USER MOD reduce.3.24.130724 H: found=0, std=0, add=1026, rem=0, adj=22 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 532 TYR OH : rot 65:sc= -1.26! USER MOD Set 1.2: A 535 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 518 CYS SG : rot 180:sc= 0.385 USER MOD Set 2.2: A 520 LYS NZ :NH3+ 156:sc= 0.421 (180deg=0) USER MOD Single : A 437 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 438 HIS : no HD1:sc= -1.87! K(o=-1.9!,f=-0.75) USER MOD Single : A 439 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 440 HIS : no HD1:sc= -0.48 X(o=-0.48,f=0) USER MOD Single : A 441 HIS : no HD1:sc= -0.0252 X(o=-0.025,f=-0.0072) USER MOD Single : A 442 HIS : no HE2:sc= -0.734 K(o=-0.73,f=-2.1!) USER MOD Single : A 443 HIS : no HD1:sc= -0.248 X(o=-0.25,f=-0.15) USER MOD Single : A 444 SER OG : rot -57:sc= 1.22 USER MOD Single : A 445 ASN : amide:sc= 0 K(o=0,f=0.76) USER MOD Single : A 447 THR OG1 : rot 180:sc= 0 USER MOD Single : A 450 GLN : amide:sc= -0.379 X(o=-0.38,f=-0.12) USER MOD Single : A 453 SER OG : rot -145:sc= 0.0365 USER MOD Single : A 458 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 461 SER OG : rot -61:sc= -1.32! 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= -1.64! C(o=-1.6!,f=-5.1!) USER MOD Single : A 474 THR OG1 : rot -75:sc= 0.509 USER MOD Single : A 479 SER OG : rot 180:sc= -0.075 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 -60:sc= -3.49! USER MOD Single : A 494 HIS : no HD1:sc= -6.79 K(o=-6.8,f=-9.1!) USER MOD Single : A 498 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 499 THR OG1 : rot 171:sc= -0.0572 USER MOD Single : A 504 GLN : amide:sc= -0.168 K(o=-0.17,f=-0.92) USER MOD Single : A 508 ASN : amide:sc= -3.38! K(o=-3.4!,f=-4.3) USER MOD Single : A 510 TYR OH : rot 130:sc= -0.155 USER MOD Single : A 511 THR OG1 : rot -88:sc= 0.00415 USER MOD Single : A 514 ASN : amide:sc= -1.91! K(o=-1.9!,f=-0.75) 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 HE2:sc= -7.87! C(o=-7.9!,f=-9.5!) USER MOD Single : A 525 SER OG : rot 180:sc= -0.131 USER MOD Single : A 528 HIS : no HD1:sc= -1.58 K(o=-1.6,f=-2.2!) USER MOD Single : A 530 GLN : amide:sc= -1.26! C(o=-1.3!,f=-2.5!) USER MOD Single : A 534 GLN : amide:sc= -0.474 X(o=-0.47,f=-0.47) USER MOD Single : A 541 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 543 LYS NZ :NH3+ -164:sc= -0.0194 (180deg=-0.455) USER MOD Single : A 545 ASN : amide:sc= -0.798 K(o=-0.8,f=-0.14) USER MOD Single : A 546 GLN : amide:sc= -0.0872 X(o=-0.087,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 63:sc= 0.0541! USER MOD Single : A 556 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 559 THR OG1 : rot 44:sc= 0.111 USER MOD Single : A 560 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 437 114.096 -0.083 -38.590 1.00 0.00 N ATOM 2 CA MET A 437 113.604 -1.347 -37.980 1.00 0.00 C ATOM 3 C MET A 437 112.083 -1.435 -38.047 1.00 0.00 C ATOM 4 O MET A 437 111.418 -0.516 -38.528 1.00 0.00 O ATOM 5 CB MET A 437 114.071 -1.402 -36.524 1.00 0.00 C ATOM 6 CG MET A 437 114.826 -2.673 -36.174 1.00 0.00 C ATOM 7 SD MET A 437 116.468 -2.344 -35.507 1.00 0.00 S ATOM 8 CE MET A 437 116.078 -2.041 -33.785 1.00 0.00 C ATOM 0 HA MET A 437 114.008 -2.193 -38.536 1.00 0.00 H new ATOM 0 HB2 MET A 437 114.711 -0.543 -36.324 1.00 0.00 H new ATOM 0 HB3 MET A 437 113.204 -1.313 -35.870 1.00 0.00 H new ATOM 0 HG2 MET A 437 114.250 -3.244 -35.446 1.00 0.00 H new ATOM 0 HG3 MET A 437 114.918 -3.294 -37.065 1.00 0.00 H new ATOM 0 HE1 MET A 437 116.995 -1.822 -33.237 1.00 0.00 H new ATOM 0 HE2 MET A 437 115.399 -1.192 -33.710 1.00 0.00 H new ATOM 0 HE3 MET A 437 115.603 -2.925 -33.359 1.00 0.00 H new ATOM 20 N HIS A 438 111.537 -2.545 -37.560 1.00 0.00 N ATOM 21 CA HIS A 438 110.094 -2.753 -37.563 1.00 0.00 C ATOM 22 C HIS A 438 109.544 -2.776 -36.140 1.00 0.00 C ATOM 23 O HIS A 438 108.849 -1.851 -35.719 1.00 0.00 O ATOM 24 CB HIS A 438 109.747 -4.060 -38.277 1.00 0.00 C ATOM 25 CG HIS A 438 108.274 -4.297 -38.404 1.00 0.00 C ATOM 26 ND1 HIS A 438 107.706 -4.948 -39.478 1.00 0.00 N ATOM 27 CD2 HIS A 438 107.251 -3.967 -37.581 1.00 0.00 C ATOM 28 CE1 HIS A 438 106.397 -5.006 -39.312 1.00 0.00 C ATOM 29 NE2 HIS A 438 106.095 -4.418 -38.169 1.00 0.00 N ATOM 0 H HIS A 438 112.073 -3.314 -37.158 1.00 0.00 H new ATOM 0 HA HIS A 438 109.634 -1.922 -38.098 1.00 0.00 H new ATOM 0 HB2 HIS A 438 110.193 -4.051 -39.272 1.00 0.00 H new ATOM 0 HB3 HIS A 438 110.196 -4.892 -37.734 1.00 0.00 H new ATOM 0 HD2 HIS A 438 107.329 -3.446 -36.638 1.00 0.00 H new ATOM 0 HE1 HIS A 438 105.693 -5.458 -39.995 1.00 0.00 H new ATOM 0 HE2 HIS A 438 105.156 -4.315 -37.785 1.00 0.00 H new ATOM 38 N HIS A 439 109.863 -3.836 -35.404 1.00 0.00 N ATOM 39 CA HIS A 439 109.401 -3.975 -34.027 1.00 0.00 C ATOM 40 C HIS A 439 110.073 -2.946 -33.123 1.00 0.00 C ATOM 41 O HIS A 439 111.244 -2.615 -33.307 1.00 0.00 O ATOM 42 CB HIS A 439 109.687 -5.387 -33.511 1.00 0.00 C ATOM 43 CG HIS A 439 108.950 -6.459 -34.254 1.00 0.00 C ATOM 44 ND1 HIS A 439 107.745 -6.977 -33.829 1.00 0.00 N ATOM 45 CD2 HIS A 439 109.255 -7.112 -35.400 1.00 0.00 C ATOM 46 CE1 HIS A 439 107.341 -7.904 -34.681 1.00 0.00 C ATOM 47 NE2 HIS A 439 108.240 -8.004 -35.643 1.00 0.00 N ATOM 0 H HIS A 439 110.438 -4.610 -35.737 1.00 0.00 H new ATOM 0 HA HIS A 439 108.325 -3.801 -34.011 1.00 0.00 H new ATOM 0 HB2 HIS A 439 110.758 -5.580 -33.580 1.00 0.00 H new ATOM 0 HB3 HIS A 439 109.421 -5.440 -32.455 1.00 0.00 H new ATOM 0 HD2 HIS A 439 110.133 -6.960 -36.010 1.00 0.00 H new ATOM 0 HE1 HIS A 439 106.431 -8.481 -34.603 1.00 0.00 H new ATOM 0 HE2 HIS A 439 108.189 -8.641 -36.438 1.00 0.00 H new ATOM 56 N HIS A 440 109.325 -2.445 -32.146 1.00 0.00 N ATOM 57 CA HIS A 440 109.850 -1.453 -31.215 1.00 0.00 C ATOM 58 C HIS A 440 109.946 -2.026 -29.805 1.00 0.00 C ATOM 59 O HIS A 440 110.105 -1.285 -28.834 1.00 0.00 O ATOM 60 CB HIS A 440 108.964 -0.207 -31.212 1.00 0.00 C ATOM 61 CG HIS A 440 107.683 -0.385 -30.460 1.00 0.00 C ATOM 62 ND1 HIS A 440 107.171 0.571 -29.608 1.00 0.00 N ATOM 63 CD2 HIS A 440 106.808 -1.419 -30.431 1.00 0.00 C ATOM 64 CE1 HIS A 440 106.037 0.134 -29.088 1.00 0.00 C ATOM 65 NE2 HIS A 440 105.796 -1.070 -29.572 1.00 0.00 N ATOM 0 H HIS A 440 108.354 -2.709 -31.978 1.00 0.00 H new ATOM 0 HA HIS A 440 110.852 -1.178 -31.544 1.00 0.00 H new ATOM 0 HB2 HIS A 440 109.520 0.623 -30.775 1.00 0.00 H new ATOM 0 HB3 HIS A 440 108.736 0.069 -32.242 1.00 0.00 H new ATOM 0 HD2 HIS A 440 106.891 -2.345 -30.981 1.00 0.00 H new ATOM 0 HE1 HIS A 440 105.414 0.670 -28.387 1.00 0.00 H new ATOM 0 HE2 HIS A 440 104.987 -1.648 -29.344 1.00 0.00 H new ATOM 74 N HIS A 441 109.847 -3.346 -29.697 1.00 0.00 N ATOM 75 CA HIS A 441 109.921 -4.014 -28.403 1.00 0.00 C ATOM 76 C HIS A 441 111.355 -4.040 -27.885 1.00 0.00 C ATOM 77 O HIS A 441 112.307 -3.939 -28.659 1.00 0.00 O ATOM 78 CB HIS A 441 109.376 -5.439 -28.506 1.00 0.00 C ATOM 79 CG HIS A 441 108.233 -5.710 -27.577 1.00 0.00 C ATOM 80 ND1 HIS A 441 107.035 -6.250 -27.993 1.00 0.00 N ATOM 81 CD2 HIS A 441 108.111 -5.510 -26.243 1.00 0.00 C ATOM 82 CE1 HIS A 441 106.223 -6.369 -26.956 1.00 0.00 C ATOM 83 NE2 HIS A 441 106.852 -5.927 -25.883 1.00 0.00 N ATOM 0 H HIS A 441 109.715 -3.975 -30.489 1.00 0.00 H new ATOM 0 HA HIS A 441 109.310 -3.451 -27.698 1.00 0.00 H new ATOM 0 HB2 HIS A 441 109.053 -5.623 -29.531 1.00 0.00 H new ATOM 0 HB3 HIS A 441 110.181 -6.143 -28.295 1.00 0.00 H new ATOM 0 HD2 HIS A 441 108.863 -5.099 -25.585 1.00 0.00 H new ATOM 0 HE1 HIS A 441 105.217 -6.761 -26.983 1.00 0.00 H new ATOM 0 HE2 HIS A 441 106.466 -5.899 -24.939 1.00 0.00 H new ATOM 92 N HIS A 442 111.502 -4.176 -26.570 1.00 0.00 N ATOM 93 CA HIS A 442 112.820 -4.215 -25.947 1.00 0.00 C ATOM 94 C HIS A 442 112.864 -5.256 -24.832 1.00 0.00 C ATOM 95 O HIS A 442 113.450 -5.022 -23.775 1.00 0.00 O ATOM 96 CB HIS A 442 113.184 -2.839 -25.389 1.00 0.00 C ATOM 97 CG HIS A 442 111.999 -2.048 -24.933 1.00 0.00 C ATOM 98 ND1 HIS A 442 111.048 -1.549 -25.798 1.00 0.00 N ATOM 99 CD2 HIS A 442 111.608 -1.670 -23.691 1.00 0.00 C ATOM 100 CE1 HIS A 442 110.126 -0.898 -25.112 1.00 0.00 C ATOM 101 NE2 HIS A 442 110.443 -0.958 -23.831 1.00 0.00 N ATOM 0 H HIS A 442 110.724 -4.261 -25.916 1.00 0.00 H new ATOM 0 HA HIS A 442 113.547 -4.494 -26.710 1.00 0.00 H new ATOM 0 HB2 HIS A 442 113.871 -2.965 -24.552 1.00 0.00 H new ATOM 0 HB3 HIS A 442 113.715 -2.274 -26.155 1.00 0.00 H new ATOM 0 HD1 HIS A 442 111.055 -1.665 -26.811 1.00 0.00 H new ATOM 0 HD2 HIS A 442 112.118 -1.888 -22.764 1.00 0.00 H new ATOM 0 HE1 HIS A 442 109.261 -0.402 -25.527 1.00 0.00 H new ATOM 110 N HIS A 443 112.240 -6.405 -25.075 1.00 0.00 N ATOM 111 CA HIS A 443 112.208 -7.480 -24.090 1.00 0.00 C ATOM 112 C HIS A 443 111.163 -7.201 -23.016 1.00 0.00 C ATOM 113 O HIS A 443 110.302 -8.036 -22.739 1.00 0.00 O ATOM 114 CB HIS A 443 113.584 -7.652 -23.446 1.00 0.00 C ATOM 115 CG HIS A 443 113.965 -9.082 -23.219 1.00 0.00 C ATOM 116 ND1 HIS A 443 115.168 -9.461 -22.663 1.00 0.00 N ATOM 117 CD2 HIS A 443 113.293 -10.230 -23.477 1.00 0.00 C ATOM 118 CE1 HIS A 443 115.222 -10.780 -22.590 1.00 0.00 C ATOM 119 NE2 HIS A 443 114.096 -11.269 -23.077 1.00 0.00 N ATOM 0 H HIS A 443 111.750 -6.615 -25.945 1.00 0.00 H new ATOM 0 HA HIS A 443 111.938 -8.402 -24.604 1.00 0.00 H new ATOM 0 HB2 HIS A 443 114.334 -7.181 -24.081 1.00 0.00 H new ATOM 0 HB3 HIS A 443 113.598 -7.125 -22.492 1.00 0.00 H new ATOM 0 HD2 HIS A 443 112.309 -10.312 -23.915 1.00 0.00 H new ATOM 0 HE1 HIS A 443 116.046 -11.359 -22.199 1.00 0.00 H new ATOM 0 HE2 HIS A 443 113.861 -12.259 -23.145 1.00 0.00 H new ATOM 128 N SER A 444 111.245 -6.019 -22.412 1.00 0.00 N ATOM 129 CA SER A 444 110.307 -5.628 -21.368 1.00 0.00 C ATOM 130 C SER A 444 110.472 -6.505 -20.130 1.00 0.00 C ATOM 131 O SER A 444 109.549 -6.641 -19.327 1.00 0.00 O ATOM 132 CB SER A 444 108.871 -5.718 -21.885 1.00 0.00 C ATOM 133 OG SER A 444 107.938 -5.460 -20.851 1.00 0.00 O ATOM 0 H SER A 444 111.952 -5.316 -22.629 1.00 0.00 H new ATOM 0 HA SER A 444 110.521 -4.596 -21.089 1.00 0.00 H new ATOM 0 HB2 SER A 444 108.728 -5.003 -22.695 1.00 0.00 H new ATOM 0 HB3 SER A 444 108.693 -6.710 -22.300 1.00 0.00 H new ATOM 0 HG SER A 444 108.088 -6.085 -20.111 1.00 0.00 H new ATOM 139 N ASN A 445 111.652 -7.096 -19.984 1.00 0.00 N ATOM 140 CA ASN A 445 111.938 -7.959 -18.844 1.00 0.00 C ATOM 141 C ASN A 445 113.315 -7.654 -18.262 1.00 0.00 C ATOM 142 O ASN A 445 114.275 -8.388 -18.497 1.00 0.00 O ATOM 143 CB ASN A 445 111.858 -9.430 -19.258 1.00 0.00 C ATOM 144 CG ASN A 445 110.429 -9.914 -19.398 1.00 0.00 C ATOM 145 OD1 ASN A 445 109.773 -9.664 -20.409 1.00 0.00 O ATOM 146 ND2 ASN A 445 109.937 -10.611 -18.380 1.00 0.00 N ATOM 0 H ASN A 445 112.426 -6.994 -20.640 1.00 0.00 H new ATOM 0 HA ASN A 445 111.189 -7.765 -18.076 1.00 0.00 H new ATOM 0 HB2 ASN A 445 112.379 -9.567 -20.205 1.00 0.00 H new ATOM 0 HB3 ASN A 445 112.375 -10.041 -18.518 1.00 0.00 H new ATOM 0 HD21 ASN A 445 108.980 -10.962 -18.417 1.00 0.00 H new ATOM 0 HD22 ASN A 445 110.516 -10.795 -17.561 1.00 0.00 H new ATOM 153 N ALA A 446 113.402 -6.567 -17.502 1.00 0.00 N ATOM 154 CA ALA A 446 114.660 -6.165 -16.886 1.00 0.00 C ATOM 155 C ALA A 446 114.948 -7.003 -15.644 1.00 0.00 C ATOM 156 O ALA A 446 114.030 -7.509 -14.999 1.00 0.00 O ATOM 157 CB ALA A 446 114.644 -4.686 -16.531 1.00 0.00 C ATOM 0 H ALA A 446 112.616 -5.949 -17.298 1.00 0.00 H new ATOM 0 HA ALA A 446 115.455 -6.336 -17.611 1.00 0.00 H new ATOM 0 HB1 ALA A 446 115.594 -4.411 -16.073 1.00 0.00 H new ATOM 0 HB2 ALA A 446 114.493 -4.096 -17.435 1.00 0.00 H new ATOM 0 HB3 ALA A 446 113.833 -4.489 -15.830 1.00 0.00 H new ATOM 163 N THR A 447 116.227 -7.146 -15.316 1.00 0.00 N ATOM 164 CA THR A 447 116.636 -7.923 -14.153 1.00 0.00 C ATOM 165 C THR A 447 117.974 -7.437 -13.608 1.00 0.00 C ATOM 166 O THR A 447 118.849 -7.019 -14.366 1.00 0.00 O ATOM 167 CB THR A 447 116.745 -9.422 -14.489 1.00 0.00 C ATOM 168 OG1 THR A 447 118.079 -9.773 -14.878 1.00 0.00 O ATOM 169 CG2 THR A 447 115.802 -9.793 -15.622 1.00 0.00 C ATOM 0 H THR A 447 116.999 -6.733 -15.840 1.00 0.00 H new ATOM 0 HA THR A 447 115.866 -7.783 -13.394 1.00 0.00 H new ATOM 0 HB THR A 447 116.474 -9.970 -13.586 1.00 0.00 H new ATOM 0 HG1 THR A 447 118.119 -10.730 -15.084 1.00 0.00 H new ATOM 0 HG21 THR A 447 115.897 -10.856 -15.841 1.00 0.00 H new ATOM 0 HG22 THR A 447 114.776 -9.574 -15.328 1.00 0.00 H new ATOM 0 HG23 THR A 447 116.056 -9.215 -16.511 1.00 0.00 H new ATOM 177 N GLY A 448 118.127 -7.494 -12.290 1.00 0.00 N ATOM 178 CA GLY A 448 119.361 -7.057 -11.666 1.00 0.00 C ATOM 179 C GLY A 448 119.140 -5.953 -10.651 1.00 0.00 C ATOM 180 O GLY A 448 119.668 -6.010 -9.541 1.00 0.00 O ATOM 0 H GLY A 448 117.417 -7.836 -11.642 1.00 0.00 H new ATOM 0 HA2 GLY A 448 119.837 -7.906 -11.176 1.00 0.00 H new ATOM 0 HA3 GLY A 448 120.049 -6.706 -12.435 1.00 0.00 H new ATOM 184 N PRO A 449 118.356 -4.925 -11.010 1.00 0.00 N ATOM 185 CA PRO A 449 118.068 -3.798 -10.117 1.00 0.00 C ATOM 186 C PRO A 449 117.508 -4.249 -8.773 1.00 0.00 C ATOM 187 O PRO A 449 117.313 -5.442 -8.539 1.00 0.00 O ATOM 188 CB PRO A 449 117.019 -2.990 -10.886 1.00 0.00 C ATOM 189 CG PRO A 449 117.229 -3.352 -12.315 1.00 0.00 C ATOM 190 CD PRO A 449 117.691 -4.783 -12.317 1.00 0.00 C ATOM 0 HA PRO A 449 118.969 -3.233 -9.876 1.00 0.00 H new ATOM 0 HB2 PRO A 449 116.010 -3.240 -10.559 1.00 0.00 H new ATOM 0 HB3 PRO A 449 117.149 -1.920 -10.726 1.00 0.00 H new ATOM 0 HG2 PRO A 449 116.307 -3.239 -12.886 1.00 0.00 H new ATOM 0 HG3 PRO A 449 117.972 -2.702 -12.777 1.00 0.00 H new ATOM 0 HD2 PRO A 449 116.856 -5.475 -12.421 1.00 0.00 H new ATOM 0 HD3 PRO A 449 118.376 -4.984 -13.141 1.00 0.00 H new ATOM 198 N GLN A 450 117.249 -3.287 -7.895 1.00 0.00 N ATOM 199 CA GLN A 450 116.710 -3.583 -6.573 1.00 0.00 C ATOM 200 C GLN A 450 115.809 -2.452 -6.087 1.00 0.00 C ATOM 201 O GLN A 450 116.110 -1.788 -5.095 1.00 0.00 O ATOM 202 CB GLN A 450 117.845 -3.812 -5.575 1.00 0.00 C ATOM 203 CG GLN A 450 117.365 -4.197 -4.185 1.00 0.00 C ATOM 204 CD GLN A 450 117.929 -5.525 -3.720 1.00 0.00 C ATOM 205 OE1 GLN A 450 118.348 -5.666 -2.571 1.00 0.00 O ATOM 206 NE2 GLN A 450 117.945 -6.508 -4.613 1.00 0.00 N ATOM 0 H GLN A 450 117.404 -2.295 -8.075 1.00 0.00 H new ATOM 0 HA GLN A 450 116.113 -4.492 -6.647 1.00 0.00 H new ATOM 0 HB2 GLN A 450 118.499 -4.597 -5.955 1.00 0.00 H new ATOM 0 HB3 GLN A 450 118.444 -2.904 -5.505 1.00 0.00 H new ATOM 0 HG2 GLN A 450 117.650 -3.418 -3.478 1.00 0.00 H new ATOM 0 HG3 GLN A 450 116.276 -4.248 -4.182 1.00 0.00 H new ATOM 0 HE21 GLN A 450 117.587 -6.347 -5.555 1.00 0.00 H new ATOM 0 HE22 GLN A 450 118.315 -7.424 -4.357 1.00 0.00 H new ATOM 215 N PHE A 451 114.705 -2.238 -6.794 1.00 0.00 N ATOM 216 CA PHE A 451 113.759 -1.186 -6.438 1.00 0.00 C ATOM 217 C PHE A 451 113.270 -1.353 -5.002 1.00 0.00 C ATOM 218 O PHE A 451 112.648 -2.359 -4.661 1.00 0.00 O ATOM 219 CB PHE A 451 112.569 -1.195 -7.399 1.00 0.00 C ATOM 220 CG