1.00 0.00 C ATOM 83 NE2 HIS A 441 120.383 4.257 -27.342 1.00 0.00 N ATOM 0 H HIS A 441 124.728 -0.153 -28.631 1.00 0.00 H new ATOM 0 HA HIS A 441 123.428 1.216 -26.364 1.00 0.00 H new ATOM 0 HB2 HIS A 441 124.198 2.965 -27.894 1.00 0.00 H new ATOM 0 HB3 HIS A 441 123.522 2.115 -29.270 1.00 0.00 H new ATOM 0 HD2 HIS A 441 122.194 4.094 -26.118 1.00 0.00 H new ATOM 0 HE1 HIS A 441 119.113 3.896 -29.027 1.00 0.00 H new ATOM 0 HE2 HIS A 441 119.794 4.866 -26.774 1.00 0.00 H new ATOM 92 N HIS A 442 122.331 -1.148 -27.423 1.00 0.00 N ATOM 93 CA HIS A 442 121.243 -2.083 -27.691 1.00 0.00 C ATOM 94 C HIS A 442 120.498 -2.429 -26.405 1.00 0.00 C ATOM 95 O HIS A 442 119.322 -2.101 -26.251 1.00 0.00 O ATOM 96 CB HIS A 442 121.785 -3.356 -28.343 1.00 0.00 C ATOM 97 CG HIS A 442 120.918 -3.880 -29.446 1.00 0.00 C ATOM 98 ND1 HIS A 442 121.378 -4.097 -30.728 1.00 0.00 N ATOM 99 CD2 HIS A 442 119.610 -4.232 -29.453 1.00 0.00 C ATOM 100 CE1 HIS A 442 120.392 -4.560 -31.476 1.00 0.00 C ATOM 101 NE2 HIS A 442 119.309 -4.651 -30.725 1.00 0.00 N ATOM 0 H HIS A 442 123.137 -1.561 -26.954 1.00 0.00 H new ATOM 0 HA HIS A 442 120.544 -1.605 -28.377 1.00 0.00 H new ATOM 0 HB2 HIS A 442 122.781 -3.156 -28.739 1.00 0.00 H new ATOM 0 HB3 HIS A 442 121.894 -4.127 -27.580 1.00 0.00 H new ATOM 0 HD2 HIS A 442 118.931 -4.191 -28.614 1.00 0.00 H new ATOM 0 HE1 HIS A 442 120.460 -4.820 -32.522 1.00 0.00 H new ATOM 0 HE2 HIS A 442 118.396 -4.980 -31.040 1.00 0.00 H new ATOM 110 N HIS A 443 121.194 -3.089 -25.483 1.00 0.00 N ATOM 111 CA HIS A 443 120.599 -3.476 -24.208 1.00 0.00 C ATOM 112 C HIS A 443 121.293 -2.767 -23.049 1.00 0.00 C ATOM 113 O HIS A 443 122.463 -3.021 -22.766 1.00 0.00 O ATOM 114 CB HIS A 443 120.689 -4.992 -24.015 1.00 0.00 C ATOM 115 CG HIS A 443 119.375 -5.693 -24.166 1.00 0.00 C ATOM 116 ND1 HIS A 443 119.131 -6.950 -23.652 1.00 0.00 N ATOM 117 CD2 HIS A 443 118.230 -5.309 -24.777 1.00 0.00 C ATOM 118 CE1 HIS A 443 117.892 -7.308 -23.942 1.00 0.00 C ATOM 119 NE2 HIS A 443 117.325 -6.330 -24.622 1.00 0.00 N ATOM 0 H HIS A 443 122.169 -3.366 -25.595 1.00 0.00 H new ATOM 0 HA HIS A 443 119.550 -3.180 -24.222 1.00 0.00 H new ATOM 0 HB2 HIS A 443 121.395 -5.401 -24.738 1.00 0.00 H new ATOM 0 HB3 HIS A 443 121.091 -5.201 -23.024 1.00 0.00 H new ATOM 0 HD2 HIS A 443 118.060 -4.374 -25.291 1.00 0.00 H new ATOM 0 HE1 HIS A 443 117.424 -8.242 -23.669 1.00 0.00 H new ATOM 0 HE2 HIS A 443 116.368 -6.332 -24.976 1.00 0.00 H new ATOM 128 N SER A 444 120.564 -1.878 -22.383 1.00 0.00 N ATOM 129 CA SER A 444 121.109 -1.132 -21.256 1.00 0.00 C ATOM 130 C SER A 444 121.798 -2.063 -20.264 1.00 0.00 C ATOM 131 O SER A 444 121.267 -3.118 -19.914 1.00 0.00 O ATOM 132 CB SER A 444 120.000 -0.349 -20.551 1.00 0.00 C ATOM 133 OG SER A 444 119.353 0.540 -21.445 1.00 0.00 O ATOM 0 H SER A 444 119.593 -1.657 -22.605 1.00 0.00 H new ATOM 0 HA SER A 444 121.850 -0.433 -21.643 1.00 0.00 H new ATOM 0 HB2 SER A 444 119.271 -1.043 -20.133 1.00 0.00 H new ATOM 0 HB3 SER A 444 120.421 0.212 -19.717 1.00 0.00 H new ATOM 0 HG SER A 444 118.648 1.026 -20.969 1.00 0.00 H new ATOM 139 N ASN A 445 122.982 -1.664 -19.811 1.00 0.00 N ATOM 140 CA ASN A 445 123.744 -2.459 -18.855 1.00 0.00 C ATOM 141 C ASN A 445 123.839 -1.744 -17.511 1.00 0.00 C ATOM 142 O ASN A 445 123.921 -2.381 -16.461 1.00 0.00 O ATOM 143 CB ASN A 445 125.146 -2.743 -19.396 1.00 0.00 C ATOM 144 CG ASN A 445 125.334 -4.197 -19.782 1.00 0.00 C ATOM 145 OD1 ASN A 445 124.388 -4.983 -19.759 1.00 0.00 O ATOM 146 ND2 ASN A 445 126.560 -4.561 -20.136 1.00 0.00 N ATOM 0 H ASN A 445 123.435 -0.794 -20.091 1.00 0.00 H new ATOM 0 HA ASN A 445 123.223 -3.405 -18.709 1.00 0.00 H new ATOM 0 HB2 ASN A 445 125.331 -2.112 -20.266 1.00 0.00 H new ATOM 0 HB3 ASN A 445 125.885 -2.472 -18.642 1.00 0.00 H new ATOM 0 HD21 ASN A 445 126.748 -5.527 -20.404 1.00 0.00 H new ATOM 0 HD22 ASN A 445 127.315 -3.875 -20.140 1.00 0.00 H new ATOM 153 N ALA A 446 123.828 -0.416 -17.554 1.00 0.00 N ATOM 154 CA ALA A 446 123.913 0.390 -16.342 1.00 0.00 C ATOM 155 C ALA A 446 122.626 0.299 -15.530 1.00 0.00 C ATOM 156 O ALA A 446 122.553 0.796 -14.406 1.00 0.00 O ATOM 157 CB ALA A 446 124.221 1.842 -16.677 1.00 0.00 C ATOM 0 H ALA A 446 123.761 0.125 -18.416 1.00 0.00 H new ATOM 0 HA ALA A 446 124.728 -0.008 -15.738 1.00 0.00 H new ATOM 0 HB1 ALA A 446 124.279 2.423 -15.757 1.00 0.00 H new ATOM 0 HB2 ALA A 446 125.174 1.900 -17.204 1.00 0.00 H new ATOM 0 HB3 ALA A 446 123.431 2.245 -17.311 1.00 0.00 H new ATOM 163 N THR A 447 121.610 -0.339 -16.103 1.00 0.00 N ATOM 164 CA THR A 447 120.329 -0.493 -15.428 1.00 0.00 C ATOM 165 C THR A 447 120.499 -1.180 -14.078 1.00 0.00 C ATOM 166 O THR A 447 121.301 -2.103 -13.937 1.00 0.00 O ATOM 167 CB THR A 447 119.337 -1.307 -16.281 1.00 0.00 C ATOM 168 OG1 THR A 447 118.043 -1.360 -15.668 1.00 0.00 O ATOM 169 CG2 THR A 447 119.834 -2.731 -16.477 1.00 0.00 C ATOM 0 H THR A 447 121.650 -0.757 -17.033 1.00 0.00 H new ATOM 0 HA THR A 447 119.930 0.510 -15.277 1.00 0.00 H new ATOM 0 HB THR A 447 119.261 -0.804 -17.245 1.00 0.00 H new ATOM 0 HG1 THR A 447 117.435 -1.881 -16.233 1.00 0.00 H new ATOM 0 HG21 THR A 447 119.117 -3.286 -17.082 1.00 0.00 H new ATOM 0 HG22 THR A 447 120.799 -2.713 -16.983 1.00 0.00 H new ATOM 0 HG23 THR A 447 119.942 -3.215 -15.507 1.00 0.00 H new ATOM 177 N GLY A 448 119.739 -0.724 -13.089 1.00 0.00 N ATOM 178 CA GLY A 448 119.819 -1.308 -11.763 1.00 0.00 C ATOM 179 C GLY A 448 118.453 -1.598 -11.176 1.00 0.00 C ATOM 180 O GLY A 448 117.882 -0.760 -10.480 1.00 0.00 O ATOM 0 H GLY A 448 119.069 0.039 -13.182 1.00 0.00 H new ATOM 0 HA2 GLY A 448 120.395 -2.232 -11.810 1.00 0.00 H new ATOM 0 HA3 GLY A 448 120.359 -0.630 -11.102 1.00 0.00 H new ATOM 184 N PRO A 449 117.901 -2.791 -11.444 1.00 0.00 N ATOM 185 CA PRO A 449 116.585 -3.188 -10.933 1.00 0.00 C ATOM 186 C PRO A 449 116.603 -3.441 -9.430 1.00 0.00 C ATOM 187 O PRO A 449 116.511 -4.582 -8.980 1.00 0.00 O ATOM 188 CB PRO A 449 116.289 -4.485 -11.691 1.00 0.00 C ATOM 189 CG PRO A 449 117.630 -5.038 -12.026 1.00 0.00 C ATOM 190 CD PRO A 449 118.519 -3.848 -12.266 1.00 0.00 C ATOM 0 HA PRO A 449 115.835 -2.411 -11.082 1.00 0.00 H new ATOM 0 HB2 PRO A 449 115.715 -5.180 -11.078 1.00 0.00 H new ATOM 0 HB3 PRO A 449 115.703 -4.294 -12.590 1.00 0.00 H new ATOM 0 HG2 PRO A 449 118.013 -5.654 -11.212 1.00 0.00 H new ATOM 0 HG3 PRO A 449 117.581 -5.673 -12.910 1.00 0.00 H new ATOM 0 HD2 PRO A 449 119.547 -4.046 -11.961 1.00 0.00 H new ATOM 0 HD3 PRO A 449 118.547 -3.573 -13.320 1.00 0.00 H new ATOM 198 N GLN A 450 116.724 -2.365 -8.658 1.00 0.00 N ATOM 199 CA GLN A 450 116.757 -2.468 -7.205 1.00 0.00 C ATOM 200 C GLN A 450 115.779 -1.487 -6.566 1.00 0.00 C ATOM 201 O GLN A 450 116.113 -0.804 -5.597 1.00 0.00 O ATOM 202 CB GLN A 450 118.170 -2.204 -6.686 1.00 0.00 C ATOM 203 CG GLN A 450 118.669 -3.261 -5.714 1.00 0.00 C ATOM 204 CD GLN A 450 118.763 -4.636 -6.346 1.00 0.00 C ATOM 205 OE1 GLN A 450 119.611 -4.882 -7.202 1.00 0.00 O ATOM 206 NE2 GLN A 450 117.886 -5.543 -5.927 1.00 0.00 N ATOM 0 H GLN A 450 116.801 -1.413 -9.015 1.00 0.00 H new ATOM 0 HA GLN A 450 116.459 -3.480 -6.932 1.00 0.00 H new ATOM 0 HB2 GLN A 450 118.854 -2.149 -7.532 1.00 0.00 H new ATOM 0 HB3 GLN A 450 118.192 -1.231 -6.195 1.00 0.00 H new ATOM 0 HG2 GLN A 450 119.650 -2.970 -5.339 1.00 0.00 H new ATOM 0 HG3 GLN A 450 117.999 -3.305 -4.855 1.00 0.00 H new ATOM 0 HE21 GLN A 450 117.199 -5.297 -5.215 1.00 0.00 H new ATOM 0 HE22 GLN A 450 117.900 -6.485 -6.318 1.00 0.00 H new ATOM 215 N PHE A 451 114.569 -1.424 -7.112 1.00 0.00 N ATOM 216 CA PHE A 451 113.545 -0.528 -6.593 1.00 0.00 C ATOM 217 C PHE A 451 113.175 -0.898 -5.160 1.00 0.00 C ATOM 218 O PHE A 451 112.649 -1.982 -4.906 1.00 0.00 O ATOM 219 CB PHE A 451 112.298 -0.571 -7.482 1.00 0.00 C ATOM 220 CG PHE A 451 111.468 -1.811 -7.304 1.00 0.00 C ATOM 221 CD1 PHE A 451 111.646 -2.906 -8.136 1.00 0.00 C ATOM 222 CD2 PHE A 451 110.508 -1.883 -6.307 1.00 0.00 C ATOM 223 CE1 PHE A 451 110.884 -4.048 -7.977 1.00 0.00 C ATOM 224 CE2 PHE A 451 109.742 -3.023 -6.143 1.00 0.00 C ATOM 225 CZ PHE A 451 109.930 -4.107 -6.979 1.00 0.00 C ATOM 0 H PHE A 451 114.275 -1.983 -7.913 1.00 0.00 H new ATOM 0 HA PHE A 451 113.949 0.484 -6.596 1.00 0.00 H new ATOM 0 HB2 PHE A 451 111.681 0.302 -7.268 1.00 0.00 H new ATOM 0 HB3 PHE A 451 112.604 -0.497 -8.525 1.00 0.00 H new ATOM 0 HD1 PHE A 451 112.390 -2.866 -8.918 1.00 0.00 H new ATOM 0 HD2 PHE A 451 110.356 -1.039 -5.650 1.00 0.00 H new ATOM 0 HE1 PHE A 451 111.034 -4.893 -8.632 1.00 0.00 H new ATOM 0 HE2 PHE A 451 108.997 -3.066 -5.362 1.00 0.00 H new ATOM 0 HZ PHE A 451 109.333 -4.998 -6.853 1.00 0.00 H new ATOM 235 N VAL A 452 113.448 0.008 -4.225 1.00 0.00 N ATOM 236 CA VAL A 452 113.133 -0.232 -2.821 1.00 0.00 C ATOM 237 C VAL A 452 111.669 -0.625 -2.668 1.00 0.00 C ATOM 238 O VAL A 452 110.782 0.226 -2.726 1.00 0.00 O ATOM 239 CB VAL A 452 113.416 1.012 -1.957 1.00 0.00 C ATOM 240 CG1 VAL A 452 112.480 2.150 -2.334 1.00 0.00 C ATOM 241 CG2 VAL A 452 113.290 0.676 -0.478 1.00 0.00 C ATOM 0 H VAL A 452 113.884 0.910 -4.413 1.00 0.00 H new ATOM 0 HA VAL A 452 113.772 -1.045 -2.478 1.00 0.00 H new ATOM 0 HB VAL A 452 114.439 1.337 -2.146 1.00 0.00 H new ATOM 0 HG11 VAL A 452 112.696 3.019 -1.713 1.00 0.00 H new ATOM 0 HG12 VAL A 452 112.625 2.408 -3.383 1.00 0.00 H new ATOM 0 HG13 VAL A 452 111.447 1.839 -2.177 1.00 0.00 H new ATOM 0 HG21 VAL A 452 113.493 1.567 0.116 1.00 0.00 H new ATOM 0 HG22 VAL A 452 112.280 0.324 -0.270 1.00 0.00 H new ATOM 0 HG23 VAL A 452 114.007 -0.104 -0.220 1.00 0.00 H new ATOM 251 N SER A 453 111.420 -1.919 -2.485 1.00 0.00 N ATOM 252 CA SER A 453 110.056 -2.424 -2.342 1.00 0.00 C ATOM 253 C SER A 453 109.415 -2.058 -0.996 1.00 0.00 C ATOM 254 O SER A 453 108.400 -2.645 -0.625 1.00 0.00 O ATOM 255 CB SER A 453 110.045 -3.943 -2.515 1.00 0.00 C ATOM 256 OG SER A 453 110.123 -4.599 -1.261 1.00 0.00 O ATOM 0 H SER A 453 112.143 -2.636 -2.432 1.00 0.00 H new ATOM 0 HA SER A 453 109.462 -1.945 -3.120 1.00 0.00 H new ATOM 0 HB2 SER A 453 109.135 -4.247 -3.032 1.00 0.00 H new ATOM 0 HB3 SER A 453 110.884 -4.247 -3.141 1.00 0.00 H new ATOM 0 HG SER A 453 111.004 -5.018 -1.165 1.00 0.00 H new ATOM 262 N GLY A 454 109.980 -1.079 -0.286 1.00 0.00 N ATOM 263 CA GLY A 454 109.420 -0.654 0.990 1.00 0.00 C ATOM 264 C GLY A 454 108.705 -1.762 1.746 1.00 0.00 C ATOM 265 O GLY A 454 107.738 -1.502 2.455 1.00 0.00 O ATOM 0 H GLY A 454 110.817 -0.572 -0.573 1.00 0.00 H new ATOM 0 HA2 GLY A 454 110.222 -0.260 1.615 1.00 0.00 H new ATOM 0 HA3 GLY A 454 108.721 0.163 0.815 1.00 0.00 H new ATOM 269 N VAL A 455 109.164 -2.998 1.585 1.00 0.00 N ATOM 270 CA VAL A 455 108.542 -4.136 2.255 1.00 0.00 C ATOM 271 C VAL A 455 107.027 -3.961 2.327 1.00 0.00 C ATOM 272 O VAL A 455 106.501 -3.433 3.306 1.00 0.00 O ATOM 273 CB VAL A 455 109.093 -4.339 3.683 1.00 0.00 C ATOM 274 CG1 VAL A 455 109.629 -5.752 3.849 1.00 0.00 C ATOM 275 CG2 VAL A 455 110.170 -3.313 4.006 1.00 0.00 C ATOM 0 H VAL A 455 109.963 -3.238 0.998 1.00 0.00 H new ATOM 0 HA VAL A 455 108.784 -5.018 1.662 1.00 0.00 H new ATOM 0 HB VAL A 455 108.273 -4.195 4.387 1.00 0.00 H new ATOM 0 HG11 VAL A 455 110.014 -5.879 4.861 1.00 0.00 H new ATOM 0 HG12 VAL A 455 108.827 -6.468 3.673 1.00 0.00 H new ATOM 0 HG13 VAL A 455 110.432 -5.923 3.132 1.00 0.00 H new ATOM 0 HG21 VAL A 455 110.540 -3.480 5.018 1.00 0.00 H new ATOM 0 HG22 VAL A 455 110.992 -3.414 3.298 1.00 0.00 H new ATOM 0 HG23 VAL A 455 109.750 -2.310 3.934 1.00 0.00 H new ATOM 285 N ILE A 456 106.333 -4.397 1.279 1.00 0.00 N ATOM 286 CA ILE A 456 104.879 -4.278 1.220 1.00 0.00 C ATOM 287 C ILE A 456 104.198 -5.240 2.181 1.00 0.00 C ATOM 288 O ILE A 456 103.885 -6.376 1.826 1.00 0.00 O ATOM 289 CB ILE A 456 104.347 -4.536 -0.201 1.00 0.00 C ATOM 290 CG1 ILE A 456 104.756 -3.398 -1.129 1.00 0.00 C ATOM 291 CG2 ILE A 456 102.834 -4.691 -0.187 1.00 0.00 C ATOM 292 CD1 ILE A 456 104.672 -2.032 -0.485 1.00 0.00 C ATOM 0 H ILE A 456 106.754 -4.836 0.460 1.00 0.00 H new ATOM 0 HA ILE A 456 104.644 -3.254 1.511 1.00 0.00 H new ATOM 0 HB ILE A 456 104.782 -5.464 -0.571 1.00 0.00 H new ATOM 0 HG12 ILE A 456 105.777 -3.568 -1.470 1.00 0.00 H new ATOM 0 HG13 ILE A 456 104.118 -3.414 -2.013 1.00 0.00 H new ATOM 0 HG21 ILE A 456 102.477 -4.873 -1.201 1.00 0.00 H new ATOM 0 HG22 ILE A 456 102.560 -5.532 0.450 1.00 0.00 H new ATOM 0 HG23 ILE A 456 102.378 -3.779 0.200 1.00 0.00 H new ATOM 0 HD11 ILE A 456 104.978 -1.272 -1.204 1.00 0.00 H new ATOM 0 HD12 ILE A 456 103.646 -1.841 -0.169 1.00 0.00 H new ATOM 0 HD13 ILE A 456 105.331 -1.997 0.382 1.00 0.00 H new ATOM 304 N VAL A 457 103.972 -4.776 3.399 1.00 0.00 N ATOM 305 CA VAL A 457 103.326 -5.592 4.417 1.00 0.00 C ATOM 306 C VAL A 457 101.825 -5.686 4.171 1.00 0.00 C ATOM 307 O VAL A 457 101.094 -4.708 4.332 1.00 0.00 O ATOM 308 CB VAL A 457 103.578 -5.034 5.830 1.00 0.00 C ATOM 309 CG1 VAL A 457 102.786 -5.813 6.869 1.00 0.00 C ATOM 310 CG2 VAL A 457 105.064 -5.061 6.154 1.00 0.00 C ATOM 0 H VAL A 457 104.226 -3.838 3.708 1.00 0.00 H new ATOM 0 HA VAL A 457 103.763 -6.588 4.351 1.00 0.00 H new ATOM 0 HB VAL A 457 103.238 -3.999 5.855 1.00 0.00 H new ATOM 0 HG11 VAL A 457 102.980 -5.400 7.859 1.00 0.00 H new ATOM 0 HG12 VAL A 457 101.722 -5.737 6.647 1.00 0.00 H new ATOM 0 HG13 VAL A 457 103.088 -6.860 6.847 1.00 0.00 H new ATOM 0 HG21 VAL A 457 105.225 -4.663 7.156 1.00 0.00 H new ATOM 0 HG22 VAL A 457 105.428 -6.087 6.108 1.00 0.00 H new ATOM 0 HG23 VAL A 457 105.605 -4.451 5.430 1.00 0.00 H new ATOM 320 N LYS A 458 101.375 -6.870 3.775 1.00 0.00 N ATOM 321 CA LYS A 458 99.962 -7.099 3.499 1.00 0.00 C ATOM 322 C LYS A 458 99.198 -7.443 4.774 1.00 0.00 C ATOM 323 O LYS A 458 99.519 -8.411 5.463 1.00 0.00 O ATOM 324 CB LYS A 458 99.795 -8.220 2.473 1.00 0.00 C ATOM 325 CG LYS A 458 98.387 -8.788 2.422 1.00 0.00 C ATOM 326 CD LYS A 458 98.337 -10.085 1.630 1.00 0.00 C ATOM 327 CE LYS A 458 96.936 -10.674 1.617 1.00 0.00 C ATOM 328 NZ LYS A 458 96.795 -11.749 0.597 1.00 0.00 N ATOM 0 H LYS A 458 101.969 -7.688 3.638 1.00 0.00 H new ATOM 0 HA LYS A 458 99.549 -6.176 3.092 1.00 0.00 H new ATOM 0 HB2 LYS A 458 100.062 -7.842 1.486 1.00 0.00 H new ATOM 0 HB3 LYS A 458 100.494 -9.023 2.706 1.00 0.00 H new ATOM 0 HG2 LYS A 458 98.028 -8.966 3.436 1.00 0.00 H new ATOM 0 HG3 LYS A 458 97.715 -8.058 1.970 1.00 0.00 H new ATOM 0 HD2 LYS A 458 98.665 -9.901 0.607 1.00 0.00 H new ATOM 0 HD3 LYS A 458 99.032 -10.805 2.063 1.00 0.00 H new ATOM 0 HE2 LYS A 458 96.702 -11.076 2.603 1.00 0.00 H new ATOM 0 HE3 LYS A 458 96.212 -9.885 1.