USER MOD reduce.3.24.130724 H: found=0, std=0, add=1318, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1314 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 94 LYS NZ :NH3+ 170:sc= 0.425 (180deg=0) USER MOD Set 1.2: A 100 TYR OH : rot 180:sc= 0.386 USER MOD Set 2.1: A 22 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 62 TYR OH : rot 180:sc= -2.24! USER MOD Set 3.1: A 45 SER OG : rot 180:sc=0.000893 USER MOD Set 3.2: A 46 ASN : amide:sc= 0.0726 K(o=0.074,f=-3.2!) USER MOD Set 4.1: A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 24 THR OG1 : rot -170:sc= -0.298 USER MOD Single : A 1 SER OG : rot 180:sc= -0.225 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 49:sc= 0.243 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -1 GLY N :NH3+ -102:sc= 0.0797 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -0.176 K(o=-0.18,f=-1.6!) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 142:sc= -0.112 (180deg=-1.29!) USER MOD Single : A 38 SER OG : rot -54:sc= 0.199 USER MOD Single : A 39 SER OG : rot 39:sc= 0.0674 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ -116:sc= 1.25 (180deg=-0.655) USER MOD Single : A 48 GLN : amide:sc= -3.19 K(o=-3.2,f=-6.7!) USER MOD Single : A 53 MET CE :methyl -170:sc= -6.87! (180deg=-7.96!) USER MOD Single : A 54 GLN : amide:sc= -0.246 K(o=-0.25,f=-1.5!) USER MOD Single : A 56 HIS : no HE2:sc= -3.68! C(o=-3.7!,f=-9.1!) USER MOD Single : A 57 HIS : no HD1:sc= -3.43! C(o=-3.4!,f=-5.3!) USER MOD Single : A 58 GLN : amide:sc= -1.16 K(o=-1.2,f=0.19) USER MOD Single : A 60 SER OG : rot -41:sc= 1.08 USER MOD Single : A 64 TYR OH : rot 30:sc= 0 USER MOD Single : A 65 THR OG1 : rot 70:sc= 0.955 USER MOD Single : A 67 TYR OH : rot 165:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 80:sc= 0.481 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 61:sc= 0.0773 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= -0.41 K(o=-0.41,f=-3.7!) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= -0.715 K(o=-0.71,f=-2.9!) USER MOD Single : A 116 ASN : amide:sc= -0.065 X(o=-0.065,f=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot -41:sc= -5.27! USER MOD Single : A 128 GLN : amide:sc= -0.325 K(o=-0.33,f=-1.4) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot -112:sc= 0.0809 USER MOD Single : A 139 GLN : amide:sc= -0.0332 X(o=-0.033,f=-0.35) USER MOD Single : A 141 SER OG : rot 180:sc=-0.00669 USER MOD Single : A 143 HIS : no HD1:sc= -0.0368 X(o=-0.037,f=-0.15) USER MOD Single : A 144 GLN : amide:sc= -2.35 K(o=-2.4,f=-3.1!) USER MOD Single : A 147 HIS : no HD1:sc= -0.507 X(o=-0.51,f=-0.29) USER MOD Single : A 155 SER OG : rot 180:sc= 0.371 USER MOD Single : A 156 THR OG1 : rot 180:sc= 0.00698 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 -49.227 5.894 22.349 1.00 0.00 N ATOM 2 CA GLY A -1 -48.442 5.213 23.419 1.00 0.00 C ATOM 3 C GLY A -1 -47.255 4.470 22.791 1.00 0.00 C ATOM 4 O GLY A -1 -47.310 4.071 21.643 1.00 0.00 O ATOM 0 H1 GLY A -1 -48.995 6.908 22.340 1.00 0.00 H new ATOM 0 H2 GLY A -1 -48.990 5.477 21.426 1.00 0.00 H new ATOM 0 H3 GLY A -1 -50.243 5.773 22.533 1.00 0.00 H new ATOM 0 HA2 GLY A -1 -48.084 5.945 24.143 1.00 0.00 H new ATOM 0 HA3 GLY A -1 -49.077 4.512 23.961 1.00 0.00 H new ATOM 10 N GLY A 0 -46.180 4.279 23.530 1.00 0.00 N ATOM 11 CA GLY A 0 -45.000 3.561 22.962 1.00 0.00 C ATOM 12 C GLY A 0 -45.098 2.066 23.297 1.00 0.00 C ATOM 13 O GLY A 0 -46.032 1.637 23.949 1.00 0.00 O ATOM 0 H GLY A 0 -46.075 4.590 24.496 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -44.962 3.700 21.882 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -44.078 3.976 23.370 1.00 0.00 H new ATOM 17 N SER A 1 -44.145 1.267 22.860 1.00 0.00 N ATOM 18 CA SER A 1 -44.198 -0.196 23.161 1.00 0.00 C ATOM 19 C SER A 1 -42.907 -0.639 23.867 1.00 0.00 C ATOM 20 O SER A 1 -41.855 -0.081 23.626 1.00 0.00 O ATOM 21 CB SER A 1 -44.325 -0.874 21.798 1.00 0.00 C ATOM 22 OG SER A 1 -44.095 -2.271 21.945 1.00 0.00 O ATOM 0 H SER A 1 -43.340 1.568 22.311 1.00 0.00 H new ATOM 0 HA SER A 1 -45.025 -0.453 23.823 1.00 0.00 H new ATOM 0 HB2 SER A 1 -45.317 -0.699 21.383 1.00 0.00 H new ATOM 0 HB3 SER A 1 -43.607 -0.447 21.098 