PHE A 451 111.740 -2.446 -7.320 1.00 0.00 C ATOM 221 CD1 PHE A 451 112.006 -3.523 -8.151 1.00 0.00 C ATOM 222 CD2 PHE A 451 110.691 -2.543 -6.418 1.00 0.00 C ATOM 223 CE1 PHE A 451 111.243 -4.673 -8.084 1.00 0.00 C ATOM 224 CE2 PHE A 451 109.925 -3.691 -6.347 1.00 0.00 C ATOM 225 CZ PHE A 451 110.201 -4.758 -7.181 1.00 0.00 C ATOM 0 H PHE A 451 114.443 -2.779 -7.618 1.00 0.00 H new ATOM 0 HA PHE A 451 114.274 -0.229 -6.517 1.00 0.00 H new ATOM 0 HB2 PHE A 451 111.934 -0.335 -7.186 1.00 0.00 H new ATOM 0 HB3 PHE A 451 112.935 -1.076 -8.419 1.00 0.00 H new ATOM 0 HD1 PHE A 451 112.819 -3.463 -8.859 1.00 0.00 H new ATOM 0 HD2 PHE A 451 110.470 -1.712 -5.764 1.00 0.00 H new ATOM 0 HE1 PHE A 451 111.461 -5.505 -8.737 1.00 0.00 H new ATOM 0 HE2 PHE A 451 109.111 -3.754 -5.640 1.00 0.00 H new ATOM 0 HZ PHE A 451 109.604 -5.656 -7.127 1.00 0.00 H new ATOM 235 N VAL A 452 113.551 -0.356 -4.167 1.00 0.00 N ATOM 236 CA VAL A 452 113.137 -0.388 -2.769 1.00 0.00 C ATOM 237 C VAL A 452 111.663 -0.759 -2.645 1.00 0.00 C ATOM 238 O VAL A 452 110.786 0.090 -2.802 1.00 0.00 O ATOM 239 CB VAL A 452 113.370 0.973 -2.085 1.00 0.00 C ATOM 240 CG1 VAL A 452 112.782 2.100 -2.919 1.00 0.00 C ATOM 241 CG2 VAL A 452 112.779 0.974 -0.683 1.00 0.00 C ATOM 0 H VAL A 452 114.064 0.484 -4.435 1.00 0.00 H new ATOM 0 HA VAL A 452 113.745 -1.145 -2.273 1.00 0.00 H new ATOM 0 HB VAL A 452 114.444 1.137 -2.003 1.00 0.00 H new ATOM 0 HG11 VAL A 452 112.957 3.052 -2.419 1.00 0.00 H new ATOM 0 HG12 VAL A 452 113.257 2.113 -3.900 1.00 0.00 H new ATOM 0 HG13 VAL A 452 111.710 1.944 -3.037 1.00 0.00 H new ATOM 0 HG21 VAL A 452 112.953 1.943 -0.215 1.00 0.00 H new ATOM 0 HG22 VAL A 452 111.707 0.786 -0.740 1.00 0.00 H new ATOM 0 HG23 VAL A 452 113.253 0.194 -0.088 1.00 0.00 H new ATOM 251 N SER A 453 111.395 -2.033 -2.364 1.00 0.00 N ATOM 252 CA SER A 453 110.022 -2.520 -2.221 1.00 0.00 C ATOM 253 C SER A 453 109.355 -2.047 -0.922 1.00 0.00 C ATOM 254 O SER A 453 108.347 -2.617 -0.508 1.00 0.00 O ATOM 255 CB SER A 453 110.001 -4.048 -2.279 1.00 0.00 C ATOM 256 OG SER A 453 110.168 -4.610 -0.989 1.00 0.00 O ATOM 0 H SER A 453 112.110 -2.748 -2.231 1.00 0.00 H new ATOM 0 HA SER A 453 109.451 -2.102 -3.050 1.00 0.00 H new ATOM 0 HB2 SER A 453 109.057 -4.386 -2.707 1.00 0.00 H new ATOM 0 HB3 SER A 453 110.794 -4.401 -2.938 1.00 0.00 H new ATOM 0 HG SER A 453 110.682 -5.442 -1.059 1.00 0.00 H new ATOM 262 N GLY A 454 109.900 -1.007 -0.290 1.00 0.00 N ATOM 263 CA GLY A 454 109.321 -0.491 0.940 1.00 0.00 C ATOM 264 C GLY A 454 108.652 -1.559 1.788 1.00 0.00 C ATOM 265 O GLY A 454 107.681 -1.276 2.489 1.00 0.00 O ATOM 0 H GLY A 454 110.733 -0.513 -0.609 1.00 0.00 H new ATOM 0 HA2 GLY A 454 110.103 -0.009 1.527 1.00 0.00 H new ATOM 0 HA3 GLY A 454 108.589 0.278 0.693 1.00 0.00 H new ATOM 269 N VAL A 455 109.161 -2.786 1.724 1.00 0.00 N ATOM 270 CA VAL A 455 108.593 -3.889 2.493 1.00 0.00 C ATOM 271 C VAL A 455 107.073 -3.772 2.583 1.00 0.00 C ATOM 272 O VAL A 455 106.545 -3.074 3.450 1.00 0.00 O ATOM 273 CB VAL A 455 109.175 -3.950 3.921 1.00 0.00 C ATOM 274 CG1 VAL A 455 109.810 -5.307 4.179 1.00 0.00 C ATOM 275 CG2 VAL A 455 110.184 -2.833 4.147 1.00 0.00 C ATOM 0 H VAL A 455 109.964 -3.041 1.149 1.00 0.00 H new ATOM 0 HA VAL A 455 108.858 -4.805 1.965 1.00 0.00 H new ATOM 0 HB VAL A 455 108.357 -3.811 4.627 1.00 0.00 H new ATOM 0 HG11 VAL A 455 110.215 -5.333 5.190 1.00 0.00 H new ATOM 0 HG12 VAL A 455 109.057 -6.088 4.070 1.00 0.00 H new ATOM 0 HG13 VAL A 455 110.613 -5.475 3.462 1.00 0.00 H new ATOM 0 HG21 VAL A 455 110.579 -2.899 5.161 1.00 0.00 H new ATOM 0 HG22 VAL A 455 111.001 -2.931 3.432 1.00 0.00 H new ATOM 0 HG23 VAL A 455 109.696 -1.868 4.010 1.00 0.00 H new ATOM 285 N ILE A 456 106.374 -4.458 1.682 1.00 0.00 N ATOM 286 CA ILE A 456 104.914 -4.431 1.660 1.00 0.00 C ATOM 287 C ILE A 456 104.328 -5.307 2.763 1.00 0.00 C ATOM 288 O ILE A 456 104.641 -6.492 2.862 1.00 0.00 O ATOM 289 CB ILE A 456 104.358 -4.903 0.301 1.00 0.00 C ATOM 290 CG1 ILE A 456 104.931 -4.054 -0.834 1.00 0.00 C ATOM 291 CG2 ILE A 456 102.838 -4.837 0.300 1.00 0.00 C ATOM 292 CD1 ILE A 456 104.824 -2.565 -0.586 1.00 0.00 C ATOM 0 H ILE A 456 106.795 -5.039 0.957 1.00 0.00 H new ATOM 0 HA ILE A 456 104.620 -3.395 1.825 1.00 0.00 H new ATOM 0 HB ILE A 456 104.660 -5.938 0.143 1.00 0.00 H new ATOM 0 HG12 ILE A 456 105.979 -4.316 -0.980 1.00 0.00 H new ATOM 0 HG13 ILE A 456 104.410 -4.299 -1.759 1.00 0.00 H new ATOM 0 HG21 ILE A 456 102.460 -5.173 -0.665 1.00 0.00 H new ATOM 0 HG22 ILE A 456 102.445 -5.480 1.087 1.00 0.00 H new ATOM 0 HG23 ILE A 456 102.518 -3.810 0.477 1.00 0.00 H new ATOM 0 HD11 ILE A 456 105.250 -2.024 -1.431 1.00 0.00 H new ATOM 0 HD12 ILE A 456 103.776 -2.290 -0.470 1.00 0.00 H new ATOM 0 HD13 ILE A 456 105.369 -2.307 0.322 1.00 0.00 H new ATOM 304 N VAL A 457 103.453 -4.720 3.576 1.00 0.00 N ATOM 305 CA VAL A 457 102.796 -5.449 4.655 1.00 0.00 C ATOM 306 C VAL A 457 101.301 -5.584 4.376 1.00 0.00 C ATOM 307 O VAL A 457 100.529 -4.661 4.640 1.00 0.00 O ATOM 308 CB VAL A 457 102.997 -4.755 6.014 1.00 0.00 C ATOM 309 CG1 VAL A 457 102.102 -5.385 7.070 1.00 0.00 C ATOM 310 CG2 VAL A 457 104.458 -4.823 6.434 1.00 0.00 C ATOM 0 H VAL A 457 103.183 -3.739 3.507 1.00 0.00 H new ATOM 0 HA VAL A 457 103.253 -6.438 4.700 1.00 0.00 H new ATOM 0 HB VAL A 457 102.719 -3.706 5.913 1.00 0.00 H new ATOM 0 HG11 VAL A 457 102.257 -4.883 8.025 1.00 0.00 H new ATOM 0 HG12 VAL A 457 101.059 -5.283 6.771 1.00 0.00 H new ATOM 0 HG13 VAL A 457 102.348 -6.442 7.172 1.00 0.00 H new ATOM 0 HG21 VAL A 457 104.583 -4.328 7.397 1.00 0.00 H new ATOM 0 HG22 VAL A 457 104.764 -5.866 6.520 1.00 0.00 H new ATOM 0 HG23 VAL A 457 105.075 -4.324 5.687 1.00 0.00 H new ATOM 320 N LYS A 458 100.894 -6.728 3.834 1.00 0.00 N ATOM 321 CA LYS A 458 99.487 -6.957 3.517 1.00 0.00 C ATOM 322 C LYS A 458 98.679 -7.281 4.769 1.00 0.00 C ATOM 323 O LYS A 458 98.933 -8.275 5.449 1.00 0.00 O ATOM 324 CB LYS A 458 99.342 -8.089 2.498 1.00 0.00 C ATOM 325 CG LYS A 458 97.904 -8.340 2.074 1.00 0.00 C ATOM 326 CD LYS A 458 97.817 -9.398 0.985 1.00 0.00 C ATOM 327 CE LYS A 458 96.689 -10.381 1.252 1.00 0.00 C ATOM 328 NZ LYS A 458 96.926 -11.691 0.587 1.00 0.00 N ATOM 0 H LYS A 458 101.513 -7.506 3.606 1.00 0.00 H new ATOM 0 HA LYS A 458 99.095 -6.036 3.086 1.00 0.00 H new ATOM 0 HB2 LYS A 458 99.937 -7.852 1.616 1.00 0.00 H new ATOM 0 HB3 LYS A 458 99.753 -9.005 2.923 1.00 0.00 H new ATOM 0 HG2 LYS A 458 97.320 -8.657 2.938 1.00 0.00 H new ATOM 0 HG3 LYS A 458 97.463 -7.410 1.715 1.00 0.00 H new ATOM 0 HD2 LYS A 458 97.660 -8.916 0.020 1.00 0.00 H new ATOM 0 HD3 LYS A 458 98.763 -9.936 0.923 1.00 0.00 H new ATOM 0 HE2 LYS A 458 96.586 -10.533 2.327 1.00 0.00 H new ATOM 0 HE3 LYS A 458 95.748 -9.959 0.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 458 96.135 -12.333 0.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 458 96.999 -11.550 -0.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 458 97.811 -12.106 0.943 1.00 0.00 H new ATOM 342 N ILE A 459 97.681 -6.446 5.045 1.00 0.00 N ATOM 343 CA ILE A 459 96.802 -6.648 6.190 1.00 0.00 C ATOM 344 C ILE A 459 95.385 -6.966 5.729 1.00 0.00 C ATOM 345 O ILE A 459 94.789 -6.209 4.963 1.00 0.00 O ATOM 346 CB ILE A 459 96.755 -5.418 7.114 1.00 0.00 C ATOM 347 CG1 ILE A 459 98.167 -4.909 7.403 1.00 0.00 C ATOM 348 CG2 ILE A 459 96.034 -5.765 8.411 1.00 0.00 C ATOM 349 CD1 ILE A 459 98.227 -3.922 8.548 1.00 0.00 C ATOM 0 H ILE A 459 97.461 -5.620 4.488 1.00 0.00 H new ATOM 0 HA ILE A 459 97.213 -7.487 6.751 1.00 0.00 H new ATOM 0 HB ILE A 459 96.204 -4.624 6.610 1.00 0.00 H new ATOM 0 HG12 ILE A 459 98.812 -5.758 7.631 1.00 0.00 H new ATOM 0 HG13 ILE A 459 98.566 -4.437 6.505 1.00 0.00 H new ATOM 0 HG21 ILE A 459 96.006 -4.888 9.058 1.00 0.00 H new ATOM 0 HG22 ILE A 459 95.016 -6.083 8.187 1.00 0.00 H new ATOM 0 HG23 ILE A 459 96.564 -6.572 8.917 1.00 0.00 H new ATOM 0 HD11 ILE A 459 99.258 -3.602 8.699 1.00 0.00 H new ATOM 0 HD12 ILE A 459 97.608 -3.056 8.314 1.00 0.00 H new ATOM 0 HD13 ILE A 459 97.858 -4.397 9.457 1.00 0.00 H new ATOM 361 N ILE A 460 94.838 -8.069 6.217 1.00 0.00 N ATOM 362 CA ILE A 460 93.477 -8.452 5.864 1.00 0.00 C ATOM 363 C ILE A 460 92.682 -8.822 7.109 1.00 0.00 C ATOM 364 O ILE A 460 93.187 -9.501 8.001 1.00 0.00 O ATOM 365 CB ILE A 460 93.443 -9.613 4.843 1.00 0.00 C ATOM 366 CG1 ILE A 460 92.089 -9.656 4.134 1.00 0.00 C ATOM 367 CG2 ILE A 460 93.737 -10.949 5.508 1.00 0.00 C ATOM 368 CD1 ILE A 460 91.004 -10.328 4.945 1.00 0.00 C ATOM 0 H ILE A 460 95.310 -8.711 6.854 1.00 0.00 H new ATOM 0 HA ILE A 460 93.015 -7.586 5.390 1.00 0.00 H new ATOM 0 HB ILE A 460 94.224 -9.432 4.105 1.00 0.00 H new ATOM 0 HG12 ILE A 460 91.778 -8.638 3.899 1.00 0.00 H new ATOM 0 HG13 ILE A 460 92.201 -10.182 3.186 1.00 0.00 H new ATOM 0 HG21 ILE A 460 93.705 -11.742 4.761 1.00 0.00 H new ATOM 0 HG22 ILE A 460 94.727 -10.919 5.963 1.00 0.00 H new ATOM 0 HG23 ILE A 460 92.990 -11.145 6.277 1.00 0.00 H new ATOM 0 HD11 ILE A 460 90.072 -10.322 4.381 1.00 0.00 H new ATOM 0 HD12 ILE A 460 91.293 -11.357 5.158 1.00 0.00 H new ATOM 0 HD13 ILE A 460 90.864 -9.789 5.882 1.00 0.00 H new ATOM 380 N SER A 461 91.442 -8.360 7.170 1.00 0.00 N ATOM 381 CA SER A 461 90.584 -8.642 8.314 1.00 0.00 C ATOM 382 C SER A 461 89.269 -9.266 7.866 1.00 0.00 C ATOM 383 O SER A 461 89.093 -9.600 6.694 1.00 0.00 O ATOM 384 CB SER A 461 90.306 -7.360 9.103 1.00 0.00 C ATOM 385 OG SER A 461 88.994 -6.885 8.856 1.00 0.00 O ATOM 0 H SER A 461 91.007 -7.790 6.444 1.00 0.00 H new ATOM 0 HA SER A 461 91.105 -9.351 8.957 1.00 0.00 H new ATOM 0 HB2 SER A 461 90.433 -7.550 10.169 1.00 0.00 H new ATOM 0 HB3 SER A 461 91.031 -6.595 8.827 1.00 0.00 H new ATOM 0 HG SER A 461 88.895 -6.677 7.903 1.00 0.00 H new ATOM 391 N THR A 462 88.347 -9.414 8.808 1.00 0.00 N ATOM 392 CA THR A 462 87.038 -9.991 8.521 1.00 0.00 C ATOM 393 C THR A 462 85.926 -9.157 9.148 1.00 0.00 C ATOM 394 O THR A 462 84.786 -9.607 9.260 1.00 0.00 O ATOM 395 CB THR A 462 86.932 -11.438 9.038 1.00 0.00 C ATOM 396 OG1 THR A 462 87.650 -11.607 10.267 1.00 0.00 O ATOM 397 CG2 THR A 462 87.489 -12.415 8.016 1.00 0.00 C ATOM 0 H THR A 462 88.481 -9.142 9.782 1.00 0.00 H new ATOM 0 HA THR A 462 86.924 -9.994 7.437 1.00 0.00 H new ATOM 0 HB THR A 462 85.874 -11.640 9.208 1.00 0.00 H new ATOM 0 HG1 THR A 462 87.563 -12.534 10.572 1.00 0.00 H new ATOM 0 HG21 THR A 462 87.405 -13.431 8.401 1.00 0.00 H new ATOM 0 HG22 THR A 462 86.925 -12.331 7.087 1.00 0.00 H new ATOM 0 HG23 THR A 462 88.537 -12.185 7.826 1.00 0.00 H new ATOM 405 N GLU A 463 86.274 -7.942 9.557 1.00 0.00 N ATOM 406 CA GLU A 463 85.319 -7.033 10.181 1.00 0.00 C ATOM 407 C GLU A 463 86.050 -6.016 11.048 1.00 0.00 C ATOM 408 O GLU A 463 85.814 -4.812 10.951 1.00 0.00 O ATOM 409 CB GLU A 463 84.310 -7.812 11.028 1.00 0.00 C ATOM 410 CG GLU A 463 82.991 -8.075 10.319 1.00 0.00 C ATOM 411 CD GLU A 463 81.950 -7.014 10.616 1.00 0.00 C ATOM 412 OE1 GLU A 463 82.052 -6.361 11.676 1.00 0.00 O ATOM 413 OE2 GLU A 463 81.031 -6.836 9.787 1.00 0.00 O ATOM 0 H GLU A 463 87.216 -7.562 9.467 1.00 0.00 H new ATOM 0 HA GLU A 463 84.780 -6.506 9.393 1.00 0.00 H new ATOM 0 HB2 GLU A 463 84.752 -8.765 11.319 1.00 0.00 H new ATOM 0 HB3 GLU A 463 84.115 -7.258 11.946 1.00 0.00 H new ATOM 0 HG2 GLU A 463 83.163 -8.119 9.244 1.00 0.00 H new ATOM 0 HG3 GLU A 463 82.608 -9.050 10.621 1.00 0.00 H new ATOM 420 N PRO A 464 86.955 -6.501 11.909 1.00 0.00 N ATOM 421 CA PRO A 464 87.740 -5.652 12.805 1.00 0.00 C ATOM 422 C PRO A 464 88.263 -4.395 12.117 1.00 0.00 C ATOM 423 O PRO A 464 88.168 -3.295 12.663 1.00 0.00 O ATOM 424 CB PRO A 464 88.896 -6.564 13.208 1.00 0.00 C ATOM 425 CG PRO A 464 88.309 -7.932 13.183 1.00 0.00 C ATOM 426 CD PRO A 464 87.287 -7.930 12.074 1.00 0.00 C ATOM 0 HA PRO A 464 87.150 -5.281 13.643 1.00 0.00 H new ATOM 0 HB2 PRO A 464 89.732 -6.477 12.514 1.00 0.00 H new ATOM 0 HB3 PRO A 464 89.276 -6.312 14.198 1.00 0.00 H new ATOM 0 HG2 PRO A 464 89.078 -8.683 13.002 1.00 0.00 H new ATOM 0 HG3 PRO A 464 87.846 -8.174 14.139 1.00 0.00 H new ATOM 0 HD2 PRO A 464 87.691 -8.356 11.156 1.00 0.00 H new ATOM 0 HD3 PRO A 464 86.408 -8.518 12.338 1.00 0.00 H new ATOM 434 N LEU A 465 88.820 -4.560 10.920 1.00 0.00 N ATOM 435 CA LEU A 465 89.356 -3.429 10.173 1.00 0.00 C ATOM 436 C LEU A 465 88.473 -2.201 10.354 1.00 0.00 C ATOM 437 O LEU A 465 87.458 -2.038 9.677 1.00 0.00 O ATOM 438 CB LEU A 465 89.491 -3.774 8.689 1.00 0.00 C ATOM 439 CG LEU A 465 90.916 -3.692 8.140 1.00 0.00 C ATOM 440 CD1 LEU A 465 91.169 -4.799 7.129 1.00 0.00 C ATOM 441 CD2 LEU A 465 91.165 -2.329 7.513 1.00 0.00 C ATOM 0 H LEU A 465 88.911 -5.461 10.450 1.00 0.00 H new ATOM 0 HA LEU A 465 90.348 -3.203 10.564 1.00 0.00 H new ATOM 0 HB2 LEU A 465 89.112 -4.783 8.529 1.00 0.00 H new ATOM 0 HB3 LEU A 465 88.856 -3.100 8.114 1.00 0.00 H new ATOM 0 HG LEU A 465 91.611 -3.824 8.969 1.00 0.00 H new ATOM 0 HD11 LEU A 465 92.189 -4.721 6.752 1.00 0.00 H new ATOM 0 HD12 LEU A 465 91.033 -5.768 7.609 1.00 0.00 H new ATOM 0 HD13 LEU A 465 90.467 -4.702 6.301 1.00 0.00 H new ATOM 0 HD21 LEU A 465 92.183 -2.287 7.127 1.00 0.00 H new ATOM 0 HD22 LEU A 465 90.461 -2.170 6.697 1.00 0.00 H new ATOM 0 HD23 LEU A 465 91.030 -1.552 8.265 1.00 0.00 H new ATOM 453 N PRO A 466 88.854 -1.328 11.294 1.00 0.00 N ATOM 454 CA PRO A 466 88.112 -0.105 11.613 1.00 0.00 C ATOM 455 C PRO A 466 88.265 0.978 10.549 1.00 0.00 C ATOM 456 O PRO A 466 87.339 1.749 10.297 1.00 0.00 O ATOM 457 CB PRO A 466 88.740 0.369 12.933 1.00 0.00 C ATOM 458 CG PRO A 466 89.644 -0.736 13.379 1.00 0.00 C ATOM 459 CD PRO A 466 90.039 -1.477 12.141 1.00 0.00 C ATOM 0 HA PRO A 466 87.041 -0.299 11.672 1.00 0.00 H new ATOM 0 HB2 PRO A 466 89.297 1.295 12.790 1.00 0.00 H new ATOM 0 HB3 PRO A 466 87.972 0.571 13.680 1.00 0.00 H new ATOM 0 HG2 PRO A 466 90.520 -0.339 13.892 1.00 0.00 H new ATOM 0 HG3 PRO A 466 89.135 -1.396 14.082 1.00 0.00 H new ATOM 0 HD2 PRO A 466 90.927 -1.048 11.677 1.00 0.00 H new ATOM 0 HD3 PRO A 466 90.262 -2.524 12.348 1.00 0.00 H new ATOM 467 N GLY A 467 89.441 1.037 9.933 1.00 0.00 N ATOM 468 CA GLY A 467 89.695 2.036 8.910 1.00 0.00 C ATOM 469 C GLY A 467 91.176 2.289 8.712 1.00 0.00 C ATOM 470 O GLY A 467 92.004 1.740 9.436 1.00 0.00 O ATOM 0 H GLY A 467 90.223 0.411 10.124 1.00 0.00 H new ATOM 0 HA2 GLY A 467 89.255 1.709 7.968 1.00 0.00 H new ATOM 0 HA3 GLY A 467 89.202 2.969 9.185 1.00 0.00 H new ATOM 474 N ARG A 468 91.515 3.130 7.739 1.00 0.00 N ATOM 475 CA ARG A 468 92.911 3.450 7.466 1.00 0.00 C ATOM 476 C ARG A 468 93.561 4.112 8.677 1.00 0.00 C ATOM 477 O ARG A 468 94.697 3.801 9.034 1.00 0.00 O ATOM 478 CB ARG A 468 93.013 4.376 6.254 1.00 0.00 C ATOM 479 CG ARG A 468 92.323 5.715 6.458 1.00 0.00 C ATOM 480 CD ARG A 468 92.327 6.547 5.186 1.00 0.00 C ATOM 481 NE ARG A 468 92.092 7.962 5.462 1.00 0.00 N ATOM 482 CZ ARG A 468 92.971 8.747 6.077 1.00 0.00 C ATOM 483 NH1 ARG A 468 94.145 8.261 6.457 1.00 0.00 N ATOM 484 NH2 ARG A 468 92.677 10.019 6.309 1.00 0.00 N ATOM 0 H ARG A 468 90.845 3.600 7.130 1.00 0.00 H new ATOM 0 HA ARG A 468 93.438 2.520 7.253 1.00 0.00 H new ATOM 0 HB2 ARG A 468 94.065 4.549 6.025 1.00 0.00 H new ATOM 0 HB3 ARG A 468 92.576 3.879 5.388 1.00 0.00 H new ATOM 0 HG2 ARG A 468 91.295 5.550 6.782 1.00 0.00 H new ATOM 0 HG3 ARG A 468 92.824 6.265 7.255 1.00 0.00 H new ATOM 0 HD2 ARG A 468 93.284 6.430 4.678 1.00 0.00 H new ATOM 0 HD3 ARG A 468 91.559 6.177 4.507 1.00 0.00 H new ATOM 0 HE ARG A 468 91.205 8.370 5.167 1.00 0.00 H new ATOM 0 HH11 ARG A 468 94.375 7.284 6.277 1.00 0.00 H new ATOM 0 HH12 ARG A 468 94.818 8.865 6.929 1.00 0.00 H new ATOM 0 HH21 ARG A 468 91.776 10.396 6.016 1.00 0.00 H new ATOM 0 HH22 ARG A 468 93.352 10.621 6.781 1.00 0.00 H new ATOM 498 N LYS A 469 92.829 5.029 9.302 1.00 0.00 N ATOM 499 CA LYS A 469 93.325 5.740 10.474 1.00 0.00 C ATOM 500 C LYS A 469 93.584 4.779 11.630 1.00 0.00 C ATOM 501 O LYS A 469 94.606 4.871 12.311 1.00 0.00 O ATOM 502 CB LYS A 469 92.322 6.811 10.904 1.00 0.00 C ATOM 503 CG LYS A 469 90.872 6.389 10.730 1.00 0.00 C ATOM 504 CD LYS A 469 89.996 6.920 11.853 1.00 0.00 C ATOM 505 CE LYS A 469 89.629 8.378 11.630 1.00 0.00 C ATOM 506 NZ LYS A 469 88.378 8.752 12.346 1.00 0.00 N ATOM 0 H LYS A 469 91.888 5.297 9.015 1.00 0.00 H new ATOM 0 HA LYS A 469 94.268 6.216 10.206 1.00 0.00 H new ATOM 0 HB2 LYS A 469 92.496 7.061 11.950 1.00 0.00 H new ATOM 0 HB3 LYS A 469 92.500 7.717 10.326 1.00 0.00 H new ATOM 0 HG2 LYS A 469 90.499 6.754 9.773 1.00 0.00 H new ATOM 0 HG3 LYS A 469 90.810 5.301 10.703 1.00 0.00 H new ATOM 0 HD2 LYS A 469 89.088 6.321 11.922 1.00 0.00 H new ATOM 0 HD3 LYS A 469 90.519 6.816 12.804 1.00 0.00 H new ATOM 0 HE2 LYS A 469 90.446 9.014 11.970 1.00 0.00 H new ATOM 0 HE3 LYS A 469 89.505 8.562 10.