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 458 95.825 -12.125 0.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 458 96.993 -11.360 -0.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 458 97.468 -12.515 0.804 1.00 0.00 H new ATOM 342 N ILE A 459 98.163 -6.659 5.060 1.00 0.00 N ATOM 343 CA ILE A 459 97.322 -6.890 6.227 1.00 0.00 C ATOM 344 C ILE A 459 95.917 -7.297 5.801 1.00 0.00 C ATOM 345 O ILE A 459 95.287 -6.618 4.990 1.00 0.00 O ATOM 346 CB ILE A 459 97.223 -5.646 7.131 1.00 0.00 C ATOM 347 CG1 ILE A 459 98.576 -5.340 7.771 1.00 0.00 C ATOM 348 CG2 ILE A 459 96.163 -5.861 8.203 1.00 0.00 C ATOM 349 CD1 ILE A 459 98.552 -4.137 8.686 1.00 0.00 C ATOM 0 H ILE A 459 97.887 -5.855 4.496 1.00 0.00 H new ATOM 0 HA ILE A 459 97.792 -7.693 6.795 1.00 0.00 H new ATOM 0 HB ILE A 459 96.933 -4.792 6.519 1.00 0.00 H new ATOM 0 HG12 ILE A 459 98.906 -6.211 8.337 1.00 0.00 H new ATOM 0 HG13 ILE A 459 99.312 -5.174 6.984 1.00 0.00 H new ATOM 0 HG21 ILE A 459 96.101 -4.976 8.836 1.00 0.00 H new ATOM 0 HG22 ILE A 459 95.197 -6.037 7.730 1.00 0.00 H new ATOM 0 HG23 ILE A 459 96.431 -6.725 8.812 1.00 0.00 H new ATOM 0 HD11 ILE A 459 99.546 -3.979 9.105 1.00 0.00 H new ATOM 0 HD12 ILE A 459 98.252 -3.255 8.120 1.00 0.00 H new ATOM 0 HD13 ILE A 459 97.841 -4.308 9.494 1.00 0.00 H new ATOM 361 N ILE A 460 95.421 -8.391 6.359 1.00 0.00 N ATOM 362 CA ILE A 460 94.079 -8.856 6.035 1.00 0.00 C ATOM 363 C ILE A 460 93.294 -9.185 7.299 1.00 0.00 C ATOM 364 O ILE A 460 93.814 -9.815 8.220 1.00 0.00 O ATOM 365 CB ILE A 460 94.101 -10.080 5.097 1.00 0.00 C ATOM 366 CG1 ILE A 460 92.717 -10.308 4.487 1.00 0.00 C ATOM 367 CG2 ILE A 460 94.568 -11.319 5.841 1.00 0.00 C ATOM 368 CD1 ILE A 460 91.798 -11.137 5.359 1.00 0.00 C ATOM 0 H ILE A 460 95.922 -8.970 7.033 1.00 0.00 H new ATOM 0 HA ILE A 460 93.582 -8.040 5.510 1.00 0.00 H new ATOM 0 HB ILE A 460 94.807 -9.882 4.290 1.00 0.00 H new ATOM 0 HG12 ILE A 460 92.250 -9.342 4.297 1.00 0.00 H new ATOM 0 HG13 ILE A 460 92.832 -10.802 3.522 1.00 0.00 H new ATOM 0 HG21 ILE A 460 94.576 -12.171 5.161 1.00 0.00 H new ATOM 0 HG22 ILE A 460 95.574 -11.154 6.227 1.00 0.00 H new ATOM 0 HG23 ILE A 460 93.890 -11.523 6.670 1.00 0.00 H new ATOM 0 HD11 ILE A 460 90.835 -11.257 4.862 1.00 0.00 H new ATOM 0 HD12 ILE A 460 92.244 -12.117 5.528 1.00 0.00 H new ATOM 0 HD13 ILE A 460 91.653 -10.634 6.315 1.00 0.00 H new ATOM 380 N SER A 461 92.043 -8.744 7.342 1.00 0.00 N ATOM 381 CA SER A 461 91.189 -8.987 8.497 1.00 0.00 C ATOM 382 C SER A 461 89.915 -9.711 8.084 1.00 0.00 C ATOM 383 O SER A 461 89.815 -10.234 6.974 1.00 0.00 O ATOM 384 CB SER A 461 90.831 -7.669 9.183 1.00 0.00 C ATOM 385 OG SER A 461 89.960 -6.896 8.377 1.00 0.00 O ATOM 0 H SER A 461 91.598 -8.217 6.591 1.00 0.00 H new ATOM 0 HA SER A 461 91.740 -9.616 9.196 1.00 0.00 H new ATOM 0 HB2 SER A 461 90.358 -7.872 10.144 1.00 0.00 H new ATOM 0 HB3 SER A 461 91.740 -7.103 9.388 1.00 0.00 H new ATOM 0 HG SER A 461 90.080 -7.143 7.436 1.00 0.00 H new ATOM 391 N THR A 462 88.945 -9.738 8.988 1.00 0.00 N ATOM 392 CA THR A 462 87.671 -10.399 8.725 1.00 0.00 C ATOM 393 C THR A 462 86.507 -9.420 8.821 1.00 0.00 C ATOM 394 O THR A 462 85.373 -9.758 8.482 1.00 0.00 O ATOM 395 CB THR A 462 87.426 -11.562 9.704 1.00 0.00 C ATOM 396 OG1 THR A 462 87.012 -11.083 10.991 1.00 0.00 O ATOM 397 CG2 THR A 462 88.686 -12.395 9.881 1.00 0.00 C ATOM 0 H THR A 462 89.015 -9.310 9.911 1.00 0.00 H new ATOM 0 HA THR A 462 87.729 -10.792 7.710 1.00 0.00 H new ATOM 0 HB THR A 462 86.634 -12.176 9.276 1.00 0.00 H new ATOM 0 HG1 THR A 462 86.862 -11.844 11.591 1.00 0.00 H new ATOM 0 HG21 THR A 462 88.488 -13.210 10.577 1.00 0.00 H new ATOM 0 HG22 THR A 462 88.989 -12.805 8.918 1.00 0.00 H new ATOM 0 HG23 THR A 462 89.485 -11.767 10.275 1.00 0.00 H new ATOM 405 N GLU A 463 86.797 -8.206 9.283 1.00 0.00 N ATOM 406 CA GLU A 463 85.775 -7.173 9.426 1.00 0.00 C ATOM 407 C GLU A 463 86.185 -6.144 10.474 1.00 0.00 C ATOM 408 O GLU A 463 86.059 -4.938 10.259 1.00 0.00 O ATOM 409 CB GLU A 463 84.431 -7.796 9.814 1.00 0.00 C ATOM 410 CG GLU A 463 83.486 -7.987 8.639 1.00 0.00 C ATOM 411 CD GLU A 463 82.385 -6.945 8.603 1.00 0.00 C ATOM 412 OE1 GLU A 463 82.698 -5.745 8.757 1.00 0.00 O ATOM 413 OE2 GLU A 463 81.210 -7.328 8.421 1.00 0.00 O ATOM 0 H GLU A 463 87.733 -7.914 9.565 1.00 0.00 H new ATOM 0 HA GLU A 463 85.671 -6.671 8.464 1.00 0.00 H new ATOM 0 HB2 GLU A 463 84.611 -8.762 10.285 1.00 0.00 H new ATOM 0 HB3 GLU A 463 83.948 -7.163 10.558 1.00 0.00 H new ATOM 0 HG2 GLU A 463 84.054 -7.943 7.710 1.00 0.00 H new ATOM 0 HG3 GLU A 463 83.040 -8.980 8.693 1.00 0.00 H new ATOM 420 N PRO A 464 86.681 -6.611 11.628 1.00 0.00 N ATOM 421 CA PRO A 464 87.111 -5.736 12.721 1.00 0.00 C ATOM 422 C PRO A 464 87.903 -4.528 12.232 1.00 0.00 C ATOM 423 O PRO A 464 87.947 -3.494 12.898 1.00 0.00 O ATOM 424 CB PRO A 464 87.986 -6.656 13.563 1.00 0.00 C ATOM 425 CG PRO A 464 87.375 -8.003 13.382 1.00 0.00 C ATOM 426 CD PRO A 464 86.862 -8.037 11.966 1.00 0.00 C ATOM 0 HA PRO A 464 86.269 -5.305 13.262 1.00 0.00 H new ATOM 0 HB2 PRO A 464 89.022 -6.640 13.226 1.00 0.00 H new ATOM 0 HB3 PRO A 464 87.987 -6.356 14.611 1.00 0.00 H new ATOM 0 HG2 PRO A 464 88.109 -8.791 13.550 1.00 0.00 H new ATOM 0 HG3 PRO A 464 86.566 -8.164 14.094 1.00 0.00 H new ATOM 0 HD2 PRO A 464 87.571 -8.521 11.294 1.00 0.00 H new ATOM 0 HD3 PRO A 464 85.925 -8.589 11.892 1.00 0.00 H new ATOM 434 N LEU A 465 88.527 -4.661 11.065 1.00 0.00 N ATOM 435 CA LEU A 465 89.313 -3.572 10.495 1.00 0.00 C ATOM 436 C LEU A 465 88.607 -2.234 10.704 1.00 0.00 C ATOM 437 O LEU A 465 87.597 -1.945 10.064 1.00 0.00 O ATOM 438 CB LEU A 465 89.555 -3.813 9.003 1.00 0.00 C ATOM 439 CG LEU A 465 91.019 -3.725 8.564 1.00 0.00 C ATOM 440 CD1 LEU A 465 91.365 -4.873 7.630 1.00 0.00 C ATOM 441 CD2 LEU A 465 91.293 -2.389 7.891 1.00 0.00 C ATOM 0 H LEU A 465 88.504 -5.508 10.498 1.00 0.00 H new ATOM 0 HA LEU A 465 90.275 -3.540 11.006 1.00 0.00 H new ATOM 0 HB2 LEU A 465 89.172 -4.800 8.743 1.00 0.00 H new ATOM 0 HB3 LEU A 465 88.976 -3.086 8.434 1.00 0.00 H new ATOM 0 HG LEU A 465 91.650 -3.801 9.450 1.00 0.00 H new ATOM 0 HD11 LEU A 465 92.409 -4.794 7.328 1.00 0.00 H new ATOM 0 HD12 LEU A 465 91.206 -5.821 8.144 1.00 0.00 H new ATOM 0 HD13 LEU A 465 90.728 -4.828 6.747 1.00 0.00 H new ATOM 0 HD21 LEU A 465 92.338 -2.343 7.585 1.00 0.00 H new ATOM 0 HD22 LEU A 465 90.654 -2.285 7.014 1.00 0.00 H new ATOM 0 HD23 LEU A 465 91.084 -1.580 8.590 1.00 0.00 H new ATOM 453 N PRO A 466 89.135 -1.406 11.617 1.00 0.00 N ATOM 454 CA PRO A 466 88.557 -0.091 11.932 1.00 0.00 C ATOM 455 C PRO A 466 88.713 0.915 10.796 1.00 0.00 C ATOM 456 O PRO A 466 87.771 1.633 10.458 1.00 0.00 O ATOM 457 CB PRO A 466 89.360 0.363 13.152 1.00 0.00 C ATOM 458 CG PRO A 466 90.656 -0.363 13.044 1.00 0.00 C ATOM 459 CD PRO A 466 90.332 -1.691 12.425 1.00 0.00 C ATOM 0 HA PRO A 466 87.482 -0.156 12.102 1.00 0.00 H new ATOM 0 HB2 PRO A 466 89.510 1.443 13.148 1.00 0.00 H new ATOM 0 HB3 PRO A 466 88.844 0.116 14.080 1.00 0.00 H new ATOM 0 HG2 PRO A 466 91.365 0.192 12.429 1.00 0.00 H new ATOM 0 HG3 PRO A 466 91.115 -0.490 14.024 1.00 0.00 H new ATOM 0 HD2 PRO A 466 91.154 -2.059 11.811 1.00 0.00 H new ATOM 0 HD3 PRO A 466 90.135 -2.450 13.182 1.00 0.00 H new ATOM 467 N GLY A 467 89.905 0.969 10.212 1.00 0.00 N ATOM 468 CA GLY A 467 90.152 1.898 9.123 1.00 0.00 C ATOM 469 C GLY A 467 91.626 2.200 8.937 1.00 0.00 C ATOM 470 O GLY A 467 92.471 1.674 9.661 1.00 0.00 O ATOM 0 H GLY A 467 90.703 0.389 10.471 1.00 0.00 H new ATOM 0 HA2 GLY A 467 89.750 1.483 8.198 1.00 0.00 H new ATOM 0 HA3 GLY A 467 89.616 2.827 9.315 1.00 0.00 H new ATOM 474 N ARG A 468 91.935 3.050 7.962 1.00 0.00 N ATOM 475 CA ARG A 468 93.317 3.425 7.680 1.00 0.00 C ATOM 476 C ARG A 468 93.957 4.129 8.873 1.00 0.00 C ATOM 477 O ARG A 468 95.110 3.871 9.213 1.00 0.00 O ATOM 478 CB ARG A 468 93.376 4.335 6.452 1.00 0.00 C ATOM 479 CG ARG A 468 92.534 5.593 6.588 1.00 0.00 C ATOM 480 CD ARG A 468 91.830 5.933 5.286 1.00 0.00 C ATOM 481 NE ARG A 468 90.509 6.511 5.515 1.00 0.00 N ATOM 482 CZ ARG A 468 89.732 6.980 4.545 1.00 0.00 C ATOM 483 NH1 ARG A 468 90.141 6.938 3.284 1.00 0.00 N ATOM 484 NH2 ARG A 468 88.543 7.489 4.837 1.00 0.00 N ATOM 0 H ARG A 468 91.246 3.492 7.353 1.00 0.00 H new ATOM 0 HA ARG A 468 93.876 2.510 7.483 1.00 0.00 H new ATOM 0 HB2 ARG A 468 94.412 4.619 6.270 1.00 0.00 H new ATOM 0 HB3 ARG A 468 93.041 3.776 5.579 1.00 0.00 H new ATOM 0 HG2 ARG A 468 91.795 5.454 7.377 1.00 0.00 H new ATOM 0 HG3 ARG A 468 93.169 6.427 6.888 1.00 0.00 H new ATOM 0 HD2 ARG A 468 92.439 6.635 4.717 1.00 0.00 H new ATOM 0 HD3 ARG A 468 91.732 5.032 4.681 1.00 0.00 H new ATOM 0 HE ARG A 468 90.163 6.557 6.474 1.00 0.00 H new ATOM 0 HH11 ARG A 468 91.054 6.545 3.057 1.00 0.00 H new ATOM 0 HH12 ARG A 468 89.542 7.299 2.541 1.00 0.00 H new ATOM 0 HH21 ARG A 468 88.226 7.520 5.806 1.00 0.00 H new ATOM 0 HH22 ARG A 468 87.946 7.849 4.093 1.00 0.00 H new ATOM 498 N LYS A 469 93.201 5.026 9.501 1.00 0.00 N ATOM 499 CA LYS A 469 93.696 5.772 10.651 1.00 0.00 C ATOM 500 C LYS A 469 94.026 4.841 11.812 1.00 0.00 C ATOM 501 O LYS A 469 95.038 5.013 12.493 1.00 0.00 O ATOM 502 CB LYS A 469 92.668 6.819 11.087 1.00 0.00 C ATOM 503 CG LYS A 469 91.604 6.281 12.029 1.00 0.00 C ATOM 504 CD LYS A 469 90.636 7.372 12.458 1.00 0.00 C ATOM 505 CE LYS A 469 90.191 8.221 11.278 1.00 0.00 C ATOM 506 NZ LYS A 469 89.166 9.227 11.672 1.00 0.00 N ATOM 0 H LYS A 469 92.244 5.253 9.232 1.00 0.00 H new ATOM 0 HA LYS A 469 94.614 6.279 10.354 1.00 0.00 H new ATOM 0 HB2 LYS A 469 93.188 7.644 11.575 1.00 0.00 H new ATOM 0 HB3 LYS A 469 92.182 7.228 10.201 1.00 0.00 H new ATOM 0 HG2 LYS A 469 91.054 5.478 11.538 1.00 0.00 H new ATOM 0 HG3 LYS A 469 92.080 5.849 12.909 1.00 0.00 H new ATOM 0 HD2 LYS A 469 89.764 6.920 12.931 1.00 0.00 H new ATOM 0 HD3 LYS A 469 91.111 8.007 13.206 1.00 0.00 H new ATOM 0 HE2 LYS A 469 91.055 8.731 10.852 1.00 0.00 H new ATOM 0 HE3 LYS A 469 89.785 7.576 10.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 469 88.889 9.785 10.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 469 88.331 8.740 12.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 469 89.561 9.859 12.397 1.00 0.00 H new ATOM 520 N GLN A 470 93.163 3.857 12.037 1.00 0.00 N ATOM 521 CA GLN A 470 93.362 2.903 13.121 1.00 0.00 C ATOM 522 C GLN A 470 94.419 1.865 12.755 1.00 0.00 C ATOM 523 O GLN A 470 95.278 1.531 13.571 1.00 0.00 O ATOM 524 CB GLN A 470 92.042 2.214 13.467 1.00 0.00 C ATOM 525 CG GLN A 470 91.282 2.897 14.592 1.00 0.00 C ATOM 526 CD GLN A 470 90.060 3.648 14.103 1.00 0.00 C ATOM 527 OE1 GLN A 470 90.078 4.258 13.033 1.00 0.00 O ATOM 528 NE2 GLN A 470 88.989 3.609 14.887 1.00 0.00 N ATOM 0 H GLN A 470 92.320 3.699 11.484 1.00 0.00 H new ATOM 0 HA GLN A 470 93.716 3.452 13.993 1.00 0.00 H new ATOM 0 HB2 GLN A 470 91.412 2.185 12.578 1.00 0.00 H new ATOM 0 HB3 GLN A 470 92.243 1.181 13.749 1.00 0.00 H new ATOM 0 HG2 GLN A 470 90.975 2.149 15.323 1.00 0.00 H new ATOM 0 HG3 GLN A 470 91.948 3.591 15.106 1.00 0.00 H new ATOM 0 HE21 GLN A 470 89.018 3.091 15.765 1.00 0.00 H new ATOM 0 HE22 GLN A 470 88.137 4.097 14.611 1.00 0.00 H new ATOM 537 N VAL A 471 94.356 1.361 11.526 1.00 0.00 N ATOM 538 CA VAL A 471 95.317 0.366 11.066 1.00 0.00 C ATOM 539 C VAL A 471 96.719 0.966 10.995 1.00 0.00 C ATOM 540 O VAL A 471 97.699 0.350 11.428 1.00 0.00 O ATOM 541 CB VAL A 471 94.927 -0.194 9.684 1.00 0.00 C ATOM 542 CG1 VAL A 471 96.017 -1.107 9.146 1.00 0.00 C ATOM 543 CG2 VAL A 471 93.597 -0.929 9.766 1.00 0.00 C ATOM 0 H VAL A 471 93.653 1.624 10.835 1.00 0.00 H new ATOM 0 HA VAL A 471 95.310 -0.452 11.787 1.00 0.00 H new ATOM 0 HB VAL A 471 94.816 0.641 8.992 1.00 0.00 H new ATOM 0 HG11 VAL A 471 95.721 -1.491 8.170 1.00 0.00 H new ATOM 0 HG12 VAL A 471 96.946 -0.546 9.049 1.00 0.00 H new ATOM 0 HG13 VAL A 471 96.166 -1.940 9.833 1.00 0.00 H new ATOM 0 HG21 VAL A 471 93.335 -1.319 8.782 1.00 0.00 H new ATOM 0 HG22 VAL A 471 93.681 -1.755 10.473 1.00 0.00 H new ATOM 0 HG23 VAL A 471 92.821 -0.241 10.102 1.00 0.00 H new ATOM 553 N ARG A 472 96.803 2.180 10.461 1.00 0.00 N ATOM 554 CA ARG A 472 98.077 2.877 10.355 1.00 0.00 C ATOM 555 C ARG A 472 98.646 3.130 11.745 1.00 0.00 C ATOM 556 O ARG A 472 99.833 2.919 11.991 1.00 0.00 O ATOM 557 CB ARG A 472 97.904 4.198 9.603 1.00 0.00 C ATOM 558 CG ARG A 472 97.384 5.330 10.472 1.00 0.00 C ATOM 559 CD ARG A 472 96.965 6.525 9.632 1.00 0.00 C ATOM 560 NE ARG A 472 98.051 7.001 8.781 1.00 0.00 N ATOM 561 CZ ARG A 472 97.985 8.114 8.057 1.00 0.00 C ATOM 562 NH1 ARG A 472 96.888 8.858 8.081 1.00 0.00 N ATOM 563 NH2 ARG A 472 99.016 8.482 7.307 1.00 0.00 N ATOM 0 H ARG A 472 96.005 2.700 10.096 1.00 0.00 H new ATOM 0 HA ARG A 472 98.773 2.253 9.795 1.00 0.00 H new ATOM 0 HB2 ARG A 472 98.863 4.491 9.175 1.00 0.00 H new ATOM 0 HB3 ARG A 472 97.217 4.045 8.771 1.00 0.00 H new ATOM 0 HG2 ARG A 472 96.535 4.980 11.059 1.00 0.00 H new ATOM 0 HG3 ARG A 472 98.157 5.633 11.179 1.00 0.00 H new ATOM 0 HD2 ARG A 472 96.111 6.251 9.012 1.00 0.00 H new ATOM 0 HD3 ARG A 472 96.637 7.332 10.287 1.00 0.00 H new ATOM 0 HE ARG A 472 98.908 6.449 8.739 1.00 0.00 H new ATOM 0 HH11 ARG A 472 96.093 8.577 8.655 1.00 0.00 H new ATOM 0 HH12 ARG A 472 96.839 9.712 7.525 1.00 0.00 H new ATOM 0 HH21 ARG A 472 99.861 7.911 7.285 1.00 0.00 H new ATOM 0 HH22 ARG A 472 98.964 9.336 6.752 1.00 0.00 H new ATOM 577 N ASP A 473 97.783 3.573 12.654 1.00 0.00 N ATOM 578 CA ASP A 473 98.192 3.842 14.026 1.00 0.00 C ATOM 