1.00 0.00 H new ATOM 0 HG SER A 1 -44.177 -2.710 21.073 1.00 0.00 H new ATOM 28 N PRO A 2 -43.020 -1.633 24.725 1.00 0.00 N ATOM 29 CA PRO A 2 -41.827 -2.131 25.455 1.00 0.00 C ATOM 30 C PRO A 2 -40.911 -2.925 24.511 1.00 0.00 C ATOM 31 O PRO A 2 -41.323 -3.913 23.932 1.00 0.00 O ATOM 32 CB PRO A 2 -42.416 -3.040 26.531 1.00 0.00 C ATOM 33 CG PRO A 2 -43.738 -3.480 25.989 1.00 0.00 C ATOM 34 CD PRO A 2 -44.238 -2.378 25.092 1.00 0.00 C ATOM 0 HA PRO A 2 -41.215 -1.330 25.869 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -41.766 -3.893 26.725 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -42.534 -2.508 27.475 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -43.636 -4.412 25.433 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -44.443 -3.667 26.799 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -44.741 -2.778 24.212 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -44.956 -1.740 25.607 1.00 0.00 H new ATOM 42 N ARG A 3 -39.671 -2.507 24.350 1.00 0.00 N ATOM 43 CA ARG A 3 -38.743 -3.248 23.442 1.00 0.00 C ATOM 44 C ARG A 3 -37.306 -3.197 23.988 1.00 0.00 C ATOM 45 O ARG A 3 -36.736 -2.132 24.138 1.00 0.00 O ATOM 46 CB ARG A 3 -38.833 -2.516 22.102 1.00 0.00 C ATOM 47 CG ARG A 3 -38.681 -3.522 20.960 1.00 0.00 C ATOM 48 CD ARG A 3 -37.233 -4.013 20.900 1.00 0.00 C ATOM 49 NE ARG A 3 -37.200 -4.981 19.761 1.00 0.00 N ATOM 50 CZ ARG A 3 -37.709 -6.198 19.879 1.00 0.00 C ATOM 51 NH1 ARG A 3 -38.263 -6.604 20.999 1.00 0.00 N ATOM 52 NH2 ARG A 3 -37.662 -7.018 18.862 1.00 0.00 N ATOM 0 H ARG A 3 -39.269 -1.689 24.808 1.00 0.00 H new ATOM 0 HA ARG A 3 -39.009 -4.301 23.352 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -39.790 -2.000 22.021 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -38.054 -1.756 22.038 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -39.356 -4.365 21.112 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -38.958 -3.058 20.013 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -36.542 -3.186 20.735 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -36.940 -4.492 21.834 1.00 0.00 H new ATOM 0 HE ARG A 3 -36.778 -4.699 18.877 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -38.308 -5.977 21.802 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -38.648 -7.546 21.065 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -37.235 -6.719 17.985 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -38.052 -7.957 18.945 1.00 0.00 H new ATOM 66 N ILE A 4 -36.714 -4.336 24.289 1.00 0.00 N ATOM 67 CA ILE A 4 -35.315 -4.334 24.825 1.00 0.00 C ATOM 68 C ILE A 4 -34.618 -5.677 24.530 1.00 0.00 C ATOM 69 O ILE A 4 -34.163 -6.352 25.435 1.00 0.00 O ATOM 70 CB ILE A 4 -35.469 -4.110 26.335 1.00 0.00 C ATOM 71 CG1 ILE A 4 -34.086 -4.078 26.994 1.00 0.00 C ATOM 72 CG2 ILE A 4 -36.300 -5.241 26.952 1.00 0.00 C ATOM 73 CD1 ILE A 4 -34.110 -3.122 28.187 1.00 0.00 C ATOM 0 H ILE A 4 -37.138 -5.258 24.186 1.00 0.00 H new ATOM 0 HA ILE A 4 -34.698 -3.563 24.364 1.00 0.00 H new ATOM 0 HB ILE A 4 -35.976 -3.160 26.502 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -33.805 -5.079 27.322 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -33.335 -3.757 26.272 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -36.404 -5.073 28.024 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -37.287 -5.261 26.491 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -35.801 -6.195 26.781 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -33.126 -3.100 28.655 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -34.372 -2.121 27.846 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -34.849 -3.463 28.912 1.00 0.00 H new ATOM 85 N LYS A 5 -34.529 -6.069 23.275 1.00 0.00 N ATOM 86 CA LYS A 5 -33.862 -7.364 22.941 1.00 0.00 C ATOM 87 C LYS A 5 -32.606 -7.113 22.091 1.00 0.00 C ATOM 88 O LYS A 5 -31.514 -7.495 22.471 1.00 0.00 O ATOM 89 CB LYS A 5 -34.901 -8.152 22.141 1.00 0.00 C ATOM 90 CG LYS A 5 -35.667 -9.087 23.079 1.00 0.00 C ATOM 91 CD LYS A 5 -37.052 -9.375 22.496 1.00 0.00 C ATOM 92 CE LYS A 5 -37.515 -10.765 22.939 1.00 0.00 C ATOM 93 NZ LYS A 5 -37.103 -11.677 21.835 1.00 0.00 N ATOM 0 H LYS A 5 -34.889 -5.548 22.476 