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 469 88.163 9.754 12.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 469 87.592 8.163 12.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 469 88.504 8.601 13.367 1.00 0.00 H new ATOM 520 N GLN A 470 92.646 3.864 11.851 1.00 0.00 N ATOM 521 CA GLN A 470 92.764 2.893 12.930 1.00 0.00 C ATOM 522 C GLN A 470 93.821 1.839 12.614 1.00 0.00 C ATOM 523 O GLN A 470 94.624 1.480 13.475 1.00 0.00 O ATOM 524 CB GLN A 470 91.412 2.231 13.197 1.00 0.00 C ATOM 525 CG GLN A 470 90.433 3.136 13.927 1.00 0.00 C ATOM 526 CD GLN A 470 90.873 3.450 15.342 1.00 0.00 C ATOM 527 OE1 GLN A 470 91.976 3.950 15.566 1.00 0.00 O ATOM 528 NE2 GLN A 470 90.012 3.157 16.310 1.00 0.00 N ATOM 0 H GLN A 470 91.795 3.775 11.296 1.00 0.00 H new ATOM 0 HA GLN A 470 93.080 3.424 13.828 1.00 0.00 H new ATOM 0 HB2 GLN A 470 90.973 1.922 12.248 1.00 0.00 H new ATOM 0 HB3 GLN A 470 91.568 1.327 13.785 1.00 0.00 H new ATOM 0 HG2 GLN A 470 90.320 4.067 13.371 1.00 0.00 H new ATOM 0 HG3 GLN A 470 89.453 2.659 13.953 1.00 0.00 H new ATOM 0 HE21 GLN A 470 89.108 2.743 16.081 1.00 0.00 H new ATOM 0 HE22 GLN A 470 90.255 3.346 17.283 1.00 0.00 H new ATOM 537 N VAL A 471 93.825 1.347 11.379 1.00 0.00 N ATOM 538 CA VAL A 471 94.799 0.341 10.974 1.00 0.00 C ATOM 539 C VAL A 471 96.211 0.915 11.014 1.00 0.00 C ATOM 540 O VAL A 471 97.139 0.273 11.505 1.00 0.00 O ATOM 541 CB VAL A 471 94.514 -0.197 9.557 1.00 0.00 C ATOM 542 CG1 VAL A 471 95.599 -1.171 9.129 1.00 0.00 C ATOM 543 CG2 VAL A 471 93.145 -0.854 9.491 1.00 0.00 C ATOM 0 H VAL A 471 93.171 1.626 10.648 1.00 0.00 H new ATOM 0 HA VAL A 471 94.715 -0.484 11.681 1.00 0.00 H new ATOM 0 HB VAL A 471 94.516 0.646 8.866 1.00 0.00 H new ATOM 0 HG11 VAL A 471 95.382 -1.541 8.127 1.00 0.00 H new ATOM 0 HG12 VAL A 471 96.564 -0.663 9.127 1.00 0.00 H new ATOM 0 HG13 VAL A 471 95.631 -2.009 9.826 1.00 0.00 H new ATOM 0 HG21 VAL A 471 92.968 -1.225 8.482 1.00 0.00 H new ATOM 0 HG22 VAL A 471 93.106 -1.685 10.195 1.00 0.00 H new ATOM 0 HG23 VAL A 471 92.378 -0.124 9.749 1.00 0.00 H new ATOM 553 N ARG A 472 96.364 2.135 10.504 1.00 0.00 N ATOM 554 CA ARG A 472 97.661 2.802 10.494 1.00 0.00 C ATOM 555 C ARG A 472 98.155 3.041 11.916 1.00 0.00 C ATOM 556 O ARG A 472 99.346 2.919 12.201 1.00 0.00 O ATOM 557 CB ARG A 472 97.578 4.129 9.734 1.00 0.00 C ATOM 558 CG ARG A 472 96.891 5.239 10.512 1.00 0.00 C ATOM 559 CD ARG A 472 97.262 6.611 9.970 1.00 0.00 C ATOM 560 NE ARG A 472 96.942 7.677 10.916 1.00 0.00 N ATOM 561 CZ ARG A 472 97.180 8.965 10.686 1.00 0.00 C ATOM 562 NH1 ARG A 472 97.724 9.345 9.537 1.00 0.00 N ATOM 563 NH2 ARG A 472 96.870 9.873 11.601 1.00 0.00 N ATOM 0 H ARG A 472 95.606 2.680 10.093 1.00 0.00 H new ATOM 0 HA ARG A 472 98.372 2.152 9.985 1.00 0.00 H new ATOM 0 HB2 ARG A 472 98.586 4.451 9.473 1.00 0.00 H new ATOM 0 HB3 ARG A 472 97.042 3.968 8.798 1.00 0.00 H new ATOM 0 HG2 ARG A 472 95.810 5.106 10.460 1.00 0.00 H new ATOM 0 HG3 ARG A 472 97.170 5.174 11.564 1.00 0.00 H new ATOM 0 HD2 ARG A 472 98.328 6.635 9.743 1.00 0.00 H new ATOM 0 HD3 ARG A 472 96.733 6.786 9.033 1.00 0.00 H new ATOM 0 HE ARG A 472 96.511 7.419 11.804 1.00 0.00 H new ATOM 0 HH11 ARG A 472 97.960 8.649 8.830 1.00 0.00 H new ATOM 0 HH12 ARG A 472 97.906 10.333 9.361 1.00 0.00 H new ATOM 0 HH21 ARG A 472 96.448 9.584 12.484 1.00 0.00 H new ATOM 0 HH22 ARG A 472 97.053 10.860 11.422 1.00 0.00 H new ATOM 577 N ASP A 473 97.227 3.379 12.808 1.00 0.00 N ATOM 578 CA ASP A 473 97.564 3.631 14.204 1.00 0.00 C ATOM 579 C ASP A 473 98.042 2.352 14.881 1.00 0.00 C ATOM 580 O ASP A 473 98.980 2.374 15.676 1.00 0.00 O ATOM 581 CB ASP A 473 96.356 4.196 14.952 1.00 0.00 C ATOM 582 CG ASP A 473 96.588 5.615 15.433 1.00 0.00 C ATOM 583 OD1 ASP A 473 95.977 6.006 16.450 1.00 0.00 O ATOM 584 OD2 ASP A 473 97.382 6.336 14.792 1.00 0.00 O ATOM 0 H ASP A 473 96.237 3.484 12.588 1.00 0.00 H new ATOM 0 HA ASP A 473 98.371 4.364 14.231 1.00 0.00 H new ATOM 0 HB2 ASP A 473 95.484 4.175 14.298 1.00 0.00 H new ATOM 0 HB3 ASP A 473 96.130 3.558 15.806 1.00 0.00 H new ATOM 589 N THR A 474 97.392 1.241 14.557 1.00 0.00 N ATOM 590 CA THR A 474 97.752 -0.050 15.129 1.00 0.00 C ATOM 591 C THR A 474 99.155 -0.461 14.693 1.00 0.00 C ATOM 592 O THR A 474 100.018 -0.768 15.522 1.00 0.00 O ATOM 593 CB THR A 474 96.755 -1.145 14.706 1.00 0.00 C ATOM 594 OG1 THR A 474 95.854 -0.669 13.698 1.00 0.00 O ATOM 595 CG2 THR A 474 95.935 -1.626 15.894 1.00 0.00 C ATOM 0 H THR A 474 96.612 1.208 13.900 1.00 0.00 H new ATOM 0 HA THR A 474 97.723 0.057 16.213 1.00 0.00 H new ATOM 0 HB THR A 474 97.345 -1.970 14.306 1.00 0.00 H new ATOM 0 HG1 THR A 474 95.188 -0.078 14.107 1.00 0.00 H new ATOM 0 HG21 THR A 474 95.239 -2.399 15.567 1.00 0.00 H new ATOM 0 HG22 THR A 474 96.601 -2.035 16.654 1.00 0.00 H new ATOM 0 HG23 THR A 474 95.377 -0.789 16.313 1.00 0.00 H new ATOM 603 N LEU A 475 99.386 -0.441 13.385 1.00 0.00 N ATOM 604 CA LEU A 475 100.689 -0.793 12.842 1.00 0.00 C ATOM 605 C LEU A 475 101.735 0.206 13.312 1.00 0.00 C ATOM 606 O LEU A 475 102.856 -0.169 13.657 1.00 0.00 O ATOM 607 CB LEU A 475 100.643 -0.831 11.313 1.00 0.00 C ATOM 608 CG LEU A 475 100.010 0.393 10.649 1.00 0.00 C ATOM 609 CD1 LEU A 475 101.077 1.412 10.280 1.00 0.00 C ATOM 610 CD2 LEU A 475 99.217 -0.024 9.418 1.00 0.00 C ATOM 0 H LEU A 475 98.690 -0.186 12.685 1.00 0.00 H new ATOM 0 HA LEU A 475 100.959 -1.786 13.202 1.00 0.00 H new ATOM 0 HB2 LEU A 475 101.660 -0.942 10.938 1.00 0.00 H new ATOM 0 HB3 LEU A 475 100.090 -1.718 11.004 1.00 0.00 H new ATOM 0 HG LEU A 475 99.326 0.858 11.359 1.00 0.00 H new ATOM 0 HD11 LEU A 475 100.608 2.276 9.809 1.00 0.00 H new ATOM 0 HD12 LEU A 475 101.603 1.731 11.180 1.00 0.00 H new ATOM 0 HD13 LEU A 475 101.786 0.961 9.586 1.00 0.00 H new ATOM 0 HD21 LEU A 475 98.772 0.857 8.956 1.00 0.00 H new ATOM 0 HD22 LEU A 475 99.882 -0.511 8.705 1.00 0.00 H new ATOM 0 HD23 LEU A 475 98.428 -0.717 9.711 1.00 0.00 H new ATOM 622 N ALA A 476 101.357 1.480 13.339 1.00 0.00 N ATOM 623 CA ALA A 476 102.261 2.528 13.787 1.00 0.00 C ATOM 624 C ALA A 476 102.521 2.401 15.281 1.00 0.00 C ATOM 625 O ALA A 476 103.556 2.837 15.781 1.00 0.00 O ATOM 626 CB ALA A 476 101.703 3.906 13.464 1.00 0.00 C ATOM 0 H ALA A 476 100.434 1.809 13.057 1.00 0.00 H new ATOM 0 HA ALA A 476 103.205 2.410 13.254 1.00 0.00 H new ATOM 0 HB1 ALA A 476 102.399 4.670 13.810 1.00 0.00 H new ATOM 0 HB2 ALA A 476 101.567 4.000 12.387 1.00 0.00 H new ATOM 0 HB3 ALA A 476 100.743 4.036 13.964 1.00 0.00 H new ATOM 632 N ALA A 477 101.574 1.790 15.992 1.00 0.00 N ATOM 633 CA ALA A 477 101.712 1.599 17.429 1.00 0.00 C ATOM 634 C ALA A 477 102.733 0.512 17.725 1.00 0.00 C ATOM 635 O ALA A 477 103.406 0.540 18.755 1.00 0.00 O ATOM 636 CB ALA A 477 100.374 1.255 18.068 1.00 0.00 C ATOM 0 H ALA A 477 100.709 1.422 15.596 1.00 0.00 H new ATOM 0 HA ALA A 477 102.062 2.537 17.860 1.00 0.00 H new ATOM 0 HB1 ALA A 477 100.508 1.118 19.141 1.00 0.00 H new ATOM 0 HB2 ALA A 477 99.667 2.066 17.891 1.00 0.00 H new ATOM 0 HB3 ALA A 477 99.988 0.335 17.630 1.00 0.00 H new ATOM 642 N ILE A 478 102.851 -0.444 16.807 1.00 0.00 N ATOM 643 CA ILE A 478 103.805 -1.536 16.969 1.00 0.00 C ATOM 644 C ILE A 478 105.212 -1.092 16.568 1.00 0.00 C ATOM 645 O ILE A 478 106.203 -1.564 17.125 1.00 0.00 O ATOM 646 CB ILE A 478 103.396 -2.777 16.144 1.00 0.00 C ATOM 647 CG1 ILE A 478 102.256 -3.523 16.839 1.00 0.00 C ATOM 648 CG2 ILE A 478 104.584 -3.710 15.936 1.00 0.00 C ATOM 649 CD1 ILE A 478 100.897 -3.253 16.233 1.00 0.00 C ATOM 0 H ILE A 478 102.301 -0.484 15.949 1.00 0.00 H new ATOM 0 HA ILE A 478 103.803 -1.810 18.024 1.00 0.00 H new ATOM 0 HB ILE A 478 103.054 -2.437 15.167 1.00 0.00 H new ATOM 0 HG12 ILE A 478 102.456 -4.594 16.799 1.00 0.00 H new ATOM 0 HG13 ILE A 478 102.237 -3.241 17.892 1.00 0.00 H new ATOM 0 HG21 ILE A 478 104.269 -4.575 15.353 1.00 0.00 H new ATOM 0 HG22 ILE A 478 105.373 -3.180 15.403 1.00 0.00 H new ATOM 0 HG23 ILE A 478 104.960 -4.042 16.904 1.00 0.00 H new ATOM 0 HD11 ILE A 478 100.138 -3.815 16.777 1.00 0.00 H new ATOM 0 HD12 ILE A 478 100.675 -2.188 16.297 1.00 0.00 H new ATOM 0 HD13 ILE A 478 100.897 -3.561 15.187 1.00 0.00 H new ATOM 661 N SER A 479 105.292 -0.187 15.597 1.00 0.00 N ATOM 662 CA SER A 479 106.581 0.313 15.126 1.00 0.00 C ATOM 663 C SER A 479 106.399 1.495 14.179 1.00 0.00 C ATOM 664 O SER A 479 105.297 1.757 13.699 1.00 0.00 O ATOM 665 CB SER A 479 107.355 -0.802 14.420 1.00 0.00 C ATOM 666 OG SER A 479 108.679 -0.396 14.124 1.00 0.00 O ATOM 0 H SER A 479 104.483 0.214 15.122 1.00 0.00 H new ATOM 0 HA SER A 479 107.147 0.651 15.994 1.00 0.00 H new ATOM 0 HB2 SER A 479 107.376 -1.690 15.052 1.00 0.00 H new ATOM 0 HB3 SER A 479 106.842 -1.078 13.499 1.00 0.00 H new ATOM 0 HG SER A 479 109.153 -1.127 13.675 1.00 0.00 H new ATOM 672 N GLU A 480 107.493 2.203 13.913 1.00 0.00 N ATOM 673 CA GLU A 480 107.461 3.356 13.021 1.00 0.00 C ATOM 674 C GLU A 480 107.313 2.912 11.569 1.00 0.00 C ATOM 675 O GLU A 480 108.224 2.312 10.997 1.00 0.00 O ATOM 676 CB GLU A 480 108.734 4.190 13.187 1.00 0.00 C ATOM 677 CG GLU A 480 108.729 5.475 12.373 1.00 0.00 C ATOM 678 CD GLU A 480 109.824 5.505 11.326 1.00 0.00 C ATOM 679 OE1 GLU A 480 109.829 6.441 10.499 1.00 0.00 O ATOM 680 OE2 GLU A 480 110.678 4.593 11.334 1.00 0.00 O ATOM 0 H GLU A 480 108.413 1.998 14.303 1.00 0.00 H new ATOM 0 HA GLU A 480 106.599 3.968 13.285 1.00 0.00 H new ATOM 0 HB2 GLU A 480 108.862 4.438 14.241 1.00 0.00 H new ATOM 0 HB3 GLU A 480 109.594 3.588 12.895 1.00 0.00 H new ATOM 0 HG2 GLU A 480 107.761 5.588 11.885 1.00 0.00 H new ATOM 0 HG3 GLU A 480 108.849 6.326 13.043 1.00 0.00 H new ATOM 687 N VAL A 481 106.158 3.205 10.981 1.00 0.00 N ATOM 688 CA VAL A 481 105.885 2.830 9.598 1.00 0.00 C ATOM 689 C VAL A 481 106.059 4.013 8.654 1.00 0.00 C ATOM 690 O VAL A 481 105.938 5.169 9.059 1.00 0.00 O ATOM 691 CB VAL A 481 104.458 2.274 9.442 1.00 0.00 C ATOM 692 CG1 VAL A 481 104.361 0.877 10.036 1.00 0.00 C ATOM 693 CG2 VAL A 481 103.447 3.210 10.089 1.00 0.00 C ATOM 0 H VAL A 481 105.395 3.702 11.441 1.00 0.00 H new ATOM 0 HA VAL A 481 106.606 2.055 9.336 1.00 0.00 H new ATOM 0 HB VAL A 481 104.227 2.207 8.379 1.00 0.00 H new ATOM 0 HG11 VAL A 481 103.345 0.501 9.916 1.00 0.00 H new ATOM 0 HG12 VAL A 481 105.057 0.214 9.522 1.00 0.00 H new ATOM 0 HG13 VAL A 481 104.612 0.914 11.096 1.00 0.00 H new ATOM 0 HG21 VAL A 481 102.444 2.801 9.969 1.00 0.00 H new ATOM 0 HG22 VAL A 481 103.673 3.312 11.150 1.00 0.00 H new ATOM 0 HG23 VAL A 481 103.499 4.188 9.611 1.00 0.00 H new ATOM 703 N LEU A 482 106.340 3.714 7.389 1.00 0.00 N ATOM 704 CA LEU A 482 106.525 4.752 6.382 1.00 0.00 C ATOM 705 C LEU A 482 105.177 5.284 5.907 1.00 0.00 C ATOM 706 O LEU A 482 104.784 6.401 6.248 1.00 0.00 O ATOM 707 CB LEU A 482 107.326 4.205 5.195 1.00 0.00 C ATOM 708 CG LEU A 482 108.102 5.253 4.396 1.00 0.00 C ATOM 709 CD1 LEU A 482 109.172 4.588 3.542 1.00 0.00 C ATOM 710 CD2 LEU A 482 107.156 6.068 3.527 1.00 0.00 C ATOM 0 H LEU A 482 106.444 2.762 7.038 1.00 0.00 H new ATOM 0 HA LEU A 482 107.082 5.573 6.833 1.00 0.00 H new ATOM 0 HB2 LEU A 482 108.029 3.459 5.565 1.00 0.00 H new ATOM 0 HB3 LEU A 482 106.641 3.691 4.521 1.00 0.00 H new ATOM 0 HG LEU A 482 108.592 5.928 5.098 1.00 0.00 H new ATOM 0 HD11 LEU A 482 109.714 5.349 2.980 1.00 0.00 H new ATOM 0 HD12 LEU A 482 109.867 4.048 4.185 1.00 0.00 H new ATOM 0 HD13 LEU A 482 108.702 3.891 2.848 1.00 0.00 H new ATOM 0 HD21 LEU A 482 107.725 6.809 2.965 1.00 0.00 H new ATOM 0 HD22 LEU A 482 106.638 5.406 2.833 1.00 0.00 H new ATOM 0 HD23 LEU A 482 106.426 6.574 4.159 1.00 0.00 H new ATOM 722 N TYR A 483 104.470 4.480 5.118 1.00 0.00 N ATOM 723 CA TYR A 483 103.164 4.879 4.599 1.00 0.00 C ATOM 724 C TYR A 483 102.247 3.674 4.440 1.00 0.00 C ATOM 725 O TYR A 483 102.689 2.599 4.046 1.00 0.00 O ATOM 726 CB TYR A 483 103.318 5.594 3.255 1.00 0.00 C ATOM 727 CG TYR A 483 102.039 5.643 2.449 1.00 0.00 C ATOM 728 CD1 TYR A 483 101.618 4.543 1.712 1.00 0.00 C ATOM 729 CD2 TYR A 483 101.252 6.788 2.427 1.00 0.00 C ATOM 730 CE1 TYR A 483 100.449 4.582 0.976 1.00 0.00 C ATOM 731 CE2 TYR A 483 100.082 6.834 1.694 1.00 0.00 C ATOM 732 CZ TYR A 483 99.685 5.730 0.970 1.00 0.00 C ATOM 733 OH TYR A 483 98.519 5.771 0.240 1.00 0.00 O ATOM 0 H TYR A 483 104.777 3.553 4.825 1.00 0.00 H new ATOM 0 HA TYR A 483 102.714 5.564 5.318 1.00 0.00 H new ATOM 0 HB2 TYR A 483 103.666 6.612 3.431 1.00 0.00 H new ATOM 0 HB3 TYR A 483 104.088 5.090 2.670 1.00 0.00 H new ATOM 0 HD1 TYR A 483 102.214 3.643 1.714 1.00 0.00 H new ATOM 0 HD2 TYR A 483 101.560 7.656 2.992 1.00 0.00 H new ATOM 0 HE1 TYR A 483 100.135 3.718 0.409 1.00 0.00 H new ATOM 0 HE2 TYR A 483 99.481 7.731 1.688 1.00 0.00 H new ATOM 0 HH TYR A 483 98.099 6.651 0.343 1.00 0.00 H new ATOM 743 N VAL A 484 100.968 3.858 4.751 1.00 0.00 N ATOM 744 CA VAL A 484 99.997 2.777 4.641 1.00 0.00 C ATOM 745 C VAL A 484 99.178 2.885 3.359 1.00 0.00 C ATOM 746 O VAL A 484 98.529 3.900 3.108 1.00 0.00 O ATOM 747 CB VAL A 484 99.034 2.756 5.842 1.00 0.00 C ATOM 748 CG1 VAL A 484 98.455 1.363 6.037 1.00 0.00 C