579 C ASP A 473 98.737 2.576 14.672 1.00 0.00 C ATOM 580 O ASP A 473 99.714 2.618 15.420 1.00 0.00 O ATOM 581 CB ASP A 473 97.013 4.378 14.840 1.00 0.00 C ATOM 582 CG ASP A 473 96.873 5.883 14.732 1.00 0.00 C ATOM 583 OD1 ASP A 473 97.736 6.514 14.085 1.00 0.00 O ATOM 584 OD2 ASP A 473 95.901 6.432 15.293 1.00 0.00 O ATOM 0 H ASP A 473 96.797 3.753 12.464 1.00 0.00 H new ATOM 0 HA ASP A 473 98.978 4.597 14.009 1.00 0.00 H new ATOM 0 HB2 ASP A 473 96.093 3.905 14.497 1.00 0.00 H new ATOM 0 HB3 ASP A 473 97.142 4.102 15.887 1.00 0.00 H new ATOM 589 N THR A 474 98.104 1.446 14.369 1.00 0.00 N ATOM 590 CA THR A 474 98.531 0.165 14.909 1.00 0.00 C ATOM 591 C THR A 474 99.918 -0.199 14.394 1.00 0.00 C ATOM 592 O THR A 474 100.923 0.019 15.073 1.00 0.00 O ATOM 593 CB THR A 474 97.549 -0.967 14.543 1.00 0.00 C ATOM 594 OG1 THR A 474 96.892 -0.710 13.298 1.00 0.00 O ATOM 595 CG2 THR A 474 96.484 -1.137 15.614 1.00 0.00 C ATOM 0 H THR A 474 97.294 1.395 13.752 1.00 0.00 H new ATOM 0 HA THR A 474 98.554 0.270 15.994 1.00 0.00 H new ATOM 0 HB THR A 474 98.143 -1.877 14.461 1.00 0.00 H new ATOM 0 HG1 THR A 474 97.531 -0.322 12.665 1.00 0.00 H new ATOM 0 HG21 THR A 474 95.806 -1.942 15.329 1.00 0.00 H new ATOM 0 HG22 THR A 474 96.959 -1.382 16.564 1.00 0.00 H new ATOM 0 HG23 THR A 474 95.922 -0.209 15.719 1.00 0.00 H new ATOM 603 N LEU A 475 99.967 -0.770 13.194 1.00 0.00 N ATOM 604 CA LEU A 475 101.236 -1.176 12.602 1.00 0.00 C ATOM 605 C LEU A 475 102.307 -0.113 12.821 1.00 0.00 C ATOM 606 O LEU A 475 103.454 -0.433 13.134 1.00 0.00 O ATOM 607 CB LEU A 475 101.061 -1.435 11.106 1.00 0.00 C ATOM 608 CG LEU A 475 100.444 -0.278 10.319 1.00 0.00 C ATOM 609 CD1 LEU A 475 101.507 0.452 9.514 1.00 0.00 C ATOM 610 CD2 LEU A 475 99.338 -0.784 9.407 1.00 0.00 C ATOM 0 H LEU A 475 99.148 -0.961 12.616 1.00 0.00 H new ATOM 0 HA LEU A 475 101.558 -2.095 13.091 1.00 0.00 H new ATOM 0 HB2 LEU A 475 102.035 -1.669 10.676 1.00 0.00 H new ATOM 0 HB3 LEU A 475 100.435 -2.318 10.976 1.00 0.00 H new ATOM 0 HG LEU A 475 100.010 0.426 11.029 1.00 0.00 H new ATOM 0 HD11 LEU A 475 101.047 1.271 8.962 1.00 0.00 H new ATOM 0 HD12 LEU A 475 102.265 0.850 10.189 1.00 0.00 H new ATOM 0 HD13 LEU A 475 101.973 -0.241 8.813 1.00 0.00 H new ATOM 0 HD21 LEU A 475 98.910 0.053 8.855 1.00 0.00 H new ATOM 0 HD22 LEU A 475 99.749 -1.510 8.705 1.00 0.00 H new ATOM 0 HD23 LEU A 475 98.561 -1.258 10.006 1.00 0.00 H new ATOM 622 N ALA A 476 101.928 1.153 12.661 1.00 0.00 N ATOM 623 CA ALA A 476 102.867 2.250 12.849 1.00 0.00 C ATOM 624 C ALA A 476 103.243 2.405 14.319 1.00 0.00 C ATOM 625 O ALA A 476 104.319 2.906 14.646 1.00 0.00 O ATOM 626 CB ALA A 476 102.295 3.554 12.313 1.00 0.00 C ATOM 0 H ALA A 476 100.984 1.441 12.404 1.00 0.00 H new ATOM 0 HA ALA A 476 103.770 2.011 12.287 1.00 0.00 H new ATOM 0 HB1 ALA A 476 103.016 4.357 12.466 1.00 0.00 H new ATOM 0 HB2 ALA A 476 102.088 3.450 11.248 1.00 0.00 H new ATOM 0 HB3 ALA A 476 101.371 3.790 12.841 1.00 0.00 H new ATOM 632 N ALA A 477 102.348 1.973 15.202 1.00 0.00 N ATOM 633 CA ALA A 477 102.586 2.068 16.637 1.00 0.00 C ATOM 634 C ALA A 477 103.623 1.047 17.089 1.00 0.00 C ATOM 635 O ALA A 477 104.336 1.265 18.067 1.00 0.00 O ATOM 636 CB ALA A 477 101.293 1.886 17.417 1.00 0.00 C ATOM 0 H ALA A 477 101.453 1.554 14.949 1.00 0.00 H new ATOM 0 HA ALA A 477 102.975 3.066 16.841 1.00 0.00 H new ATOM 0 HB1 ALA A 477 101.499 1.961 18.485 1.00 0.00 H new ATOM 0 HB2 ALA A 477 100.582 2.660 17.129 1.00 0.00 H new ATOM 0 HB3 ALA A 477 100.870 0.906 17.197 1.00 0.00 H new ATOM 642 N ILE A 478 103.702 -0.066 16.370 1.00 0.00 N ATOM 643 CA ILE A 478 104.657 -1.120 16.700 1.00 0.00 C ATOM 644 C ILE A 478 106.049 -0.786 16.172 1.00 0.00 C ATOM 645 O ILE A 478 107.057 -1.163 16.770 1.00 0.00 O ATOM 646 CB ILE A 478 104.214 -2.481 16.131 1.00 0.00 C ATOM 647 CG1 ILE A 478 102.956 -2.972 16.849 1.00 0.00 C ATOM 648 CG2 ILE A 478 105.335 -3.502 16.261 1.00 0.00 C ATOM 649 CD1 ILE A 478 101.760 -3.123 15.936 1.00 0.00 C ATOM 0 H ILE A 478 103.119 -0.263 15.557 1.00 0.00 H new ATOM 0 HA ILE A 478 104.691 -1.186 17.787 1.00 0.00 H new ATOM 0 HB ILE A 478 103.983 -2.357 15.073 1.00 0.00 H new ATOM 0 HG12 ILE A 478 103.167 -3.932 17.320 1.00 0.00 H new ATOM 0 HG13 ILE A 478 102.707 -2.273 17.648 1.00 0.00 H new ATOM 0 HG21 ILE A 478 105.005 -4.458 15.854 1.00 0.00 H new ATOM 0 HG22 ILE A 478 106.209 -3.155 15.710 1.00 0.00 H new ATOM 0 HG23 ILE A 478 105.595 -3.625 17.312 1.00 0.00 H new ATOM 0 HD11 ILE A 478 100.904 -3.474 16.512 1.00 0.00 H new ATOM 0 HD12 ILE A 478 101.523 -2.160 15.485 1.00 0.00 H new ATOM 0 HD13 ILE A 478 101.990 -3.844 15.152 1.00 0.00 H new ATOM 661 N SER A 479 106.096 -0.078 15.048 1.00 0.00 N ATOM 662 CA SER A 479 107.364 0.306 14.439 1.00 0.00 C ATOM 663 C SER A 479 107.160 1.415 13.413 1.00 0.00 C ATOM 664 O SER A 479 106.055 1.610 12.906 1.00 0.00 O ATOM 665 CB SER A 479 108.022 -0.905 13.775 1.00 0.00 C ATOM 666 OG SER A 479 107.587 -2.115 14.373 1.00 0.00 O ATOM 0 H SER A 479 105.271 0.241 14.541 1.00 0.00 H new ATOM 0 HA SER A 479 108.019 0.680 15.226 1.00 0.00 H new ATOM 0 HB2 SER A 479 107.783 -0.915 12.712 1.00 0.00 H new ATOM 0 HB3 SER A 479 109.106 -0.824 13.857 1.00 0.00 H new ATOM 0 HG SER A 479 106.789 -2.441 13.908 1.00 0.00 H new ATOM 672 N GLU A 480 108.231 2.144 13.116 1.00 0.00 N ATOM 673 CA GLU A 480 108.169 3.238 12.153 1.00 0.00 C ATOM 674 C GLU A 480 107.973 2.709 10.734 1.00 0.00 C ATOM 675 O GLU A 480 108.876 2.104 10.155 1.00 0.00 O ATOM 676 CB GLU A 480 109.446 4.080 12.231 1.00 0.00 C ATOM 677 CG GLU A 480 109.753 4.855 10.959 1.00 0.00 C ATOM 678 CD GLU A 480 110.714 4.119 10.048 1.00 0.00 C ATOM 679 OE1 GLU A 480 111.731 3.600 10.555 1.00 0.00 O ATOM 680 OE2 GLU A 480 110.452 4.060 8.828 1.00 0.00 O ATOM 0 H GLU A 480 109.152 1.997 13.528 1.00 0.00 H new ATOM 0 HA GLU A 480 107.312 3.864 12.403 1.00 0.00 H new ATOM 0 HB2 GLU A 480 109.356 4.782 13.060 1.00 0.00 H new ATOM 0 HB3 GLU A 480 110.288 3.425 12.458 1.00 0.00 H new ATOM 0 HG2 GLU A 480 108.824 5.048 10.422 1.00 0.00 H new ATOM 0 HG3 GLU A 480 110.177 5.824 11.221 1.00 0.00 H new ATOM 687 N VAL A 481 106.788 2.945 10.182 1.00 0.00 N ATOM 688 CA VAL A 481 106.467 2.501 8.831 1.00 0.00 C ATOM 689 C VAL A 481 106.442 3.678 7.865 1.00 0.00 C ATOM 690 O VAL A 481 106.100 4.799 8.246 1.00 0.00 O ATOM 691 CB VAL A 481 105.107 1.784 8.777 1.00 0.00 C ATOM 692 CG1 VAL A 481 105.106 0.566 9.686 1.00 0.00 C ATOM 693 CG2 VAL A 481 103.986 2.741 9.151 1.00 0.00 C ATOM 0 H VAL A 481 106.032 3.443 10.651 1.00 0.00 H new ATOM 0 HA VAL A 481 107.247 1.800 8.536 1.00 0.00 H new ATOM 0 HB VAL A 481 104.937 1.443 7.756 1.00 0.00 H new ATOM 0 HG11 VAL A 481 104.135 0.073 9.633 1.00 0.00 H new ATOM 0 HG12 VAL A 481 105.883 -0.128 9.365 1.00 0.00 H new ATOM 0 HG13 VAL A 481 105.299 0.878 10.712 1.00 0.00 H new ATOM 0 HG21 VAL A 481 103.031 2.217 9.108 1.00 0.00 H new ATOM 0 HG22 VAL A 481 104.149 3.115 10.162 1.00 0.00 H new ATOM 0 HG23 VAL A 481 103.973 3.577 8.452 1.00 0.00 H new ATOM 703 N LEU A 482 106.806 3.419 6.617 1.00 0.00 N ATOM 704 CA LEU A 482 106.825 4.457 5.597 1.00 0.00 C ATOM 705 C LEU A 482 105.432 5.039 5.386 1.00 0.00 C ATOM 706 O LEU A 482 105.135 6.145 5.836 1.00 0.00 O ATOM 707 CB LEU A 482 107.364 3.896 4.280 1.00 0.00 C ATOM 708 CG LEU A 482 107.401 4.886 3.115 1.00 0.00 C ATOM 709 CD1 LEU A 482 108.702 5.676 3.128 1.00 0.00 C ATOM 710 CD2 LEU A 482 107.232 4.155 1.792 1.00 0.00 C ATOM 0 H LEU A 482 107.092 2.498 6.286 1.00 0.00 H new ATOM 0 HA LEU A 482 107.483 5.256 5.939 1.00 0.00 H new ATOM 0 HB2 LEU A 482 108.374 3.522 4.450 1.00 0.00 H new ATOM 0 HB3 LEU A 482 106.752 3.042 3.990 1.00 0.00 H new ATOM 0 HG LEU A 482 106.574 5.586 3.229 1.00 0.00 H new ATOM 0 HD11 LEU A 482 108.711 6.376 2.292 1.00 0.00 H new ATOM 0 HD12 LEU A 482 108.783 6.228 4.064 1.00 0.00 H new ATOM 0 HD13 LEU A 482 109.545 4.991 3.037 1.00 0.00 H new ATOM 0 HD21 LEU A 482 107.261 4.874 0.973 1.00 0.00 H new ATOM 0 HD22 LEU A 482 108.039 3.433 1.670 1.00 0.00 H new ATOM 0 HD23 LEU A 482 106.275 3.634 1.784 1.00 0.00 H new ATOM 722 N TYR A 483 104.583 4.291 4.688 1.00 0.00 N ATOM 723 CA TYR A 483 103.223 4.744 4.408 1.00 0.00 C ATOM 724 C TYR A 483 102.240 3.578 4.390 1.00 0.00 C ATOM 725 O TYR A 483 102.558 2.495 3.908 1.00 0.00 O ATOM 726 CB TYR A 483 103.180 5.479 3.069 1.00 0.00 C ATOM 727 CG TYR A 483 101.785 5.861 2.632 1.00 0.00 C ATOM 728 CD1 TYR A 483 100.871 4.891 2.237 1.00 0.00 C ATOM 729 CD2 TYR A 483 101.381 7.189 2.613 1.00 0.00 C ATOM 730 CE1 TYR A 483 99.595 5.235 1.835 1.00 0.00 C ATOM 731 CE2 TYR A 483 100.106 7.541 2.213 1.00 0.00 C ATOM 732 CZ TYR A 483 99.217 6.560 1.825 1.00 0.00 C ATOM 733 OH TYR A 483 97.948 6.907 1.425 1.00 0.00 O ATOM 0 H TYR A 483 104.810 3.373 4.307 1.00 0.00 H new ATOM 0 HA TYR A 483 102.927 5.425 5.206 1.00 0.00 H new ATOM 0 HB2 TYR A 483 103.789 6.380 3.139 1.00 0.00 H new ATOM 0 HB3 TYR A 483 103.631 4.848 2.303 1.00 0.00 H new ATOM 0 HD1 TYR A 483 101.163 3.851 2.245 1.00 0.00 H new ATOM 0 HD2 TYR A 483 102.074 7.960 2.916 1.00 0.00 H new ATOM 0 HE1 TYR A 483 98.897 4.469 1.530 1.00 0.00 H new ATOM 0 HE2 TYR A 483 99.807 8.579 2.204 1.00 0.00 H new ATOM 0 HH TYR A 483 97.843 7.880 1.477 1.00 0.00 H new ATOM 743 N VAL A 484 101.042 3.813 4.916 1.00 0.00 N ATOM 744 CA VAL A 484 100.009 2.784 4.961 1.00 0.00 C ATOM 745 C VAL A 484 99.073 2.887 3.760 1.00 0.00 C ATOM 746 O VAL A 484 98.314 3.848 3.635 1.00 0.00 O ATOM 747 CB VAL A 484 99.173 2.890 6.248 1.00 0.00 C ATOM 748 CG1 VAL A 484 98.269 4.111 6.196 1.00 0.00 C ATOM 749 CG2 VAL A 484 98.360 1.623 6.464 1.00 0.00 C ATOM 0 H VAL A 484 100.762 4.708 5.317 1.00 0.00 H new ATOM 0 HA VAL A 484 100.522 1.822 4.940 1.00 0.00 H new ATOM 0 HB VAL A 484 99.852 3.005 7.093 1.00 0.00 H new ATOM 0 HG11 VAL A 484 97.685 4.171 7.114 1.00 0.00 H new ATOM 0 HG12 VAL A 484 98.877 5.010 6.094 1.00 0.00 H new ATOM 0 HG13 VAL A 484 97.596 4.029 5.342 1.00 0.00 H new ATOM 0 HG21 VAL A 484 97.775 1.717 7.379 1.00 0.00 H new ATOM 0 HG22 VAL A 484 97.689 1.473 5.618 1.00 0.00 H new ATOM 0 HG23 VAL A 484 99.032 0.769 6.549 1.00 0.00 H new ATOM 759 N ASP A 485 99.129 1.892 2.879 1.00 0.00 N ATOM 760 CA ASP A 485 98.282 1.879 1.692 1.00 0.00 C ATOM 761 C ASP A 485 97.090 0.947 1.875 1.00 0.00 C ATOM 762 O ASP A 485 97.124 -0.214 1.470 1.00 0.00 O ATOM 763 CB ASP A 485 99.091 1.465 0.467 1.00 0.00 C ATOM 764 CG ASP A 485 98.323 1.660 -0.826 1.00 0.00 C ATOM 765 OD1 ASP A 485 97.076 1.708 -0.774 1.00 0.00 O ATOM 766 OD2 ASP A 485 98.969 1.767 -1.889 1.00 0.00 O ATOM 0 H ASP A 485 99.750 1.087 2.965 1.00 0.00 H new ATOM 0 HA ASP A 485 97.902 2.889 1.541 1.00 0.00 H new ATOM 0 HB2 ASP A 485 100.012 2.046 0.430 1.00 0.00 H new ATOM 0 HB3 ASP A 485 99.378 0.418 0.561 1.00 0.00 H new ATOM 771 N LEU A 486 96.037 1.474 2.484 1.00 0.00 N ATOM 772 CA LEU A 486 94.819 0.709 2.725 1.00 0.00 C ATOM 773 C LEU A 486 93.852 0.858 1.555 1.00 0.00 C ATOM 774 O LEU A 486 93.517 1.975 1.159 1.00 0.00 O ATOM 775 CB LEU A 486 94.148 1.178 4.016 1.00 0.00 C ATOM 776 CG LEU A 486 92.940 0.352 4.454 1.00 0.00 C ATOM 777 CD1 LEU A 486 92.985 0.102 5.952 1.00 0.00 C ATOM 778 CD2 LEU A 486 91.647 1.052 4.067 1.00 0.00 C ATOM 0 H LEU A 486 96.001 2.435 2.823 1.00 0.00 H new ATOM 0 HA LEU A 486 95.088 -0.343 2.824 1.00 0.00 H new ATOM 0 HB2 LEU A 486 94.887 1.165 4.817 1.00 0.00 H new ATOM 0 HB3 LEU A 486 93.834 2.214 3.889 1.00 0.00 H new ATOM 0 HG LEU A 486 92.975 -0.610 3.943 1.00 0.00 H new ATOM 0 HD11 LEU A 486 92.118 -0.488 6.249 1.00 0.00 H new ATOM 0 HD12 LEU A 486 93.896 -0.441 6.203 1.00 0.00 H new ATOM 0 HD13 LEU A 486 92.974 1.055 6.480 1.00 0.00 H new ATOM 0 HD21 LEU A 486 90.797 0.449 4.387 1.00 0.00 H new ATOM 0 HD22 LEU A 486 91.603 2.028 4.551 1.00 0.00 H new ATOM 0 HD23 LEU A 486 91.613 1.182 2.985 1.00 0.00 H new ATOM 790 N LEU A 487 93.400 -0.266 1.002 1.00 0.00 N ATOM 791 CA LEU A 487 92.470 -0.229 -0.121 1.00 0.00 C ATOM 792 C LEU A 487 91.155 0.417 0.297 1.00 0.00 C ATOM 793 O LEU A 487 90.236 -0.255 0.766 1.00 0.00 O ATOM 794 CB LEU A 487 92.221 -1.634 -0.664 1.00 0.00 C ATOM 795 CG LEU A 487 92.612 -1.838 -2.129 1.00 0.00 C ATOM 796 CD1 LEU A 487 92.210 -0.630 -2.962 1.00 0.00 C ATOM 797 CD2 LEU A 487 94.107 -2.094 -2.251 1.00 0.00 C ATOM 0 H LEU A 487 93.660 -1.203 1.310 1.00 0.00 H new ATOM 0 HA LEU A 487 92.917 0.371 -0.913 1.00 0.00 H new ATOM 0 HB2 LEU A 487 92.774 -2.347 -0.053 1.00 0.00 H new ATOM 0 HB3 LEU A 487 91.163 -1.870 -0.549 1.00 0.00 H new ATOM 0 HG LEU A 487 92.080 -2.711 -2.508 1.00 0.00 H new ATOM 0 HD11 LEU A 487 92.496 -0.793 -4.001 1.00 0.00 H new ATOM 0 HD12 LEU A 487 91.131 -0.488 -2.901 1.00 0.00 H new ATOM 0 HD13 LEU A 487 92.715 0.258 -2.582 1.00 0.00 H new ATOM 0 HD21 LEU A 487 94.367 -2.237 -3.300 1.00 0.00 H new ATOM 0 HD22 LEU A 487 94.656 -1.240 -1.854 1.00 0.00 H new ATOM 0 HD23 LEU A 487 94.370 -2.989 -1.687 1.00 0.00 H new ATOM 809 N GLU A 488 91.084 1.730 0.131 1.00 0.00 N ATOM 810 CA GLU A 488 89.897 2.497 0.491 1.00 0.00 C ATOM 811 C GLU A 488 88.618 1.694 0.265 1.00 0.00 C ATOM 812 O GLU A 488 88.372 1.192 -0.832 1.00 0.00 O ATOM 813 CB GLU A 488 89.844 3.797 -0.315 1.00 0.00 C ATOM 814 CG GLU A 488 91.210 4.422 -0.552 1.00 0.00 C ATOM 815 CD GLU A 488 91.859 3.938 -1.834 1.00 0.00 C ATOM 816 OE1 GLU A 488 91.396 4.339 -2.923 1.00 0.00 O ATOM 817 OE2 GLU A 488 92.832 3.158 -1.749 1.00 0.00 O ATOM 0 H GLU A 488 91.842 2.292 -0.255 1.00 0.00 H new ATOM 0 HA GLU A 488 89.964 2.730 1.554 1.00 0.00 H new ATOM 0 HB2 GLU A 488 89.372 3.599 -1.277 1.00 0.00 H new ATOM 0 HB3 GLU A 488 89.211 4.514 0.209 1.00 0.00 H new ATOM 0 HG2 GLU A 488 91.108 5.507 -0.588 1.00 0.00 H new ATOM 0 HG3 GLU A 488 91.862 4.191 0.290 1.00 0.00 H new ATOM 824 N GLY A 489 87.803 1.591 1.312 1.00 0.00 N ATOM 825 CA GLY A 489 86.550 0.862 1.215 1.00 0.00 C ATOM 826 C GLY A 489 86.743 -0.642 1.173 1.00 0.00 C ATOM 827 O GLY A 489 85.810 -1.383 0.866 1.00 0.00 O ATOM 0 H GLY A 489 87.989 2.000 2.228 1.00 0.00 H new ATOM 0 HA2 GLY A 489 85.920 1.119 2.066 1.00 0.00 