1.00 0.00 H new ATOM 0 HA LYS A 5 -33.540 -7.902 23.832 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -35.592 -7.468 21.649 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -34.411 -8.729 21.357 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -35.116 -10.018 23.211 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -35.763 -8.631 24.064 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -37.763 -8.620 22.831 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -37.018 -9.321 21.408 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -37.052 -11.053 23.883 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -38.594 -10.792 23.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -37.386 -12.651 22.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -37.564 -11.382 20.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -36.071 -11.635 21.717 1.00 0.00 H new ATOM 107 N THR A 6 -32.745 -6.478 20.945 1.00 0.00 N ATOM 108 CA THR A 6 -31.551 -6.213 20.086 1.00 0.00 C ATOM 109 C THR A 6 -31.350 -4.701 19.903 1.00 0.00 C ATOM 110 O THR A 6 -31.963 -4.092 19.047 1.00 0.00 O ATOM 111 CB THR A 6 -31.874 -6.876 18.746 1.00 0.00 C ATOM 112 OG1 THR A 6 -33.210 -6.565 18.376 1.00 0.00 O ATOM 113 CG2 THR A 6 -31.717 -8.392 18.873 1.00 0.00 C ATOM 0 H THR A 6 -33.631 -6.136 20.574 1.00 0.00 H new ATOM 0 HA THR A 6 -30.633 -6.603 20.525 1.00 0.00 H new ATOM 0 HB THR A 6 -31.190 -6.506 17.983 1.00 0.00 H new ATOM 0 HG1 THR A 6 -33.358 -5.600 18.464 1.00 0.00 H new ATOM 0 HG21 THR A 6 -31.948 -8.863 17.917 1.00 0.00 H new ATOM 0 HG22 THR A 6 -30.692 -8.629 19.156 1.00 0.00 H new ATOM 0 HG23 THR A 6 -32.400 -8.766 19.636 1.00 0.00 H new ATOM 121 N ARG A 7 -30.496 -4.087 20.698 1.00 0.00 N ATOM 122 CA ARG A 7 -30.267 -2.616 20.558 1.00 0.00 C ATOM 123 C ARG A 7 -28.781 -2.330 20.282 1.00 0.00 C ATOM 124 O ARG A 7 -28.445 -1.714 19.287 1.00 0.00 O ATOM 125 CB ARG A 7 -30.692 -2.017 21.899 1.00 0.00 C ATOM 126 CG ARG A 7 -30.920 -0.513 21.737 1.00 0.00 C ATOM 127 CD ARG A 7 -31.330 0.090 23.083 1.00 0.00 C ATOM 128 NE ARG A 7 -32.825 0.078 23.070 1.00 0.00 N ATOM 129 CZ ARG A 7 -33.513 0.912 22.304 1.00 0.00 C ATOM 130 NH1 ARG A 7 -32.911 1.781 21.526 1.00 0.00 N ATOM 131 NH2 ARG A 7 -34.820 0.872 22.319 1.00 0.00 N ATOM 0 H ARG A 7 -29.953 -4.543 21.432 1.00 0.00 H new ATOM 0 HA ARG A 7 -30.829 -2.190 19.727 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -31.604 -2.498 22.251 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -29.924 -2.200 22.651 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -30.011 -0.034 21.374 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -31.696 -0.330 20.993 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -30.937 -0.496 23.914 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -30.944 1.103 23.196 1.00 0.00 H new ATOM 0 HE ARG A 7 -33.325 -0.585 23.662 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -31.892 1.824 21.502 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -33.462 2.413 20.945 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -35.303 0.202 22.918 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -35.357 1.511 21.732 1.00 0.00 H new ATOM 145 N ARG A 8 -27.888 -2.766 21.148 1.00 0.00 N ATOM 146 CA ARG A 8 -26.434 -2.508 20.920 1.00 0.00 C ATOM 147 C ARG A 8 -25.663 -3.836 20.851 1.00 0.00 C ATOM 148 O ARG A 8 -26.092 -4.831 21.404 1.00 0.00 O ATOM 149 CB ARG A 8 -25.984 -1.688 22.128 1.00 0.00 C ATOM 150 CG ARG A 8 -24.647 -1.011 21.819 1.00 0.00 C ATOM 151 CD ARG A 8 -23.500 -1.882 22.336 1.00 0.00 C ATOM 152 NE ARG A 8 -23.419 -1.583 23.799 1.00 0.00 N ATOM 153 CZ ARG A 8 -22.907 -0.445 24.240 1.00 0.00 C ATOM 154 NH1 ARG A 8 -22.449 0.467 23.415 1.00 0.00 N ATOM 155 NH2 ARG A 8 -22.855 -0.218 25.528 1.00 0.00 N ATOM 0 H ARG A 8 -28.108 -3.286 21.997 1.00 0.00 H new ATOM 0 HA ARG A 8 -26.249 -1.986 19.981 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -26.736 -0.937 22.371 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -25.884 -2.333 23.001 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -24.545 -0.858 20.745 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -24.609 -0.027 22.286 