ATOM 749 CG2 VAL A 484 99.742 3.230 7.103 1.00 0.00 C ATOM 0 H VAL A 484 100.581 4.743 5.080 1.00 0.00 H new ATOM 0 HA VAL A 484 100.572 1.851 4.624 1.00 0.00 H new ATOM 0 HB VAL A 484 98.211 3.441 5.637 1.00 0.00 H new ATOM 0 HG11 VAL A 484 97.777 1.367 6.890 1.00 0.00 H new ATOM 0 HG12 VAL A 484 97.909 1.067 5.141 1.00 0.00 H new ATOM 0 HG13 VAL A 484 99.264 0.655 6.220 1.00 0.00 H new ATOM 0 HG21 VAL A 484 99.046 3.208 7.941 1.00 0.00 H new ATOM 0 HG22 VAL A 484 100.586 2.573 7.315 1.00 0.00 H new ATOM 0 HG23 VAL A 484 100.102 4.248 6.957 1.00 0.00 H new ATOM 759 N ASP A 485 99.206 1.825 2.557 1.00 0.00 N ATOM 760 CA ASP A 485 98.457 1.795 1.306 1.00 0.00 C ATOM 761 C ASP A 485 97.170 0.999 1.477 1.00 0.00 C ATOM 762 O ASP A 485 97.063 -0.141 1.026 1.00 0.00 O ATOM 763 CB ASP A 485 99.305 1.190 0.191 1.00 0.00 C ATOM 764 CG ASP A 485 98.566 1.129 -1.132 1.00 0.00 C ATOM 765 OD1 ASP A 485 97.408 1.595 -1.188 1.00 0.00 O ATOM 766 OD2 ASP A 485 99.145 0.616 -2.112 1.00 0.00 O ATOM 0 H ASP A 485 99.738 0.977 2.751 1.00 0.00 H new ATOM 0 HA ASP A 485 98.202 2.819 1.033 1.00 0.00 H new ATOM 0 HB2 ASP A 485 100.214 1.780 0.069 1.00 0.00 H new ATOM 0 HB3 ASP A 485 99.613 0.185 0.478 1.00 0.00 H new ATOM 771 N LEU A 486 96.201 1.613 2.140 1.00 0.00 N ATOM 772 CA LEU A 486 94.913 0.973 2.391 1.00 0.00 C ATOM 773 C LEU A 486 93.934 1.238 1.253 1.00 0.00 C ATOM 774 O LEU A 486 93.685 2.388 0.890 1.00 0.00 O ATOM 775 CB LEU A 486 94.324 1.473 3.712 1.00 0.00 C ATOM 776 CG LEU A 486 92.809 1.305 3.857 1.00 0.00 C ATOM 777 CD1 LEU A 486 92.074 2.399 3.099 1.00 0.00 C ATOM 778 CD2 LEU A 486 92.374 -0.069 3.369 1.00 0.00 C ATOM 0 H LEU A 486 96.281 2.558 2.516 1.00 0.00 H new ATOM 0 HA LEU A 486 95.079 -0.102 2.454 1.00 0.00 H new ATOM 0 HB2 LEU A 486 94.812 0.945 4.531 1.00 0.00 H new ATOM 0 HB3 LEU A 486 94.568 2.529 3.823 1.00 0.00 H new ATOM 0 HG LEU A 486 92.555 1.390 4.913 1.00 0.00 H new ATOM 0 HD11 LEU A 486 90.999 2.262 3.214 1.00 0.00 H new ATOM 0 HD12 LEU A 486 92.361 3.373 3.497 1.00 0.00 H new ATOM 0 HD13 LEU A 486 92.335 2.348 2.042 1.00 0.00 H new ATOM 0 HD21 LEU A 486 91.294 -0.170 3.480 1.00 0.00 H new ATOM 0 HD22 LEU A 486 92.643 -0.184 2.319 1.00 0.00 H new ATOM 0 HD23 LEU A 486 92.873 -0.839 3.958 1.00 0.00 H new ATOM 790 N LEU A 487 93.377 0.166 0.697 1.00 0.00 N ATOM 791 CA LEU A 487 92.419 0.283 -0.396 1.00 0.00 C ATOM 792 C LEU A 487 91.199 1.090 0.040 1.00 0.00 C ATOM 793 O LEU A 487 90.285 0.562 0.674 1.00 0.00 O ATOM 794 CB LEU A 487 91.987 -1.104 -0.871 1.00 0.00 C ATOM 795 CG LEU A 487 92.842 -1.702 -1.989 1.00 0.00 C ATOM 796 CD1 LEU A 487 92.424 -3.137 -2.272 1.00 0.00 C ATOM 797 CD2 LEU A 487 92.739 -0.856 -3.248 1.00 0.00 C ATOM 0 H LEU A 487 93.573 -0.793 0.986 1.00 0.00 H new ATOM 0 HA LEU A 487 92.903 0.806 -1.221 1.00 0.00 H new ATOM 0 HB2 LEU A 487 92.003 -1.784 -0.019 1.00 0.00 H new ATOM 0 HB3 LEU A 487 90.954 -1.048 -1.215 1.00 0.00 H new ATOM 0 HG LEU A 487 93.882 -1.707 -1.663 1.00 0.00 H new ATOM 0 HD11 LEU A 487 93.043 -3.546 -3.070 1.00 0.00 H new ATOM 0 HD12 LEU A 487 92.551 -3.737 -1.371 1.00 0.00 H new ATOM 0 HD13 LEU A 487 91.378 -3.158 -2.578 1.00 0.00 H new ATOM 0 HD21 LEU A 487 93.354 -1.296 -4.033 1.00 0.00 H new ATOM 0 HD22 LEU A 487 91.701 -0.819 -3.578 1.00 0.00 H new ATOM 0 HD23 LEU A 487 93.089 0.155 -3.037 1.00 0.00 H new ATOM 809 N GLU A 488 91.198 2.375 -0.296 1.00 0.00 N ATOM 810 CA GLU A 488 90.099 3.265 0.064 1.00 0.00 C ATOM 811 C GLU A 488 88.750 2.553 -0.025 1.00 0.00 C ATOM 812 O GLU A 488 88.300 2.185 -1.110 1.00 0.00 O ATOM 813 CB GLU A 488 90.098 4.498 -0.843 1.00 0.00 C ATOM 814 CG GLU A 488 89.930 4.171 -2.319 1.00 0.00 C ATOM 815 CD GLU A 488 91.095 4.653 -3.160 1.00 0.00 C ATOM 816 OE1 GLU A 488 92.211 4.117 -2.993 1.00 0.00 O ATOM 817 OE2 GLU A 488 90.893 5.568 -3.987 1.00 0.00 O ATOM 0 H GLU A 488 91.949 2.826 -0.819 1.00 0.00 H new ATOM 0 HA GLU A 488 90.249 3.576 1.098 1.00 0.00 H new ATOM 0 HB2 GLU A 488 89.293 5.165 -0.534 1.00 0.00 H new ATOM 0 HB3 GLU A 488 91.033 5.041 -0.704 1.00 0.00 H new ATOM 0 HG2 GLU A 488 89.822 3.093 -2.438 1.00 0.00 H new ATOM 0 HG3 GLU A 488 89.010 4.626 -2.685 1.00 0.00 H new ATOM 824 N GLY A 489 88.104 2.376 1.125 1.00 0.00 N ATOM 825 CA GLY A 489 86.806 1.725 1.158 1.00 0.00 C ATOM 826 C GLY A 489 86.893 0.212 1.077 1.00 0.00 C ATOM 827 O GLY A 489 85.885 -0.458 0.854 1.00 0.00 O ATOM 0 H GLY A 489 88.457 2.672 2.035 1.00 0.00 H new ATOM 0 HA2 GLY A 489 86.290 2.004 2.077 1.00 0.00 H new ATOM 0 HA3 GLY A 489 86.201 2.092 0.329 1.00 0.00 H new ATOM 831 N ASP A 490 88.092 -0.330 1.256 1.00 0.00 N ATOM 832 CA ASP A 490 88.286 -1.775 1.196 1.00 0.00 C ATOM 833 C ASP A 490 88.786 -2.321 2.530 1.00 0.00 C ATOM 834 O ASP A 490 89.301 -1.577 3.364 1.00 0.00 O ATOM 835 CB ASP A 490 89.272 -2.134 0.084 1.00 0.00 C ATOM 836 CG ASP A 490 88.984 -3.488 -0.530 1.00 0.00 C ATOM 837 OD1 ASP A 490 89.013 -4.494 0.211 1.00 0.00 O ATOM 838 OD2 ASP A 490 88.728 -3.545 -1.751 1.00 0.00 O ATOM 0 H ASP A 490 88.940 0.205 1.443 1.00 0.00 H new ATOM 0 HA ASP A 490 87.320 -2.232 0.980 1.00 0.00 H new ATOM 0 HB2 ASP A 490 89.233 -1.370 -0.693 1.00 0.00 H new ATOM 0 HB3 ASP A 490 90.285 -2.129 0.485 1.00 0.00 H new ATOM 843 N THR A 491 88.627 -3.628 2.721 1.00 0.00 N ATOM 844 CA THR A 491 89.058 -4.280 3.951 1.00 0.00 C ATOM 845 C THR A 491 90.478 -4.819 3.820 1.00 0.00 C ATOM 846 O THR A 491 90.937 -5.594 4.659 1.00 0.00 O ATOM 847 CB THR A 491 88.119 -5.440 4.333 1.00 0.00 C ATOM 848 OG1 THR A 491 88.058 -6.427 3.295 1.00 0.00 O ATOM 849 CG2 THR A 491 86.711 -4.933 4.598 1.00 0.00 C ATOM 0 H THR A 491 88.202 -4.256 2.038 1.00 0.00 H new ATOM 0 HA THR A 491 89.028 -3.523 4.734 1.00 0.00 H new ATOM 0 HB THR A 491 88.527 -5.891 5.237 1.00 0.00 H new ATOM 0 HG1 THR A 491 87.456 -7.151 3.567 1.00 0.00 H new ATOM 0 HG21 THR A 491 86.067 -5.771 4.866 1.00 0.00 H new ATOM 0 HG22 THR A 491 86.731 -4.214 5.417 1.00 0.00 H new ATOM 0 HG23 THR A 491 86.324 -4.450 3.701 1.00 0.00 H new ATOM 857 N GLU A 492 91.170 -4.405 2.764 1.00 0.00 N ATOM 858 CA GLU A 492 92.538 -4.849 2.528 1.00 0.00 C ATOM 859 C GLU A 492 93.482 -3.660 2.377 1.00 0.00 C ATOM 860 O GLU A 492 93.316 -2.831 1.483 1.00 0.00 O ATOM 861 CB GLU A 492 92.607 -5.723 1.275 1.00 0.00 C ATOM 862 CG GLU A 492 91.407 -6.636 1.098 1.00 0.00 C ATOM 863 CD GLU A 492 91.243 -7.113 -0.332 1.00 0.00 C ATOM 864 OE1 GLU A 492 91.080 -8.335 -0.535 1.00 0.00 O ATOM 865 OE2 GLU A 492 91.279 -6.265 -1.249 1.00 0.00 O ATOM 0 H GLU A 492 90.806 -3.764 2.059 1.00 0.00 H new ATOM 0 HA GLU A 492 92.852 -5.434 3.392 1.00 0.00 H new ATOM 0 HB2 GLU A 492 92.695 -5.080 0.399 1.00 0.00 H new ATOM 0 HB3 GLU A 492 93.511 -6.331 1.316 1.00 0.00 H new ATOM 0 HG2 GLU A 492 91.512 -7.499 1.755 1.00 0.00 H new ATOM 0 HG3 GLU A 492 90.505 -6.108 1.407 1.00 0.00 H new ATOM 872 N CYS A 493 94.478 -3.587 3.255 1.00 0.00 N ATOM 873 CA CYS A 493 95.456 -2.504 3.219 1.00 0.00 C ATOM 874 C CYS A 493 96.874 -3.063 3.243 1.00 0.00 C ATOM 875 O CYS A 493 97.139 -4.072 3.893 1.00 0.00 O ATOM 876 CB CYS A 493 95.247 -1.557 4.402 1.00 0.00 C ATOM 877 SG CYS A 493 94.805 -2.388 5.946 1.00 0.00 S ATOM 0 H CYS A 493 94.629 -4.266 4.001 1.00 0.00 H new ATOM 0 HA CYS A 493 95.315 -1.947 2.293 1.00 0.00 H new ATOM 0 HB2 CYS A 493 96.160 -0.983 4.560 1.00 0.00 H new ATOM 0 HB3 CYS A 493 94.462 -0.844 4.148 1.00 0.00 H new ATOM 0 HG CYS A 493 93.694 -3.043 5.783 1.00 0.00 H new ATOM 883 N HIS A 494 97.783 -2.400 2.539 1.00 0.00 N ATOM 884 CA HIS A 494 99.174 -2.835 2.489 1.00 0.00 C ATOM 885 C HIS A 494 100.104 -1.718 2.949 1.00 0.00 C ATOM 886 O HIS A 494 100.345 -0.757 2.218 1.00 0.00 O ATOM 887 CB HIS A 494 99.542 -3.276 1.072 1.00 0.00 C ATOM 888 CG HIS A 494 98.723 -4.426 0.571 1.00 0.00 C ATOM 889 ND1 HIS A 494 97.345 -4.454 0.637 1.00 0.00 N ATOM 890 CD2 HIS A 494 99.094 -5.593 -0.009 1.00 0.00 C ATOM 891 CE1 HIS A 494 96.905 -5.589 0.123 1.00 0.00 C ATOM 892 NE2 HIS A 494 97.946 -6.296 -0.277 1.00 0.00 N ATOM 0 H HIS A 494 97.583 -1.560 1.995 1.00 0.00 H new ATOM 0 HA HIS A 494 99.292 -3.683 3.164 1.00 0.00 H new ATOM 0 HB2 HIS A 494 99.420 -2.431 0.394 1.00 0.00 H new ATOM 0 HB3 HIS A 494 100.596 -3.554 1.049 1.00 0.00 H new ATOM 0 HD2 HIS A 494 100.104 -5.911 -0.221 1.00 0.00 H new ATOM 0 HE1 HIS A 494 95.870 -5.888 0.044 1.00 0.00 H new ATOM 0 HE2 HIS A 494 97.904 -7.216 -0.715 1.00 0.00 H new ATOM 901 N ALA A 495 100.612 -1.845 4.169 1.00 0.00 N ATOM 902 CA ALA A 495 101.504 -0.841 4.733 1.00 0.00 C ATOM 903 C ALA A 495 102.939 -1.024 4.250 1.00 0.00 C ATOM 904 O ALA A 495 103.494 -2.122 4.307 1.00 0.00 O ATOM 905 CB ALA A 495 101.455 -0.866 6.253 1.00 0.00 C ATOM 0 H ALA A 495 100.421 -2.634 4.787 1.00 0.00 H new ATOM 0 HA ALA A 495 101.155 0.131 4.385 1.00 0.00 H new ATOM 0 HB1 ALA A 495 102.129 -0.108 6.651 1.00 0.00 H new ATOM 0 HB2 ALA A 495 100.438 -0.660 6.588 1.00 0.00 H new ATOM 0 HB3 ALA A 495 101.762 -1.849 6.611 1.00 0.00 H new ATOM 911 N ARG A 496 103.535 0.068 3.784 1.00 0.00 N ATOM 912 CA ARG A 496 104.907 0.053 3.298 1.00 0.00 C ATOM 913 C ARG A 496 105.870 0.478 4.404 1.00 0.00 C ATOM 914 O ARG A 496 105.640 1.478 5.091 1.00 0.00 O ATOM 915 CB ARG A 496 105.058 0.980 2.091 1.00 0.00 C ATOM 916 CG ARG A 496 103.805 1.075 1.237 1.00 0.00 C ATOM 917 CD ARG A 496 104.147 1.203 -0.240 1.00 0.00 C ATOM 918 NE ARG A 496 104.981 2.371 -0.508 1.00 0.00 N ATOM 919 CZ ARG A 496 105.000 3.009 -1.674 1.00 0.00 C ATOM 920 NH1 ARG A 496 104.240 2.587 -2.677 1.00 0.00 N ATOM 921 NH2 ARG A 496 105.780 4.068 -1.839 1.00 0.00 N ATOM 0 H ARG A 496 103.084 0.981 3.733 1.00 0.00 H new ATOM 0 HA ARG A 496 105.149 -0.965 2.992 1.00 0.00 H new ATOM 0 HB2 ARG A 496 105.326 1.977 2.440 1.00 0.00 H new ATOM 0 HB3 ARG A 496 105.883 0.626 1.473 1.00 0.00 H new ATOM 0 HG2 ARG A 496 103.188 0.190 1.394 1.00 0.00 H new ATOM 0 HG3 ARG A 496 103.214 1.935 1.551 1.00 0.00 H new ATOM 0 HD2 ARG A 496 104.665 0.303 -0.572 1.00 0.00 H new ATOM 0 HD3 ARG A 496 103.227 1.273 -0.821 1.00 0.00 H new ATOM 0 HE ARG A 496 105.582 2.716 0.240 1.00 0.00 H new ATOM 0 HH11 ARG A 496 103.640 1.772 -2.554 1.00 0.00 H new ATOM 0 HH12 ARG A 496 104.256 3.078 -3.571 1.00 0.00 H new ATOM 0 HH21 ARG A 496 106.366 4.394 -1.071 1.00 0.00 H new ATOM 0 HH22 ARG A 496 105.794 4.557 -2.734 1.00 0.00 H new ATOM 935 N PHE A 497 106.949 -0.283 4.562 1.00 0.00 N ATOM 936 CA PHE A 497 107.956 0.004 5.577 1.00 0.00 C ATOM 937 C PHE A 497 109.261 0.470 4.938 1.00 0.00 C ATOM 938 O PHE A 497 109.530 0.184 3.772 1.00 0.00 O ATOM 939 CB PHE A 497 108.203 -1.236 6.437 1.00 0.00 C ATOM 940 CG PHE A 497 107.027 -1.612 7.290 1.00 0.00 C ATOM 941 CD1 PHE A 497 105.778 -1.810 6.722 1.00 0.00 C ATOM 942 CD2 PHE A 497 107.166 -1.763 8.660 1.00 0.00 C ATOM 943 CE1 PHE A 497 104.693 -2.152 7.503 1.00 0.00 C ATOM 944 CE2 PHE A 497 106.083 -2.106 9.447 1.00 0.00 C ATOM 945 CZ PHE A 497 104.844 -2.300 8.868 1.00 0.00 C ATOM 0 H PHE A 497 107.148 -1.108 3.996 1.00 0.00 H new ATOM 0 HA PHE A 497 107.582 0.809 6.210 1.00 0.00 H new ATOM 0 HB2 PHE A 497 108.455 -2.075 5.788 1.00 0.00 H new ATOM 0 HB3 PHE A 497 109.066 -1.058 7.079 1.00 0.00 H new ATOM 0 HD1 PHE A 497 105.653 -1.695 5.655 1.00 0.00 H new ATOM 0 HD2 PHE A 497 108.132 -1.611 9.118 1.00 0.00 H new ATOM 0 HE1 PHE A 497 103.726 -2.304 7.047 1.00 0.00 H new ATOM 0 HE2 PHE A 497 106.205 -2.222 10.514 1.00 0.00 H new ATOM 0 HZ PHE A 497 103.996 -2.567 9.481 1.00 0.00 H new ATOM 955 N LYS A 498 110.062 1.203 5.707 1.00 0.00 N ATOM 956 CA LYS A 498 111.334 1.723 5.214 1.00 0.00 C ATOM 957 C LYS A 498 112.437 0.668 5.269 1.00 0.00 C ATOM 958 O LYS A 498 113.451 0.787 4.582 1.00 0.00 O ATOM 959 CB LYS A 498 111.750 2.947 6.031 1.00 0.00 C ATOM 960 CG LYS A 498 111.651 4.256 5.264 1.00 0.00 C ATOM 961 CD LYS A 498 112.762 5.216 5.658 1.00 0.00 C ATOM 962 CE LYS A 498 114.037 4.939 4.879 1.00 0.00 C ATOM 963 NZ LYS A 498 115.243 4.997 5.750 1.00 0.00 N ATOM 0 H LYS A 498 109.853 1.450 6.674 1.00 0.00 H new ATOM 0 HA LYS A 498 111.193 2.006 4.171 1.00 0.00 H new ATOM 0 HB2 LYS A 498 111.123 3.009 6.921 1.00 0.00 H new ATOM 0 HB3 LYS A 498 112.776 2.813 6.373 1.00 0.00 H new ATOM 0 HG2 LYS A 498 111.703 4.057 4.194 1.00 0.00 H new ATOM 0 HG3 LYS A 498 110.683 4.719 5.455 1.00 0.00 H new ATOM 0 HD2 LYS A 498 112.439 6.242 5.478 1.00 0.00 H new ATOM 0 HD3 LYS A 498 112.960 5.127 6.726 1.00 0.00 H new ATOM 0 HE2 LYS A 498 113.972 3.955 4.414 1.00 0.00 H new ATOM 0 HE3 LYS A 498 114.136 5.667 4.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 498 116.092 4.803 5.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 498 115.320 5.943 6.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 498 115.161 4.285 6.504 1.00 0.00 H new ATOM 977 N THR A 499 112.237 -0.363 6.084 1.00 0.00 N ATOM 978 CA THR A 499 113.224 -1.430 6.215 1.00 0.00 C ATOM 979 C THR A 499 112.553 -2.776 6.454 1.00 0.00 C ATOM 980 O THR A 499 111.469 -2.849 7.032 1.00 0.00 O ATOM 981 CB THR A 499 114.211 -1.158 7.364 1.00 0.00 C ATOM 982 OG1 THR A 499 113.664 -0.238 8.318 1.00 0.00 O ATOM 983 CG2 THR A 499 115.516 -0.584 6.834 1.00 0.00 C ATOM 0 H THR A 499 111.405 -0.482 6.661 1.00 0.00 H new ATOM 0 HA THR A 499 113.774 -1.458 5.274 1.00 0.00 H new ATOM 0 HB THR A 499 114.398 -2.115 7.852 1.00 0.00 H new ATOM 0 HG1 THR A 499 114.248 -0.197 9.104 1.00 0.00 H new ATOM 0 HG21 THR A 499 116.197 -0.400 7.665 1.00 0.00 H new ATOM 0 HG22 THR A 499 115.971 -1.293 6.142 1.00 0.00 H new ATOM 0 HG23 THR A 499 115.317 0.353 6.314 1.00 0.00 H new ATOM 991 N PRO A 500 113.197 -3.863 6.008 1.00 0.00 N ATOM 992 CA PRO A 500 112.670 -5.222 6.165 1.00 0.00 C ATOM 993 C PRO A 500 112.751 -5.718 7.605 1.00 0.00 C ATOM 994 O PRO A 500 111.839 -6.385 8.093 1.00 0.00 O ATOM 995 CB PRO A 500 113.578 -6.056 5.262 1.00 0.00 C ATOM 996 CG PRO A 500 114.864 -5.306 5.228 1.00 0.00 C ATOM 997 CD PRO A 500 114.495 -3.849 5.311 1.00 0.00 C ATOM 0 HA PRO A 500 111.613 -5.281 5.906 1.00 0.00 H new ATOM 0 HB2 PRO A 500 113.716 -7.062 5.659 1.00 0.00 H new ATOM 0 HB3 PRO A 500 113.154 -6.162 4.263 1.00 0.00 H new ATOM 0 HG2 PRO A 500 115.506 -5.594 6.060 1.00 0.00 H new ATOM 0 HG3 PRO A 500 115.415 -5.518 4.312 1.00 0.00 H new ATOM 0 HD2 PRO A 500 115.241 -3.277 5.863 1.00 0.00 H new ATOM 0 HD3 PRO A 500 114.415 -3.398 4.322 1.00 0.00 H new ATOM 1005 N GLU A 501 113.846 -5.386 8.282 1.00 0.00 N ATOM 1006 CA GLU A 501 114.036 -5.799 9.667 1.00 0.00 C ATOM 1007 C GLU A 501 112.911 -5.261 10.545 1.00 0.00 C ATOM 1008 O GLU A 501 112.424 -5.950 11.443 1.00 0.00 O ATOM 1009 CB GLU A 501 115.388 -5.307 10.191 1.00 0.00 C ATOM 1010 CG GLU A 501 115.592 -3.809 10.038 1.00 0.00 C ATOM 1011 CD GLU A 501 116.954 -3.353 10.522 1.00 0.00 C ATOM 1012 OE1 GLU A 501 117.321 -3.690 11.666 1.00 0.00 O ATOM 1013 OE2 GLU A 501 117.654 -2.656 9.755 1.00 0.00 O ATOM 0 H GLU A 501 114.612 -4.834 7.895 1.00 0.00 H new ATOM 0 HA GLU A 501 114.019 -6.888 9.704 1.00 0.00 H new ATOM 0 HB2 GLU A 501 