H new ATOM 0 HA3 GLY A 489 86.019 1.180 0.318 1.00 0.00 H new ATOM 831 N ASP A 490 87.953 -1.095 1.481 1.00 0.00 N ATOM 832 CA ASP A 490 88.256 -2.522 1.471 1.00 0.00 C ATOM 833 C ASP A 490 88.794 -2.980 2.823 1.00 0.00 C ATOM 834 O ASP A 490 89.285 -2.175 3.614 1.00 0.00 O ATOM 835 CB ASP A 490 89.269 -2.844 0.373 1.00 0.00 C ATOM 836 CG ASP A 490 89.067 -4.228 -0.212 1.00 0.00 C ATOM 837 OD1 ASP A 490 89.073 -5.207 0.564 1.00 0.00 O ATOM 838 OD2 ASP A 490 88.902 -4.332 -1.446 1.00 0.00 O ATOM 0 H ASP A 490 88.738 -0.497 1.740 1.00 0.00 H new ATOM 0 HA ASP A 490 87.329 -3.058 1.270 1.00 0.00 H new ATOM 0 HB2 ASP A 490 89.188 -2.102 -0.421 1.00 0.00 H new ATOM 0 HB3 ASP A 490 90.278 -2.768 0.779 1.00 0.00 H new ATOM 843 N THR A 491 88.698 -4.282 3.078 1.00 0.00 N ATOM 844 CA THR A 491 89.172 -4.856 4.330 1.00 0.00 C ATOM 845 C THR A 491 90.612 -5.339 4.201 1.00 0.00 C ATOM 846 O THR A 491 91.117 -6.055 5.066 1.00 0.00 O ATOM 847 CB THR A 491 88.285 -6.035 4.774 1.00 0.00 C ATOM 848 OG1 THR A 491 88.696 -7.261 4.154 1.00 0.00 O ATOM 849 CG2 THR A 491 86.830 -5.779 4.417 1.00 0.00 C ATOM 0 H THR A 491 88.295 -4.960 2.431 1.00 0.00 H new ATOM 0 HA THR A 491 89.122 -4.068 5.081 1.00 0.00 H new ATOM 0 HB THR A 491 88.393 -6.124 5.855 1.00 0.00 H new ATOM 0 HG1 THR A 491 88.116 -7.991 4.456 1.00 0.00 H new ATOM 0 HG21 THR A 491 86.222 -6.624 4.740 1.00 0.00 H new ATOM 0 HG22 THR A 491 86.487 -4.873 4.917 1.00 0.00 H new ATOM 0 HG23 THR A 491 86.736 -5.656 3.338 1.00 0.00 H new ATOM 857 N GLU A 492 91.267 -4.944 3.115 1.00 0.00 N ATOM 858 CA GLU A 492 92.648 -5.338 2.869 1.00 0.00 C ATOM 859 C GLU A 492 93.550 -4.116 2.728 1.00 0.00 C ATOM 860 O GLU A 492 93.410 -3.329 1.789 1.00 0.00 O ATOM 861 CB GLU A 492 92.736 -6.201 1.610 1.00 0.00 C ATOM 862 CG GLU A 492 91.578 -7.172 1.459 1.00 0.00 C ATOM 863 CD GLU A 492 91.849 -8.246 0.424 1.00 0.00 C ATOM 864 OE1 GLU A 492 92.211 -7.891 -0.717 1.00 0.00 O ATOM 865 OE2 GLU A 492 91.699 -9.441 0.754 1.00 0.00 O ATOM 0 H GLU A 492 90.863 -4.351 2.391 1.00 0.00 H new ATOM 0 HA GLU A 492 92.991 -5.919 3.725 1.00 0.00 H new ATOM 0 HB2 GLU A 492 92.771 -5.551 0.736 1.00 0.00 H new ATOM 0 HB3 GLU A 492 93.670 -6.762 1.628 1.00 0.00 H new ATOM 0 HG2 GLU A 492 91.375 -7.643 2.421 1.00 0.00 H new ATOM 0 HG3 GLU A 492 90.681 -6.621 1.179 1.00 0.00 H new ATOM 872 N CYS A 493 94.477 -3.963 3.667 1.00 0.00 N ATOM 873 CA CYS A 493 95.406 -2.841 3.648 1.00 0.00 C ATOM 874 C CYS A 493 96.838 -3.335 3.493 1.00 0.00 C ATOM 875 O CYS A 493 97.206 -4.375 4.032 1.00 0.00 O ATOM 876 CB CYS A 493 95.276 -2.019 4.928 1.00 0.00 C ATOM 877 SG CYS A 493 96.621 -0.836 5.184 1.00 0.00 S ATOM 0 H CYS A 493 94.605 -4.603 4.451 1.00 0.00 H new ATOM 0 HA CYS A 493 95.159 -2.208 2.795 1.00 0.00 H new ATOM 0 HB2 CYS A 493 94.330 -1.478 4.906 1.00 0.00 H new ATOM 0 HB3 CYS A 493 95.235 -2.697 5.780 1.00 0.00 H new ATOM 0 HG CYS A 493 96.670 -0.499 6.439 1.00 0.00 H new ATOM 883 N HIS A 494 97.640 -2.582 2.753 1.00 0.00 N ATOM 884 CA HIS A 494 99.034 -2.946 2.528 1.00 0.00 C ATOM 885 C HIS A 494 99.959 -1.787 2.881 1.00 0.00 C ATOM 886 O HIS A 494 100.104 -0.838 2.111 1.00 0.00 O ATOM 887 CB HIS A 494 99.245 -3.363 1.072 1.00 0.00 C ATOM 888 CG HIS A 494 98.493 -4.601 0.693 1.00 0.00 C ATOM 889 ND1 HIS A 494 97.118 -4.692 0.745 1.00 0.00 N ATOM 890 CD2 HIS A 494 98.931 -5.805 0.257 1.00 0.00 C ATOM 891 CE1 HIS A 494 96.743 -5.898 0.358 1.00 0.00 C ATOM 892 NE2 HIS A 494 97.823 -6.593 0.057 1.00 0.00 N ATOM 0 H HIS A 494 97.351 -1.716 2.298 1.00 0.00 H new ATOM 0 HA HIS A 494 99.275 -3.789 3.175 1.00 0.00 H new ATOM 0 HB2 HIS A 494 98.937 -2.546 0.420 1.00 0.00 H new ATOM 0 HB3 HIS A 494 100.309 -3.526 0.899 1.00 0.00 H new ATOM 0 HD2 HIS A 494 99.959 -6.093 0.096 1.00 0.00 H new ATOM 0 HE1 HIS A 494 95.725 -6.254 0.298 1.00 0.00 H new ATOM 0 HE2 HIS A 494 97.834 -7.559 -0.271 1.00 0.00 H new ATOM 901 N ALA A 495 100.572 -1.868 4.056 1.00 0.00 N ATOM 902 CA ALA A 495 101.473 -0.821 4.518 1.00 0.00 C ATOM 903 C ALA A 495 102.899 -1.050 4.032 1.00 0.00 C ATOM 904 O ALA A 495 103.433 -2.156 4.121 1.00 0.00 O ATOM 905 CB ALA A 495 101.451 -0.720 6.035 1.00 0.00 C ATOM 0 H ALA A 495 100.461 -2.647 4.705 1.00 0.00 H new ATOM 0 HA ALA A 495 101.119 0.119 4.095 1.00 0.00 H new ATOM 0 HB1 ALA A 495 102.131 0.068 6.357 1.00 0.00 H new ATOM 0 HB2 ALA A 495 100.440 -0.486 6.369 1.00 0.00 H new ATOM 0 HB3 ALA A 495 101.766 -1.670 6.467 1.00 0.00 H new ATOM 911 N ARG A 496 103.512 0.015 3.533 1.00 0.00 N ATOM 912 CA ARG A 496 104.883 -0.034 3.045 1.00 0.00 C ATOM 913 C ARG A 496 105.851 0.309 4.175 1.00 0.00 C ATOM 914 O ARG A 496 105.758 1.378 4.782 1.00 0.00 O ATOM 915 CB ARG A 496 105.054 0.942 1.880 1.00 0.00 C ATOM 916 CG ARG A 496 103.778 1.143 1.077 1.00 0.00 C ATOM 917 CD ARG A 496 104.054 1.809 -0.259 1.00 0.00 C ATOM 918 NE ARG A 496 103.691 3.222 -0.243 1.00 0.00 N ATOM 919 CZ ARG A 496 103.540 3.958 -1.339 1.00 0.00 C ATOM 920 NH1 ARG A 496 103.722 3.417 -2.536 1.00 0.00 N ATOM 921 NH2 ARG A 496 103.205 5.236 -1.237 1.00 0.00 N ATOM 0 H ARG A 496 103.075 0.933 3.455 1.00 0.00 H new ATOM 0 HA ARG A 496 105.103 -1.042 2.693 1.00 0.00 H new ATOM 0 HB2 ARG A 496 105.388 1.905 2.267 1.00 0.00 H new ATOM 0 HB3 ARG A 496 105.838 0.575 1.218 1.00 0.00 H new ATOM 0 HG2 ARG A 496 103.297 0.179 0.911 1.00 0.00 H new ATOM 0 HG3 ARG A 496 103.080 1.753 1.650 1.00 0.00 H new ATOM 0 HD2 ARG A 496 105.111 1.708 -0.505 1.00 0.00 H new ATOM 0 HD3 ARG A 496 103.494 1.298 -1.043 1.00 0.00 H new ATOM 0 HE ARG A 496 103.545 3.671 0.661 1.00 0.00 H new ATOM 0 HH11 ARG A 496 103.979 2.433 -2.617 1.00 0.00 H new ATOM 0 HH12 ARG A 496 103.605 3.985 -3.375 1.00 0.00 H new ATOM 0 HH21 ARG A 496 103.063 5.654 -0.318 1.00 0.00 H new ATOM 0 HH22 ARG A 496 103.089 5.801 -2.078 1.00 0.00 H new ATOM 935 N PHE A 497 106.774 -0.607 4.450 1.00 0.00 N ATOM 936 CA PHE A 497 107.760 -0.414 5.508 1.00 0.00 C ATOM 937 C PHE A 497 109.094 0.052 4.935 1.00 0.00 C ATOM 938 O PHE A 497 109.441 -0.271 3.799 1.00 0.00 O ATOM 939 CB PHE A 497 107.953 -1.710 6.298 1.00 0.00 C ATOM 940 CG PHE A 497 106.792 -2.043 7.189 1.00 0.00 C ATOM 941 CD1 PHE A 497 106.984 -2.303 8.536 1.00 0.00 C ATOM 942 CD2 PHE A 497 105.506 -2.091 6.677 1.00 0.00 C ATOM 943 CE1 PHE A 497 105.915 -2.606 9.356 1.00 0.00 C ATOM 944 CE2 PHE A 497 104.432 -2.395 7.492 1.00 0.00 C ATOM 945 CZ PHE A 497 104.637 -2.652 8.834 1.00 0.00 C ATOM 0 H PHE A 497 106.860 -1.494 3.953 1.00 0.00 H new ATOM 0 HA PHE A 497 107.387 0.359 6.179 1.00 0.00 H new ATOM 0 HB2 PHE A 497 108.113 -2.532 5.600 1.00 0.00 H new ATOM 0 HB3 PHE A 497 108.855 -1.626 6.905 1.00 0.00 H new ATOM 0 HD1 PHE A 497 107.981 -2.268 8.950 1.00 0.00 H new ATOM 0 HD2 PHE A 497 105.341 -1.889 5.629 1.00 0.00 H new ATOM 0 HE1 PHE A 497 106.078 -2.807 10.405 1.00 0.00 H new ATOM 0 HE2 PHE A 497 103.434 -2.432 7.081 1.00 0.00 H new ATOM 0 HZ PHE A 497 103.800 -2.888 9.474 1.00 0.00 H new ATOM 955 N LYS A 498 109.831 0.824 5.725 1.00 0.00 N ATOM 956 CA LYS A 498 111.123 1.349 5.297 1.00 0.00 C ATOM 957 C LYS A 498 112.232 0.312 5.460 1.00 0.00 C ATOM 958 O LYS A 498 113.322 0.470 4.912 1.00 0.00 O ATOM 959 CB LYS A 498 111.469 2.610 6.091 1.00 0.00 C ATOM 960 CG LYS A 498 112.426 3.543 5.366 1.00 0.00 C ATOM 961 CD LYS A 498 111.763 4.869 5.030 1.00 0.00 C ATOM 962 CE LYS A 498 112.779 5.996 4.947 1.00 0.00 C ATOM 963 NZ LYS A 498 112.504 7.067 5.945 1.00 0.00 N ATOM 0 H LYS A 498 109.556 1.101 6.667 1.00 0.00 H new ATOM 0 HA LYS A 498 111.046 1.596 4.238 1.00 0.00 H new ATOM 0 HB2 LYS A 498 110.550 3.150 6.317 1.00 0.00 H new ATOM 0 HB3 LYS A 498 111.911 2.319 7.044 1.00 0.00 H new ATOM 0 HG2 LYS A 498 113.303 3.721 5.988 1.00 0.00 H new ATOM 0 HG3 LYS A 498 112.776 3.067 4.450 1.00 0.00 H new ATOM 0 HD2 LYS A 498 111.236 4.783 4.080 1.00 0.00 H new ATOM 0 HD3 LYS A 498 111.017 5.106 5.788 1.00 0.00 H new ATOM 0 HE2 LYS A 498 113.779 5.596 5.111 1.00 0.00 H new ATOM 0 HE3 LYS A 498 112.767 6.423 3.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 498 113.219 7.817 5.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 498 111.560 7.467 5.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 498 112.541 6.666 6.904 1.00 0.00 H new ATOM 977 N THR A 499 111.953 -0.747 6.214 1.00 0.00 N ATOM 978 CA THR A 499 112.940 -1.798 6.439 1.00 0.00 C ATOM 979 C THR A 499 112.276 -3.162 6.596 1.00 0.00 C ATOM 980 O THR A 499 111.129 -3.260 7.033 1.00 0.00 O ATOM 981 CB THR A 499 113.789 -1.516 7.691 1.00 0.00 C ATOM 982 OG1 THR A 499 113.136 -0.587 8.567 1.00 0.00 O ATOM 983 CG2 THR A 499 115.148 -0.949 7.310 1.00 0.00 C ATOM 0 H THR A 499 111.057 -0.900 6.677 1.00 0.00 H new ATOM 0 HA THR A 499 113.585 -1.809 5.561 1.00 0.00 H new ATOM 0 HB THR A 499 113.918 -2.468 8.206 1.00 0.00 H new ATOM 0 HG1 THR A 499 113.221 -0.896 9.493 1.00 0.00 H new ATOM 0 HG21 THR A 499 115.729 -0.758 8.213 1.00 0.00 H new ATOM 0 HG22 THR A 499 115.678 -1.665 6.682 1.00 0.00 H new ATOM 0 HG23 THR A 499 115.013 -0.017 6.762 1.00 0.00 H new ATOM 991 N PRO A 500 113.001 -4.234 6.247 1.00 0.00 N ATOM 992 CA PRO A 500 112.494 -5.605 6.351 1.00 0.00 C ATOM 993 C PRO A 500 112.434 -6.085 7.798 1.00 0.00 C ATOM 994 O PRO A 500 111.489 -6.760 8.203 1.00 0.00 O ATOM 995 CB PRO A 500 113.521 -6.415 5.562 1.00 0.00 C ATOM 996 CG PRO A 500 114.786 -5.641 5.701 1.00 0.00 C ATOM 997 CD PRO A 500 114.380 -4.192 5.726 1.00 0.00 C ATOM 0 HA PRO A 500 111.475 -5.699 5.975 1.00 0.00 H new ATOM 0 HB2 PRO A 500 113.625 -7.423 5.963 1.00 0.00 H new ATOM 0 HB3 PRO A 500 113.230 -6.516 4.517 1.00 0.00 H new ATOM 0 HG2 PRO A 500 115.314 -5.915 6.615 1.00 0.00 H new ATOM 0 HG3 PRO A 500 115.462 -5.843 4.870 1.00 0.00 H new ATOM 0 HD2 PRO A 500 115.034 -3.602 6.368 1.00 0.00 H new ATOM 0 HD3 PRO A 500 114.421 -3.746 4.732 1.00 0.00 H new ATOM 1005 N GLU A 501 113.453 -5.723 8.573 1.00 0.00 N ATOM 1006 CA GLU A 501 113.521 -6.107 9.978 1.00 0.00 C ATOM 1007 C GLU A 501 112.386 -5.468 10.769 1.00 0.00 C ATOM 1008 O GLU A 501 111.851 -6.068 11.702 1.00 0.00 O ATOM 1009 CB GLU A 501 114.869 -5.697 10.575 1.00 0.00 C ATOM 1010 CG GLU A 501 114.922 -4.244 11.018 1.00 0.00 C ATOM 1011 CD GLU A 501 116.247 -3.879 11.658 1.00 0.00 C ATOM 1012 OE1 GLU A 501 116.250 -3.036 12.580 1.00 0.00 O ATOM 1013 OE2 GLU A 501 117.282 -4.436 11.237 1.00 0.00 O ATOM 0 H GLU A 501 114.243 -5.164 8.251 1.00 0.00 H new ATOM 0 HA GLU A 501 113.419 -7.190 10.040 1.00 0.00 H new ATOM 0 HB2 GLU A 501 115.088 -6.337 11.430 1.00 0.00 H new ATOM 0 HB3 GLU A 501 115.652 -5.872 9.837 1.00 0.00 H new ATOM 0 HG2 GLU A 501 114.748 -3.599 10.157 1.00 0.00 H new ATOM 0 HG3 GLU A 501 114.116 -4.054 11.726 1.00 0.00 H new ATOM 1020 N ASP A 502 112.022 -4.247 10.390 1.00 0.00 N ATOM 1021 CA ASP A 502 110.947 -3.526 11.062 1.00 0.00 C ATOM 1022 C ASP A 502 109.619 -4.258 10.902 1.00 0.00 C ATOM 1023 O ASP A 502 108.843 -4.374 11.852 1.00 0.00 O ATOM 1024 CB ASP A 502 110.832 -2.106 10.505 1.00 0.00 C ATOM 1025 CG ASP A 502 111.548 -1.084 11.369 1.00 0.00 C ATOM 1026 OD1 ASP A 502 112.017 -0.066 10.819 1.00 0.00 O ATOM 1027 OD2 ASP A 502 111.637 -1.302 12.595 1.00 0.00 O ATOM 0 H ASP A 502 112.456 -3.736 9.621 1.00 0.00 H new ATOM 0 HA ASP A 502 111.186 -3.473 12.124 1.00 0.00 H new ATOM 0 HB2 ASP A 502 111.247 -2.080 9.497 1.00 0.00 H new ATOM 0 HB3 ASP A 502 109.779 -1.835 10.424 1.00 0.00 H new ATOM 1032 N ALA A 503 109.365 -4.751 9.694 1.00 0.00 N ATOM 1033 CA ALA A 503 108.131 -5.472 9.403 1.00 0.00 C ATOM 1034 C ALA A 503 108.069 -6.792 10.166 1.00 0.00 C ATOM 1035 O ALA A 503 107.010 -7.194 10.649 1.00 0.00 O ATOM 1036 CB ALA A 503 107.995 -5.724 7.909 1.00 0.00 C ATOM 0 H ALA A 503 109.999 -4.664 8.899 1.00 0.00 H new ATOM 0 HA ALA A 503 107.299 -4.849 9.731 1.00 0.00 H new ATOM 0 HB1 ALA A 503 107.068 -6.263 7.714 1.00 0.00 H new ATOM 0 HB2 ALA A 503 107.979 -4.771 7.379 1.00 0.00 H new ATOM 0 HB3 ALA A 503 108.840 -6.318 7.562 1.00 0.00 H new ATOM 1042 N GLN A 504 109.207 -7.468 10.267 1.00 0.00 N ATOM 1043 CA GLN A 504 109.278 -8.745 10.966 1.00 0.00 C ATOM 1044 C GLN A 504 108.836 -8.598 12.420 1.00 0.00 C ATOM 1045 O GLN A 504 108.140 -9.457 12.960 1.00 0.00 O ATOM 1046 CB GLN A 504 110.703 -9.299 10.910 1.00 0.00 C ATOM 1047 CG GLN A 504 110.868 -10.628 11.626 1.00 0.00 C ATOM 1048 CD GLN A 504 111.003 -11.795 10.667 1.00 0.00 C ATOM 1049 OE1 GLN A 504 110.410 -11.798 9.589 1.00 0.00 O ATOM 1050 NE2 GLN A 504 111.786 -12.793 11.057 1.00 0.00 N ATOM 0 H GLN A 504 110.094 -7.153 9.873 1.00 0.00 H new ATOM 0 HA GLN A 504 108.602 -9.441 10.469 1.00 0.00 H new ATOM 0 HB2 GLN A 504 110.996 -9.419 9.867 1.00 0.00 H new ATOM 0 HB3 GLN A 504 111.384 -8.571 11.351 1.00 0.00 H new ATOM 0 HG2 GLN A 504 111.749 -10.585 12.266 1.00 0.00 H new ATOM 0 HG3 GLN A 504 110.010 -10.795 12.277 1.00 0.00 H new ATOM 0 HE21 GLN A 504 112.258 -12.748 11.960 1.00 0.00 H new ATOM 0 HE22 GLN A 504 111.915 -13.605 10.454 1.00 0.00 H new ATOM 1059 N ALA A 505 109.263 -7.513 13.054 1.00 0.00 N ATOM 1060 CA ALA A 505 108.924 -7.260 14.451 1.00 0.00 C ATOM 1061 C ALA A 505 107.426 -7.021 14.643 1.00 0.00 C ATOM 1062 O ALA A 505 106.840 -7.482 15.622 1.00 0.00 O ATOM 1063 CB ALA A 505 109.716 -6.079 14.990 1.00 0.00 C ATOM 0 H ALA A 505 109.845 -6.794 12.624 1.00 0.00 H new ATOM 0 HA ALA A 505 109.191 -8.155 15.013 1.00 0.00 H new ATOM 0 HB1 ALA A 505 109.449 -5.907 16.033 1.00 0.00 H new ATOM 0 HB2 ALA A 505 110.782 -6.293 14.919 1.00 0.00 H new ATOM 0 HB3 ALA A 505 109.485 -5.189 14.405 1.00 0.00 H new ATOM 1069 N VAL A 506 106.810 -6.285 13.719 1.00 0.00 N ATOM 1070 CA VAL A 506 105.384 -5.978 13.814 1.00 0.00 C ATOM 1071 C VAL A 506 104.512 -7.216 13.608 1.00 0.00 C ATOM 1072 O VAL A 506 103.534 -7.420 14.328 1.00 0.00 O ATOM 1073 CB VAL A 506 104.973 -4.908 12.788 1.00 0.00 C ATOM 1074 CG1 VAL A 506 105.440 -5.295 11.394 1.00 0.00 C ATOM 1075 CG2 VAL A 506 103.467 -4.691 12.813 1.00 0.00 C ATOM 0 H VAL A 506 107.274 -5.892 12.900 1.00 0.00 H new ATOM 0 HA VAL A 506 105.224 -5.600 14.824 1.00 0.00 H new ATOM 0 HB VAL A 506 105.456 -3.969 13.060 1.00 