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -23.696 -2.939 22.159 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -22.564 -1.643 21.831 1.00 0.00 H new ATOM 0 HE ARG A 8 -23.765 -2.269 24.470 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -22.483 0.307 22.408 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -22.059 1.336 23.781 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -23.207 -0.916 26.183 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -22.462 0.656 25.876 1.00 0.00 H new ATOM 169 N SER A 9 -24.530 -3.862 20.178 1.00 0.00 N ATOM 170 CA SER A 9 -23.745 -5.130 20.084 1.00 0.00 C ATOM 171 C SER A 9 -22.275 -4.874 20.454 1.00 0.00 C ATOM 172 O SER A 9 -21.903 -3.764 20.786 1.00 0.00 O ATOM 173 CB SER A 9 -23.862 -5.559 18.622 1.00 0.00 C ATOM 174 OG SER A 9 -25.114 -6.202 18.420 1.00 0.00 O ATOM 0 H SER A 9 -24.122 -3.062 19.694 1.00 0.00 H new ATOM 0 HA SER A 9 -24.115 -5.896 20.765 1.00 0.00 H new ATOM 0 HB2 SER A 9 -23.776 -4.691 17.968 1.00 0.00 H new ATOM 0 HB3 SER A 9 -23.047 -6.235 18.363 1.00 0.00 H new ATOM 0 HG SER A 9 -25.193 -6.477 17.483 1.00 0.00 H new ATOM 180 N LYS A 10 -21.435 -5.889 20.402 1.00 0.00 N ATOM 181 CA LYS A 10 -19.997 -5.690 20.754 1.00 0.00 C ATOM 182 C LYS A 10 -19.098 -6.444 19.761 1.00 0.00 C ATOM 183 O LYS A 10 -18.618 -7.519 20.064 1.00 0.00 O ATOM 184 CB LYS A 10 -19.852 -6.268 22.163 1.00 0.00 C ATOM 185 CG LYS A 10 -18.796 -5.473 22.935 1.00 0.00 C ATOM 186 CD LYS A 10 -19.456 -4.267 23.606 1.00 0.00 C ATOM 187 CE LYS A 10 -19.330 -3.042 22.696 1.00 0.00 C ATOM 188 NZ LYS A 10 -19.502 -1.872 23.602 1.00 0.00 N ATOM 0 H LYS A 10 -21.688 -6.840 20.132 1.00 0.00 H new ATOM 0 HA LYS A 10 -19.701 -4.642 20.713 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -20.808 -6.226 22.685 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -19.565 -7.318 22.109 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -18.324 -6.107 23.685 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -18.009 -5.141 22.258 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -20.507 -4.478 23.805 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -18.983 -4.069 24.568 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -18.360 -3.017 22.199 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -20.089 -3.051 21.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -19.428 -0.993 23.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -20.436 -1.919 24.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -18.761 -1.886 24.332 1.00 0.00 H new ATOM 202 N PRO A 11 -18.891 -5.860 18.599 1.00 0.00 N ATOM 203 CA PRO A 11 -18.037 -6.510 17.574 1.00 0.00 C ATOM 204 C PRO A 11 -16.557 -6.434 17.977 1.00 0.00 C ATOM 205 O PRO A 11 -16.166 -5.586 18.754 1.00 0.00 O ATOM 206 CB PRO A 11 -18.296 -5.692 16.312 1.00 0.00 C ATOM 207 CG PRO A 11 -18.738 -4.351 16.802 1.00 0.00 C ATOM 208 CD PRO A 11 -19.420 -4.567 18.130 1.00 0.00 C ATOM 0 HA PRO A 11 -18.263 -7.568 17.444 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -17.396 -5.612 15.702 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -19.062 -6.157 15.691 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -17.886 -3.681 16.911 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -19.420 -3.886 16.090 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -19.191 -3.765 18.831 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -20.504 -4.595 18.021 1.00 0.00 H new ATOM 216 N ALA A 12 -15.728 -7.312 17.442 1.00 0.00 N ATOM 217 CA ALA A 12 -14.264 -7.302 17.784 1.00 0.00 C ATOM 218 C ALA A 12 -14.056 -7.561 19.289 1.00 0.00 C ATOM 219 O ALA A 12 -14.886 -7.196 20.097 1.00 0.00 O ATOM 220 CB ALA A 12 -13.749 -5.910 17.393 1.00 0.00 C ATOM 0 H ALA A 12 -16.007 -8.037 16.781 1.00 0.00 H new ATOM 0 HA ALA A 12 -13.724 -8.087 17.254 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.685 -5.839 17.618 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.905 -5.751 16.326 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.290 -5.150 17.957 1.00 0.00 H new ATOM 226 N PRO A 13 -12.948 -8.191 19.624 1.00 0.00 N ATOM 227 CA PRO A 13 -12.656 -8.491 21.048 1.00 0.00 C ATOM 228 C