115.478 -5.572 11.245 1.00 0.00 H new ATOM 0 HB3 GLU A 501 116.185 -5.830 9.662 1.00 0.00 H new ATOM 0 HG2 GLU A 501 115.473 -3.535 8.990 1.00 0.00 H new ATOM 0 HG3 GLU A 501 114.817 -3.282 10.595 1.00 0.00 H new ATOM 1020 N ASP A 502 112.499 -4.027 10.275 1.00 0.00 N ATOM 1021 CA ASP A 502 111.430 -3.390 11.033 1.00 0.00 C ATOM 1022 C ASP A 502 110.112 -4.139 10.861 1.00 0.00 C ATOM 1023 O ASP A 502 109.367 -4.330 11.823 1.00 0.00 O ATOM 1024 CB ASP A 502 111.262 -1.935 10.594 1.00 0.00 C ATOM 1025 CG ASP A 502 112.459 -1.078 10.961 1.00 0.00 C ATOM 1026 OD1 ASP A 502 113.595 -1.594 10.916 1.00 0.00 O ATOM 1027 OD2 ASP A 502 112.259 0.109 11.291 1.00 0.00 O ATOM 0 H ASP A 502 112.891 -3.447 9.534 1.00 0.00 H new ATOM 0 HA ASP A 502 111.705 -3.417 12.087 1.00 0.00 H new ATOM 0 HB2 ASP A 502 111.110 -1.899 9.515 1.00 0.00 H new ATOM 0 HB3 ASP A 502 110.366 -1.520 11.056 1.00 0.00 H new ATOM 1032 N ALA A 503 109.829 -4.563 9.633 1.00 0.00 N ATOM 1033 CA ALA A 503 108.599 -5.293 9.346 1.00 0.00 C ATOM 1034 C ALA A 503 108.606 -6.650 10.039 1.00 0.00 C ATOM 1035 O ALA A 503 107.578 -7.107 10.540 1.00 0.00 O ATOM 1036 CB ALA A 503 108.400 -5.466 7.847 1.00 0.00 C ATOM 0 H ALA A 503 110.432 -4.414 8.824 1.00 0.00 H new ATOM 0 HA ALA A 503 107.765 -4.707 9.734 1.00 0.00 H new ATOM 0 HB1 ALA A 503 107.476 -6.013 7.663 1.00 0.00 H new ATOM 0 HB2 ALA A 503 108.342 -4.487 7.372 1.00 0.00 H new ATOM 0 HB3 ALA A 503 109.240 -6.022 7.430 1.00 0.00 H new ATOM 1042 N GLN A 504 109.773 -7.287 10.067 1.00 0.00 N ATOM 1043 CA GLN A 504 109.916 -8.589 10.705 1.00 0.00 C ATOM 1044 C GLN A 504 109.588 -8.496 12.193 1.00 0.00 C ATOM 1045 O GLN A 504 108.899 -9.351 12.747 1.00 0.00 O ATOM 1046 CB GLN A 504 111.340 -9.119 10.517 1.00 0.00 C ATOM 1047 CG GLN A 504 111.515 -10.565 10.946 1.00 0.00 C ATOM 1048 CD GLN A 504 112.160 -11.418 9.871 1.00 0.00 C ATOM 1049 OE1 GLN A 504 111.939 -11.206 8.679 1.00 0.00 O ATOM 1050 NE2 GLN A 504 112.962 -12.390 10.290 1.00 0.00 N ATOM 0 H GLN A 504 110.632 -6.922 9.655 1.00 0.00 H new ATOM 0 HA GLN A 504 109.216 -9.279 10.235 1.00 0.00 H new ATOM 0 HB2 GLN A 504 111.618 -9.025 9.467 1.00 0.00 H new ATOM 0 HB3 GLN A 504 112.029 -8.495 11.086 1.00 0.00 H new ATOM 0 HG2 GLN A 504 112.125 -10.601 11.848 1.00 0.00 H new ATOM 0 HG3 GLN A 504 110.542 -10.984 11.202 1.00 0.00 H new ATOM 0 HE21 GLN A 504 113.116 -12.529 11.289 1.00 0.00 H new ATOM 0 HE22 GLN A 504 113.424 -12.997 9.613 1.00 0.00 H new ATOM 1059 N ALA A 505 110.089 -7.449 12.838 1.00 0.00 N ATOM 1060 CA ALA A 505 109.843 -7.248 14.259 1.00 0.00 C ATOM 1061 C ALA A 505 108.365 -6.972 14.519 1.00 0.00 C ATOM 1062 O ALA A 505 107.792 -7.466 15.490 1.00 0.00 O ATOM 1063 CB ALA A 505 110.695 -6.113 14.805 1.00 0.00 C ATOM 0 H ALA A 505 110.665 -6.730 12.401 1.00 0.00 H new ATOM 0 HA ALA A 505 110.121 -8.165 14.778 1.00 0.00 H new ATOM 0 HB1 ALA A 505 110.492 -5.984 15.868 1.00 0.00 H new ATOM 0 HB2 ALA A 505 111.750 -6.349 14.663 1.00 0.00 H new ATOM 0 HB3 ALA A 505 110.455 -5.191 14.275 1.00 0.00 H new ATOM 1069 N VAL A 506 107.755 -6.177 13.644 1.00 0.00 N ATOM 1070 CA VAL A 506 106.344 -5.833 13.780 1.00 0.00 C ATOM 1071 C VAL A 506 105.445 -7.039 13.521 1.00 0.00 C ATOM 1072 O VAL A 506 104.474 -7.266 14.241 1.00 0.00 O ATOM 1073 CB VAL A 506 105.956 -4.697 12.813 1.00 0.00 C ATOM 1074 CG1 VAL A 506 104.445 -4.552 12.723 1.00 0.00 C ATOM 1075 CG2 VAL A 506 106.599 -3.389 13.244 1.00 0.00 C ATOM 0 H VAL A 506 108.215 -5.760 12.835 1.00 0.00 H new ATOM 0 HA VAL A 506 106.198 -5.499 14.807 1.00 0.00 H new ATOM 0 HB VAL A 506 106.328 -4.952 11.821 1.00 0.00 H new ATOM 0 HG11 VAL A 506 104.197 -3.744 12.035 1.00 0.00 H new ATOM 0 HG12 VAL A 506 104.011 -5.484 12.360 1.00 0.00 H new ATOM 0 HG13 VAL A 506 104.042 -4.324 13.710 1.00 0.00 H new ATOM 0 HG21 VAL A 506 106.315 -2.598 12.550 1.00 0.00 H new ATOM 0 HG22 VAL A 506 106.261 -3.131 14.248 1.00 0.00 H new ATOM 0 HG23 VAL A 506 107.683 -3.499 13.244 1.00 0.00 H new ATOM 1085 N ILE A 507 105.769 -7.806 12.483 1.00 0.00 N ATOM 1086 CA ILE A 507 104.977 -8.981 12.136 1.00 0.00 C ATOM 1087 C ILE A 507 105.068 -10.045 13.220 1.00 0.00 C ATOM 1088 O ILE A 507 104.108 -10.770 13.476 1.00 0.00 O ATOM 1089 CB ILE A 507 105.407 -9.598 10.792 1.00 0.00 C ATOM 1090 CG1 ILE A 507 106.913 -9.851 10.768 1.00 0.00 C ATOM 1091 CG2 ILE A 507 104.996 -8.698 9.636 1.00 0.00 C ATOM 1092 CD1 ILE A 507 107.303 -11.211 11.311 1.00 0.00 C ATOM 0 H ILE A 507 106.568 -7.636 11.872 1.00 0.00 H new ATOM 0 HA ILE A 507 103.947 -8.637 12.045 1.00 0.00 H new ATOM 0 HB ILE A 507 104.900 -10.557 10.679 1.00 0.00 H new ATOM 0 HG12 ILE A 507 107.273 -9.760 9.743 1.00 0.00 H new ATOM 0 HG13 ILE A 507 107.413 -9.078 11.351 1.00 0.00 H new ATOM 0 HG21 ILE A 507 105.308 -9.150 8.694 1.00 0.00 H new ATOM 0 HG22 ILE A 507 103.913 -8.575 9.638 1.00 0.00 H new ATOM 0 HG23 ILE A 507 105.472 -7.724 9.746 1.00 0.00 H new ATOM 0 HD11 ILE A 507 108.386 -11.324 11.265 1.00 0.00 H new ATOM 0 HD12 ILE A 507 106.973 -11.298 12.346 1.00 0.00 H new ATOM 0 HD13 ILE A 507 106.831 -11.991 10.713 1.00 0.00 H new ATOM 1104 N ASN A 508 106.223 -10.119 13.868 1.00 0.00 N ATOM 1105 CA ASN A 508 106.427 -11.080 14.940 1.00 0.00 C ATOM 1106 C ASN A 508 105.590 -10.692 16.154 1.00 0.00 C ATOM 1107 O ASN A 508 105.002 -11.541 16.822 1.00 0.00 O ATOM 1108 CB ASN A 508 107.907 -11.146 15.325 1.00 0.00 C ATOM 1109 CG ASN A 508 108.761 -11.767 14.236 1.00 0.00 C ATOM 1110 OD1 ASN A 508 108.353 -12.729 13.584 1.00 0.00 O ATOM 1111 ND2 ASN A 508 109.953 -11.219 14.034 1.00 0.00 N ATOM 0 H ASN A 508 107.029 -9.527 13.670 1.00 0.00 H new ATOM 0 HA ASN A 508 106.114 -12.064 14.590 1.00 0.00 H new ATOM 0 HB2 ASN A 508 108.269 -10.140 15.538 1.00 0.00 H new ATOM 0 HB3 ASN A 508 108.015 -11.725 16.242 1.00 0.00 H new ATOM 0 HD21 ASN A 508 110.572 -11.594 13.315 1.00 0.00 H new ATOM 0 HD22 ASN A 508 110.250 -10.423 14.598 1.00 0.00 H new ATOM 1118 N ALA A 509 105.546 -9.391 16.419 1.00 0.00 N ATOM 1119 CA ALA A 509 104.786 -8.852 17.542 1.00 0.00 C ATOM 1120 C ALA A 509 103.289 -8.821 17.248 1.00 0.00 C ATOM 1121 O ALA A 509 102.470 -8.728 18.162 1.00 0.00 O ATOM 1122 CB ALA A 509 105.272 -7.455 17.900 1.00 0.00 C ATOM 0 H ALA A 509 106.032 -8.685 15.866 1.00 0.00 H new ATOM 0 HA ALA A 509 104.950 -9.516 18.391 1.00 0.00 H new ATOM 0 HB1 ALA A 509 104.692 -7.072 18.740 1.00 0.00 H new ATOM 0 HB2 ALA A 509 106.326 -7.496 18.176 1.00 0.00 H new ATOM 0 HB3 ALA A 509 105.147 -6.795 17.042 1.00 0.00 H new ATOM 1128 N TYR A 510 102.939 -8.868 15.968 1.00 0.00 N ATOM 1129 CA TYR A 510 101.540 -8.809 15.555 1.00 0.00 C ATOM 1130 C TYR A 510 100.723 -9.971 16.103 1.00 0.00 C ATOM 1131 O TYR A 510 99.497 -9.887 16.178 1.00 0.00 O ATOM 1132 CB TYR A 510 101.428 -8.775 14.036 1.00 0.00 C ATOM 1133 CG TYR A 510 100.908 -7.457 13.518 1.00 0.00 C ATOM 1134 CD1 TYR A 510 100.015 -7.404 12.457 1.00 0.00 C ATOM 1135 CD2 TYR A 510 101.316 -6.263 14.094 1.00 0.00 C ATOM 1136 CE1 TYR A 510 99.542 -6.196 11.981 1.00 0.00 C ATOM 1137 CE2 TYR A 510 100.848 -5.050 13.626 1.00 0.00 C ATOM 1138 CZ TYR A 510 99.963 -5.021 12.568 1.00 0.00 C ATOM 1139 OH TYR A 510 99.494 -3.816 12.098 1.00 0.00 O ATOM 0 H TYR A 510 103.603 -8.947 15.198 1.00 0.00 H new ATOM 0 HA TYR A 510 101.130 -7.889 15.972 1.00 0.00 H new ATOM 0 HB2 TYR A 510 102.407 -8.971 13.599 1.00 0.00 H new ATOM 0 HB3 TYR A 510 100.766 -9.576 13.707 1.00 0.00 H new ATOM 0 HD1 TYR A 510 99.684 -8.323 11.995 1.00 0.00 H new ATOM 0 HD2 TYR A 510 102.010 -6.282 14.921 1.00 0.00 H new ATOM 0 HE1 TYR A 510 98.847 -6.172 11.155 1.00 0.00 H new ATOM 0 HE2 TYR A 510 101.174 -4.129 14.086 1.00 0.00 H new ATOM 0 HH TYR A 510 99.165 -3.278 12.848 1.00 0.00 H new ATOM 1149 N THR A 511 101.388 -11.050 16.492 1.00 0.00 N ATOM 1150 CA THR A 511 100.678 -12.197 17.036 1.00 0.00 C ATOM 1151 C THR A 511 99.675 -11.736 18.086 1.00 0.00 C ATOM 1152 O THR A 511 98.589 -12.298 18.221 1.00 0.00 O ATOM 1153 CB THR A 511 101.644 -13.217 17.670 1.00 0.00 C ATOM 1154 OG1 THR A 511 102.456 -12.609 18.682 1.00 0.00 O ATOM 1155 CG2 THR A 511 102.560 -13.823 16.618 1.00 0.00 C ATOM 0 H THR A 511 102.401 -11.155 16.442 1.00 0.00 H new ATOM 0 HA THR A 511 100.159 -12.685 16.211 1.00 0.00 H new ATOM 0 HB THR A 511 101.029 -13.997 18.120 1.00 0.00 H new ATOM 0 HG1 THR A 511 103.267 -12.240 18.273 1.00 0.00 H new ATOM 0 HG21 THR A 511 103.232 -14.540 17.090 1.00 0.00 H new ATOM 0 HG22 THR A 511 101.960 -14.331 15.863 1.00 0.00 H new ATOM 0 HG23 THR A 511 103.145 -13.033 16.146 1.00 0.00 H new ATOM 1163 N GLU A 512 100.067 -10.713 18.838 1.00 0.00 N ATOM 1164 CA GLU A 512 99.229 -10.166 19.900 1.00 0.00 C ATOM 1165 C GLU A 512 97.954 -9.533 19.348 1.00 0.00 C ATOM 1166 O GLU A 512 97.017 -9.258 20.097 1.00 0.00 O ATOM 1167 CB GLU A 512 100.010 -9.131 20.707 1.00 0.00 C ATOM 1168 CG GLU A 512 101.078 -9.736 21.600 1.00 0.00 C ATOM 1169 CD GLU A 512 101.717 -8.713 22.518 1.00 0.00 C ATOM 1170 OE1 GLU A 512 101.090 -8.358 23.538 1.00 0.00 O ATOM 1171 OE2 GLU A 512 102.844 -8.267 22.217 1.00 0.00 O ATOM 0 H GLU A 512 100.966 -10.243 18.731 1.00 0.00 H new ATOM 0 HA GLU A 512 98.940 -10.994 20.547 1.00 0.00 H new ATOM 0 HB2 GLU A 512 100.479 -8.426 20.021 1.00 0.00 H new ATOM 0 HB3 GLU A 512 99.314 -8.562 21.322 1.00 0.00 H new ATOM 0 HG2 GLU A 512 100.637 -10.532 22.200 1.00 0.00 H new ATOM 0 HG3 GLU A 512 101.849 -10.194 20.980 1.00 0.00 H new ATOM 1178 N ILE A 513 97.925 -9.294 18.043 1.00 0.00 N ATOM 1179 CA ILE A 513 96.761 -8.681 17.412 1.00 0.00 C ATOM 1180 C ILE A 513 95.504 -9.522 17.621 1.00 0.00 C ATOM 1181 O ILE A 513 94.446 -8.994 17.964 1.00 0.00 O ATOM 1182 CB ILE A 513 96.988 -8.465 15.904 1.00 0.00 C ATOM 1183 CG1 ILE A 513 98.074 -7.412 15.679 1.00 0.00 C ATOM 1184 CG2 ILE A 513 95.690 -8.050 15.225 1.00 0.00 C ATOM 1185 CD1 ILE A 513 97.745 -6.066 16.288 1.00 0.00 C ATOM 0 H ILE A 513 98.689 -9.513 17.403 1.00 0.00 H new ATOM 0 HA ILE A 513 96.619 -7.712 17.890 1.00 0.00 H new ATOM 0 HB ILE A 513 97.320 -9.405 15.462 1.00 0.00 H new ATOM 0 HG12 ILE A 513 99.012 -7.773 16.101 1.00 0.00 H new ATOM 0 HG13 ILE A 513 98.233 -7.288 14.608 1.00 0.00 H new ATOM 0 HG21 ILE A 513 95.868 -7.901 14.160 1.00 0.00 H new ATOM 0 HG22 ILE A 513 94.942 -8.831 15.362 1.00 0.00 H new ATOM 0 HG23 ILE A 513 95.330 -7.120 15.666 1.00 0.00 H new ATOM 0 HD11 ILE A 513 98.559 -5.368 16.090 1.00 0.00 H new ATOM 0 HD12 ILE A 513 96.824 -5.683 15.849 1.00 0.00 H new ATOM 0 HD13 ILE A 513 97.615 -6.176 17.365 1.00 0.00 H new ATOM 1197 N ASN A 514 95.619 -10.830 17.411 1.00 0.00 N ATOM 1198 CA ASN A 514 94.483 -11.732 17.577 1.00 0.00 C ATOM 1199 C ASN A 514 93.988 -11.738 19.020 1.00 0.00 C ATOM 1200 O ASN A 514 92.814 -12.004 19.282 1.00 0.00 O ATOM 1201 CB ASN A 514 94.869 -13.153 17.155 1.00 0.00 C ATOM 1202 CG ASN A 514 93.893 -14.196 17.665 1.00 0.00 C ATOM 1203 OD1 ASN A 514 94.293 -15.274 18.106 1.00 0.00 O ATOM 1204 ND2 ASN A 514 92.604 -13.880 17.607 1.00 0.00 N ATOM 0 H ASN A 514 96.485 -11.288 17.126 1.00 0.00 H new ATOM 0 HA ASN A 514 93.675 -11.373 16.940 1.00 0.00 H new ATOM 0 HB2 ASN A 514 94.916 -13.205 16.067 1.00 0.00 H new ATOM 0 HB3 ASN A 514 95.867 -13.381 17.529 1.00 0.00 H new ATOM 0 HD21 ASN A 514 91.901 -14.542 17.936 1.00 0.00 H new ATOM 0 HD22 ASN A 514 92.317 -12.975 17.234 1.00 0.00 H new ATOM 1211 N LYS A 515 94.887 -11.445 19.955 1.00 0.00 N ATOM 1212 CA LYS A 515 94.535 -11.420 21.370 1.00 0.00 C ATOM 1213 C LYS A 515 93.421 -10.413 21.639 1.00 0.00 C ATOM 1214 O LYS A 515 92.709 -10.511 22.639 1.00 0.00 O ATOM 1215 CB LYS A 515 95.763 -11.078 22.217 1.00 0.00 C ATOM 1216 CG LYS A 515 96.886 -12.095 22.097 1.00 0.00 C ATOM 1217 CD LYS A 515 96.830 -13.123 23.215 1.00 0.00 C ATOM 1218 CE LYS A 515 95.812 -14.212 22.923 1.00 0.00 C ATOM 1219 NZ LYS A 515 95.925 -15.348 23.877 1.00 0.00 N ATOM 0 H LYS A 515 95.863 -11.222 19.758 1.00 0.00 H new ATOM 0 HA LYS A 515 94.176 -12.412 21.645 1.00 0.00 H new ATOM 0 HB2 LYS A 515 96.138 -10.098 21.920 1.00 0.00 H new ATOM 0 HB3 LYS A 515 95.463 -11.001 23.262 1.00 0.00 H new ATOM 0 HG2 LYS A 515 96.819 -12.600 21.133 1.00 0.00 H new ATOM 0 HG3 LYS A 515 97.847 -11.582 22.122 1.00 0.00 H new ATOM 0 HD2 LYS A 515 97.815 -13.571 23.348 1.00 0.00 H new ATOM 0 HD3 LYS A 515 96.576 -12.628 24.152 1.00 0.00 H new ATOM 0 HE2 LYS A 515 94.807 -13.793 22.975 1.00 0.00 H new ATOM 0 HE3 LYS A 515 95.953 -14.577 21.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 515 95.213 -16.069 23.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 515 96.875 -15.765 23.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 515 95.765 -15.005 24.846 1.00 0.00 H new ATOM 1233 N LYS A 516 93.276 -9.447 20.739 1.00 0.00 N ATOM 1234 CA LYS A 516 92.247 -8.421 20.878 1.00 0.00 C ATOM 1235 C LYS A 516 91.242 -8.501 19.733 1.00 0.00 C ATOM 1236 O LYS A 516 90.038 -8.627 19.960 1.00 0.00 O ATOM 1237 CB LYS A 516 92.883 -7.030 20.920 1.00 0.00 C ATOM 1238 CG LYS A 516 91.912 -5.929 21.314 1.00 0.00 C ATOM 1239 CD LYS A 516 91.554 -5.999 22.789 1.00 0.00 C ATOM 1240 CE LYS A 516 90.225 -6.705 23.009 1.00 0.00 C ATOM 1241 NZ LYS A 516 89.100 -5.742 23.168 1.00 0.00 N ATOM 0 H LYS A 516 93.857 -9.352 19.906 1.00 0.00 H new ATOM 0 HA LYS A 516 91.718 -8.597 21.815 1.00 0.00 H new ATOM 0 HB2 LYS A 516 93.713 -7.040 21.626 1.00 0.00 H new ATOM 0 HB3 LYS A 516 93.301 -6.801 19.940 1.00 0.00 H new ATOM 0 HG2 LYS A 516 92.353 -4.957 21.092 1.00 0.00 H new ATOM 0 HG3 LYS A 516 91.005 -6.011 20.715 1.00 0.00 H new ATOM 0 HD2 LYS A 516 92.340 -6.525 23.330 1.00 0.00 H new ATOM 0 HD3 LYS A 516 91.504 -4.991 23.200 1.00 0.00 H new ATOM 0 HE2 LYS A 516 90.021 -7.364 22.165 1.00 0.00 H new ATOM 0 HE3 LYS A 516 90.292 -7.334 23.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 88.213 -6.265 23.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 89.281 -5.129 23.