0.00 H new ATOM 0 HG11 VAL A 506 105.140 -4.525 10.683 1.00 0.00 H new ATOM 0 HG12 VAL A 506 106.526 -5.391 11.388 1.00 0.00 H new ATOM 0 HG13 VAL A 506 104.990 -6.246 11.111 1.00 0.00 H new ATOM 0 HG21 VAL A 506 103.197 -3.931 12.080 1.00 0.00 H new ATOM 0 HG22 VAL A 506 102.961 -5.625 12.570 1.00 0.00 H new ATOM 0 HG23 VAL A 506 103.163 -4.362 13.807 1.00 0.00 H new ATOM 1085 N ILE A 507 104.860 -8.030 12.618 1.00 0.00 N ATOM 1086 CA ILE A 507 104.091 -9.236 12.323 1.00 0.00 C ATOM 1087 C ILE A 507 104.181 -10.249 13.456 1.00 0.00 C ATOM 1088 O ILE A 507 103.215 -10.952 13.752 1.00 0.00 O ATOM 1089 CB ILE A 507 104.550 -9.905 11.013 1.00 0.00 C ATOM 1090 CG1 ILE A 507 106.069 -10.070 10.993 1.00 0.00 C ATOM 1091 CG2 ILE A 507 104.084 -9.096 9.812 1.00 0.00 C ATOM 1092 CD1 ILE A 507 106.532 -11.463 11.358 1.00 0.00 C ATOM 0 H ILE A 507 105.664 -7.880 12.009 1.00 0.00 H new ATOM 0 HA ILE A 507 103.055 -8.915 12.210 1.00 0.00 H new ATOM 0 HB ILE A 507 104.100 -10.896 10.958 1.00 0.00 H new ATOM 0 HG12 ILE A 507 106.440 -9.822 9.999 1.00 0.00 H new ATOM 0 HG13 ILE A 507 106.513 -9.355 11.686 1.00 0.00 H new ATOM 0 HG21 ILE A 507 104.416 -9.582 8.895 1.00 0.00 H new ATOM 0 HG22 ILE A 507 102.996 -9.033 9.816 1.00 0.00 H new ATOM 0 HG23 ILE A 507 104.505 -8.092 9.864 1.00 0.00 H new ATOM 0 HD11 ILE A 507 107.621 -11.506 11.323 1.00 0.00 H new ATOM 0 HD12 ILE A 507 106.192 -11.708 12.364 1.00 0.00 H new ATOM 0 HD13 ILE A 507 106.118 -12.181 10.650 1.00 0.00 H new ATOM 1104 N ASN A 508 105.338 -10.304 14.101 1.00 0.00 N ATOM 1105 CA ASN A 508 105.536 -11.218 15.220 1.00 0.00 C ATOM 1106 C ASN A 508 104.724 -10.755 16.426 1.00 0.00 C ATOM 1107 O ASN A 508 104.133 -11.561 17.145 1.00 0.00 O ATOM 1108 CB ASN A 508 107.019 -11.306 15.584 1.00 0.00 C ATOM 1109 CG ASN A 508 107.820 -12.090 14.562 1.00 0.00 C ATOM 1110 OD1 ASN A 508 107.323 -13.047 13.968 1.00 0.00 O ATOM 1111 ND2 ASN A 508 109.068 -11.686 14.352 1.00 0.00 N ATOM 0 H ASN A 508 106.150 -9.731 13.872 1.00 0.00 H new ATOM 0 HA ASN A 508 105.193 -12.209 14.923 1.00 0.00 H new ATOM 0 HB2 ASN A 508 107.430 -10.300 15.669 1.00 0.00 H new ATOM 0 HB3 ASN A 508 107.123 -11.777 16.562 1.00 0.00 H new ATOM 0 HD21 ASN A 508 109.655 -12.174 13.676 1.00 0.00 H new ATOM 0 HD22 ASN A 508 109.439 -10.888 14.867 1.00 0.00 H new ATOM 1118 N ALA A 509 104.710 -9.442 16.632 1.00 0.00 N ATOM 1119 CA ALA A 509 103.981 -8.833 17.741 1.00 0.00 C ATOM 1120 C ALA A 509 102.478 -8.795 17.482 1.00 0.00 C ATOM 1121 O ALA A 509 101.678 -8.716 18.415 1.00 0.00 O ATOM 1122 CB ALA A 509 104.491 -7.425 18.007 1.00 0.00 C ATOM 0 H ALA A 509 105.201 -8.773 16.039 1.00 0.00 H new ATOM 0 HA ALA A 509 104.156 -9.454 18.619 1.00 0.00 H new ATOM 0 HB1 ALA A 509 103.936 -6.988 18.837 1.00 0.00 H new ATOM 0 HB2 ALA A 509 105.551 -7.464 18.260 1.00 0.00 H new ATOM 0 HB3 ALA A 509 104.353 -6.813 17.115 1.00 0.00 H new ATOM 1128 N TYR A 510 102.102 -8.818 16.210 1.00 0.00 N ATOM 1129 CA TYR A 510 100.696 -8.751 15.825 1.00 0.00 C ATOM 1130 C TYR A 510 99.891 -9.934 16.344 1.00 0.00 C ATOM 1131 O TYR A 510 98.661 -9.903 16.329 1.00 0.00 O ATOM 1132 CB TYR A 510 100.563 -8.667 14.313 1.00 0.00 C ATOM 1133 CG TYR A 510 99.975 -7.360 13.843 1.00 0.00 C ATOM 1134 CD1 TYR A 510 99.120 -7.306 12.751 1.00 0.00 C ATOM 1135 CD2 TYR A 510 100.278 -6.176 14.500 1.00 0.00 C ATOM 1136 CE1 TYR A 510 98.582 -6.106 12.326 1.00 0.00 C ATOM 1137 CE2 TYR A 510 99.745 -4.971 14.081 1.00 0.00 C ATOM 1138 CZ TYR A 510 98.898 -4.942 12.994 1.00 0.00 C ATOM 1139 OH TYR A 510 98.365 -3.745 12.575 1.00 0.00 O ATOM 0 H TYR A 510 102.751 -8.883 15.426 1.00 0.00 H new ATOM 0 HA TYR A 510 100.288 -7.850 16.283 1.00 0.00 H new ATOM 0 HB2 TYR A 510 101.545 -8.801 13.860 1.00 0.00 H new ATOM 0 HB3 TYR A 510 99.936 -9.487 13.963 1.00 0.00 H new ATOM 0 HD1 TYR A 510 98.871 -8.216 12.225 1.00 0.00 H new ATOM 0 HD2 TYR A 510 100.941 -6.196 15.352 1.00 0.00 H new ATOM 0 HE1 TYR A 510 97.917 -6.080 11.475 1.00 0.00 H new ATOM 0 HE2 TYR A 510 99.991 -4.058 14.602 1.00 0.00 H new ATOM 0 HH TYR A 510 97.478 -3.900 12.187 1.00 0.00 H new ATOM 1149 N THR A 511 100.568 -10.970 16.813 1.00 0.00 N ATOM 1150 CA THR A 511 99.867 -12.130 17.340 1.00 0.00 C ATOM 1151 C THR A 511 98.885 -11.684 18.415 1.00 0.00 C ATOM 1152 O THR A 511 97.798 -12.242 18.560 1.00 0.00 O ATOM 1153 CB THR A 511 100.843 -13.160 17.941 1.00 0.00 C ATOM 1154 OG1 THR A 511 101.454 -12.663 19.139 1.00 0.00 O ATOM 1155 CG2 THR A 511 101.942 -13.508 16.948 1.00 0.00 C ATOM 0 H THR A 511 101.586 -11.032 16.840 1.00 0.00 H new ATOM 0 HA THR A 511 99.337 -12.605 16.514 1.00 0.00 H new ATOM 0 HB THR A 511 100.260 -14.050 18.175 1.00 0.00 H new ATOM 0 HG1 THR A 511 102.066 -13.338 19.498 1.00 0.00 H new ATOM 0 HG21 THR A 511 102.619 -14.237 17.395 1.00 0.00 H new ATOM 0 HG22 THR A 511 101.498 -13.930 16.047 1.00 0.00 H new ATOM 0 HG23 THR A 511 102.498 -12.607 16.690 1.00 0.00 H new ATOM 1163 N GLU A 512 99.300 -10.675 19.172 1.00 0.00 N ATOM 1164 CA GLU A 512 98.489 -10.134 20.257 1.00 0.00 C ATOM 1165 C GLU A 512 97.174 -9.553 19.743 1.00 0.00 C ATOM 1166 O GLU A 512 96.129 -9.711 20.373 1.00 0.00 O ATOM 1167 CB GLU A 512 99.272 -9.057 21.012 1.00 0.00 C ATOM 1168 CG GLU A 512 100.343 -9.618 21.935 1.00 0.00 C ATOM 1169 CD GLU A 512 99.958 -9.523 23.398 1.00 0.00 C ATOM 1170 OE1 GLU A 512 100.508 -10.299 24.209 1.00 0.00 O ATOM 1171 OE2 GLU A 512 99.108 -8.672 23.735 1.00 0.00 O ATOM 0 H GLU A 512 100.201 -10.212 19.053 1.00 0.00 H new ATOM 0 HA GLU A 512 98.252 -10.955 20.933 1.00 0.00 H new ATOM 0 HB2 GLU A 512 99.740 -8.387 20.291 1.00 0.00 H new ATOM 0 HB3 GLU A 512 98.576 -8.458 21.599 1.00 0.00 H new ATOM 0 HG2 GLU A 512 100.529 -10.661 21.679 1.00 0.00 H new ATOM 0 HG3 GLU A 512 101.276 -9.079 21.773 1.00 0.00 H new ATOM 1178 N ILE A 513 97.230 -8.874 18.602 1.00 0.00 N ATOM 1179 CA ILE A 513 96.035 -8.269 18.023 1.00 0.00 C ATOM 1180 C ILE A 513 94.821 -9.175 18.201 1.00 0.00 C ATOM 1181 O ILE A 513 93.737 -8.710 18.555 1.00 0.00 O ATOM 1182 CB ILE A 513 96.221 -7.961 16.524 1.00 0.00 C ATOM 1183 CG1 ILE A 513 97.531 -7.204 16.293 1.00 0.00 C ATOM 1184 CG2 ILE A 513 95.042 -7.152 16.004 1.00 0.00 C ATOM 1185 CD1 ILE A 513 97.658 -5.950 17.130 1.00 0.00 C ATOM 0 H ILE A 513 98.084 -8.729 18.063 1.00 0.00 H new ATOM 0 HA ILE A 513 95.869 -7.332 18.555 1.00 0.00 H new ATOM 0 HB ILE A 513 96.266 -8.903 15.977 1.00 0.00 H new ATOM 0 HG12 ILE A 513 98.368 -7.866 16.515 1.00 0.00 H new ATOM 0 HG13 ILE A 513 97.606 -6.937 15.239 1.00 0.00 H new ATOM 0 HG21 ILE A 513 95.185 -6.941 14.944 1.00 0.00 H new ATOM 0 HG22 ILE A 513 94.122 -7.721 16.140 1.00 0.00 H new ATOM 0 HG23 ILE A 513 94.973 -6.214 16.555 1.00 0.00 H new ATOM 0 HD11 ILE A 513 98.610 -5.464 16.915 1.00 0.00 H new ATOM 0 HD12 ILE A 513 96.841 -5.269 16.891 1.00 0.00 H new ATOM 0 HD13 ILE A 513 97.615 -6.212 18.187 1.00 0.00 H new ATOM 1197 N ASN A 514 95.006 -10.467 17.950 1.00 0.00 N ATOM 1198 CA ASN A 514 93.924 -11.435 18.079 1.00 0.00 C ATOM 1199 C ASN A 514 93.203 -11.284 19.414 1.00 0.00 C ATOM 1200 O ASN A 514 92.001 -11.531 19.514 1.00 0.00 O ATOM 1201 CB ASN A 514 94.469 -12.858 17.942 1.00 0.00 C ATOM 1202 CG ASN A 514 93.379 -13.908 18.036 1.00 0.00 C ATOM 1203 OD1 ASN A 514 93.565 -14.957 18.651 1.00 0.00 O ATOM 1204 ND2 ASN A 514 92.235 -13.629 17.424 1.00 0.00 N ATOM 0 H ASN A 514 95.897 -10.868 17.656 1.00 0.00 H new ATOM 0 HA ASN A 514 93.207 -11.244 17.280 1.00 0.00 H new ATOM 0 HB2 ASN A 514 94.983 -12.957 16.986 1.00 0.00 H new ATOM 0 HB3 ASN A 514 95.210 -13.037 18.722 1.00 0.00 H new ATOM 0 HD21 ASN A 514 91.465 -14.298 17.452 1.00 0.00 H new ATOM 0 HD22 ASN A 514 92.125 -12.746 16.926 1.00 0.00 H new ATOM 1211 N LYS A 515 93.944 -10.879 20.440 1.00 0.00 N ATOM 1212 CA LYS A 515 93.373 -10.699 21.769 1.00 0.00 C ATOM 1213 C LYS A 515 92.106 -9.853 21.705 1.00 0.00 C ATOM 1214 O LYS A 515 91.148 -10.093 22.442 1.00 0.00 O ATOM 1215 CB LYS A 515 94.393 -10.042 22.702 1.00 0.00 C ATOM 1216 CG LYS A 515 95.604 -10.914 22.987 1.00 0.00 C ATOM 1217 CD LYS A 515 95.525 -11.545 24.366 1.00 0.00 C ATOM 1218 CE LYS A 515 96.844 -11.422 25.113 1.00 0.00 C ATOM 1219 NZ LYS A 515 96.816 -10.319 26.111 1.00 0.00 N ATOM 0 H LYS A 515 94.940 -10.669 20.376 1.00 0.00 H new ATOM 0 HA LYS A 515 93.113 -11.682 22.162 1.00 0.00 H new ATOM 0 HB2 LYS A 515 94.727 -9.104 22.259 1.00 0.00 H new ATOM 0 HB3 LYS A 515 93.904 -9.794 23.644 1.00 0.00 H new ATOM 0 HG2 LYS A 515 95.676 -11.696 22.232 1.00 0.00 H new ATOM 0 HG3 LYS A 515 96.511 -10.314 22.912 1.00 0.00 H new ATOM 0 HD2 LYS A 515 94.734 -11.065 24.942 1.00 0.00 H new ATOM 0 HD3 LYS A 515 95.257 -12.597 24.271 1.00 0.00 H new ATOM 0 HE2 LYS A 515 97.064 -12.363 25.618 1.00 0.00 H new ATOM 0 HE3 LYS A 515 97.650 -11.246 24.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 515 97.733 -10.268 26.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 515 96.631 -9.417 25.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 515 96.064 -10.499 26.806 1.00 0.00 H new ATOM 1233 N LYS A 516 92.108 -8.862 20.820 1.00 0.00 N ATOM 1234 CA LYS A 516 90.959 -7.979 20.659 1.00 0.00 C ATOM 1235 C LYS A 516 90.242 -8.253 19.341 1.00 0.00 C ATOM 1236 O LYS A 516 89.035 -8.494 19.318 1.00 0.00 O ATOM 1237 CB LYS A 516 91.402 -6.516 20.719 1.00 0.00 C ATOM 1238 CG LYS A 516 90.374 -5.595 21.355 1.00 0.00 C ATOM 1239 CD LYS A 516 88.971 -5.881 20.841 1.00 0.00 C ATOM 1240 CE LYS A 516 88.233 -6.854 21.748 1.00 0.00 C ATOM 1241 NZ LYS A 516 86.980 -6.264 22.296 1.00 0.00 N ATOM 0 H LYS A 516 92.892 -8.650 20.203 1.00 0.00 H new ATOM 0 HA LYS A 516 90.264 -8.175 21.476 1.00 0.00 H new ATOM 0 HB2 LYS A 516 92.334 -6.450 21.281 1.00 0.00 H new ATOM 0 HB3 LYS A 516 91.614 -6.167 19.708 1.00 0.00 H new ATOM 0 HG2 LYS A 516 90.397 -5.716 22.438 1.00 0.00 H new ATOM 0 HG3 LYS A 516 90.635 -4.558 21.145 1.00 0.00 H new ATOM 0 HD2 LYS A 516 88.410 -4.949 20.773 1.00 0.00 H new ATOM 0 HD3 LYS A 516 89.028 -6.293 19.834 1.00 0.00 H new ATOM 0 HE2 LYS A 516 87.994 -7.759 21.190 1.00 0.00 H new ATOM 0 HE3 LYS A 516 88.885 -7.149 22.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 86.508 -6.959 22.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 87.210 -5.414 22.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 86.346 -6.006 21.513 1.00 0.00 H new ATOM 1255 N HIS A 517 90.993 -8.215 18.246 1.00 0.00 N ATOM 1256 CA HIS A 517 90.431 -8.459 16.923 1.00 0.00 C ATOM 1257 C HIS A 517 91.376 -9.309 16.082 1.00 0.00 C ATOM 1258 O HIS A 517 92.507 -8.906 15.807 1.00 0.00 O ATOM 1259 CB HIS A 517 90.152 -7.136 16.208 1.00 0.00 C ATOM 1260 CG HIS A 517 89.824 -6.008 17.138 1.00 0.00 C ATOM 1261 ND1 HIS A 517 88.531 -5.633 17.440 1.00 0.00 N ATOM 1262 CD2 HIS A 517 90.629 -5.170 17.833 1.00 0.00 C ATOM 1263 CE1 HIS A 517 88.556 -4.613 18.279 1.00 0.00 C ATOM 1264 NE2 HIS A 517 89.815 -4.314 18.534 1.00 0.00 N ATOM 0 H HIS A 517 91.994 -8.017 18.249 1.00 0.00 H new ATOM 0 HA HIS A 517 89.493 -9.000 17.050 1.00 0.00 H new ATOM 0 HB2 HIS A 517 91.024 -6.863 15.613 1.00 0.00 H new ATOM 0 HB3 HIS A 517 89.323 -7.276 15.514 1.00 0.00 H new ATOM 0 HD2 HIS A 517 91.709 -5.174 17.836 1.00 0.00 H new ATOM 0 HE1 HIS A 517 87.692 -4.109 18.687 1.00 0.00 H new ATOM 0 HE2 HIS A 517 90.133 -3.567 19.152 1.00 0.00 H new ATOM 1273 N CYS A 518 90.907 -10.480 15.663 1.00 0.00 N ATOM 1274 CA CYS A 518 91.720 -11.369 14.843 1.00 0.00 C ATOM 1275 C CYS A 518 92.278 -10.611 13.646 1.00 0.00 C ATOM 1276 O CYS A 518 91.526 -10.007 12.882 1.00 0.00 O ATOM 1277 CB CYS A 518 90.892 -12.564 14.368 1.00 0.00 C ATOM 1278 SG CYS A 518 91.828 -13.770 13.400 1.00 0.00 S ATOM 0 H CYS A 518 89.974 -10.833 15.876 1.00 0.00 H new ATOM 0 HA CYS A 518 92.549 -11.738 15.447 1.00 0.00 H new ATOM 0 HB2 CYS A 518 90.464 -13.064 15.237 1.00 0.00 H new ATOM 0 HB3 CYS A 518 90.059 -12.200 13.767 1.00 0.00 H new ATOM 0 HG CYS A 518 91.044 -14.744 13.045 1.00 0.00 H new ATOM 1284 N TRP A 519 93.597 -10.628 13.493 1.00 0.00 N ATOM 1285 CA TRP A 519 94.234 -9.921 12.390 1.00 0.00 C ATOM 1286 C TRP A 519 95.373 -10.720 11.783 1.00 0.00 C ATOM 1287 O TRP A 519 96.082 -11.453 12.472 1.00 0.00 O ATOM 1288 CB TRP A 519 94.746 -8.565 12.862 1.00 0.00 C ATOM 1289 CG TRP A 519 94.467 -7.469 11.887 1.00 0.00 C ATOM 1290 CD1 TRP A 519 93.831 -7.591 10.689 1.00 0.00 C ATOM 1291 CD2 TRP A 519 94.812 -6.086 12.024 1.00 0.00 C ATOM 1292 NE1 TRP A 519 93.753 -6.375 10.070 1.00 0.00 N ATOM 1293 CE2 TRP A 519 94.347 -5.429 10.869 1.00 0.00 C ATOM 1294 CE3 TRP A 519 95.466 -5.339 13.009 1.00 0.00 C ATOM 1295 CZ2 TRP A 519 94.515 -4.057 10.678 1.00 0.00 C ATOM 1296 CZ3 TRP A 519 95.632 -3.982 12.816 1.00 0.00 C ATOM 1297 CH2 TRP A 519 95.158 -3.354 11.661 1.00 0.00 C ATOM 0 H TRP A 519 94.241 -11.119 14.113 1.00 0.00 H new ATOM 0 HA TRP A 519 93.480 -9.779 11.615 1.00 0.00 H new ATOM 0 HB2 TRP A 519 94.284 -8.320 13.818 1.00 0.00 H new ATOM 0 HB3 TRP A 519 95.821 -8.627 13.034 1.00 0.00 H new ATOM 0 HD1 TRP A 519 93.444 -8.515 10.286 1.00 0.00 H new ATOM 0 HE1 TRP A 519 93.323 -6.199 9.162 1.00 0.00 H new ATOM 0 HE3 TRP A 519 95.835 -5.815 13.905 1.00 0.00 H new ATOM 0 HZ2 TRP A 519 94.151 -3.567 9.787 1.00 0.00 H new ATOM 0 HZ3 TRP A 519 96.137 -3.396 13.570 1.00 0.00 H new ATOM 0 HH2 TRP A 519 95.302 -2.290 11.541 1.00 0.00 H new ATOM 1308 N LYS A 520 95.531 -10.563 10.478 1.00 0.00 N ATOM 1309 CA LYS A 520 96.570 -11.252 9.735 1.00 0.00 C ATOM 1310 C LYS A 520 97.650 -10.280 9.276 1.00 0.00 C ATOM 1311 O LYS A 520 97.347 -9.207 8.749 1.00 0.00 O ATOM 1312 CB LYS A 520 95.950 -11.937 8.526 1.00 0.00 C ATOM 1313 CG LYS A 520 94.557 -12.483 8.792 1.00 0.00 C ATOM 1314 CD LYS A 520 94.583 -13.608 9.812 1.00 0.00 C ATOM 1315 CE LYS A 520 93.552 -13.388 10.905 1.00 0.00 C ATOM 1316 NZ LYS A 520 92.309 -12.761 10.375 1.00 0.00 N ATOM 0 H LYS A 520 94.943 -9.956 9.907 1.00 0.00 H new ATOM 0 HA LYS A 520 97.033 -11.992 10.387 1.00 0.00 H new ATOM 0 HB2 LYS A 520 95.903 -11.227 7.700 1.00 0.00 H new ATOM 0 HB3 LYS A 520 96.598 -12.754 8.208 1.00 0.00 H new ATOM 0 HG2 LYS A 520 93.913 -11.680 9.151 1.00 0.00 H new ATOM 0 HG3 LYS A 520 94.124 -12.846 7.860 1.00 0.00 H new ATOM 0 HD2 LYS A 520 94.390 -14.558 9.313 1.00 0.00 H new ATOM 0 HD3 LYS A 520 95.576 -13.677 10.255 1.00 0.00 H new ATOM 0 HE2 LYS A 520 93.307 -14.342 11.371 1.00 0.00 H new ATOM 0 HE3 LYS A 520 93.976 -12.753 11.