PRO A 13 -12.283 -7.209 21.806 1.00 0.00 C ATOM 229 O PRO A 13 -11.978 -6.197 21.207 1.00 0.00 O ATOM 230 CB PRO A 13 -11.466 -9.445 20.982 1.00 0.00 C ATOM 231 CG PRO A 13 -10.804 -9.145 19.676 1.00 0.00 C ATOM 232 CD PRO A 13 -11.881 -8.679 18.734 1.00 0.00 C ATOM 0 HA PRO A 13 -13.510 -8.917 21.574 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.784 -9.284 21.817 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.790 -10.485 21.031 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -10.040 -8.377 19.798 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.305 -10.031 19.284 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.520 -7.890 18.074 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -12.233 -9.491 18.097 1.00 0.00 H new ATOM 240 N ASP A 14 -12.312 -7.247 23.124 1.00 0.00 N ATOM 241 CA ASP A 14 -11.959 -6.015 23.932 1.00 0.00 C ATOM 242 C ASP A 14 -10.643 -5.378 23.440 1.00 0.00 C ATOM 243 O ASP A 14 -10.478 -4.174 23.501 1.00 0.00 O ATOM 244 CB ASP A 14 -11.800 -6.479 25.389 1.00 0.00 C ATOM 245 CG ASP A 14 -13.181 -6.637 26.028 1.00 0.00 C ATOM 246 OD1 ASP A 14 -13.866 -5.637 26.169 1.00 0.00 O ATOM 247 OD2 ASP A 14 -13.531 -7.756 26.365 1.00 0.00 O ATOM 0 H ASP A 14 -12.562 -8.068 23.675 1.00 0.00 H new ATOM 0 HA ASP A 14 -12.738 -5.259 23.829 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -11.261 -7.426 25.423 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -11.209 -5.755 25.950 1.00 0.00 H new ATOM 252 N GLY A 15 -9.706 -6.169 22.952 1.00 0.00 N ATOM 253 CA GLY A 15 -8.413 -5.597 22.458 1.00 0.00 C ATOM 254 C GLY A 15 -8.675 -4.492 21.413 1.00 0.00 C ATOM 255 O GLY A 15 -7.940 -3.525 21.343 1.00 0.00 O ATOM 0 H GLY A 15 -9.786 -7.183 22.877 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -7.846 -5.188 23.294 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -7.804 -6.386 22.017 1.00 0.00 H new ATOM 259 N PHE A 16 -9.714 -4.618 20.604 1.00 0.00 N ATOM 260 CA PHE A 16 -9.996 -3.548 19.575 1.00 0.00 C ATOM 261 C PHE A 16 -10.106 -2.165 20.242 1.00 0.00 C ATOM 262 O PHE A 16 -9.746 -1.164 19.651 1.00 0.00 O ATOM 263 CB PHE A 16 -11.331 -3.913 18.905 1.00 0.00 C ATOM 264 CG PHE A 16 -11.609 -2.955 17.770 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.649 -2.752 16.770 1.00 0.00 C ATOM 266 CD2 PHE A 16 -12.828 -2.269 17.718 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.908 -1.864 15.720 1.00 0.00 C ATOM 268 CE2 PHE A 16 -13.088 -1.380 16.667 1.00 0.00 C ATOM 269 CZ PHE A 16 -12.128 -1.178 15.669 1.00 0.00 C ATOM 0 H PHE A 16 -10.368 -5.401 20.610 1.00 0.00 H new ATOM 0 HA PHE A 16 -9.187 -3.497 18.846 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.293 -4.936 18.530 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -12.139 -3.871 19.635 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.708 -3.281 16.810 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.568 -2.425 18.489 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -10.168 -1.708 14.949 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -14.029 -0.851 16.627 1.00 0.00 H new ATOM 0 HZ PHE A 16 -12.328 -0.493 14.859 1.00 0.00 H new ATOM 279 N GLU A 17 -10.596 -2.093 21.467 1.00 0.00 N ATOM 280 CA GLU A 17 -10.714 -0.750 22.151 1.00 0.00 C ATOM 281 C GLU A 17 -9.355 -0.031 22.146 1.00 0.00 C ATOM 282 O GLU A 17 -9.288 1.172 21.972 1.00 0.00 O ATOM 283 CB GLU A 17 -11.158 -1.026 23.597 1.00 0.00 C ATOM 284 CG GLU A 17 -11.518 0.294 24.282 1.00 0.00 C ATOM 285 CD GLU A 17 -12.863 0.795 23.752 1.00 0.00 C ATOM 286 OE1 GLU A 17 -13.753 -0.023 23.585 1.00 0.00 O ATOM 287 OE2 GLU A 17 -12.980 1.988 23.522 1.00 0.00 O ATOM 0 H GLU A 17 -10.915 -2.891 22.016 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.431 -0.111 21.635 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -12.017 -1.697 23.603 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.359 -1.526 24.145 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -11.570 0.153 25.362 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -10.742 1.036 24.095 1.00 0.00 H new ATOM 294 N LYS A 18 -8.269 -0.756 22.326 1.00 0.00 N ATOM 295 CA LYS A 18 -6.915 -0.090 22.316 1.00 0.00 C ATOM 296 C LYS