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 89.019 -5.158 22.311 1.00 0.00 H new ATOM 1255 N HIS A 517 91.741 -8.430 18.504 1.00 0.00 N ATOM 1256 CA HIS A 517 90.885 -8.501 17.324 1.00 0.00 C ATOM 1257 C HIS A 517 91.526 -9.354 16.236 1.00 0.00 C ATOM 1258 O HIS A 517 92.657 -9.098 15.820 1.00 0.00 O ATOM 1259 CB HIS A 517 90.604 -7.099 16.776 1.00 0.00 C ATOM 1260 CG HIS A 517 90.654 -6.019 17.810 1.00 0.00 C ATOM 1261 ND1 HIS A 517 89.531 -5.534 18.446 1.00 0.00 N ATOM 1262 CD2 HIS A 517 91.699 -5.319 18.310 1.00 0.00 C ATOM 1263 CE1 HIS A 517 89.882 -4.581 19.290 1.00 0.00 C ATOM 1264 NE2 HIS A 517 91.192 -4.431 19.228 1.00 0.00 N ATOM 0 H HIS A 517 92.734 -8.323 18.298 1.00 0.00 H new ATOM 0 HA HIS A 517 89.945 -8.963 17.625 1.00 0.00 H new ATOM 0 HB2 HIS A 517 91.330 -6.873 15.995 1.00 0.00 H new ATOM 0 HB3 HIS A 517 89.620 -7.094 16.308 1.00 0.00 H new ATOM 0 HD1 HIS A 517 88.577 -5.860 18.289 1.00 0.00 H new ATOM 0 HD2 HIS A 517 92.738 -5.436 18.038 1.00 0.00 H new ATOM 0 HE1 HIS A 517 89.211 -4.020 19.923 1.00 0.00 H new ATOM 1273 N CYS A 518 90.799 -10.366 15.772 1.00 0.00 N ATOM 1274 CA CYS A 518 91.302 -11.247 14.726 1.00 0.00 C ATOM 1275 C CYS A 518 91.806 -10.432 13.542 1.00 0.00 C ATOM 1276 O CYS A 518 91.054 -9.669 12.937 1.00 0.00 O ATOM 1277 CB CYS A 518 90.207 -12.213 14.270 1.00 0.00 C ATOM 1278 SG CYS A 518 90.830 -13.720 13.490 1.00 0.00 S ATOM 0 H CYS A 518 89.862 -10.595 16.104 1.00 0.00 H new ATOM 0 HA CYS A 518 92.132 -11.825 15.133 1.00 0.00 H new ATOM 0 HB2 CYS A 518 89.598 -12.488 15.131 1.00 0.00 H new ATOM 0 HB3 CYS A 518 89.552 -11.697 13.568 1.00 0.00 H new ATOM 0 HG CYS A 518 89.830 -14.474 13.141 1.00 0.00 H new ATOM 1284 N TRP A 519 93.086 -10.589 13.219 1.00 0.00 N ATOM 1285 CA TRP A 519 93.681 -9.853 12.110 1.00 0.00 C ATOM 1286 C TRP A 519 94.766 -10.663 11.420 1.00 0.00 C ATOM 1287 O TRP A 519 95.463 -11.462 12.045 1.00 0.00 O ATOM 1288 CB TRP A 519 94.255 -8.531 12.603 1.00 0.00 C ATOM 1289 CG TRP A 519 93.874 -7.377 11.741 1.00 0.00 C ATOM 1290 CD1 TRP A 519 93.341 -7.445 10.491 1.00 0.00 C ATOM 1291 CD2 TRP A 519 93.994 -5.988 12.059 1.00 0.00 C ATOM 1292 NE1 TRP A 519 93.118 -6.186 10.007 1.00 0.00 N ATOM 1293 CE2 TRP A 519 93.510 -5.266 10.951 1.00 0.00 C ATOM 1294 CE3 TRP A 519 94.461 -5.285 13.173 1.00 0.00 C ATOM 1295 CZ2 TRP A 519 93.482 -3.871 10.929 1.00 0.00 C ATOM 1296 CZ3 TRP A 519 94.432 -3.904 13.149 1.00 0.00 C ATOM 1297 CH2 TRP A 519 93.944 -3.211 12.034 1.00 0.00 C ATOM 0 H TRP A 519 93.727 -11.215 13.706 1.00 0.00 H new ATOM 0 HA TRP A 519 92.893 -9.657 11.383 1.00 0.00 H new ATOM 0 HB2 TRP A 519 93.910 -8.348 13.621 1.00 0.00 H new ATOM 0 HB3 TRP A 519 95.342 -8.605 12.643 1.00 0.00 H new ATOM 0 HD1 TRP A 519 93.126 -8.360 9.959 1.00 0.00 H new ATOM 0 HE1 TRP A 519 92.724 -5.965 9.093 1.00 0.00 H new ATOM 0 HE3 TRP A 519 94.838 -5.812 14.037 1.00 0.00 H new ATOM 0 HZ2 TRP A 519 93.109 -3.332 10.071 1.00 0.00 H new ATOM 0 HZ3 TRP A 519 94.791 -3.350 14.004 1.00 0.00 H new ATOM 0 HH2 TRP A 519 93.932 -2.131 12.047 1.00 0.00 H new ATOM 1308 N LYS A 520 94.888 -10.451 10.119 1.00 0.00 N ATOM 1309 CA LYS A 520 95.868 -11.151 9.308 1.00 0.00 C ATOM 1310 C LYS A 520 96.983 -10.216 8.854 1.00 0.00 C ATOM 1311 O LYS A 520 96.721 -9.130 8.338 1.00 0.00 O ATOM 1312 CB LYS A 520 95.175 -11.742 8.093 1.00 0.00 C ATOM 1313 CG LYS A 520 93.774 -12.256 8.386 1.00 0.00 C ATOM 1314 CD LYS A 520 93.787 -13.353 9.438 1.00 0.00 C ATOM 1315 CE LYS A 520 92.786 -13.070 10.547 1.00 0.00 C ATOM 1316 NZ LYS A 520 91.402 -13.459 10.162 1.00 0.00 N ATOM 0 H LYS A 520 94.311 -9.790 9.598 1.00 0.00 H new ATOM 0 HA LYS A 520 96.315 -11.941 9.911 1.00 0.00 H new ATOM 0 HB2 LYS A 520 95.120 -10.984 7.311 1.00 0.00 H new ATOM 0 HB3 LYS A 520 95.780 -12.560 7.702 1.00 0.00 H new ATOM 0 HG2 LYS A 520 93.148 -11.432 8.727 1.00 0.00 H new ATOM 0 HG3 LYS A 520 93.327 -12.637 7.468 1.00 0.00 H new ATOM 0 HD2 LYS A 520 93.554 -14.310 8.971 1.00 0.00 H new ATOM 0 HD3 LYS A 520 94.787 -13.441 9.862 1.00 0.00 H new ATOM 0 HE2 LYS A 520 93.078 -13.613 11.446 1.00 0.00 H new ATOM 0 HE3 LYS A 520 92.809 -12.009 10.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 520 90.841 -13.640 11.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 520 90.964 -12.689 9.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 520 91.433 -14.320 9.580 1.00 0.00 H new ATOM 1330 N LEU A 521 98.225 -10.644 9.038 1.00 0.00 N ATOM 1331 CA LEU A 521 99.372 -9.842 8.634 1.00 0.00 C ATOM 1332 C LEU A 521 100.442 -10.708 7.972 1.00 0.00 C ATOM 1333 O LEU A 521 100.929 -11.669 8.565 1.00 0.00 O ATOM 1334 CB LEU A 521 99.954 -9.110 9.842 1.00 0.00 C ATOM 1335 CG LEU A 521 101.459 -8.846 9.787 1.00 0.00 C ATOM 1336 CD1 LEU A 521 101.768 -7.431 10.248 1.00 0.00 C ATOM 1337 CD2 LEU A 521 102.206 -9.862 10.636 1.00 0.00 C ATOM 0 H LEU A 521 98.464 -11.540 9.463 1.00 0.00 H new ATOM 0 HA LEU A 521 99.033 -9.107 7.903 1.00 0.00 H new ATOM 0 HB2 LEU A 521 99.439 -8.156 9.950 1.00 0.00 H new ATOM 0 HB3 LEU A 521 99.737 -9.692 10.737 1.00 0.00 H new ATOM 0 HG LEU A 521 101.792 -8.949 8.754 1.00 0.00 H new ATOM 0 HD11 LEU A 521 102.844 -7.260 10.203 1.00 0.00 H new ATOM 0 HD12 LEU A 521 101.260 -6.718 9.599 1.00 0.00 H new ATOM 0 HD13 LEU A 521 101.423 -7.299 11.273 1.00 0.00 H new ATOM 0 HD21 LEU A 521 103.276 -9.661 10.587 1.00 0.00 H new ATOM 0 HD22 LEU A 521 101.870 -9.789 11.670 1.00 0.00 H new ATOM 0 HD23 LEU A 521 102.008 -10.866 10.260 1.00 0.00 H new ATOM 1349 N GLU A 522 100.807 -10.358 6.742 1.00 0.00 N ATOM 1350 CA GLU A 522 101.823 -11.104 6.009 1.00 0.00 C ATOM 1351 C GLU A 522 102.735 -10.163 5.225 1.00 0.00 C ATOM 1352 O GLU A 522 102.277 -9.176 4.652 1.00 0.00 O ATOM 1353 CB GLU A 522 101.166 -12.104 5.056 1.00 0.00 C ATOM 1354 CG GLU A 522 102.155 -12.831 4.159 1.00 0.00 C ATOM 1355 CD GLU A 522 103.256 -13.520 4.942 1.00 0.00 C ATOM 1356 OE1 GLU A 522 102.939 -14.194 5.944 1.00 0.00 O ATOM 1357 OE2 GLU A 522 104.435 -13.384 4.553 1.00 0.00 O ATOM 0 H GLU A 522 100.415 -9.565 6.234 1.00 0.00 H new ATOM 0 HA GLU A 522 102.429 -11.647 6.735 1.00 0.00 H new ATOM 0 HB2 GLU A 522 100.610 -12.838 5.640 1.00 0.00 H new ATOM 0 HB3 GLU A 522 100.442 -11.578 4.433 1.00 0.00 H new ATOM 0 HG2 GLU A 522 101.622 -13.570 3.561 1.00 0.00 H new ATOM 0 HG3 GLU A 522 102.600 -12.119 3.463 1.00 0.00 H new ATOM 1364 N ILE A 523 104.026 -10.481 5.199 1.00 0.00 N ATOM 1365 CA ILE A 523 104.998 -9.670 4.478 1.00 0.00 C ATOM 1366 C ILE A 523 105.187 -10.199 3.058 1.00 0.00 C ATOM 1367 O ILE A 523 105.680 -11.309 2.859 1.00 0.00 O ATOM 1368 CB ILE A 523 106.360 -9.638 5.210 1.00 0.00 C ATOM 1369 CG1 ILE A 523 106.277 -8.722 6.432 1.00 0.00 C ATOM 1370 CG2 ILE A 523 107.470 -9.175 4.275 1.00 0.00 C ATOM 1371 CD1 ILE A 523 107.311 -9.034 7.493 1.00 0.00 C ATOM 0 H ILE A 523 104.422 -11.295 5.669 1.00 0.00 H new ATOM 0 HA ILE A 523 104.609 -8.653 4.434 1.00 0.00 H new ATOM 0 HB ILE A 523 106.597 -10.649 5.540 1.00 0.00 H new ATOM 0 HG12 ILE A 523 106.399 -7.688 6.110 1.00 0.00 H new ATOM 0 HG13 ILE A 523 105.282 -8.804 6.870 1.00 0.00 H new ATOM 0 HG21 ILE A 523 108.417 -9.161 4.814 1.00 0.00 H new ATOM 0 HG22 ILE A 523 107.543 -9.860 3.430 1.00 0.00 H new ATOM 0 HG23 ILE A 523 107.245 -8.172 3.911 1.00 0.00 H new ATOM 0 HD11 ILE A 523 107.193 -8.345 8.330 1.00 0.00 H new ATOM 0 HD12 ILE A 523 107.176 -10.057 7.843 1.00 0.00 H new ATOM 0 HD13 ILE A 523 108.310 -8.924 7.071 1.00 0.00 H new ATOM 1383 N LEU A 524 104.786 -9.398 2.076 1.00 0.00 N ATOM 1384 CA LEU A 524 104.906 -9.787 0.676 1.00 0.00 C ATOM 1385 C LEU A 524 106.346 -10.153 0.334 1.00 0.00 C ATOM 1386 O LEU A 524 107.286 -9.488 0.770 1.00 0.00 O ATOM 1387 CB LEU A 524 104.423 -8.655 -0.232 1.00 0.00 C ATOM 1388 CG LEU A 524 102.917 -8.362 -0.185 1.00 0.00 C ATOM 1389 CD1 LEU A 524 102.240 -8.859 -1.452 1.00 0.00 C ATOM 1390 CD2 LEU A 524 102.273 -8.991 1.045 1.00 0.00 C ATOM 0 H LEU A 524 104.375 -8.476 2.224 1.00 0.00 H new ATOM 0 HA LEU A 524 104.281 -10.665 0.513 1.00 0.00 H new ATOM 0 HB2 LEU A 524 104.960 -7.745 0.035 1.00 0.00 H new ATOM 0 HB3 LEU A 524 104.696 -8.896 -1.259 1.00 0.00 H new ATOM 0 HG LEU A 524 102.786 -7.282 -0.119 1.00 0.00 H new ATOM 0 HD11 LEU A 524 101.173 -8.644 -1.403 1.00 0.00 H new ATOM 0 HD12 LEU A 524 102.672 -8.356 -2.317 1.00 0.00 H new ATOM 0 HD13 LEU A 524 102.389 -9.935 -1.546 1.00 0.00 H new ATOM 0 HD21 LEU A 524 101.206 -8.767 1.052 1.00 0.00 H new ATOM 0 HD22 LEU A 524 102.417 -10.071 1.019 1.00 0.00 H new ATOM 0 HD23 LEU A 524 102.735 -8.585 1.945 1.00 0.00 H new ATOM 1402 N SER A 525 106.510 -11.224 -0.434 1.00 0.00 N ATOM 1403 CA SER A 525 107.835 -11.694 -0.820 1.00 0.00 C ATOM 1404 C SER A 525 107.829 -12.271 -2.232 1.00 0.00 C ATOM 1405 O SER A 525 106.775 -12.605 -2.775 1.00 0.00 O ATOM 1406 CB SER A 525 108.338 -12.744 0.172 1.00 0.00 C ATOM 1407 OG SER A 525 108.968 -13.821 -0.500 1.00 0.00 O ATOM 0 H SER A 525 105.741 -11.784 -0.802 1.00 0.00 H new ATOM 0 HA SER A 525 108.509 -10.837 -0.806 1.00 0.00 H new ATOM 0 HB2 SER A 525 109.040 -12.285 0.867 1.00 0.00 H new ATOM 0 HB3 SER A 525 107.503 -13.119 0.764 1.00 0.00 H new ATOM 0 HG SER A 525 109.282 -14.477 0.156 1.00 0.00 H new ATOM 1413 N GLY A 526 109.018 -12.386 -2.814 1.00 0.00 N ATOM 1414 CA GLY A 526 109.146 -12.931 -4.153 1.00 0.00 C ATOM 1415 C GLY A 526 108.263 -12.233 -5.165 1.00 0.00 C ATOM 1416 O GLY A 526 108.184 -11.005 -5.191 1.00 0.00 O ATOM 0 H GLY A 526 109.899 -12.110 -2.380 1.00 0.00 H new ATOM 0 HA2 GLY A 526 110.185 -12.854 -4.472 1.00 0.00 H new ATOM 0 HA3 GLY A 526 108.897 -13.992 -4.132 1.00 0.00 H new ATOM 1420 N ASP A 527 107.606 -13.022 -6.009 1.00 0.00 N ATOM 1421 CA ASP A 527 106.732 -12.481 -7.041 1.00 0.00 C ATOM 1422 C ASP A 527 105.566 -11.712 -6.434 1.00 0.00 C ATOM 1423 O ASP A 527 105.061 -10.764 -7.034 1.00 0.00 O ATOM 1424 CB ASP A 527 106.199 -13.608 -7.926 1.00 0.00 C ATOM 1425 CG ASP A 527 107.280 -14.230 -8.788 1.00 0.00 C ATOM 1426 OD1 ASP A 527 108.474 -14.005 -8.496 1.00 0.00 O ATOM 1427 OD2 ASP A 527 106.934 -14.941 -9.755 1.00 0.00 O ATOM 0 H ASP A 527 107.663 -14.040 -5.997 1.00 0.00 H new ATOM 0 HA ASP A 527 107.320 -11.790 -7.645 1.00 0.00 H new ATOM 0 HB2 ASP A 527 105.752 -14.378 -7.298 1.00 0.00 H new ATOM 0 HB3 ASP A 527 105.407 -13.219 -8.566 1.00 0.00 H new ATOM 1432 N HIS A 528 105.134 -12.121 -5.245 1.00 0.00 N ATOM 1433 CA HIS A 528 104.021 -11.455 -4.581 1.00 0.00 C ATOM 1434 C HIS A 528 104.372 -10.010 -4.242 1.00 0.00 C ATOM 1435 O HIS A 528 103.587 -9.097 -4.497 1.00 0.00 O ATOM 1436 CB HIS A 528 103.627 -12.207 -3.310 1.00 0.00 C ATOM 1437 CG HIS A 528 102.173 -12.089 -2.975 1.00 0.00 C ATOM 1438 ND1 HIS A 528 101.682 -12.230 -1.694 1.00 0.00 N ATOM 1439 CD2 HIS A 528 101.101 -11.840 -3.763 1.00 0.00 C ATOM 1440 CE1 HIS A 528 100.370 -12.071 -1.709 1.00 0.00 C ATOM 1441 NE2 HIS A 528 99.993 -11.832 -2.951 1.00 0.00 N ATOM 0 H HIS A 528 105.534 -12.903 -4.726 1.00 0.00 H new ATOM 0 HA HIS A 528 103.175 -11.453 -5.268 1.00 0.00 H new ATOM 0 HB2 HIS A 528 103.881 -13.261 -3.427 1.00 0.00 H new ATOM 0 HB3 HIS A 528 104.216 -11.828 -2.475 1.00 0.00 H new ATOM 0 HD2 HIS A 528 101.114 -11.678 -4.831 1.00 0.00 H new ATOM 0 HE1 HIS A 528 99.717 -12.127 -0.850 1.00 0.00 H new ATOM 0 HE2 HIS A 528 99.034 -11.668 -3.258 1.00 0.00 H new ATOM 1450 N GLU A 529 105.557 -9.805 -3.674 1.00 0.00 N ATOM 1451 CA GLU A 529 105.999 -8.461 -3.314 1.00 0.00 C ATOM 1452 C GLU A 529 106.251 -7.623 -4.562 1.00 0.00 C ATOM 1453 O GLU A 529 105.823 -6.471 -4.651 1.00 0.00 O ATOM 1454 CB GLU A 529 107.268 -8.530 -2.461 1.00 0.00 C ATOM 1455 CG GLU A 529 108.096 -7.255 -2.493 1.00 0.00 C ATOM 1456 CD GLU A 529 108.930 -7.068 -1.241 1.00 0.00 C ATOM 1457 OE1 GLU A 529 110.169 -6.963 -1.363 1.00 0.00 O ATOM 1458 OE2 GLU A 529 108.344 -7.027 -0.138 1.00 0.00 O ATOM 0 H GLU A 529 106.224 -10.545 -3.454 1.00 0.00 H new ATOM 0 HA GLU A 529 105.208 -7.986 -2.733 1.00 0.00 H new ATOM 0 HB2 GLU A 529 106.990 -8.747 -1.429 1.00 0.00 H new ATOM 0 HB3 GLU A 529 107.883 -9.361 -2.807 1.00 0.00 H new ATOM 0 HG2 GLU A 529 108.753 -7.275 -3.363 1.00 0.00 H new ATOM 0 HG3 GLU A 529 107.433 -6.399 -2.614 1.00 0.00 H new ATOM 1465 N GLN A 530 106.945 -8.214 -5.528 1.00 0.00 N ATOM 1466 CA GLN A 530 107.251 -7.527 -6.776 1.00 0.00 C ATOM 1467 C GLN A 530 105.972 -7.194 -7.537 1.00 0.00 C ATOM 1468 O GLN A 530 105.844 -6.117 -8.119 1.00 0.00 O ATOM 1469 CB GLN A 530 108.185 -8.380 -7.642 1.00 0.00 C ATOM 1470 CG GLN A 530 107.460 -9.301 -8.612 1.00 0.00 C ATOM 1471 CD GLN A 530 107.104 -8.613 -9.914 1.00 0.00 C ATOM 1472 OE1 GLN A 530 107.827 -7.734 -10.384 1.00 0.00 O ATOM 1473 NE2 GLN A 530 105.983 -9.008 -10.505 1.00 0.00 N ATOM 0 H GLN A 530 107.306 -9.166 -5.471 1.00 0.00 H new ATOM 0 HA GLN A 530 107.758 -6.592 -6.537 1.00 0.00 H new ATOM 0 HB2 GLN A 530 108.843 -7.720 -8.207 1.00 0.00 H new ATOM 0 HB3 GLN A 530 108.819 -8.982 -6.991 1.00 0.00 H new ATOM 0 HG2 GLN A 530 108.088 -10.167 -8.823 1.00 0.00 H new ATOM 0 HG3 GLN A 530 106.550 -9.674 -8.142 1.00 0.00 H new ATOM 0 HE21 GLN A 530 105.413 -9.740 -10.081 1.00 0.00 H new ATOM 0 HE22 GLN A 530 105.691 -8.579 -11.383 1.00 0.00 H new ATOM 1482 N ARG A 531 105.029 -8.131 -7.531 1.00 0.00 N ATOM 1483 CA ARG A 531 103.757 -7.951 -8.222 1.00 0.00 C ATOM 1484 C ARG A 531 102.990 -6.755 -7.671 1.00 0.00 C ATOM 1485 O ARG A 531 102.650 -5.831 -8.412 1.00 0.00 O ATOM 1486 CB ARG A 531 102.906 -9.216 -8.097 1.00 0.00 C ATOM 1487 CG ARG A 531 101.644 -9.187 -8.945 1.00 0.00 C ATOM 1488 CD ARG A 531 100.542 -8.379 -8.280 1.00 0.00 C ATOM 1489 NE ARG A 531 99.228 -8.989 -8.471 1.00 0.00 N ATOM 1490 CZ ARG A 531 98.115 -8.538 -7.898 1.00 0.00 C ATOM 1491 NH1 ARG A 531 98.157 -7.474 -7.109 1.00 0.00 N ATOM 1492 NH2 ARG A 531 96.960 -9.153 -8.117 1.00 0.00 N ATOM 0 H ARG A 531 105.123 -9.027 -7.053 1.00 0.00 H new ATOM 0 HA ARG A 531 103.972 -7.761 -9.274 1.00 0.00 H new ATOM 0 HB2 ARG A 531 103.507 -10.078 -8.385 1.00 0.00 H new ATOM 0 HB3 ARG A 531 102.629 -9.355 -7.052 1.00 0.00 H new ATOM 0 HG2 ARG A 531 101.871 -8.759 -9.922 1.00 0.00 H new ATOM 0 HG3 ARG A 531 101.296 -10.206 -9.116 1.00 0.00 H new ATOM 0 HD2 ARG A 531 100.750 -8.291 -7.214 1.00 0.00 H new ATOM 0 HD3 ARG A 531 100.536 -7.368 -8.688 1.00 0.00 H new ATOM 0 HE ARG A 531 99.160 -9.806 -9.078 1.00 0.00 H new ATOM 0 HH11 ARG A 531 99.044 -6.999 -6.940 1.00 0.00 H new ATOM 0 HH12 ARG A 531 97.303 -7.130 -6.671 1.00 0.00 H new ATOM 0 HH21 ARG A 531 96.925 -9.972 -8.725 1.00 0.00 H new ATOM 0 HH22 ARG A 531 96.107 -8.807 -7.678 1.00 0.00 H new ATOM 1506 N TYR A 532 102.716 -6.774 -6.370 1.00 0.00 N ATOM 1507 CA TYR A 532 101.986 -5.683 -5.738 1.00 0.00 C ATOM 1508 C TYR A 532 102.630 -4.346 -6.072 1.00 0.00 C ATOM 1509 O TYR A 532 101.940 -3.373 -6.380 1.00 0.00 O ATOM 1510 CB TYR A 532 101.935 -5.877 -4.222 1.00 0.00 C ATOM 1511 CG TYR A 532 101.220 -4.758 -3.503 1.00 0.00 C ATOM 1512 CD1 TYR A 532 101.885 -3.586 -3.179 1.00 0.00 C ATOM 1513 CD2 TYR A 532 99.881 -4.872 -3.152 1.00 0.00 C ATOM 1514 CE1 TYR A 532 101.239 -2.554 -2.523 1.00 0.00 C ATOM 1515 CE2 TYR A 532 99.226 -3.846 -2.497 1.00 0.00 C ATOM 1516 CZ TYR A 532 99.910 -2.689 -2.185 1.00 0.00 C ATOM 1517 OH TYR A 532 99.262 -1.664 -1.536 1.00 0.00 O ATOM 0 H TYR A 532 102.987 -7.527 -5.738 1.00 0.00 H new ATOM 0 HA TYR A 532 100.967 -5.687 -6.125 1.00 0.00 H new ATOM 0 HB2 TYR A 532 101.436 -6.820 -3.999 1.00 0.00 H new ATOM 0 HB3 TYR A 532 102.952 -5.956 -3.838 1.00 0.00 H new ATOM 0 HD1 TYR A 532 102.926 -3.477 -3.444 1.00 0.00 H new ATOM 0 HD2 TYR A 532 99.343 -5.777 -3.395 1.00 0.00 H new ATOM 0 HE1 TYR A 532 101.773 -1.648 -2.277 1.00 0.00 H new ATOM 0 HE2 TYR A 532 98.184 -3.949 -2.231 1.00 0.00 H new ATOM 0 HH TYR A 532 99.210 -0.884 -2.127 1.00 0.00 H new ATOM 1527 N TRP A 533 103.956 -4.305 -6.023 1.00 0.00 N ATOM 1528 CA TRP A 533 104.682 -3.083 -6.335 1.00 0.00 C ATOM 1529 C TRP A 533 104.422 -2.657 -7.772 1.00 0.00 C ATOM 1530 O TRP A 533 104.215 -1.476 -8.050 1.00 0.00 O ATOM 1531 CB