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 520 91.511 -12.988 11.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 520 92.432 -11.729 10.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 520 92.115 -13.128 9.421 1.00 0.00 H new ATOM 1330 N LEU A 521 98.907 -10.661 9.467 1.00 0.00 N ATOM 1331 CA LEU A 521 100.025 -9.821 9.060 1.00 0.00 C ATOM 1332 C LEU A 521 101.080 -10.641 8.324 1.00 0.00 C ATOM 1333 O LEU A 521 101.676 -11.558 8.890 1.00 0.00 O ATOM 1334 CB LEU A 521 100.647 -9.137 10.279 1.00 0.00 C ATOM 1335 CG LEU A 521 100.748 -7.613 10.183 1.00 0.00 C ATOM 1336 CD1 LEU A 521 101.538 -7.053 11.357 1.00 0.00 C ATOM 1337 CD2 LEU A 521 101.386 -7.205 8.864 1.00 0.00 C ATOM 0 H LEU A 521 99.177 -11.544 9.900 1.00 0.00 H new ATOM 0 HA LEU A 521 99.647 -9.057 8.380 1.00 0.00 H new ATOM 0 HB2 LEU A 521 100.058 -9.392 11.160 1.00 0.00 H new ATOM 0 HB3 LEU A 521 101.646 -9.543 10.435 1.00 0.00 H new ATOM 0 HG LEU A 521 99.741 -7.198 10.221 1.00 0.00 H new ATOM 0 HD11 LEU A 521 101.599 -5.968 11.270 1.00 0.00 H new ATOM 0 HD12 LEU A 521 101.039 -7.315 12.290 1.00 0.00 H new ATOM 0 HD13 LEU A 521 102.543 -7.474 11.353 1.00 0.00 H new ATOM 0 HD21 LEU A 521 101.450 -6.118 8.812 1.00 0.00 H new ATOM 0 HD22 LEU A 521 102.387 -7.631 8.797 1.00 0.00 H new ATOM 0 HD23 LEU A 521 100.779 -7.573 8.037 1.00 0.00 H new ATOM 1349 N GLU A 522 101.304 -10.306 7.057 1.00 0.00 N ATOM 1350 CA GLU A 522 102.284 -11.012 6.240 1.00 0.00 C ATOM 1351 C GLU A 522 103.077 -10.039 5.375 1.00 0.00 C ATOM 1352 O GLU A 522 102.532 -9.062 4.862 1.00 0.00 O ATOM 1353 CB GLU A 522 101.586 -12.046 5.354 1.00 0.00 C ATOM 1354 CG GLU A 522 102.538 -13.052 4.728 1.00 0.00 C ATOM 1355 CD GLU A 522 102.073 -14.484 4.910 1.00 0.00 C ATOM 1356 OE1 GLU A 522 101.602 -15.086 3.921 1.00 0.00 O ATOM 1357 OE2 GLU A 522 102.179 -15.004 6.041 1.00 0.00 O ATOM 0 H GLU A 522 100.820 -9.549 6.574 1.00 0.00 H new ATOM 0 HA GLU A 522 102.978 -11.522 6.909 1.00 0.00 H new ATOM 0 HB2 GLU A 522 100.845 -12.581 5.948 1.00 0.00 H new ATOM 0 HB3 GLU A 522 101.046 -11.528 4.562 1.00 0.00 H new ATOM 0 HG2 GLU A 522 102.638 -12.839 3.664 1.00 0.00 H new ATOM 0 HG3 GLU A 522 103.527 -12.936 5.171 1.00 0.00 H new ATOM 1364 N ILE A 523 104.368 -10.313 5.216 1.00 0.00 N ATOM 1365 CA ILE A 523 105.237 -9.464 4.411 1.00 0.00 C ATOM 1366 C ILE A 523 105.383 -10.014 2.996 1.00 0.00 C ATOM 1367 O ILE A 523 105.859 -11.132 2.801 1.00 0.00 O ATOM 1368 CB ILE A 523 106.633 -9.328 5.049 1.00 0.00 C ATOM 1369 CG1 ILE A 523 106.545 -8.529 6.350 1.00 0.00 C ATOM 1370 CG2 ILE A 523 107.600 -8.667 4.078 1.00 0.00 C ATOM 1371 CD1 ILE A 523 107.391 -9.102 7.467 1.00 0.00 C ATOM 0 H ILE A 523 104.835 -11.117 5.635 1.00 0.00 H new ATOM 0 HA ILE A 523 104.770 -8.480 4.367 1.00 0.00 H new ATOM 0 HB ILE A 523 107.009 -10.325 5.280 1.00 0.00 H new ATOM 0 HG12 ILE A 523 106.857 -7.502 6.159 1.00 0.00 H new ATOM 0 HG13 ILE A 523 105.505 -8.491 6.675 1.00 0.00 H new ATOM 0 HG21 ILE A 523 108.581 -8.579 4.545 1.00 0.00 H new ATOM 0 HG22 ILE A 523 107.681 -9.273 3.176 1.00 0.00 H new ATOM 0 HG23 ILE A 523 107.232 -7.675 3.817 1.00 0.00 H new ATOM 0 HD11 ILE A 523 107.281 -8.486 8.359 1.00 0.00 H new ATOM 0 HD12 ILE A 523 107.065 -10.119 7.685 1.00 0.00 H new ATOM 0 HD13 ILE A 523 108.437 -9.114 7.161 1.00 0.00 H new ATOM 1383 N LEU A 524 104.968 -9.223 2.010 1.00 0.00 N ATOM 1384 CA LEU A 524 105.051 -9.635 0.613 1.00 0.00 C ATOM 1385 C LEU A 524 106.497 -9.914 0.214 1.00 0.00 C ATOM 1386 O LEU A 524 107.415 -9.215 0.644 1.00 0.00 O ATOM 1387 CB LEU A 524 104.457 -8.559 -0.298 1.00 0.00 C ATOM 1388 CG LEU A 524 102.956 -8.692 -0.559 1.00 0.00 C ATOM 1389 CD1 LEU A 524 102.666 -9.934 -1.389 1.00 0.00 C ATOM 1390 CD2 LEU A 524 102.192 -8.737 0.754 1.00 0.00 C ATOM 0 H LEU A 524 104.571 -8.294 2.153 1.00 0.00 H new ATOM 0 HA LEU A 524 104.476 -10.554 0.498 1.00 0.00 H new ATOM 0 HB2 LEU A 524 104.649 -7.582 0.146 1.00 0.00 H new ATOM 0 HB3 LEU A 524 104.981 -8.583 -1.254 1.00 0.00 H new ATOM 0 HG LEU A 524 102.625 -7.819 -1.122 1.00 0.00 H new ATOM 0 HD11 LEU A 524 101.593 -10.012 -1.565 1.00 0.00 H new ATOM 0 HD12 LEU A 524 103.186 -9.863 -2.344 1.00 0.00 H new ATOM 0 HD13 LEU A 524 103.011 -10.818 -0.853 1.00 0.00 H new ATOM 0 HD21 LEU A 524 101.125 -8.832 0.551 1.00 0.00 H new ATOM 0 HD22 LEU A 524 102.527 -9.592 1.341 1.00 0.00 H new ATOM 0 HD23 LEU A 524 102.375 -7.819 1.313 1.00 0.00 H new ATOM 1402 N SER A 525 106.694 -10.949 -0.597 1.00 0.00 N ATOM 1403 CA SER A 525 108.031 -11.332 -1.040 1.00 0.00 C ATOM 1404 C SER A 525 108.003 -11.925 -2.446 1.00 0.00 C ATOM 1405 O SER A 525 106.952 -12.335 -2.941 1.00 0.00 O ATOM 1406 CB SER A 525 108.651 -12.331 -0.062 1.00 0.00 C ATOM 1407 OG SER A 525 110.042 -12.474 -0.293 1.00 0.00 O ATOM 0 H SER A 525 105.945 -11.538 -0.961 1.00 0.00 H new ATOM 0 HA SER A 525 108.643 -10.430 -1.065 1.00 0.00 H new ATOM 0 HB2 SER A 525 108.482 -11.996 0.961 1.00 0.00 H new ATOM 0 HB3 SER A 525 108.160 -13.299 -0.166 1.00 0.00 H new ATOM 0 HG SER A 525 110.415 -13.116 0.346 1.00 0.00 H new ATOM 1413 N GLY A 526 109.172 -11.976 -3.076 1.00 0.00 N ATOM 1414 CA GLY A 526 109.279 -12.533 -4.412 1.00 0.00 C ATOM 1415 C GLY A 526 108.379 -11.850 -5.421 1.00 0.00 C ATOM 1416 O GLY A 526 108.047 -10.673 -5.275 1.00 0.00 O ATOM 0 H GLY A 526 110.051 -11.640 -2.683 1.00 0.00 H new ATOM 0 HA2 GLY A 526 110.313 -12.457 -4.748 1.00 0.00 H new ATOM 0 HA3 GLY A 526 109.033 -13.594 -4.376 1.00 0.00 H new ATOM 1420 N ASP A 527 107.992 -12.594 -6.452 1.00 0.00 N ATOM 1421 CA ASP A 527 107.133 -12.062 -7.501 1.00 0.00 C ATOM 1422 C ASP A 527 105.882 -11.422 -6.914 1.00 0.00 C ATOM 1423 O ASP A 527 105.335 -10.477 -7.483 1.00 0.00 O ATOM 1424 CB ASP A 527 106.738 -13.174 -8.474 1.00 0.00 C ATOM 1425 CG ASP A 527 106.074 -12.638 -9.727 1.00 0.00 C ATOM 1426 OD1 ASP A 527 104.827 -12.577 -9.759 1.00 0.00 O ATOM 1427 OD2 ASP A 527 106.803 -12.277 -10.675 1.00 0.00 O ATOM 0 H ASP A 527 108.261 -13.569 -6.583 1.00 0.00 H new ATOM 0 HA ASP A 527 107.692 -11.295 -8.037 1.00 0.00 H new ATOM 0 HB2 ASP A 527 107.626 -13.742 -8.751 1.00 0.00 H new ATOM 0 HB3 ASP A 527 106.060 -13.866 -7.975 1.00 0.00 H new ATOM 1432 N HIS A 528 105.428 -11.936 -5.777 1.00 0.00 N ATOM 1433 CA HIS A 528 104.239 -11.400 -5.131 1.00 0.00 C ATOM 1434 C HIS A 528 104.468 -9.960 -4.685 1.00 0.00 C ATOM 1435 O HIS A 528 103.630 -9.087 -4.917 1.00 0.00 O ATOM 1436 CB HIS A 528 103.842 -12.265 -3.937 1.00 0.00 C ATOM 1437 CG HIS A 528 102.393 -12.642 -3.937 1.00 0.00 C ATOM 1438 ND1 HIS A 528 101.786 -13.309 -2.893 1.00 0.00 N ATOM 1439 CD2 HIS A 528 101.428 -12.443 -4.865 1.00 0.00 C ATOM 1440 CE1 HIS A 528 100.511 -13.504 -3.181 1.00 0.00 C ATOM 1441 NE2 HIS A 528 100.269 -12.987 -4.372 1.00 0.00 N ATOM 0 H HIS A 528 105.863 -12.718 -5.287 1.00 0.00 H new ATOM 0 HA HIS A 528 103.426 -11.411 -5.856 1.00 0.00 H new ATOM 0 HB2 HIS A 528 104.447 -13.172 -3.937 1.00 0.00 H new ATOM 0 HB3 HIS A 528 104.071 -11.729 -3.016 1.00 0.00 H new ATOM 0 HD2 HIS A 528 101.548 -11.948 -5.817 1.00 0.00 H new ATOM 0 HE1 HIS A 528 99.790 -14.002 -2.550 1.00 0.00 H new ATOM 0 HE2 HIS A 528 99.367 -12.991 -4.848 1.00 0.00 H new ATOM 1450 N GLU A 529 105.613 -9.711 -4.055 1.00 0.00 N ATOM 1451 CA GLU A 529 105.946 -8.368 -3.595 1.00 0.00 C ATOM 1452 C GLU A 529 106.171 -7.439 -4.783 1.00 0.00 C ATOM 1453 O GLU A 529 105.672 -6.314 -4.813 1.00 0.00 O ATOM 1454 CB GLU A 529 107.196 -8.399 -2.714 1.00 0.00 C ATOM 1455 CG GLU A 529 107.900 -7.057 -2.606 1.00 0.00 C ATOM 1456 CD GLU A 529 109.131 -7.114 -1.723 1.00 0.00 C ATOM 1457 OE1 GLU A 529 108.977 -7.331 -0.502 1.00 0.00 O ATOM 1458 OE2 GLU A 529 110.250 -6.943 -2.252 1.00 0.00 O ATOM 0 H GLU A 529 106.321 -10.417 -3.853 1.00 0.00 H new ATOM 0 HA GLU A 529 105.110 -7.991 -3.006 1.00 0.00 H new ATOM 0 HB2 GLU A 529 106.918 -8.735 -1.715 1.00 0.00 H new ATOM 0 HB3 GLU A 529 107.894 -9.134 -3.114 1.00 0.00 H new ATOM 0 HG2 GLU A 529 108.187 -6.720 -3.602 1.00 0.00 H new ATOM 0 HG3 GLU A 529 107.205 -6.317 -2.207 1.00 0.00 H new ATOM 1465 N GLN A 530 106.927 -7.927 -5.762 1.00 0.00 N ATOM 1466 CA GLN A 530 107.224 -7.151 -6.961 1.00 0.00 C ATOM 1467 C GLN A 530 105.949 -6.852 -7.744 1.00 0.00 C ATOM 1468 O GLN A 530 105.800 -5.779 -8.327 1.00 0.00 O ATOM 1469 CB GLN A 530 108.229 -7.900 -7.844 1.00 0.00 C ATOM 1470 CG GLN A 530 107.584 -8.831 -8.859 1.00 0.00 C ATOM 1471 CD GLN A 530 107.374 -8.167 -10.206 1.00 0.00 C ATOM 1472 OE1 GLN A 530 107.953 -7.119 -10.492 1.00 0.00 O ATOM 1473 NE2 GLN A 530 106.542 -8.775 -11.042 1.00 0.00 N ATOM 0 H GLN A 530 107.345 -8.857 -5.748 1.00 0.00 H new ATOM 0 HA GLN A 530 107.665 -6.203 -6.654 1.00 0.00 H new ATOM 0 HB2 GLN A 530 108.845 -7.173 -8.373 1.00 0.00 H new ATOM 0 HB3 GLN A 530 108.896 -8.480 -7.206 1.00 0.00 H new ATOM 0 HG2 GLN A 530 108.210 -9.714 -8.987 1.00 0.00 H new ATOM 0 HG3 GLN A 530 106.624 -9.174 -8.473 1.00 0.00 H new ATOM 0 HE21 GLN A 530 106.083 -9.643 -10.764 1.00 0.00 H new ATOM 0 HE22 GLN A 530 106.361 -8.375 -11.963 1.00 0.00 H new ATOM 1482 N ARG A 531 105.031 -7.814 -7.749 1.00 0.00 N ATOM 1483 CA ARG A 531 103.763 -7.664 -8.454 1.00 0.00 C ATOM 1484 C ARG A 531 102.967 -6.496 -7.878 1.00 0.00 C ATOM 1485 O ARG A 531 102.520 -5.613 -8.611 1.00 0.00 O ATOM 1486 CB ARG A 531 102.959 -8.968 -8.364 1.00 0.00 C ATOM 1487 CG ARG A 531 101.452 -8.777 -8.236 1.00 0.00 C ATOM 1488 CD ARG A 531 100.912 -7.820 -9.286 1.00 0.00 C ATOM 1489 NE ARG A 531 99.723 -8.353 -9.946 1.00 0.00 N ATOM 1490 CZ ARG A 531 99.066 -7.720 -10.911 1.00 0.00 C ATOM 1491 NH1 ARG A 531 99.472 -6.527 -11.324 1.00 0.00 N ATOM 1492 NH2 ARG A 531 97.998 -8.280 -11.464 1.00 0.00 N ATOM 0 H ARG A 531 105.143 -8.708 -7.271 1.00 0.00 H new ATOM 0 HA ARG A 531 103.964 -7.450 -9.504 1.00 0.00 H new ATOM 0 HB2 ARG A 531 103.162 -9.567 -9.252 1.00 0.00 H new ATOM 0 HB3 ARG A 531 103.314 -9.540 -7.506 1.00 0.00 H new ATOM 0 HG2 ARG A 531 100.954 -9.742 -8.333 1.00 0.00 H new ATOM 0 HG3 ARG A 531 101.217 -8.396 -7.242 1.00 0.00 H new ATOM 0 HD2 ARG A 531 100.671 -6.866 -8.818 1.00 0.00 H new ATOM 0 HD3 ARG A 531 101.684 -7.624 -10.030 1.00 0.00 H new ATOM 0 HE ARG A 531 99.377 -9.265 -9.648 1.00 0.00 H new ATOM 0 HH11 ARG A 531 100.292 -6.092 -10.900 1.00 0.00 H new ATOM 0 HH12 ARG A 531 98.965 -6.044 -12.065 1.00 0.00 H new ATOM 0 HH21 ARG A 531 97.682 -9.197 -11.148 1.00 0.00 H new ATOM 0 HH22 ARG A 531 97.493 -7.794 -12.205 1.00 0.00 H new ATOM 1506 N TYR A 532 102.796 -6.499 -6.561 1.00 0.00 N ATOM 1507 CA TYR A 532 102.057 -5.440 -5.887 1.00 0.00 C ATOM 1508 C TYR A 532 102.667 -4.077 -6.204 1.00 0.00 C ATOM 1509 O TYR A 532 101.951 -3.113 -6.484 1.00 0.00 O ATOM 1510 CB TYR A 532 102.055 -5.693 -4.379 1.00 0.00 C ATOM 1511 CG TYR A 532 101.401 -4.597 -3.570 1.00 0.00 C ATOM 1512 CD1 TYR A 532 102.096 -3.442 -3.253 1.00 0.00 C ATOM 1513 CD2 TYR A 532 100.096 -4.727 -3.112 1.00 0.00 C ATOM 1514 CE1 TYR A 532 101.513 -2.440 -2.499 1.00 0.00 C ATOM 1515 CE2 TYR A 532 99.503 -3.729 -2.361 1.00 0.00 C ATOM 1516 CZ TYR A 532 100.215 -2.588 -2.057 1.00 0.00 C ATOM 1517 OH TYR A 532 99.629 -1.593 -1.307 1.00 0.00 O ATOM 0 H TYR A 532 103.159 -7.222 -5.940 1.00 0.00 H new ATOM 0 HA TYR A 532 101.028 -5.440 -6.246 1.00 0.00 H new ATOM 0 HB2 TYR A 532 101.540 -6.633 -4.180 1.00 0.00 H new ATOM 0 HB3 TYR A 532 103.084 -5.815 -4.041 1.00 0.00 H new ATOM 0 HD1 TYR A 532 103.111 -3.322 -3.601 1.00 0.00 H new ATOM 0 HD2 TYR A 532 99.536 -5.621 -3.346 1.00 0.00 H new ATOM 0 HE1 TYR A 532 102.071 -1.547 -2.258 1.00 0.00 H new ATOM 0 HE2 TYR A 532 98.487 -3.843 -2.014 1.00 0.00 H new ATOM 0 HH TYR A 532 98.654 -1.648 -1.394 1.00 0.00 H new ATOM 1527 N TRP A 533 103.994 -4.005 -6.176 1.00 0.00 N ATOM 1528 CA TRP A 533 104.689 -2.763 -6.481 1.00 0.00 C ATOM 1529 C TRP A 533 104.389 -2.324 -7.905 1.00 0.00 C ATOM 1530 O TRP A 533 104.148 -1.145 -8.166 1.00 0.00 O ATOM 1531 CB TRP A 533 106.194 -2.927 -6.286 1.00 0.00 C ATOM 1532 CG TRP A 533 106.628 -2.620 -4.890 1.00 0.00 C ATOM 1533 CD1 TRP A 533 107.063 -3.509 -3.955 1.00 0.00 C ATOM 1534 CD2 TRP A 533 106.652 -1.331 -4.267 1.00 0.00 C ATOM 1535 NE1 TRP A 533 107.356 -2.855 -2.786 1.00 0.00 N ATOM 1536 CE2 TRP A 533 107.113 -1.515 -2.951 1.00 0.00 C ATOM 1537 CE3 TRP A 533 106.330 -0.040 -4.694 1.00 0.00 C ATOM 1538 CZ2 TRP A 533 107.258 -0.456 -2.058 1.00 0.00 C ATOM 1539 CZ3 TRP A 533 106.475 1.010 -3.808 1.00 0.00 C ATOM 1540 CH2 TRP A 533 106.936 0.797 -2.503 1.00 0.00 C ATOM 0 H TRP A 533 104.605 -4.788 -5.946 1.00 0.00 H new ATOM 0 HA TRP A 533 104.333 -1.994 -5.795 1.00 0.00 H new ATOM 0 HB2 TRP A 533 106.480 -3.949 -6.535 1.00 0.00 H new ATOM 0 HB3 TRP A 533 106.720 -2.271 -6.979 1.00 0.00 H new ATOM 0 HD1 TRP A 533 107.163 -4.573 -4.111 1.00 0.00 H new ATOM 0 HE1 TRP A 533 107.699 -3.294 -1.932 1.00 0.00 H new ATOM 0 HE3 TRP A 533 105.974 0.134 -5.699 1.00 0.00 H new ATOM 0 HZ2 TRP A 533 107.612 -0.618 -1.051 1.00 0.00 H new ATOM 0 HZ3 TRP A 533 106.229 2.012 -4.127 1.00 0.00 H new ATOM 0 HH2 TRP A 533 107.039 1.639 -1.834 1.00 0.00 H new ATOM 1551 N GLN A 534 104.388 -3.285 -8.823 1.00 0.00 N ATOM 1552 CA GLN A 534 104.098 -3.000 -10.220 1.00 0.00 C ATOM 1553 C GLN A 534 102.798 -2.219 -10.330 1.00 0.00 C ATOM 1554 O GLN A 534 102.707 -1.239 -11.068 1.00 0.00 O ATOM 1555 CB GLN A 534 103.994 -4.301 -11.017 1.00 0.00 C ATOM 1556 CG GLN A 534 105.338 -4.951 -11.305 1.00 0.00 C ATOM 1557 CD GLN A 534 106.026 -4.354 -12.517 1.00 0.00 C ATOM 1558 OE1 GLN A 534 105.378 -3.996 -13.499 1.00 0.00 O ATOM 1559 NE2 GLN A 534 107.349 -4.244 -12.452 1.00 0.00 N ATOM 0 H GLN A 534 104.585 -4.266 -8.623 1.00 0.00 H new ATOM 0 HA GLN A 534 104.911 -2.401 -10.632 1.00 0.00 H new ATOM 0 HB2 GLN A 534 103.371 -5.005 -10.466 1.00 0.00 H new ATOM 0 HB3 GLN A 534 103.489 -4.099 -11.961 1.00 0.00 H new ATOM 0 HG2 GLN A 534 105.984 -4.842 -10.434 1.00 0.00 H new ATOM 0 HG3 GLN A 534 105.194 -6.020 -11.463 1.00 0.00 H new ATOM 0 HE21 GLN A 534 107.846 -4.554 -11.617 1.00 0.00 H new ATOM 0 HE22 GLN A 534 107.867 -3.850 -13.237 1.00 0.00 H new ATOM 1568 N LYS A 535 101.797 -2.660 -9.576 1.00 0.00 N ATOM 1569 CA LYS A 535 100.499 -2.004 -9.570 1.00 0.00 C ATOM 1570 C LYS A 535 100.634 -0.574 -9.050 1.00 0.00 C ATOM 1571 O LYS A 535 100.013 0.348 -9.577 1.00 0.00 O ATOM 1572 CB LYS A 535 99.503 -2.819 -8.728 1.00 0.00 C ATOM 1573 CG LYS A 535 98.964 -2.100 -7.497 1.00 0.00 C ATOM 1574 CD LYS A 535 98.515 -3.088 -6.434 1.00 0.00 C ATOM 1575 CE LYS A 535 98.555 -2.473 -5.044 1.00 0.00 C ATOM 1576 NZ LYS A 535 97.454 -2.980 -4.179 1.00 0.00 N ATOM 0 H LYS A 535 101.862 -3.471 -8.961 1.00 0.00 H new ATOM 0 HA LYS A 535 100.115 -1.952 -10.589 1.00 0.00 H new ATOM 0 HB2 LYS A 535 98.663 -3.104 -9.361 1.00 0.00 H new ATOM 0 HB3 LYS A 535 99.989 -3.741 -8.409 1.00 0.00 H new ATOM 0 HG2 LYS A 535 99.735 -1.447 -7.088 1.00 0.00 H new ATOM 0 HG3 LYS A 535 98.126 -1.464 -7.782 1.00 0.00 H new ATOM 0 HD2 LYS A 535 97.502 -3.425 -6.654 1.00 0.00 H new ATOM 0 HD3 LYS A 535 99.157 -3.969 -6.461 1.00 0.00 H new ATOM 0 HE2 LYS A 535 99.515 -2.694 -4.577 1.00 0.00 H new ATOM 0 HE3 LYS A 535 98.483 -1.388 -5.