A 18 -6.685 0.628 20.976 1.00 0.00 C ATOM 297 O LYS A 18 -6.092 1.691 20.937 1.00 0.00 O ATOM 298 CB LYS A 18 -5.871 -1.202 22.507 1.00 0.00 C ATOM 299 CG LYS A 18 -5.614 -1.411 24.001 1.00 0.00 C ATOM 300 CD LYS A 18 -6.795 -2.158 24.623 1.00 0.00 C ATOM 301 CE LYS A 18 -6.342 -2.849 25.910 1.00 0.00 C ATOM 302 NZ LYS A 18 -7.590 -3.054 26.696 1.00 0.00 N ATOM 0 H LYS A 18 -8.258 -1.765 22.477 1.00 0.00 H new ATOM 0 HA LYS A 18 -6.842 0.656 23.108 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -6.225 -2.129 22.055 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -4.943 -0.935 22.002 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -4.694 -1.978 24.147 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -5.477 -0.449 24.495 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -7.606 -1.463 24.837 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -7.184 -2.895 23.920 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -5.850 -3.798 25.697 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -5.627 -2.235 26.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -7.361 -3.524 27.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -8.033 -2.133 26.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -8.249 -3.648 26.153 1.00 0.00 H new ATOM 316 N ILE A 19 -7.151 0.067 19.879 1.00 0.00 N ATOM 317 CA ILE A 19 -6.955 0.736 18.553 1.00 0.00 C ATOM 318 C ILE A 19 -8.317 1.112 17.930 1.00 0.00 C ATOM 319 O ILE A 19 -8.491 1.031 16.729 1.00 0.00 O ATOM 320 CB ILE A 19 -6.208 -0.287 17.676 1.00 0.00 C ATOM 321 CG1 ILE A 19 -7.057 -1.554 17.473 1.00 0.00 C ATOM 322 CG2 ILE A 19 -4.888 -0.674 18.350 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.877 -2.071 16.042 1.00 0.00 C ATOM 0 H ILE A 19 -7.655 -0.819 19.848 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.390 1.664 18.647 1.00 0.00 H new ATOM 0 HB ILE A 19 -6.014 0.169 16.705 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.759 -2.321 18.188 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.108 -1.334 17.661 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.361 -1.398 17.729 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.270 0.215 18.476 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.093 -1.115 19.326 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.479 -2.968 15.901 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.196 -1.305 15.335 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.827 -2.308 15.870 1.00 0.00 H new ATOM 335 N LYS A 20 -9.288 1.504 18.735 1.00 0.00 N ATOM 336 CA LYS A 20 -10.638 1.860 18.165 1.00 0.00 C ATOM 337 C LYS A 20 -10.723 3.322 17.661 1.00 0.00 C ATOM 338 O LYS A 20 -11.295 3.552 16.612 1.00 0.00 O ATOM 339 CB LYS A 20 -11.656 1.632 19.294 1.00 0.00 C ATOM 340 CG LYS A 20 -13.075 1.708 18.725 1.00 0.00 C ATOM 341 CD LYS A 20 -13.622 3.127 18.902 1.00 0.00 C ATOM 342 CE LYS A 20 -14.514 3.483 17.710 1.00 0.00 C ATOM 343 NZ LYS A 20 -14.916 4.898 17.942 1.00 0.00 N ATOM 0 H LYS A 20 -9.206 1.592 19.748 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.836 1.239 17.291 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -11.490 0.659 19.757 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.525 2.382 20.074 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -13.069 1.438 17.669 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -13.721 0.992 19.233 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.191 3.196 19.829 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -12.800 3.838 18.980 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -13.977 3.374 16.768 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -15.384 2.828 17.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -15.530 5.216 17.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -15.431 4.969 18.