TRP A 533 106.177 -3.269 -6.089 1.00 0.00 C ATOM 1532 CG TRP A 533 106.569 -2.916 -4.691 1.00 0.00 C ATOM 1533 CD1 TRP A 533 106.993 -3.770 -3.718 1.00 0.00 C ATOM 1534 CD2 TRP A 533 106.550 -1.610 -4.104 1.00 0.00 C ATOM 1535 NE1 TRP A 533 107.241 -3.076 -2.561 1.00 0.00 N ATOM 1536 CE2 TRP A 533 106.979 -1.748 -2.772 1.00 0.00 C ATOM 1537 CE3 TRP A 533 106.215 -0.337 -4.577 1.00 0.00 C ATOM 1538 CZ2 TRP A 533 107.080 -0.661 -1.906 1.00 0.00 C ATOM 1539 CZ3 TRP A 533 106.316 0.741 -3.717 1.00 0.00 C ATOM 1540 CH2 TRP A 533 106.747 0.573 -2.395 1.00 0.00 C ATOM 0 H TRP A 533 104.546 -5.098 -5.772 1.00 0.00 H new ATOM 0 HA TRP A 533 104.323 -2.293 -5.675 1.00 0.00 H new ATOM 0 HB2 TRP A 533 106.450 -4.305 -6.290 1.00 0.00 H new ATOM 0 HB3 TRP A 533 106.738 -2.650 -6.789 1.00 0.00 H new ATOM 0 HD1 TRP A 533 107.116 -4.836 -3.840 1.00 0.00 H new ATOM 0 HE1 TRP A 533 107.568 -3.483 -1.685 1.00 0.00 H new ATOM 0 HE3 TRP A 533 105.883 -0.199 -5.595 1.00 0.00 H new ATOM 0 HZ2 TRP A 533 107.409 -0.788 -0.885 1.00 0.00 H new ATOM 0 HZ3 TRP A 533 106.058 1.728 -4.070 1.00 0.00 H new ATOM 0 HH2 TRP A 533 106.818 1.435 -1.748 1.00 0.00 H new ATOM 1551 N GLN A 534 104.411 -3.626 -8.682 1.00 0.00 N ATOM 1552 CA GLN A 534 104.149 -3.336 -10.083 1.00 0.00 C ATOM 1553 C GLN A 534 102.887 -2.493 -10.191 1.00 0.00 C ATOM 1554 O GLN A 534 102.848 -1.497 -10.913 1.00 0.00 O ATOM 1555 CB GLN A 534 103.989 -4.631 -10.881 1.00 0.00 C ATOM 1556 CG GLN A 534 105.304 -5.349 -11.147 1.00 0.00 C ATOM 1557 CD GLN A 534 106.372 -4.424 -11.699 1.00 0.00 C ATOM 1558 OE1 GLN A 534 106.235 -3.884 -12.796 1.00 0.00 O ATOM 1559 NE2 GLN A 534 107.446 -4.240 -10.940 1.00 0.00 N ATOM 0 H GLN A 534 104.579 -4.610 -8.475 1.00 0.00 H new ATOM 0 HA GLN A 534 104.993 -2.785 -10.498 1.00 0.00 H new ATOM 0 HB2 GLN A 534 103.322 -5.301 -10.340 1.00 0.00 H new ATOM 0 HB3 GLN A 534 103.509 -4.404 -11.833 1.00 0.00 H new ATOM 0 HG2 GLN A 534 105.662 -5.799 -10.221 1.00 0.00 H new ATOM 0 HG3 GLN A 534 105.133 -6.163 -11.852 1.00 0.00 H new ATOM 0 HE21 GLN A 534 107.518 -4.708 -10.037 1.00 0.00 H new ATOM 0 HE22 GLN A 534 108.199 -3.631 -11.260 1.00 0.00 H new ATOM 1568 N LYS A 535 101.865 -2.893 -9.442 1.00 0.00 N ATOM 1569 CA LYS A 535 100.605 -2.170 -9.422 1.00 0.00 C ATOM 1570 C LYS A 535 100.827 -0.766 -8.867 1.00 0.00 C ATOM 1571 O LYS A 535 100.228 0.203 -9.335 1.00 0.00 O ATOM 1572 CB LYS A 535 99.568 -2.935 -8.584 1.00 0.00 C ATOM 1573 CG LYS A 535 98.640 -2.046 -7.769 1.00 0.00 C ATOM 1574 CD LYS A 535 99.293 -1.617 -6.466 1.00 0.00 C ATOM 1575 CE LYS A 535 98.651 -2.298 -5.269 1.00 0.00 C ATOM 1576 NZ LYS A 535 97.631 -1.432 -4.617 1.00 0.00 N ATOM 0 H LYS A 535 101.888 -3.716 -8.840 1.00 0.00 H new ATOM 0 HA LYS A 535 100.221 -2.085 -10.439 1.00 0.00 H new ATOM 0 HB2 LYS A 535 98.966 -3.554 -9.249 1.00 0.00 H new ATOM 0 HB3 LYS A 535 100.092 -3.610 -7.907 1.00 0.00 H new ATOM 0 HG2 LYS A 535 98.372 -1.165 -8.352 1.00 0.00 H new ATOM 0 HG3 LYS A 535 97.714 -2.581 -7.556 1.00 0.00 H new ATOM 0 HD2 LYS A 535 100.356 -1.856 -6.495 1.00 0.00 H new ATOM 0 HD3 LYS A 535 99.213 -0.535 -6.357 1.00 0.00 H new ATOM 0 HE2 LYS A 535 98.185 -3.230 -5.589 1.00 0.00 H new ATOM 0 HE3 LYS A 535 99.422 -2.560 -4.544 1.00 0.00 H new ATOM 0 HZ1 LYS A 535 97.217 -1.934 -3.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 535 98.080 -0.553 -4.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 535 96.882 -1.203 -5.301 1.00 0.00 H new ATOM 1590 N ILE A 536 101.703 -0.666 -7.869 1.00 0.00 N ATOM 1591 CA ILE A 536 102.020 0.616 -7.250 1.00 0.00 C ATOM 1592 C ILE A 536 102.651 1.568 -8.261 1.00 0.00 C ATOM 1593 O ILE A 536 102.053 2.576 -8.640 1.00 0.00 O ATOM 1594 CB ILE A 536 102.994 0.452 -6.063 1.00 0.00 C ATOM 1595 CG1 ILE A 536 102.344 -0.348 -4.933 1.00 0.00 C ATOM 1596 CG2 ILE A 536 103.445 1.814 -5.558 1.00 0.00 C ATOM 1597 CD1 ILE A 536 103.132 -0.308 -3.639 1.00 0.00 C ATOM 0 H ILE A 536 102.206 -1.460 -7.472 1.00 0.00 H new ATOM 0 HA ILE A 536 101.078 1.027 -6.887 1.00 0.00 H new ATOM 0 HB ILE A 536 103.868 -0.099 -6.411 1.00 0.00 H new ATOM 0 HG12 ILE A 536 101.342 0.041 -4.752 1.00 0.00 H new ATOM 0 HG13 ILE A 536 102.231 -1.385 -5.250 1.00 0.00 H new ATOM 0 HG21 ILE A 536 104.131 1.683 -4.721 1.00 0.00 H new ATOM 0 HG22 ILE A 536 103.950 2.351 -6.361 1.00 0.00 H new ATOM 0 HG23 ILE A 536 102.577 2.386 -5.229 1.00 0.00 H new ATOM 0 HD11 ILE A 536 102.615 -0.895 -2.880 1.00 0.00 H new ATOM 0 HD12 ILE A 536 104.126 -0.724 -3.805 1.00 0.00 H new ATOM 0 HD13 ILE A 536 103.222 0.724 -3.300 1.00 0.00 H new ATOM 1609 N LEU A 537 103.866 1.240 -8.688 1.00 0.00 N ATOM 1610 CA LEU A 537 104.591 2.063 -9.649 1.00 0.00 C ATOM 1611 C LEU A 537 103.765 2.293 -10.911 1.00 0.00 C ATOM 1612 O LEU A 537 103.606 3.429 -11.359 1.00 0.00 O ATOM 1613 CB LEU A 537 105.923 1.403 -10.015 1.00 0.00 C ATOM 1614 CG LEU A 537 107.155 2.004 -9.333 1.00 0.00 C ATOM 1615 CD1 LEU A 537 106.888 2.226 -7.853 1.00 0.00 C ATOM 1616 CD2 LEU A 537 108.365 1.103 -9.530 1.00 0.00 C ATOM 0 H LEU A 537 104.370 0.408 -8.383 1.00 0.00 H new ATOM 0 HA LEU A 537 104.784 3.029 -9.183 1.00 0.00 H new ATOM 0 HB2 LEU A 537 105.867 0.344 -9.762 1.00 0.00 H new ATOM 0 HB3 LEU A 537 106.058 1.466 -11.095 1.00 0.00 H new ATOM 0 HG LEU A 537 107.368 2.969 -9.792 1.00 0.00 H new ATOM 0 HD11 LEU A 537 107.774 2.654 -7.384 1.00 0.00 H new ATOM 0 HD12 LEU A 537 106.048 2.910 -7.733 1.00 0.00 H new ATOM 0 HD13 LEU A 537 106.650 1.274 -7.379 1.00 0.00 H new ATOM 0 HD21 LEU A 537 109.232 1.545 -9.039 1.00 0.00 H new ATOM 0 HD22 LEU A 537 108.163 0.123 -9.097 1.00 0.00 H new ATOM 0 HD23 LEU A 537 108.568 0.994 -10.595 1.00 0.00 H new ATOM 1628 N VAL A 538 103.248 1.211 -11.484 1.00 0.00 N ATOM 1629 CA VAL A 538 102.449 1.306 -12.700 1.00 0.00 C ATOM 1630 C VAL A 538 101.303 2.298 -12.529 1.00 0.00 C ATOM 1631 O VAL A 538 101.001 3.073 -13.438 1.00 0.00 O ATOM 1632 CB VAL A 538 101.871 -0.065 -13.099 1.00 0.00 C ATOM 1633 CG1 VAL A 538 100.899 0.080 -14.259 1.00 0.00 C ATOM 1634 CG2 VAL A 538 102.990 -1.035 -13.448 1.00 0.00 C ATOM 0 H VAL A 538 103.367 0.263 -11.128 1.00 0.00 H new ATOM 0 HA VAL A 538 103.114 1.656 -13.490 1.00 0.00 H new ATOM 0 HB VAL A 538 101.324 -0.469 -12.247 1.00 0.00 H new ATOM 0 HG11 VAL A 538 100.502 -0.899 -14.526 1.00 0.00 H new ATOM 0 HG12 VAL A 538 100.079 0.737 -13.967 1.00 0.00 H new ATOM 0 HG13 VAL A 538 101.418 0.507 -15.117 1.00 0.00 H new ATOM 0 HG21 VAL A 538 102.563 -1.998 -13.727 1.00 0.00 H new ATOM 0 HG22 VAL A 538 103.568 -0.639 -14.283 1.00 0.00 H new ATOM 0 HG23 VAL A 538 103.642 -1.164 -12.584 1.00 0.00 H new ATOM 1644 N ASP A 539 100.675 2.282 -11.357 1.00 0.00 N ATOM 1645 CA ASP A 539 99.575 3.196 -11.077 1.00 0.00 C ATOM 1646 C ASP A 539 100.078 4.634 -11.065 1.00 0.00 C ATOM 1647 O ASP A 539 99.406 5.545 -11.552 1.00 0.00 O ATOM 1648 CB ASP A 539 98.925 2.853 -9.735 1.00 0.00 C ATOM 1649 CG ASP A 539 97.950 3.921 -9.277 1.00 0.00 C ATOM 1650 OD1 ASP A 539 96.911 4.102 -9.948 1.00 0.00 O ATOM 1651 OD2 ASP A 539 98.225 4.575 -8.251 1.00 0.00 O ATOM 0 H ASP A 539 100.908 1.650 -10.591 1.00 0.00 H new ATOM 0 HA ASP A 539 98.827 3.091 -11.862 1.00 0.00 H new ATOM 0 HB2 ASP A 539 98.403 1.900 -9.820 1.00 0.00 H new ATOM 0 HB3 ASP A 539 99.701 2.725 -8.980 1.00 0.00 H new ATOM 1656 N ARG A 540 101.274 4.824 -10.518 1.00 0.00 N ATOM 1657 CA ARG A 540 101.886 6.144 -10.451 1.00 0.00 C ATOM 1658 C ARG A 540 102.145 6.684 -11.852 1.00 0.00 C ATOM 1659 O ARG A 540 101.935 7.866 -12.123 1.00 0.00 O ATOM 1660 CB ARG A 540 103.197 6.079 -9.665 1.00 0.00 C ATOM 1661 CG ARG A 540 103.012 5.710 -8.203 1.00 0.00 C ATOM 1662 CD ARG A 540 102.887 6.948 -7.330 1.00 0.00 C ATOM 1663 NE ARG A 540 104.107 7.204 -6.568 1.00 0.00 N ATOM 1664 CZ ARG A 540 104.520 8.418 -6.216 1.00 0.00 C ATOM 1665 NH1 ARG A 540 103.815 9.490 -6.552 1.00 0.00 N ATOM 1666 NH2 ARG A 540 105.642 8.563 -5.522 1.00 0.00 N ATOM 0 H ARG A 540 101.839 4.077 -10.114 1.00 0.00 H new ATOM 0 HA ARG A 540 101.199 6.817 -9.939 1.00 0.00 H new ATOM 0 HB2 ARG A 540 103.857 5.349 -10.135 1.00 0.00 H new ATOM 0 HB3 ARG A 540 103.696 7.046 -9.727 1.00 0.00 H new ATOM 0 HG2 ARG A 540 102.120 5.093 -8.092 1.00 0.00 H new ATOM 0 HG3 ARG A 540 103.858 5.110 -7.868 1.00 0.00 H new ATOM 0 HD2 ARG A 540 102.662 7.812 -7.956 1.00 0.00 H new ATOM 0 HD3 ARG A 540 102.049 6.825 -6.643 1.00 0.00 H new ATOM 0 HE ARG A 540 104.676 6.404 -6.290 1.00 0.00 H new ATOM 0 HH11 ARG A 540 102.951 9.386 -7.083 1.00 0.00 H new ATOM 0 HH12 ARG A 540 104.137 10.418 -6.279 1.00 0.00 H new ATOM 0 HH21 ARG A 540 106.188 7.743 -5.258 1.00 0.00 H new ATOM 0 HH22 ARG A 540 105.958 9.495 -5.252 1.00 0.00 H new ATOM 1680 N GLN A 541 102.601 5.805 -12.739 1.00 0.00 N ATOM 1681 CA GLN A 541 102.890 6.187 -14.116 1.00 0.00 C ATOM 1682 C GLN A 541 101.626 6.679 -14.812 1.00 0.00 C ATOM 1683 O GLN A 541 101.651 7.676 -15.534 1.00 0.00 O ATOM 1684 CB GLN A 541 103.480 5.000 -14.882 1.00 0.00 C ATOM 1685 CG GLN A 541 104.958 5.153 -15.200 1.00 0.00 C ATOM 1686 CD GLN A 541 105.787 3.993 -14.684 1.00 0.00 C ATOM 1687 OE1 GLN A 541 105.980 2.995 -15.377 1.00 0.00 O ATOM 1688 NE2 GLN A 541 106.281 4.119 -13.458 1.00 0.00 N ATOM 0 H GLN A 541 102.778 4.823 -12.528 1.00 0.00 H new ATOM 0 HA GLN A 541 103.618 6.998 -14.102 1.00 0.00 H new ATOM 0 HB2 GLN A 541 103.335 4.092 -14.296 1.00 0.00 H new ATOM 0 HB3 GLN A 541 102.929 4.869 -15.813 1.00 0.00 H new ATOM 0 HG2 GLN A 541 105.087 5.236 -16.279 1.00 0.00 H new ATOM 0 HG3 GLN A 541 105.326 6.081 -14.763 1.00 0.00 H new ATOM 0 HE21 GLN A 541 106.096 4.964 -12.918 1.00 0.00 H new ATOM 0 HE22 GLN A 541 106.845 3.370 -13.056 1.00 0.00 H new ATOM 1697 N ALA A 542 100.522 5.973 -14.590 1.00 0.00 N ATOM 1698 CA ALA A 542 99.248 6.339 -15.194 1.00 0.00 C ATOM 1699 C ALA A 542 98.781 7.706 -14.706 1.00 0.00 C ATOM 1700 O ALA A 542 98.197 8.481 -15.465 1.00 0.00 O ATOM 1701 CB ALA A 542 98.188 5.287 -14.903 1.00 0.00 C ATOM 0 H ALA A 542 100.485 5.144 -13.996 1.00 0.00 H new ATOM 0 HA ALA A 542 99.397 6.393 -16.272 1.00 0.00 H new ATOM 0 HB1 ALA A 542 97.246 5.583 -15.364 1.00 0.00 H new ATOM 0 HB2 ALA A 542 98.506 4.327 -15.311 1.00 0.00 H new ATOM 0 HB3 ALA A 542 98.052 5.196 -13.825 1.00 0.00 H new ATOM 1707 N LYS A 543 99.036 7.995 -13.434 1.00 0.00 N ATOM 1708 CA LYS A 543 98.635 9.268 -12.842 1.00 0.00 C ATOM 1709 C LYS A 543 99.317 10.444 -13.538 1.00 0.00 C ATOM 1710 O LYS A 543 98.823 11.571 -13.495 1.00 0.00 O ATOM 1711 CB LYS A 543 98.968 9.285 -11.348 1.00 0.00 C ATOM 1712 CG LYS A 543 97.759 9.533 -10.462 1.00 0.00 C ATOM 1713 CD LYS A 543 98.111 9.400 -8.989 1.00 0.00 C ATOM 1714 CE LYS A 543 98.305 7.945 -8.593 1.00 0.00 C ATOM 1715 NZ LYS A 543 99.633 7.714 -7.958 1.00 0.00 N ATOM 0 H LYS A 543 99.518 7.365 -12.793 1.00 0.00 H new ATOM 0 HA LYS A 543 97.558 9.372 -12.974 1.00 0.00 H new ATOM 0 HB2 LYS A 543 99.421 8.332 -11.074 1.00 0.00 H new ATOM 0 HB3 LYS A 543 99.713 10.058 -11.158 1.00 0.00 H new ATOM 0 HG2 LYS A 543 97.364 10.531 -10.654 1.00 0.00 H new ATOM 0 HG3 LYS A 543 96.970 8.824 -10.714 1.00 0.00 H new ATOM 0 HD2 LYS A 543 99.022 9.960 -8.779 1.00 0.00 H new ATOM 0 HD3 LYS A 543 97.319 9.841 -8.383 1.00 0.00 H new ATOM 0 HE2 LYS A 543 97.516 7.649 -7.902 1.00 0.00 H new ATOM 0 HE3 LYS A 543 98.210 7.313 -9.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 543 99.841 6.695 -7.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 543 100.368 8.213 -8.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 543 99.618 8.072 -6.982 1.00 0.00 H new ATOM 1729 N LEU A 544 100.452 10.178 -14.173 1.00 0.00 N ATOM 1730 CA LEU A 544 101.200 11.221 -14.870 1.00 0.00 C ATOM 1731 C LEU A 544 100.388 11.808 -16.022 1.00 0.00 C ATOM 1732 O LEU A 544 100.671 12.909 -16.493 1.00 0.00 O ATOM 1733 CB LEU A 544 102.521 10.663 -15.401 1.00 0.00 C ATOM 1734 CG LEU A 544 103.683 11.656 -15.408 1.00 0.00 C ATOM 1735 CD1 LEU A 544 103.372 12.836 -16.316 1.00 0.00 C ATOM 1736 CD2 LEU A 544 103.983 12.133 -13.996 1.00 0.00 C ATOM 0 H LEU A 544 100.875 9.251 -14.221 1.00 0.00 H new ATOM 0 HA LEU A 544 101.406 12.017 -14.154 1.00 0.00 H new ATOM 0 HB2 LEU A 544 102.803 9.800 -14.797 1.00 0.00 H new ATOM 0 HB3 LEU A 544 102.364 10.303 -16.418 1.00 0.00 H new ATOM 0 HG LEU A 544 104.567 11.149 -15.795 1.00 0.00 H new ATOM 0 HD11 LEU A 544 104.211 13.532 -16.308 1.00 0.00 H new ATOM 0 HD12 LEU A 544 103.206 12.479 -17.332 1.00 0.00 H new ATOM 0 HD13 LEU A 544 102.476 13.344 -15.959 1.00 0.00 H new ATOM 0 HD21 LEU A 544 104.813 12.839 -14.019 1.00 0.00 H new ATOM 0 HD22 LEU A 544 103.101 12.622 -13.582 1.00 0.00 H new ATOM 0 HD23 LEU A 544 104.250 11.280 -13.373 1.00 0.00 H new ATOM 1748 N ASN A 545 99.383 11.066 -16.472 1.00 0.00 N ATOM 1749 CA ASN A 545 98.537 11.516 -17.571 1.00 0.00 C ATOM 1750 C ASN A 545 97.087 11.663 -17.122 1.00 0.00 C ATOM 1751 O ASN A 545 96.606 12.772 -16.890 1.00 0.00 O ATOM 1752 CB ASN A 545 98.621 10.535 -18.740 1.00 0.00 C ATOM 1753 CG ASN A 545 99.441 11.081 -19.893 1.00 0.00 C ATOM 1754 OD1 ASN A 545 99.184 10.767 -21.056 1.00 0.00 O ATOM 1755 ND2 ASN A 545 100.435 11.902 -19.576 1.00 0.00 N ATOM 0 H ASN A 545 99.134 10.152 -16.094 1.00 0.00 H new ATOM 0 HA ASN A 545 98.898 12.492 -17.895 1.00 0.00 H new ATOM 0 HB2 ASN A 545 99.061 9.599 -18.395 1.00 0.00 H new ATOM 0 HB3 ASN A 545 97.615 10.304 -19.090 1.00 0.00 H new ATOM 0 HD21 ASN A 545 101.022 12.300 -20.310 1.00 0.00 H new ATOM 0 HD22 ASN A 545 100.612 12.135 -18.599 1.00 0.00 H new ATOM 1762 N GLN A 546 96.396 10.534 -17.007 1.00 0.00 N ATOM 1763 CA GLN A 546 94.999 10.529 -16.591 1.00 0.00 C ATOM 1764 C GLN A 546 94.726 11.621 -15.563 1.00 0.00 C ATOM 1765 O GLN A 546 95.132 11.515 -14.406 1.00 0.00 O ATOM 1766 CB GLN A 546 94.626 9.164 -16.012 1.00 0.00 C ATOM 1767 CG GLN A 546 93.532 8.451 -16.791 1.00 0.00 C ATOM 1768 CD GLN A 546 92.273 8.244 -15.972 1.00 0.00 C ATOM 1769 OE1 GLN A 546 91.775 7.125 -15.852 1.00 0.00 O ATOM 1770 NE2 GLN A 546 91.752 9.326 -15.404 1.00 0.00 N ATOM 0 H GLN A 546 96.782 9.609 -17.197 1.00 0.00 H new ATOM 0 HA GLN A 546 94.386 10.727 -17.470 1.00 0.00 H new ATOM 0 HB2 GLN A 546 95.515 8.533 -15.989 1.00 0.00 H new ATOM 0 HB3 GLN A 546 94.300 9.293 -14.980 1.00 0.00 H new ATOM 0 HG2 GLN A 546 93.290 9.030 -17.683 1.00 0.00 H new ATOM 0 HG3 GLN A 546 93.904 7.484 -17.130 1.00 0.00 H new ATOM 0 HE21 GLN A 546 92.199 10.234 -15.531 1.00 0.00 H new ATOM 0 HE22 GLN A 546 90.905 9.249 -14.841 1.00 0.00 H new ATOM 1779 N PRO A 547 94.025 12.686 -15.977 1.00 0.00 N ATOM 1780 CA PRO A 547 93.685 13.805 -15.093 1.00 0.00 C ATOM 1781 C PRO A 547 92.645 13.413 -14.048 1.00 0.00 C ATOM 1782 O PRO A 547 91.464 13.268 -14.360 1.00 0.00 O ATOM 1783 CB PRO A 547 93.114 14.852 -16.051 1.00 0.00 C ATOM 1784 CG PRO A 547 92.589 14.062 -17.200 1.00 0.00 C ATOM 1785 CD PRO A 547 93.504 12.879 -17.341 1.00 0.00 C ATOM 0 HA PRO A 547 94.546 14.156 -14.524 1.00 0.00 H new ATOM 0 HB2 PRO A 547 92.324 