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 535 96.782 -2.210 -3.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 535 96.961 -3.757 -4.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 535 97.849 -3.328 -3.282 1.00 0.00 H new ATOM 1590 N ILE A 536 101.460 -0.399 -8.022 1.00 0.00 N ATOM 1591 CA ILE A 536 101.685 0.921 -7.445 1.00 0.00 C ATOM 1592 C ILE A 536 102.308 1.859 -8.472 1.00 0.00 C ATOM 1593 O ILE A 536 101.697 2.846 -8.882 1.00 0.00 O ATOM 1594 CB ILE A 536 102.615 0.860 -6.219 1.00 0.00 C ATOM 1595 CG1 ILE A 536 101.968 0.070 -5.080 1.00 0.00 C ATOM 1596 CG2 ILE A 536 102.970 2.266 -5.756 1.00 0.00 C ATOM 1597 CD1 ILE A 536 102.822 0.017 -3.830 1.00 0.00 C ATOM 0 H ILE A 536 101.982 -1.152 -7.574 1.00 0.00 H new ATOM 0 HA ILE A 536 100.710 1.295 -7.134 1.00 0.00 H new ATOM 0 HB ILE A 536 103.530 0.345 -6.510 1.00 0.00 H new ATOM 0 HG12 ILE A 536 101.005 0.519 -4.836 1.00 0.00 H new ATOM 0 HG13 ILE A 536 101.768 -0.946 -5.419 1.00 0.00 H new ATOM 0 HG21 ILE A 536 103.628 2.208 -4.889 1.00 0.00 H new ATOM 0 HG22 ILE A 536 103.477 2.797 -6.561 1.00 0.00 H new ATOM 0 HG23 ILE A 536 102.059 2.801 -5.486 1.00 0.00 H new ATOM 0 HD11 ILE A 536 102.306 -0.558 -3.061 1.00 0.00 H new ATOM 0 HD12 ILE A 536 103.775 -0.459 -4.060 1.00 0.00 H new ATOM 0 HD13 ILE A 536 103.000 1.030 -3.468 1.00 0.00 H new ATOM 1609 N LEU A 537 103.535 1.542 -8.878 1.00 0.00 N ATOM 1610 CA LEU A 537 104.256 2.350 -9.854 1.00 0.00 C ATOM 1611 C LEU A 537 103.382 2.659 -11.065 1.00 0.00 C ATOM 1612 O LEU A 537 103.133 3.822 -11.382 1.00 0.00 O ATOM 1613 CB LEU A 537 105.531 1.631 -10.299 1.00 0.00 C ATOM 1614 CG LEU A 537 106.811 2.090 -9.598 1.00 0.00 C ATOM 1615 CD1 LEU A 537 107.572 0.897 -9.042 1.00 0.00 C ATOM 1616 CD2 LEU A 537 107.688 2.885 -10.554 1.00 0.00 C ATOM 0 H LEU A 537 104.051 0.728 -8.544 1.00 0.00 H new ATOM 0 HA LEU A 537 104.525 3.293 -9.377 1.00 0.00 H new ATOM 0 HB2 LEU A 537 105.405 0.562 -10.129 1.00 0.00 H new ATOM 0 HB3 LEU A 537 105.653 1.771 -11.373 1.00 0.00 H new ATOM 0 HG LEU A 537 106.534 2.738 -8.767 1.00 0.00 H new ATOM 0 HD11 LEU A 537 108.479 1.243 -8.547 1.00 0.00 H new ATOM 0 HD12 LEU A 537 106.946 0.369 -8.323 1.00 0.00 H new ATOM 0 HD13 LEU A 537 107.837 0.223 -9.856 1.00 0.00 H new ATOM 0 HD21 LEU A 537 108.594 3.203 -10.038 1.00 0.00 H new ATOM 0 HD22 LEU A 537 107.956 2.261 -11.406 1.00 0.00 H new ATOM 0 HD23 LEU A 537 107.143 3.762 -10.904 1.00 0.00 H new ATOM 1628 N VAL A 538 102.921 1.613 -11.742 1.00 0.00 N ATOM 1629 CA VAL A 538 102.078 1.780 -12.921 1.00 0.00 C ATOM 1630 C VAL A 538 100.932 2.747 -12.641 1.00 0.00 C ATOM 1631 O VAL A 538 100.576 3.565 -13.490 1.00 0.00 O ATOM 1632 CB VAL A 538 101.501 0.430 -13.392 1.00 0.00 C ATOM 1633 CG1 VAL A 538 100.382 0.643 -14.400 1.00 0.00 C ATOM 1634 CG2 VAL A 538 102.599 -0.442 -13.983 1.00 0.00 C ATOM 0 H VAL A 538 103.116 0.643 -11.496 1.00 0.00 H new ATOM 0 HA VAL A 538 102.708 2.190 -13.710 1.00 0.00 H new ATOM 0 HB VAL A 538 101.083 -0.084 -12.526 1.00 0.00 H new ATOM 0 HG11 VAL A 538 99.990 -0.323 -14.718 1.00 0.00 H new ATOM 0 HG12 VAL A 538 99.583 1.225 -13.940 1.00 0.00 H new ATOM 0 HG13 VAL A 538 100.769 1.180 -15.266 1.00 0.00 H new ATOM 0 HG21 VAL A 538 102.174 -1.391 -14.310 1.00 0.00 H new ATOM 0 HG22 VAL A 538 103.049 0.067 -14.835 1.00 0.00 H new ATOM 0 HG23 VAL A 538 103.362 -0.628 -13.227 1.00 0.00 H new ATOM 1644 N ASP A 539 100.360 2.654 -11.445 1.00 0.00 N ATOM 1645 CA ASP A 539 99.260 3.528 -11.058 1.00 0.00 C ATOM 1646 C ASP A 539 99.722 4.979 -10.999 1.00 0.00 C ATOM 1647 O ASP A 539 98.987 5.894 -11.378 1.00 0.00 O ATOM 1648 CB ASP A 539 98.692 3.105 -9.703 1.00 0.00 C ATOM 1649 CG ASP A 539 97.282 3.618 -9.483 1.00 0.00 C ATOM 1650 OD1 ASP A 539 97.121 4.838 -9.269 1.00 0.00 O ATOM 1651 OD2 ASP A 539 96.338 2.800 -9.527 1.00 0.00 O ATOM 0 H ASP A 539 100.640 1.984 -10.729 1.00 0.00 H new ATOM 0 HA ASP A 539 98.476 3.442 -11.811 1.00 0.00 H new ATOM 0 HB2 ASP A 539 98.695 2.017 -9.634 1.00 0.00 H new ATOM 0 HB3 ASP A 539 99.339 3.476 -8.909 1.00 0.00 H new ATOM 1656 N ARG A 540 100.948 5.183 -10.526 1.00 0.00 N ATOM 1657 CA ARG A 540 101.509 6.523 -10.421 1.00 0.00 C ATOM 1658 C ARG A 540 101.618 7.167 -11.796 1.00 0.00 C ATOM 1659 O ARG A 540 101.310 8.347 -11.966 1.00 0.00 O ATOM 1660 CB ARG A 540 102.888 6.473 -9.758 1.00 0.00 C ATOM 1661 CG ARG A 540 103.356 7.819 -9.233 1.00 0.00 C ATOM 1662 CD ARG A 540 102.268 8.508 -8.428 1.00 0.00 C ATOM 1663 NE ARG A 540 102.819 9.470 -7.477 1.00 0.00 N ATOM 1664 CZ ARG A 540 102.327 9.680 -6.257 1.00 0.00 C ATOM 1665 NH1 ARG A 540 101.260 9.012 -5.835 1.00 0.00 N ATOM 1666 NH2 ARG A 540 102.904 10.566 -5.457 1.00 0.00 N ATOM 0 H ARG A 540 101.570 4.438 -10.210 1.00 0.00 H new ATOM 0 HA ARG A 540 100.841 7.125 -9.805 1.00 0.00 H new ATOM 0 HB2 ARG A 540 102.861 5.760 -8.934 1.00 0.00 H new ATOM 0 HB3 ARG A 540 103.616 6.100 -10.479 1.00 0.00 H new ATOM 0 HG2 ARG A 540 104.240 7.681 -8.610 1.00 0.00 H new ATOM 0 HG3 ARG A 540 103.651 8.455 -10.068 1.00 0.00 H new ATOM 0 HD2 ARG A 540 101.584 9.019 -9.106 1.00 0.00 H new ATOM 0 HD3 ARG A 540 101.685 7.760 -7.891 1.00 0.00 H new ATOM 0 HE ARG A 540 103.631 10.015 -7.765 1.00 0.00 H new ATOM 0 HH11 ARG A 540 100.810 8.331 -6.447 1.00 0.00 H new ATOM 0 HH12 ARG A 540 100.891 9.180 -4.899 1.00 0.00 H new ATOM 0 HH21 ARG A 540 103.722 11.085 -5.776 1.00 0.00 H new ATOM 0 HH22 ARG A 540 102.530 10.729 -4.522 1.00 0.00 H new ATOM 1680 N GLN A 541 102.044 6.381 -12.779 1.00 0.00 N ATOM 1681 CA GLN A 541 102.176 6.875 -14.141 1.00 0.00 C ATOM 1682 C GLN A 541 100.815 7.289 -14.680 1.00 0.00 C ATOM 1683 O GLN A 541 100.676 8.331 -15.322 1.00 0.00 O ATOM 1684 CB GLN A 541 102.796 5.806 -15.041 1.00 0.00 C ATOM 1685 CG GLN A 541 104.300 5.666 -14.872 1.00 0.00 C ATOM 1686 CD GLN A 541 104.677 4.924 -13.605 1.00 0.00 C ATOM 1687 OE1 GLN A 541 104.975 5.535 -12.579 1.00 0.00 O ATOM 1688 NE2 GLN A 541 104.665 3.597 -13.670 1.00 0.00 N ATOM 0 H GLN A 541 102.303 5.402 -12.657 1.00 0.00 H new ATOM 0 HA GLN A 541 102.833 7.744 -14.133 1.00 0.00 H new ATOM 0 HB2 GLN A 541 102.324 4.846 -14.829 1.00 0.00 H new ATOM 0 HB3 GLN A 541 102.576 6.047 -16.081 1.00 0.00 H new ATOM 0 HG2 GLN A 541 104.711 5.139 -15.733 1.00 0.00 H new ATOM 0 HG3 GLN A 541 104.754 6.657 -14.857 1.00 0.00 H new ATOM 0 HE21 GLN A 541 104.412 3.131 -14.541 1.00 0.00 H new ATOM 0 HE22 GLN A 541 104.909 3.044 -12.848 1.00 0.00 H new ATOM 1697 N ALA A 542 99.807 6.467 -14.403 1.00 0.00 N ATOM 1698 CA ALA A 542 98.449 6.745 -14.847 1.00 0.00 C ATOM 1699 C ALA A 542 97.983 8.094 -14.315 1.00 0.00 C ATOM 1700 O ALA A 542 97.278 8.835 -14.999 1.00 0.00 O ATOM 1701 CB ALA A 542 97.497 5.647 -14.401 1.00 0.00 C ATOM 0 H ALA A 542 99.908 5.602 -13.872 1.00 0.00 H new ATOM 0 HA ALA A 542 98.448 6.777 -15.937 1.00 0.00 H new ATOM 0 HB1 ALA A 542 96.489 5.878 -14.745 1.00 0.00 H new ATOM 0 HB2 ALA A 542 97.816 4.695 -14.825 1.00 0.00 H new ATOM 0 HB3 ALA A 542 97.503 5.580 -13.313 1.00 0.00 H new ATOM 1707 N LYS A 543 98.389 8.407 -13.089 1.00 0.00 N ATOM 1708 CA LYS A 543 98.022 9.670 -12.461 1.00 0.00 C ATOM 1709 C LYS A 543 98.546 10.848 -13.278 1.00 0.00 C ATOM 1710 O LYS A 543 98.084 11.978 -13.124 1.00 0.00 O ATOM 1711 CB LYS A 543 98.574 9.733 -11.035 1.00 0.00 C ATOM 1712 CG LYS A 543 97.505 9.597 -9.962 1.00 0.00 C ATOM 1713 CD LYS A 543 98.117 9.482 -8.574 1.00 0.00 C ATOM 1714 CE LYS A 543 98.561 8.058 -8.277 1.00 0.00 C ATOM 1715 NZ LYS A 543 97.408 7.169 -7.966 1.00 0.00 N ATOM 0 H LYS A 543 98.973 7.803 -12.511 1.00 0.00 H new ATOM 0 HA LYS A 543 96.934 9.731 -12.422 1.00 0.00 H new ATOM 0 HB2 LYS A 543 99.311 8.941 -10.904 1.00 0.00 H new ATOM 0 HB3 LYS A 543 99.096 10.680 -10.898 1.00 0.00 H new ATOM 0 HG2 LYS A 543 96.841 10.461 -9.997 1.00 0.00 H new ATOM 0 HG3 LYS A 543 96.894 8.717 -10.165 1.00 0.00 H new ATOM 0 HD2 LYS A 543 98.971 10.155 -8.495 1.00 0.00 H new ATOM 0 HD3 LYS A 543 97.390 9.801 -7.827 1.00 0.00 H new ATOM 0 HE2 LYS A 543 99.104 7.661 -9.135 1.00 0.00 H new ATOM 0 HE3 LYS A 543 99.253 8.062 -7.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 543 97.338 7.038 -6.937 1.00 0.00 H new ATOM 0 HZ2 LYS A 543 96.531 7.601 -8.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 543 97.548 6.246 -8.424 1.00 0.00 H new ATOM 1729 N LEU A 544 99.512 10.572 -14.149 1.00 0.00 N ATOM 1730 CA LEU A 544 100.101 11.604 -14.996 1.00 0.00 C ATOM 1731 C LEU A 544 99.049 12.229 -15.907 1.00 0.00 C ATOM 1732 O LEU A 544 99.084 13.428 -16.182 1.00 0.00 O ATOM 1733 CB LEU A 544 101.233 11.014 -15.840 1.00 0.00 C ATOM 1734 CG LEU A 544 101.968 12.015 -16.733 1.00 0.00 C ATOM 1735 CD1 LEU A 544 101.200 12.239 -18.028 1.00 0.00 C ATOM 1736 CD2 LEU A 544 102.177 13.331 -15.998 1.00 0.00 C ATOM 0 H LEU A 544 99.904 9.641 -14.287 1.00 0.00 H new ATOM 0 HA LEU A 544 100.504 12.383 -14.348 1.00 0.00 H new ATOM 0 HB2 LEU A 544 101.957 10.547 -15.172 1.00 0.00 H new ATOM 0 HB3 LEU A 544 100.822 10.224 -16.468 1.00 0.00 H new ATOM 0 HG LEU A 544 102.946 11.603 -16.982 1.00 0.00 H new ATOM 0 HD11 LEU A 544 101.738 12.954 -18.651 1.00 0.00 H new ATOM 0 HD12 LEU A 544 101.103 11.294 -18.562 1.00 0.00 H new ATOM 0 HD13 LEU A 544 100.208 12.630 -17.800 1.00 0.00 H new ATOM 0 HD21 LEU A 544 102.701 14.031 -16.648 1.00 0.00 H new ATOM 0 HD22 LEU A 544 101.210 13.749 -15.719 1.00 0.00 H new ATOM 0 HD23 LEU A 544 102.770 13.156 -15.100 1.00 0.00 H new ATOM 1748 N ASN A 545 98.114 11.406 -16.371 1.00 0.00 N ATOM 1749 CA ASN A 545 97.051 11.876 -17.251 1.00 0.00 C ATOM 1750 C ASN A 545 95.798 11.021 -17.087 1.00 0.00 C ATOM 1751 O ASN A 545 95.885 9.818 -16.846 1.00 0.00 O ATOM 1752 CB ASN A 545 97.516 11.848 -18.708 1.00 0.00 C ATOM 1753 CG ASN A 545 97.493 13.223 -19.348 1.00 0.00 C ATOM 1754 OD1 ASN A 545 96.972 13.398 -20.450 1.00 0.00 O ATOM 1755 ND2 ASN A 545 98.060 14.207 -18.658 1.00 0.00 N ATOM 0 H ASN A 545 98.071 10.411 -16.152 1.00 0.00 H new ATOM 0 HA ASN A 545 96.810 12.903 -16.976 1.00 0.00 H new ATOM 0 HB2 ASN A 545 98.527 11.445 -18.756 1.00 0.00 H new ATOM 0 HB3 ASN A 545 96.876 11.174 -19.278 1.00 0.00 H new ATOM 0 HD21 ASN A 545 98.075 15.153 -19.038 1.00 0.00 H new ATOM 0 HD22 ASN A 545 98.480 14.016 -17.748 1.00 0.00 H new ATOM 1762 N GLN A 546 94.635 11.651 -17.216 1.00 0.00 N ATOM 1763 CA GLN A 546 93.369 10.943 -17.076 1.00 0.00 C ATOM 1764 C GLN A 546 93.450 9.914 -15.955 1.00 0.00 C ATOM 1765 O GLN A 546 93.843 8.768 -16.176 1.00 0.00 O ATOM 1766 CB GLN A 546 92.995 10.256 -18.391 1.00 0.00 C ATOM 1767 CG GLN A 546 91.496 10.138 -18.607 1.00 0.00 C ATOM 1768 CD GLN A 546 90.924 11.314 -19.374 1.00 0.00 C ATOM 1769 OE1 GLN A 546 90.575 11.192 -20.548 1.00 0.00 O ATOM 1770 NE2 GLN A 546 90.827 12.461 -18.713 1.00 0.00 N ATOM 0 H GLN A 546 94.543 12.647 -17.417 1.00 0.00 H new ATOM 0 HA GLN A 546 92.597 11.671 -16.825 1.00 0.00 H new ATOM 0 HB2 GLN A 546 93.431 10.814 -19.220 1.00 0.00 H new ATOM 0 HB3 GLN A 546 93.437 9.260 -18.410 1.00 0.00 H new ATOM 0 HG2 GLN A 546 91.282 9.217 -19.149 1.00 0.00 H new ATOM 0 HG3 GLN A 546 90.998 10.062 -17.640 1.00 0.00 H new ATOM 0 HE21 GLN A 546 91.129 12.516 -17.740 1.00 0.00 H new ATOM 0 HE22 GLN A 546 90.451 13.287 -19.178 1.00 0.00 H new ATOM 1779 N PRO A 547 93.081 10.316 -14.731 1.00 0.00 N ATOM 1780 CA PRO A 547 93.113 9.434 -13.560 1.00 0.00 C ATOM 1781 C PRO A 547 92.097 8.302 -13.655 1.00 0.00 C ATOM 1782 O PRO A 547 91.007 8.382 -13.088 1.00 0.00 O ATOM 1783 CB PRO A 547 92.764 10.367 -12.397 1.00 0.00 C ATOM 1784 CG PRO A 547 92.018 11.494 -13.021 1.00 0.00 C ATOM 1785 CD PRO A 547 92.606 11.668 -14.392 1.00 0.00 C ATOM 0 HA PRO A 547 94.079 8.941 -13.453 1.00 0.00 H new ATOM 0 HB2 PRO A 547 92.156 9.857 -11.650 1.00 0.00 H new ATOM 0 HB3 PRO A 547 93.662 10.720 -11.890 1.00 0.00 H new ATOM 0 HG2 PRO A 547 90.952 11.273 -13.078 1.00 0.00 H new ATOM 0 HG3 PRO A 547 92.123 12.405 -12.432 1.00 0.00 H new ATOM 0 HD2 PRO A 547 91.863 12.024 -15.106 1.00 0.00 H new ATOM 0 HD3 PRO A 547 93.421 12.392 -14.391 1.00 0.00 H new ATOM 1793 N ARG A 548 92.464 7.243 -14.372 1.00 0.00 N ATOM 1794 CA ARG A 548 91.587 6.091 -14.536 1.00 0.00 C ATOM 1795 C ARG A 548 91.802 5.085 -13.409 1.00 0.00 C ATOM 1796 O ARG A 548 92.931 4.673 -13.141 1.00 0.00 O ATOM 1797 CB ARG A 548 91.836 5.423 -15.890 1.00 0.00 C ATOM 1798 CG ARG A 548 93.302 5.126 -16.159 1.00 0.00 C ATOM 1799 CD ARG A 548 93.774 5.773 -17.450 1.00 0.00 C ATOM 1800 NE ARG A 548 94.653 4.891 -18.213 1.00 0.00 N ATOM 1801 CZ ARG A 548 95.564 5.327 -19.076 1.00 0.00 C ATOM 1802 NH1 ARG A 548 95.712 6.629 -19.286 1.00 0.00 N ATOM 1803 NH2 ARG A 548 96.328 4.463 -19.729 1.00 0.00 N ATOM 0 H ARG A 548 