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -14.068 5.498 17.980 1.00 0.00 H new ATOM 357 N PRO A 21 -10.194 4.276 18.408 1.00 0.00 N ATOM 358 CA PRO A 21 -10.290 5.695 17.973 1.00 0.00 C ATOM 359 C PRO A 21 -9.292 6.010 16.847 1.00 0.00 C ATOM 360 O PRO A 21 -9.605 6.758 15.938 1.00 0.00 O ATOM 361 CB PRO A 21 -9.957 6.486 19.232 1.00 0.00 C ATOM 362 CG PRO A 21 -9.129 5.568 20.072 1.00 0.00 C ATOM 363 CD PRO A 21 -9.473 4.151 19.684 1.00 0.00 C ATOM 0 HA PRO A 21 -11.272 5.937 17.566 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -9.410 7.397 18.990 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -10.863 6.788 19.757 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -8.068 5.760 19.915 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.330 5.734 21.130 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.576 3.542 19.573 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -10.092 3.672 20.443 1.00 0.00 H new ATOM 371 N THR A 22 -8.094 5.461 16.889 1.00 0.00 N ATOM 372 CA THR A 22 -7.100 5.765 15.795 1.00 0.00 C ATOM 373 C THR A 22 -7.665 5.329 14.437 1.00 0.00 C ATOM 374 O THR A 22 -7.558 6.047 13.459 1.00 0.00 O ATOM 375 CB THR A 22 -5.818 4.978 16.120 1.00 0.00 C ATOM 376 OG1 THR A 22 -5.354 5.348 17.410 1.00 0.00 O ATOM 377 CG2 THR A 22 -4.741 5.293 15.078 1.00 0.00 C ATOM 0 H THR A 22 -7.764 4.828 17.617 1.00 0.00 H new ATOM 0 HA THR A 22 -6.892 6.834 15.740 1.00 0.00 H new ATOM 0 HB THR A 22 -6.033 3.910 16.102 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.538 4.847 17.620 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.835 4.734 15.311 1.00 0.00 H new ATOM 0 HG22 THR A 22 -5.098 5.009 14.088 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.522 6.361 15.092 1.00 0.00 H new ATOM 385 N LEU A 23 -8.274 4.166 14.367 1.00 0.00 N ATOM 386 CA LEU A 23 -8.853 3.710 13.053 1.00 0.00 C ATOM 387 C LEU A 23 -9.967 4.674 12.613 1.00 0.00 C ATOM 388 O LEU A 23 -10.100 4.973 11.441 1.00 0.00 O ATOM 389 CB LEU A 23 -9.424 2.302 13.280 1.00 0.00 C ATOM 390 CG LEU A 23 -8.336 1.262 13.004 1.00 0.00 C ATOM 391 CD1 LEU A 23 -8.506 0.073 13.956 1.00 0.00 C ATOM 392 CD2 LEU A 23 -8.449 0.781 11.554 1.00 0.00 C ATOM 0 H LEU A 23 -8.396 3.520 15.147 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.094 3.696 12.271 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.784 2.204 14.304 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.278 2.134 12.624 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.356 1.711 13.163 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.730 -0.666 13.757 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.424 0.418 14.987 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.486 -0.379 13.802 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -7.675 0.040 11.355 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.430 0.333 11.395 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -8.323 1.628 10.879 1.00 0.00 H new ATOM 404 N THR A 24 -10.768 5.172 13.540 1.00 0.00 N ATOM 405 CA THR A 24 -11.866 6.127 13.141 1.00 0.00 C ATOM 406 C THR A 24 -11.277 7.347 12.414 1.00 0.00 C ATOM 407 O THR A 24 -11.869 7.858 11.483 1.00 0.00 O ATOM 408 CB THR A 24 -12.565 6.572 14.441 1.00 0.00 C ATOM 409 OG1 THR A 24 -12.509 5.522 15.414 1.00 0.00 O ATOM 410 CG2 THR A 24 -14.025 6.935 14.139 1.00 0.00 C ATOM 0 H THR A 24 -10.711 4.963 14.537 1.00 0.00 H new ATOM 0 HA THR A 24 -12.570 5.646 12.461 1.00 0.00 H new ATOM 0 HB THR A 24 -12.054 7.447 14.843 1.00 0.00 H new ATOM 0 HG1 THR A 24 -13.086 5.748 16.173 1.00 0.00 H new ATOM 0 HG21 THR A 24 -14.519 7.250 15.058 1.00 0.00 H new ATOM 0 HG22 THR A 24 -14.055 7.748 13.414 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.539 6.065 13.730 1.00 0.00 H new ATOM 418 N ASP A 25 -10.113 7.819 12.824 1.00 0.00 N ATOM 419 CA ASP A 25 -9.505 9.012 12.126 1.00 0.00 C ATOM 420 C ASP A 25 -9.330 8.719 10.624 1.00 0.00 C ATOM 421 O ASP A 25 -9.517 9.590 9.796 1.00 0.00 O ATOM 422 CB ASP A 25 -8.135 9.257 12.778 1.00 0.00 C ATOM 423 CG ASP A 25 -8.309 10.142 14.015 1.00 0.00 C ATOM 424 OD1 ASP A 25 -9.133 11.041 13.965 1.00 0.00 O ATOM 425 OD2 ASP A 25 -7.615 9.906 14.989 1.00 0.00 O ATOM 0 H ASP A 25 -9.566 7.439 13.597 1.00 0.00 H new ATOM 0 HA ASP A 25 -10.147 9.887 12.221 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.679 8.308 13.058 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.462 9.736 12.067 1.00 0.00 H new ATOM 430 N PHE A 26 -8.971 7.501 10.263 1.00 0.00 N ATOM 431 CA PHE A 26 -8.788 7.175 8.802 1.00 0.00 C