15.435 -15.577 1.00 0.00 H new ATOM 0 HB3 PRO A 547 93.881 15.557 -16.372 1.00 0.00 H new ATOM 0 HG2 PRO A 547 91.563 13.742 -17.017 1.00 0.00 H new ATOM 0 HG3 PRO A 547 92.579 14.659 -18.112 1.00 0.00 H new ATOM 0 HD2 PRO A 547 92.970 11.998 -17.695 1.00 0.00 H new ATOM 0 HD3 PRO A 547 94.306 13.074 -18.054 1.00 0.00 H new ATOM 1793 N ARG A 548 93.093 13.237 -12.809 1.00 0.00 N ATOM 1794 CA ARG A 548 92.203 12.857 -11.716 1.00 0.00 C ATOM 1795 C ARG A 548 91.534 11.513 -12.002 1.00 0.00 C ATOM 1796 O ARG A 548 91.434 11.090 -13.154 1.00 0.00 O ATOM 1797 CB ARG A 548 91.147 13.947 -11.483 1.00 0.00 C ATOM 1798 CG ARG A 548 89.831 13.715 -12.215 1.00 0.00 C ATOM 1799 CD ARG A 548 89.359 14.975 -12.922 1.00 0.00 C ATOM 1800 NE ARG A 548 89.300 14.801 -14.371 1.00 0.00 N ATOM 1801 CZ ARG A 548 89.290 15.811 -15.236 1.00 0.00 C ATOM 1802 NH1 ARG A 548 89.320 17.062 -14.798 1.00 0.00 N ATOM 1803 NH2 ARG A 548 89.246 15.570 -16.539 1.00 0.00 N ATOM 0 H ARG A 548 94.069 13.352 -12.536 1.00 0.00 H new ATOM 0 HA ARG A 548 92.799 12.752 -10.810 1.00 0.00 H new ATOM 0 HB2 ARG A 548 90.946 14.019 -10.414 1.00 0.00 H new ATOM 0 HB3 ARG A 548 91.558 14.907 -11.795 1.00 0.00 H new ATOM 0 HG2 ARG A 548 89.954 12.913 -12.942 1.00 0.00 H new ATOM 0 HG3 ARG A 548 89.071 13.388 -11.505 1.00 0.00 H new ATOM 0 HD2 ARG A 548 88.373 15.251 -12.550 1.00 0.00 H new ATOM 0 HD3 ARG A 548 90.032 15.798 -12.683 1.00 0.00 H new ATOM 0 HE ARG A 548 89.264 13.851 -14.740 1.00 0.00 H new ATOM 0 HH11 ARG A 548 89.351 17.251 -13.796 1.00 0.00 H new ATOM 0 HH12 ARG A 548 89.312 17.835 -15.463 1.00 0.00 H new ATOM 0 HH21 ARG A 548 89.220 14.609 -16.879 1.00 0.00 H new ATOM 0 HH22 ARG A 548 89.238 16.346 -17.201 1.00 0.00 H new ATOM 1817 N GLU A 549 91.078 10.848 -10.945 1.00 0.00 N ATOM 1818 CA GLU A 549 90.420 9.553 -11.083 1.00 0.00 C ATOM 1819 C GLU A 549 89.418 9.330 -9.955 1.00 0.00 C ATOM 1820 O GLU A 549 89.369 10.096 -8.993 1.00 0.00 O ATOM 1821 CB GLU A 549 91.456 8.428 -11.090 1.00 0.00 C ATOM 1822 CG GLU A 549 92.640 8.686 -10.173 1.00 0.00 C ATOM 1823 CD GLU A 549 93.350 7.410 -9.765 1.00 0.00 C ATOM 1824 OE1 GLU A 549 92.661 6.446 -9.372 1.00 0.00 O ATOM 1825 OE2 GLU A 549 94.597 7.375 -9.839 1.00 0.00 O ATOM 0 H GLU A 549 91.152 11.184 -9.985 1.00 0.00 H new ATOM 0 HA GLU A 549 89.882 9.546 -12.031 1.00 0.00 H new ATOM 0 HB2 GLU A 549 90.972 7.498 -10.792 1.00 0.00 H new ATOM 0 HB3 GLU A 549 91.819 8.286 -12.108 1.00 0.00 H new ATOM 0 HG2 GLU A 549 93.347 9.346 -10.676 1.00 0.00 H new ATOM 0 HG3 GLU A 549 92.296 9.208 -9.280 1.00 0.00 H new ATOM 1832 N LYS A 550 88.619 8.276 -10.080 1.00 0.00 N ATOM 1833 CA LYS A 550 87.617 7.952 -9.071 1.00 0.00 C ATOM 1834 C LYS A 550 86.688 9.139 -8.829 1.00 0.00 C ATOM 1835 O LYS A 550 87.086 10.138 -8.229 1.00 0.00 O ATOM 1836 CB LYS A 550 88.297 7.533 -7.763 1.00 0.00 C ATOM 1837 CG LYS A 550 87.454 7.779 -6.521 1.00 0.00 C ATOM 1838 CD LYS A 550 86.225 6.886 -6.495 1.00 0.00 C ATOM 1839 CE LYS A 550 86.605 5.415 -6.550 1.00 0.00 C ATOM 1840 NZ LYS A 550 85.917 4.621 -5.494 1.00 0.00 N ATOM 0 H LYS A 550 88.646 7.631 -10.870 1.00 0.00 H new ATOM 0 HA LYS A 550 87.018 7.119 -9.438 1.00 0.00 H new ATOM 0 HB2 LYS A 550 88.544 6.473 -7.818 1.00 0.00 H new ATOM 0 HB3 LYS A 550 89.237 8.075 -7.665 1.00 0.00 H new ATOM 0 HG2 LYS A 550 88.055 7.598 -5.630 1.00 0.00 H new ATOM 0 HG3 LYS A 550 87.146 8.824 -6.490 1.00 0.00 H new ATOM 0 HD2 LYS A 550 85.651 7.081 -5.589 1.00 0.00 H new ATOM 0 HD3 LYS A 550 85.580 7.128 -7.339 1.00 0.00 H new ATOM 0 HE2 LYS A 550 86.351 5.011 -7.530 1.00 0.00 H new ATOM 0 HE3 LYS A 550 87.684 5.315 -6.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 550 86.204 3.624 -5.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 550 86.179 4.989 -4.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 550 84.887 4.695 -5.620 1.00 0.00 H new ATOM 1854 N LYS A 551 85.451 9.022 -9.298 1.00 0.00 N ATOM 1855 CA LYS A 551 84.466 10.086 -9.132 1.00 0.00 C ATOM 1856 C LYS A 551 83.059 9.575 -9.423 1.00 0.00 C ATOM 1857 O LYS A 551 82.781 8.383 -9.292 1.00 0.00 O ATOM 1858 CB LYS A 551 84.795 11.262 -10.053 1.00 0.00 C ATOM 1859 CG LYS A 551 84.587 12.622 -9.405 1.00 0.00 C ATOM 1860 CD LYS A 551 85.548 13.659 -9.965 1.00 0.00 C ATOM 1861 CE LYS A 551 84.831 14.659 -10.857 1.00 0.00 C ATOM 1862 NZ LYS A 551 84.441 15.888 -10.113 1.00 0.00 N ATOM 0 H LYS A 551 85.106 8.202 -9.796 1.00 0.00 H new ATOM 0 HA LYS A 551 84.503 10.423 -8.096 1.00 0.00 H new ATOM 0 HB2 LYS A 551 85.832 11.179 -10.378 1.00 0.00 H new ATOM 0 HB3 LYS A 551 84.175 11.197 -10.947 1.00 0.00 H new ATOM 0 HG2 LYS A 551 83.560 12.950 -9.568 1.00 0.00 H new ATOM 0 HG3 LYS A 551 84.728 12.538 -8.327 1.00 0.00 H new ATOM 0 HD2 LYS A 551 86.035 14.186 -9.144 1.00 0.00 H new ATOM 0 HD3 LYS A 551 86.333 13.160 -10.534 1.00 0.00 H new ATOM 0 HE2 LYS A 551 85.478 14.930 -11.691 1.00 0.00 H new ATOM 0 HE3 LYS A 551 83.941 14.194 -11.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 551 83.955 16.544 -10.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 551 83.803 15.633 -9.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 551 85.292 16.346 -9.729 1.00 0.00 H new ATOM 1876 N ARG A 552 82.174 10.486 -9.817 1.00 0.00 N ATOM 1877 CA ARG A 552 80.796 10.128 -10.128 1.00 0.00 C ATOM 1878 C ARG A 552 80.465 10.449 -11.581 1.00 0.00 C ATOM 1879 O ARG A 552 79.939 9.609 -12.310 1.00 0.00 O ATOM 1880 CB ARG A 552 79.832 10.868 -9.198 1.00 0.00 C ATOM 1881 CG ARG A 552 79.103 9.955 -8.225 1.00 0.00 C ATOM 1882 CD ARG A 552 78.347 10.752 -7.174 1.00 0.00 C ATOM 1883 NE ARG A 552 77.289 9.965 -6.547 1.00 0.00 N ATOM 1884 CZ ARG A 552 76.767 10.249 -5.359 1.00 0.00 C ATOM 1885 NH1 ARG A 552 77.212 11.291 -4.669 1.00 0.00 N ATOM 1886 NH2 ARG A 552 75.802 9.491 -4.857 1.00 0.00 N ATOM 0 H ARG A 552 82.388 11.477 -9.928 1.00 0.00 H new ATOM 0 HA ARG A 552 80.683 9.054 -9.977 1.00 0.00 H new ATOM 0 HB2 ARG A 552 80.388 11.617 -8.634 1.00 0.00 H new ATOM 0 HB3 ARG A 552 79.098 11.403 -9.801 1.00 0.00 H new ATOM 0 HG2 ARG A 552 78.406 9.320 -8.772 1.00 0.00 H new ATOM 0 HG3 ARG A 552 79.820 9.295 -7.737 1.00 0.00 H new ATOM 0 HD2 ARG A 552 79.044 11.097 -6.410 1.00 0.00 H new ATOM 0 HD3 ARG A 552 77.914 11.640 -7.634 1.00 0.00 H new ATOM 0 HE ARG A 552 76.931 9.152 -7.049 1.00 0.00 H new ATOM 0 HH11 ARG A 552 77.956 11.875 -5.051 1.00 0.00 H new ATOM 0 HH12 ARG A 552 76.810 11.508 -3.757 1.00 0.00 H new ATOM 0 HH21 ARG A 552 75.459 8.688 -5.383 1.00 0.00 H new ATOM 0 HH22 ARG A 552 75.403 9.711 -3.945 1.00 0.00 H new ATOM 1900 N GLY A 553 80.778 11.672 -11.992 1.00 0.00 N ATOM 1901 CA GLY A 553 80.509 12.089 -13.355 1.00 0.00 C ATOM 1902 C GLY A 553 79.097 11.757 -13.793 1.00 0.00 C ATOM 1903 O GLY A 553 78.858 11.450 -14.960 1.00 0.00 O ATOM 0 H GLY A 553 81.214 12.383 -11.405 1.00 0.00 H new ATOM 0 HA2 GLY A 553 80.670 13.164 -13.442 1.00 0.00 H new ATOM 0 HA3 GLY A 553 81.218 11.605 -14.027 1.00 0.00 H new ATOM 1907 N THR A 554 78.159 11.819 -12.854 1.00 0.00 N ATOM 1908 CA THR A 554 76.762 11.523 -13.147 1.00 0.00 C ATOM 1909 C THR A 554 76.614 10.135 -13.762 1.00 0.00 C ATOM 1910 O THR A 554 77.143 9.863 -14.839 1.00 0.00 O ATOM 1911 CB THR A 554 76.155 12.564 -14.106 1.00 0.00 C ATOM 1912 OG1 THR A 554 77.167 13.212 -14.886 1.00 0.00 O ATOM 1913 CG2 THR A 554 75.388 13.627 -13.334 1.00 0.00 C ATOM 0 H THR A 554 78.341 12.072 -11.883 1.00 0.00 H new ATOM 0 HA THR A 554 76.225 11.559 -12.199 1.00 0.00 H new ATOM 0 HB THR A 554 75.479 12.025 -14.770 1.00 0.00 H new ATOM 0 HG1 THR A 554 77.615 12.551 -15.454 1.00 0.00 H new ATOM 0 HG21 THR A 554 74.968 14.352 -14.032 1.00 0.00 H new ATOM 0 HG22 THR A 554 74.582 13.157 -12.770 1.00 0.00 H new ATOM 0 HG23 THR A 554 76.063 14.135 -12.646 1.00 0.00 H new ATOM 1921 N GLU A 555 75.890 9.261 -13.070 1.00 0.00 N ATOM 1922 CA GLU A 555 75.673 7.900 -13.546 1.00 0.00 C ATOM 1923 C GLU A 555 74.806 7.892 -14.801 1.00 0.00 C ATOM 1924 O GLU A 555 73.578 7.888 -14.718 1.00 0.00 O ATOM 1925 CB GLU A 555 75.018 7.053 -12.455 1.00 0.00 C ATOM 1926 CG GLU A 555 74.501 5.712 -12.951 1.00 0.00 C ATOM 1927 CD GLU A 555 73.493 5.090 -12.004 1.00 0.00 C ATOM 1928 OE1 GLU A 555 72.879 4.069 -12.380 1.00 0.00 O ATOM 1929 OE2 GLU A 555 73.319 5.623 -10.889 1.00 0.00 O ATOM 0 H GLU A 555 75.444 9.471 -12.177 1.00 0.00 H new ATOM 0 HA GLU A 555 76.644 7.472 -13.795 1.00 0.00 H new ATOM 0 HB2 GLU A 555 75.741 6.881 -11.657 1.00 0.00 H new ATOM 0 HB3 GLU A 555 74.190 7.613 -12.020 1.00 0.00 H new ATOM 0 HG2 GLU A 555 74.041 5.844 -13.930 1.00 0.00 H new ATOM 0 HG3 GLU A 555 75.340 5.029 -13.082 1.00 0.00 H new ATOM 1936 N LYS A 556 75.454 7.886 -15.960 1.00 0.00 N ATOM 1937 CA LYS A 556 74.743 7.876 -17.233 1.00 0.00 C ATOM 1938 C LYS A 556 73.559 8.836 -17.205 1.00 0.00 C ATOM 1939 O LYS A 556 73.531 9.781 -16.416 1.00 0.00 O ATOM 1940 CB LYS A 556 74.259 6.461 -17.560 1.00 0.00 C ATOM 1941 CG LYS A 556 74.970 5.376 -16.769 1.00 0.00 C ATOM 1942 CD LYS A 556 74.665 3.993 -17.321 1.00 0.00 C ATOM 1943 CE LYS A 556 74.207 3.043 -16.226 1.00 0.00 C ATOM 1944 NZ LYS A 556 72.732 3.088 -16.032 1.00 0.00 N ATOM 0 H LYS A 556 76.470 7.888 -16.045 1.00 0.00 H new ATOM 0 HA LYS A 556 75.435 8.205 -18.008 1.00 0.00 H new ATOM 0 HB2 LYS A 556 73.188 6.398 -17.365 1.00 0.00 H new ATOM 0 HB3 LYS A 556 74.401 6.275 -18.625 1.00 0.00 H new ATOM 0 HG2 LYS A 556 76.046 5.550 -16.796 1.00 0.00 H new ATOM 0 HG3 LYS A 556 74.665 5.427 -15.724 1.00 0.00 H new ATOM 0 HD2 LYS A 556 73.892 4.068 -18.086 1.00 0.00 H new ATOM 0 HD3 LYS A 556 75.554 3.589 -17.805 1.00 0.00 H new ATOM 0 HE2 LYS A 556 74.509 2.026 -16.478 1.00 0.00 H new ATOM 0 HE3 LYS A 556 74.704 3.301 -15.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 556 72.461 2.426 -15.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 556 72.446 4.052 -15.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 556 72.257 2.817 -16.917 1.00 0.00 H new ATOM 1958 N LEU A 557 72.583 8.586 -18.071 1.00 0.00 N ATOM 1959 CA LEU A 557 71.395 9.427 -18.149 1.00 0.00 C ATOM 1960 C LEU A 557 70.322 8.946 -17.176 1.00 0.00 C ATOM 1961 O LEU A 557 69.933 7.779 -17.194 1.00 0.00 O ATOM 1962 CB LEU A 557 70.841 9.432 -19.573 1.00 0.00 C ATOM 1963 CG LEU A 557 71.456 10.482 -20.502 1.00 0.00 C ATOM 1964 CD1 LEU A 557 72.419 9.828 -21.481 1.00 0.00 C ATOM 1965 CD2 LEU A 557 70.365 11.237 -21.247 1.00 0.00 C ATOM 0 H LEU A 557 72.592 7.807 -18.729 1.00 0.00 H new ATOM 0 HA LEU A 557 71.681 10.442 -17.874 1.00 0.00 H new ATOM 0 HB2 LEU A 557 70.996 8.446 -20.011 1.00 0.00 H new ATOM 0 HB3 LEU A 557 69.764 9.595 -19.527 1.00 0.00 H new ATOM 0 HG LEU A 557 72.015 11.195 -19.896 1.00 0.00 H new ATOM 0 HD11 LEU A 557 72.847 10.589 -22.134 1.00 0.00 H new ATOM 0 HD12 LEU A 557 73.218 9.332 -20.929 1.00 0.00 H new ATOM 0 HD13 LEU A 557 71.883 9.094 -22.083 1.00 0.00 H new ATOM 0 HD21 LEU A 557 70.819 11.980 -21.903 1.00 0.00 H new ATOM 0 HD22 LEU A 557 69.779 10.537 -21.842 1.00 0.00 H new ATOM 0 HD23 LEU A 557 69.714 11.737 -20.530 1.00 0.00 H new ATOM 1977 N ILE A 558 69.851 9.854 -16.327 1.00 0.00 N ATOM 1978 CA ILE A 558 68.824 9.524 -15.346 1.00 0.00 C ATOM 1979 C ILE A 558 67.690 10.544 -15.375 1.00 0.00 C ATOM 1980 O ILE A 558 67.897 11.707 -15.721 1.00 0.00 O ATOM 1981 CB ILE A 558 69.409 9.465 -13.922 1.00 0.00 C ATOM 1982 CG1 ILE A 558 70.505 10.519 -13.756 1.00 0.00 C ATOM 1983 CG2 ILE A 558 69.953 8.075 -13.630 1.00 0.00 C ATOM 1984 CD1 ILE A 558 70.905 10.756 -12.316 1.00 0.00 C ATOM 0 H ILE A 558 70.165 10.824 -16.299 1.00 0.00 H new ATOM 0 HA ILE A 558 68.433 8.542 -15.613 1.00 0.00 H new ATOM 0 HB ILE A 558 68.614 9.679 -13.208 1.00 0.00 H new ATOM 0 HG12 ILE A 558 71.384 10.210 -14.322 1.00 0.00 H new ATOM 0 HG13 ILE A 558 70.162 11.459 -14.188 1.00 0.00 H new ATOM 0 HG21 ILE A 558 70.363 8.049 -12.620 1.00 0.00 H new ATOM 0 HG22 ILE A 558 69.148 7.344 -13.714 1.00 0.00 H new ATOM 0 HG23 ILE A 558 70.738 7.834 -14.346 1.00 0.00 H new ATOM 0 HD11 ILE A 558 71.686 11.515 -12.276 1.00 0.00 H new ATOM 0 HD12 ILE A 558 70.038 11.096 -11.749 1.00 0.00 H new ATOM 0 HD13 ILE A 558 71.279 9.827 -11.885 1.00 0.00 H new ATOM 1996 N THR A 559 66.493 10.100 -15.008 1.00 0.00 N ATOM 1997 CA THR A 559 65.327 10.975 -14.992 1.00 0.00 C ATOM 1998 C THR A 559 65.403 11.972 -13.842 1.00 0.00 C ATOM 1999 O THR A 559 65.333 11.593 -12.672 1.00 0.00 O ATOM 2000 CB THR A 559 64.020 10.168 -14.874 1.00 0.00 C ATOM 2001 OG1 THR A 559 64.115 9.169 -13.851 1.00 0.00 O ATOM 2002 CG2 THR A 559 63.689 9.482 -16.190 1.00 0.00 C ATOM 0 H THR A 559 66.305 9.140 -14.718 1.00 0.00 H new ATOM 0 HA THR A 559 65.326 11.517 -15.938 1.00 0.00 H new ATOM 0 HB THR A 559 63.231 10.875 -14.616 1.00 0.00 H new ATOM 0 HG1 THR A 559 64.534 9.556 -13.054 1.00 0.00 H new ATOM 0 HG21 THR A 559 62.762 8.918 -16.083 1.00 0.00 H new ATOM 0 HG22 THR A 559 63.569 10.232 -16.971 1.00 0.00 H new ATOM 0 HG23 THR A 559 64.498 8.803 -16.460 1.00 0.00 H new ATOM 2010 N LYS A 560 65.546 13.248 -14.181 1.00 0.00 N ATOM 2011 CA LYS A 560 65.631 14.302 -13.178 1.00 0.00 C ATOM 2012 C LYS A 560 64.243 14.680 -12.671 1.00 0.00 C ATOM 2013 O LYS A 560 63.343 14.976 -13.456 1.00 0.00 O ATOM 2014 CB LYS A 560 66.326 15.533 -13.761 1.00 0.00 C ATOM 2015 CG LYS A 560 67.781 15.294 -14.132 1.00 0.00 C ATOM 2016 CD LYS A 560 68.712 16.218 -13.366 1.00 0.00 C ATOM 2017 CE LYS A 560 69.045 15.658 -11.993 1.00 0.00 C ATOM 2018 NZ LYS A 560 70.414 16.045 -11.554 1.00 0.00 N ATOM 0 H LYS A 560 65.606 13.578 -15.144 1.00 0.00 H new ATOM 0 HA LYS A 560 66.216 13.927 -12.339 1.00 0.00 H new ATOM 0 HB2 LYS A 560 65.783 15.860 -14.648 1.00 0.00 H new ATOM 0 HB3 LYS A 560 66.274 16.346 -13.037 1.00 0.00 H new ATOM 0 HG2 LYS A 560 68.045 14.257 -13.924 1.00 0.00 H new ATOM 0 HG3 LYS A 560 67.914 15.448 -15.203 1.00 0.00 H new ATOM 0 HD2 LYS A 560 69.631 16.363 -13.934 1.00 0.00 H new ATOM 0 HD3 LYS A 560 68.246 17.198 -13.258 1.00 0.00 H new ATOM 0 HE2 LYS A 560 68.316 16.018 -11.267 1.00 0.00 H new ATOM 0 HE3 LYS A 560 68.964 14.571 -12.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 560 70.603 15.644 -10.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 560 71.112 15.680 -12.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 560 70.484 17.082 -11.509 1.00 0.00 H new ATOM 2032 N ALA A 561 64.077 14.666 -11.352 1.00 0.00 N ATOM 2033 CA ALA A 561 62.799 15.007 -10.741 1.00 0.00 C ATOM 2034 C ALA A 561 61.659 14.237 -11.397 1.00 0.00 C ATOM 2035 O ALA A 561 61.439 13.067 -11.016 1.00 0.00 O ATOM 2036 CB ALA A 561 62.538 16.503 -10.823 1.00 0.00 C ATOM 2037 OXT ALA A 561 60.995 14.809 -12.287 1.00 0.00 O ATOM 0 H ALA A 561 64.811 14.422 -10.687 1.00 0.00 H new ATOM 0 HA ALA A 561 62.848 14.723 -9.690 1.00 0.00 H new ATOM 0 HB1 ALA A 561 61.578 16.731 -10.360 1.00 0.00 H new ATOM 0 HB2 ALA A 561 63.330 17.040 -10.300 1.00 0.00 H new ATOM 0 HB3 ALA A 561 62.519 16.812 -11.868 1.00 0.00 H new TER 2043 ALA A 561