93.362 7.160 -14.848 1.00 0.00 H new ATOM 0 HA ARG A 548 90.555 6.439 -14.498 1.00 0.00 H new ATOM 0 HB2 ARG A 548 91.270 4.492 -15.937 1.00 0.00 H new ATOM 0 HB3 ARG A 548 91.453 6.068 -16.681 1.00 0.00 H new ATOM 0 HG2 ARG A 548 93.906 5.488 -15.327 1.00 0.00 H new ATOM 0 HG3 ARG A 548 93.451 4.048 -16.215 1.00 0.00 H new ATOM 0 HD2 ARG A 548 92.910 6.040 -18.059 1.00 0.00 H new ATOM 0 HD3 ARG A 548 94.300 6.699 -17.220 1.00 0.00 H new ATOM 0 HE ARG A 548 94.562 3.884 -18.076 1.00 0.00 H new ATOM 0 HH11 ARG A 548 95.126 7.296 -18.784 1.00 0.00 H new ATOM 0 HH12 ARG A 548 96.412 6.962 -19.949 1.00 0.00 H new ATOM 0 HH21 ARG A 548 96.217 3.462 -19.569 1.00 0.00 H new ATOM 0 HH22 ARG A 548 97.027 4.799 -20.391 1.00 0.00 H new ATOM 1817 N GLU A 549 90.715 4.697 -12.752 1.00 0.00 N ATOM 1818 CA GLU A 549 90.789 3.743 -11.650 1.00 0.00 C ATOM 1819 C GLU A 549 90.286 2.368 -12.080 1.00 0.00 C ATOM 1820 O GLU A 549 89.880 2.174 -13.226 1.00 0.00 O ATOM 1821 CB GLU A 549 89.975 4.247 -10.458 1.00 0.00 C ATOM 1822 CG GLU A 549 88.597 4.767 -10.838 1.00 0.00 C ATOM 1823 CD GLU A 549 87.989 4.009 -12.001 1.00 0.00 C ATOM 1824 OE1 GLU A 549 88.046 4.522 -13.139 1.00 0.00 O ATOM 1825 OE2 GLU A 549 87.456 2.901 -11.776 1.00 0.00 O ATOM 0 H GLU A 549 89.773 5.027 -12.962 1.00 0.00 H new ATOM 0 HA GLU A 549 91.834 3.649 -11.355 1.00 0.00 H new ATOM 0 HB2 GLU A 549 89.863 3.437 -9.737 1.00 0.00 H new ATOM 0 HB3 GLU A 549 90.530 5.042 -9.960 1.00 0.00 H new ATOM 0 HG2 GLU A 549 87.935 4.694 -9.975 1.00 0.00 H new ATOM 0 HG3 GLU A 549 88.670 5.824 -11.096 1.00 0.00 H new ATOM 1832 N LYS A 550 90.318 1.417 -11.152 1.00 0.00 N ATOM 1833 CA LYS A 550 89.866 0.058 -11.432 1.00 0.00 C ATOM 1834 C LYS A 550 89.332 -0.606 -10.167 1.00 0.00 C ATOM 1835 O LYS A 550 89.687 -0.219 -9.054 1.00 0.00 O ATOM 1836 CB LYS A 550 91.009 -0.777 -12.016 1.00 0.00 C ATOM 1837 CG LYS A 550 92.363 -0.086 -11.957 1.00 0.00 C ATOM 1838 CD LYS A 550 93.430 -0.885 -12.690 1.00 0.00 C ATOM 1839 CE LYS A 550 94.336 -1.627 -11.722 1.00 0.00 C ATOM 1840 NZ LYS A 550 94.310 -3.098 -11.950 1.00 0.00 N ATOM 0 H LYS A 550 90.652 1.562 -10.199 1.00 0.00 H new ATOM 0 HA LYS A 550 89.059 0.114 -12.163 1.00 0.00 H new ATOM 0 HB2 LYS A 550 91.069 -1.722 -11.476 1.00 0.00 H new ATOM 0 HB3 LYS A 550 90.778 -1.017 -13.054 1.00 0.00 H new ATOM 0 HG2 LYS A 550 92.285 0.908 -12.397 1.00 0.00 H new ATOM 0 HG3 LYS A 550 92.659 0.049 -10.917 1.00 0.00 H new ATOM 0 HD2 LYS A 550 92.954 -1.598 -13.363 1.00 0.00 H new ATOM 0 HD3 LYS A 550 94.028 -0.214 -13.308 1.00 0.00 H new ATOM 0 HE2 LYS A 550 95.357 -1.262 -11.829 1.00 0.00 H new ATOM 0 HE3 LYS A 550 94.026 -1.413 -10.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 550 94.941 -3.566 -11.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 550 93.340 -3.452 -11.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 550 94.630 -3.305 -12.918 1.00 0.00 H new ATOM 1854 N LYS A 551 88.476 -1.606 -10.347 1.00 0.00 N ATOM 1855 CA LYS A 551 87.893 -2.325 -9.220 1.00 0.00 C ATOM 1856 C LYS A 551 87.570 -3.765 -9.604 1.00 0.00 C ATOM 1857 O LYS A 551 86.568 -4.326 -9.160 1.00 0.00 O ATOM 1858 CB LYS A 551 86.625 -1.619 -8.739 1.00 0.00 C ATOM 1859 CG LYS A 551 86.415 -1.704 -7.237 1.00 0.00 C ATOM 1860 CD LYS A 551 85.072 -1.120 -6.828 1.00 0.00 C ATOM 1861 CE LYS A 551 83.922 -1.995 -7.296 1.00 0.00 C ATOM 1862 NZ LYS A 551 82.938 -2.245 -6.207 1.00 0.00 N ATOM 0 H LYS A 551 88.171 -1.937 -11.262 1.00 0.00 H new ATOM 0 HA LYS A 551 88.624 -2.337 -8.411 1.00 0.00 H new ATOM 0 HB2 LYS A 551 86.669 -0.570 -9.033 1.00 0.00 H new ATOM 0 HB3 LYS A 551 85.763 -2.055 -9.243 1.00 0.00 H new ATOM 0 HG2 LYS A 551 86.472 -2.745 -6.919 1.00 0.00 H new ATOM 0 HG3 LYS A 551 87.216 -1.170 -6.726 1.00 0.00 H new ATOM 0 HD2 LYS A 551 85.034 -1.016 -5.744 1.00 0.00 H new ATOM 0 HD3 LYS A 551 84.965 -0.120 -7.248 1.00 0.00 H new ATOM 0 HE2 LYS A 551 83.420 -1.516 -8.137 1.00 0.00 H new ATOM 0 HE3 LYS A 551 84.313 -2.946 -7.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 551 82.168 -2.846 -6.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 551 83.411 -2.725 -5.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 551 82.546 -1.339 -5.879 1.00 0.00 H new ATOM 1876 N ARG A 552 88.422 -4.357 -10.435 1.00 0.00 N ATOM 1877 CA ARG A 552 88.223 -5.731 -10.881 1.00 0.00 C ATOM 1878 C ARG A 552 88.682 -6.726 -9.821 1.00 0.00 C ATOM 1879 O ARG A 552 89.397 -6.368 -8.884 1.00 0.00 O ATOM 1880 CB ARG A 552 88.977 -5.980 -12.189 1.00 0.00 C ATOM 1881 CG ARG A 552 88.092 -5.922 -13.424 1.00 0.00 C ATOM 1882 CD ARG A 552 88.500 -4.787 -14.347 1.00 0.00 C ATOM 1883 NE ARG A 552 87.353 -4.002 -14.795 1.00 0.00 N ATOM 1884 CZ ARG A 552 87.428 -3.054 -15.725 1.00 0.00 C ATOM 1885 NH1 ARG A 552 88.593 -2.774 -16.295 1.00 0.00 N ATOM 1886 NH2 ARG A 552 86.341 -2.385 -16.083 1.00 0.00 N ATOM 0 H ARG A 552 89.256 -3.907 -10.813 1.00 0.00 H new ATOM 0 HA ARG A 552 87.156 -5.877 -11.049 1.00 0.00 H new ATOM 0 HB2 ARG A 552 89.771 -5.240 -12.287 1.00 0.00 H new ATOM 0 HB3 ARG A 552 89.456 -6.958 -12.142 1.00 0.00 H new ATOM 0 HG2 ARG A 552 88.152 -6.869 -13.961 1.00 0.00 H new ATOM 0 HG3 ARG A 552 87.053 -5.792 -13.123 1.00 0.00 H new ATOM 0 HD2 ARG A 552 89.204 -4.136 -13.830 1.00 0.00 H new ATOM 0 HD3 ARG A 552 89.020 -5.195 -15.214 1.00 0.00 H new ATOM 0 HE ARG A 552 86.445 -4.191 -14.372 1.00 0.00 H new ATOM 0 HH11 ARG A 552 89.431 -3.286 -16.020 1.00 0.00 H new ATOM 0 HH12 ARG A 552 88.650 -2.047 -17.008 1.00 0.00 H new ATOM 0 HH21 ARG A 552 85.444 -2.597 -15.645 1.00 0.00 H new ATOM 0 HH22 ARG A 552 86.401 -1.658 -16.796 1.00 0.00 H new ATOM 1900 N GLY A 553 88.263 -7.976 -9.976 1.00 0.00 N ATOM 1901 CA GLY A 553 88.636 -9.010 -9.030 1.00 0.00 C ATOM 1902 C GLY A 553 87.764 -10.243 -9.153 1.00 0.00 C ATOM 1903 O GLY A 553 86.562 -10.139 -9.397 1.00 0.00 O ATOM 0 H GLY A 553 87.670 -8.293 -10.743 1.00 0.00 H new ATOM 0 HA2 GLY A 553 89.678 -9.287 -9.190 1.00 0.00 H new ATOM 0 HA3 GLY A 553 88.563 -8.616 -8.016 1.00 0.00 H new ATOM 1907 N THR A 554 88.369 -11.414 -8.989 1.00 0.00 N ATOM 1908 CA THR A 554 87.636 -12.670 -9.091 1.00 0.00 C ATOM 1909 C THR A 554 88.073 -13.654 -8.012 1.00 0.00 C ATOM 1910 O THR A 554 89.266 -13.812 -7.748 1.00 0.00 O ATOM 1911 CB THR A 554 87.834 -13.320 -10.473 1.00 0.00 C ATOM 1912 OG1 THR A 554 88.306 -12.368 -11.435 1.00 0.00 O ATOM 1913 CG2 THR A 554 86.531 -13.915 -10.986 1.00 0.00 C ATOM 0 H THR A 554 89.363 -11.520 -8.785 1.00 0.00 H new ATOM 0 HA THR A 554 86.581 -12.433 -8.954 1.00 0.00 H new ATOM 0 HB THR A 554 88.577 -14.108 -10.347 1.00 0.00 H new ATOM 0 HG1 THR A 554 88.424 -12.810 -12.302 1.00 0.00 H new ATOM 0 HG21 THR A 554 86.698 -14.368 -11.963 1.00 0.00 H new ATOM 0 HG22 THR A 554 86.179 -14.676 -10.289 1.00 0.00 H new ATOM 0 HG23 THR A 554 85.781 -13.128 -11.074 1.00 0.00 H new ATOM 1921 N GLU A 555 87.101 -14.314 -7.394 1.00 0.00 N ATOM 1922 CA GLU A 555 87.384 -15.288 -6.346 1.00 0.00 C ATOM 1923 C GLU A 555 86.496 -16.517 -6.501 1.00 0.00 C ATOM 1924 O GLU A 555 85.339 -16.412 -6.907 1.00 0.00 O ATOM 1925 CB GLU A 555 87.183 -14.659 -4.966 1.00 0.00 C ATOM 1926 CG GLU A 555 88.425 -13.965 -4.433 1.00 0.00 C ATOM 1927 CD GLU A 555 88.137 -12.572 -3.908 1.00 0.00 C ATOM 1928 OE1 GLU A 555 86.965 -12.293 -3.575 1.00 0.00 O ATOM 1929 OE2 GLU A 555 89.082 -11.758 -3.831 1.00 0.00 O ATOM 0 H GLU A 555 86.109 -14.193 -7.600 1.00 0.00 H new ATOM 0 HA GLU A 555 88.424 -15.600 -6.440 1.00 0.00 H new ATOM 0 HB2 GLU A 555 86.367 -13.938 -5.019 1.00 0.00 H new ATOM 0 HB3 GLU A 555 86.879 -15.434 -4.262 1.00 0.00 H new ATOM 0 HG2 GLU A 555 88.858 -14.567 -3.635 1.00 0.00 H new ATOM 0 HG3 GLU A 555 89.170 -13.903 -5.226 1.00 0.00 H new ATOM 1936 N LYS A 556 87.046 -17.683 -6.183 1.00 0.00 N ATOM 1937 CA LYS A 556 86.304 -18.933 -6.296 1.00 0.00 C ATOM 1938 C LYS A 556 85.783 -19.392 -4.937 1.00 0.00 C ATOM 1939 O LYS A 556 86.485 -19.310 -3.929 1.00 0.00 O ATOM 1940 CB LYS A 556 87.193 -20.016 -6.910 1.00 0.00 C ATOM 1941 CG LYS A 556 87.886 -19.578 -8.189 1.00 0.00 C ATOM 1942 CD LYS A 556 88.093 -20.744 -9.141 1.00 0.00 C ATOM 1943 CE LYS A 556 87.523 -20.448 -10.520 1.00 0.00 C ATOM 1944 NZ LYS A 556 86.088 -20.834 -10.623 1.00 0.00 N ATOM 0 H LYS A 556 88.003 -17.789 -5.845 1.00 0.00 H new ATOM 0 HA LYS A 556 85.446 -18.759 -6.945 1.00 0.00 H new ATOM 0 HB2 LYS A 556 87.947 -20.313 -6.181 1.00 0.00 H new ATOM 0 HB3 LYS A 556 86.587 -20.898 -7.118 1.00 0.00 H new ATOM 0 HG2 LYS A 556 87.291 -18.808 -8.680 1.00 0.00 H new ATOM 0 HG3 LYS A 556 88.850 -19.130 -7.946 1.00 0.00 H new ATOM 0 HD2 LYS A 556 89.158 -20.961 -9.226 1.00 0.00 H new ATOM 0 HD3 LYS A 556 87.617 -21.636 -8.734 1.00 0.00 H new ATOM 0 HE2 LYS A 556 87.629 -19.385 -10.736 1.00 0.00 H new ATOM 0 HE3 LYS A 556 88.098 -20.986 -11.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 556 85.738 -20.616 -11.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 556 85.989 -21.853 -10.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 556 85.534 -20.302 -9.921 1.00 0.00 H new ATOM 1958 N LEU A 557 84.544 -19.879 -4.921 1.00 0.00 N ATOM 1959 CA LEU A 557 83.923 -20.357 -3.692 1.00 0.00 C ATOM 1960 C LEU A 557 82.805 -21.348 -4.002 1.00 0.00 C ATOM 1961 O LEU A 557 81.746 -21.323 -3.374 1.00 0.00 O ATOM 1962 CB LEU A 557 83.371 -19.183 -2.879 1.00 0.00 C ATOM 1963 CG LEU A 557 84.001 -19.000 -1.498 1.00 0.00 C ATOM 1964 CD1 LEU A 557 84.379 -17.545 -1.272 1.00 0.00 C ATOM 1965 CD2 LEU A 557 83.050 -19.478 -0.410 1.00 0.00 C ATOM 0 H LEU A 557 83.951 -19.952 -5.748 1.00 0.00 H new ATOM 0 HA LEU A 557 84.686 -20.866 -3.103 1.00 0.00 H new ATOM 0 HB2 LEU A 557 83.513 -18.266 -3.451 1.00 0.00 H new ATOM 0 HB3 LEU A 557 82.296 -19.319 -2.756 1.00 0.00 H new ATOM 0 HG LEU A 557 84.908 -19.602 -1.452 1.00 0.00 H new ATOM 0 HD11 LEU A 557 84.826 -17.434 -0.284 1.00 0.00 H new ATOM 0 HD12 LEU A 557 85.096 -17.233 -2.031 1.00 0.00 H new ATOM 0 HD13 LEU A 557 83.487 -16.923 -1.338 1.00 0.00 H new ATOM 0 HD21 LEU A 557 83.515 -19.340 0.566 1.00 0.00 H new ATOM 0 HD22 LEU A 557 82.126 -18.902 -0.456 1.00 0.00 H new ATOM 0 HD23 LEU A 557 82.827 -20.534 -0.560 1.00 0.00 H new ATOM 1977 N ILE A 558 83.047 -22.218 -4.977 1.00 0.00 N ATOM 1978 CA ILE A 558 82.061 -23.217 -5.373 1.00 0.00 C ATOM 1979 C ILE A 558 81.980 -24.349 -4.355 1.00 0.00 C ATOM 1980 O ILE A 558 82.876 -25.190 -4.274 1.00 0.00 O ATOM 1981 CB ILE A 558 82.389 -23.812 -6.756 1.00 0.00 C ATOM 1982 CG1 ILE A 558 82.440 -22.707 -7.815 1.00 0.00 C ATOM 1983 CG2 ILE A 558 81.366 -24.875 -7.131 1.00 0.00 C ATOM 1984 CD1 ILE A 558 81.101 -22.418 -8.461 1.00 0.00 C ATOM 0 H ILE A 558 83.918 -22.251 -5.508 1.00 0.00 H new ATOM 0 HA ILE A 558 81.099 -22.706 -5.421 1.00 0.00 H new ATOM 0 HB ILE A 558 83.370 -24.284 -6.710 1.00 0.00 H new ATOM 0 HG12 ILE A 558 82.816 -21.793 -7.355 1.00 0.00 H new ATOM 0 HG13 ILE A 558 83.153 -22.991 -8.589 1.00 0.00 H new ATOM 0 HG21 ILE A 558 81.611 -25.286 -8.110 1.00 0.00 H new ATOM 0 HG22 ILE A 558 81.381 -25.673 -6.388 1.00 0.00 H new ATOM 0 HG23 ILE A 558 80.372 -24.428 -7.163 1.00 0.00 H new ATOM 0 HD11 ILE A 558 81.217 -21.625 -9.200 1.00 0.00 H new ATOM 0 HD12 ILE A 558 80.731 -23.319 -8.951 1.00 0.00 H new ATOM 0 HD13 ILE A 558 80.390 -22.102 -7.698 1.00 0.00 H new ATOM 1996 N THR A 559 80.899 -24.367 -3.581 1.00 0.00 N ATOM 1997 CA THR A 559 80.699 -25.400 -2.571 1.00 0.00 C ATOM 1998 C THR A 559 79.218 -25.589 -2.264 1.00 0.00 C ATOM 1999 O THR A 559 78.384 -24.771 -2.649 1.00 0.00 O ATOM 2000 CB THR A 559 81.445 -25.065 -1.265 1.00 0.00 C ATOM 2001 OG1 THR A 559 81.944 -23.721 -1.277 1.00 0.00 O ATOM 2002 CG2 THR A 559 82.616 -26.013 -1.055 1.00 0.00 C ATOM 0 H THR A 559 80.149 -23.678 -3.634 1.00 0.00 H new ATOM 0 HA THR A 559 81.103 -26.325 -2.982 1.00 0.00 H new ATOM 0 HB THR A 559 80.727 -25.175 -0.452 1.00 0.00 H new ATOM 0 HG1 THR A 559 82.411 -23.538 -0.435 1.00 0.00 H new ATOM 0 HG21 THR A 559 83.128 -25.758 -0.127 1.00 0.00 H new ATOM 0 HG22 THR A 559 82.249 -27.038 -0.997 1.00 0.00 H new ATOM 0 HG23 THR A 559 83.311 -25.923 -1.890 1.00 0.00 H new ATOM 2010 N LYS A 560 78.897 -26.679 -1.573 1.00 0.00 N ATOM 2011 CA LYS A 560 77.515 -26.980 -1.217 1.00 0.00 C ATOM 2012 C LYS A 560 77.308 -26.904 0.292 1.00 0.00 C ATOM 2013 O LYS A 560 77.958 -27.620 1.054 1.00 0.00 O ATOM 2014 CB LYS A 560 77.131 -28.370 -1.728 1.00 0.00 C ATOM 2015 CG LYS A 560 75.633 -28.566 -1.895 1.00 0.00 C ATOM 2016 CD LYS A 560 75.279 -28.977 -3.315 1.00 0.00 C ATOM 2017 CE LYS A 560 73.960 -28.369 -3.757 1.00 0.00 C ATOM 2018 NZ LYS A 560 72.801 -28.984 -3.053 1.00 0.00 N ATOM 0 H LYS A 560 79.575 -27.368 -1.249 1.00 0.00 H new ATOM 0 HA LYS A 560 76.874 -26.234 -1.687 1.00 0.00 H new ATOM 0 HB2 LYS A 560 77.620 -28.543 -2.686 1.00 0.00 H new ATOM 0 HB3 LYS A 560 77.512 -29.120 -1.035 1.00 0.00 H new ATOM 0 HG2 LYS A 560 75.285 -29.328 -1.197 1.00 0.00 H new ATOM 0 HG3 LYS A 560 75.114 -27.641 -1.643 1.00 0.00 H new ATOM 0 HD2 LYS A 560 76.072 -28.663 -3.994 1.00 0.00 H new ATOM 0 HD3 LYS A 560 75.219 -30.064 -3.376 1.00 0.00 H new ATOM 0 HE2 LYS A 560 73.973 -27.296 -3.566 1.00 0.00 H new ATOM 0 HE3 LYS A 560 73.842 -28.500 -4.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 560 71.920 -28.541 -3.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 560 72.773 -30.004 -3.255 1.00 0.00 H new ATOM 0 HZ3 LYS A 560 72.900 -28.837 -2.028 1.00 0.00 H new ATOM 2032 N ALA A 561 76.397 -26.034 0.718 1.00 0.00 N ATOM 2033 CA ALA A 561 76.104 -25.869 2.137 1.00 0.00 C ATOM 2034 C ALA A 561 75.499 -27.141 2.720 1.00 0.00 C ATOM 2035 O ALA A 561 74.286 -27.136 3.017 1.00 0.00 O ATOM 2036 CB ALA A 561 75.169 -24.690 2.365 1.00 0.00 C ATOM 2037 OXT ALA A 561 76.242 -28.134 2.871 1.00 0.00 O ATOM 0 H ALA A 561 75.850 -25.433 0.101 1.00 0.00 H new ATOM 0 HA ALA A 561 77.045 -25.668 2.649 1.00 0.00 H new ATOM 0 HB1 ALA A 561 74.966 -24.588 3.431 1.00 0.00 H new ATOM 0 HB2 ALA A 561 75.637 -23.778 1.996 1.00 0.00 H new ATOM 0 HB3 ALA A 561 74.234 -24.859 1.832 1.00 0.00 H new TER 2043 ALA A 561