ATOM 432 C PHE A 26 -10.086 7.441 8.023 1.00 0.00 C ATOM 433 O PHE A 26 -10.050 7.911 6.901 1.00 0.00 O ATOM 434 CB PHE A 26 -8.444 5.679 8.725 1.00 0.00 C ATOM 435 CG PHE A 26 -6.952 5.495 8.821 1.00 0.00 C ATOM 436 CD1 PHE A 26 -6.316 5.558 10.066 1.00 0.00 C ATOM 437 CD2 PHE A 26 -6.204 5.259 7.663 1.00 0.00 C ATOM 438 CE1 PHE A 26 -4.931 5.385 10.154 1.00 0.00 C ATOM 439 CE2 PHE A 26 -4.819 5.085 7.751 1.00 0.00 C ATOM 440 CZ PHE A 26 -4.183 5.147 8.994 1.00 0.00 C ATOM 0 H PHE A 26 -8.799 6.729 10.907 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.003 7.793 8.366 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.939 5.140 9.533 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.812 5.259 7.789 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.895 5.740 10.959 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.695 5.211 6.702 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.439 5.435 11.114 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.240 4.903 6.858 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.114 5.011 9.060 1.00 0.00 H new ATOM 450 N GLU A 27 -11.231 7.129 8.597 1.00 0.00 N ATOM 451 CA GLU A 27 -12.522 7.357 7.853 1.00 0.00 C ATOM 452 C GLU A 27 -12.705 8.843 7.519 1.00 0.00 C ATOM 453 O GLU A 27 -13.179 9.179 6.449 1.00 0.00 O ATOM 454 CB GLU A 27 -13.659 6.879 8.772 1.00 0.00 C ATOM 455 CG GLU A 27 -13.495 5.384 9.054 1.00 0.00 C ATOM 456 CD GLU A 27 -14.873 4.723 9.140 1.00 0.00 C ATOM 457 OE1 GLU A 27 -15.580 4.998 10.096 1.00 0.00 O ATOM 458 OE2 GLU A 27 -15.198 3.955 8.250 1.00 0.00 O ATOM 0 H GLU A 27 -11.329 6.733 9.532 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.520 6.810 6.910 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.645 7.440 9.707 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.624 7.067 8.302 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.905 4.917 8.265 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -12.951 5.237 9.987 1.00 0.00 H new ATOM 465 N ILE A 28 -12.342 9.737 8.414 1.00 0.00 N ATOM 466 CA ILE A 28 -12.519 11.201 8.102 1.00 0.00 C ATOM 467 C ILE A 28 -11.594 11.596 6.935 1.00 0.00 C ATOM 468 O ILE A 28 -11.988 12.355 6.068 1.00 0.00 O ATOM 469 CB ILE A 28 -12.184 11.986 9.394 1.00 0.00 C ATOM 470 CG1 ILE A 28 -13.291 11.745 10.434 1.00 0.00 C ATOM 471 CG2 ILE A 28 -12.107 13.490 9.095 1.00 0.00 C ATOM 472 CD1 ILE A 28 -12.848 10.673 11.431 1.00 0.00 C ATOM 0 H ILE A 28 -11.940 9.526 9.327 1.00 0.00 H new ATOM 0 HA ILE A 28 -13.539 11.428 7.792 1.00 0.00 H new ATOM 0 HB ILE A 28 -11.223 11.643 9.777 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -13.515 12.673 10.961 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -14.208 11.432 9.935 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -11.871 14.031 10.011 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -11.329 13.674 8.354 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -13.066 13.834 8.708 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -13.638 10.509 12.164 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -12.647 9.743 10.900 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -11.943 11.002 11.941 1.00 0.00 H new ATOM 484 N GLN A 29 -10.380 11.081 6.888 1.00 0.00 N ATOM 485 CA GLN A 29 -9.473 11.442 5.740 1.00 0.00 C ATOM 486 C GLN A 29 -9.978 10.744 4.472 1.00 0.00 C ATOM 487 O GLN A 29 -10.101 11.362 3.430 1.00 0.00 O ATOM 488 CB GLN A 29 -8.065 10.948 6.107 1.00 0.00 C ATOM 489 CG GLN A 29 -7.044 11.563 5.148 1.00 0.00 C ATOM 490 CD GLN A 29 -5.706 11.751 5.876 1.00 0.00 C ATOM 491 OE1 GLN A 29 -5.685 12.072 7.048 1.00 0.00 O ATOM 492 NE2 GLN A 29 -4.579 11.565 5.233 1.00 0.00 N ATOM 0 H GLN A 29 -9.985 10.441 7.577 1.00 0.00 H new ATOM 0 HA GLN A 29 -9.457 12.516 5.557 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.827 11.224 7.134 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -8.023 9.860 6.051 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.910 10.918 4.280 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.407 12.522 4.779 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.592 11.296 4.249 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -3.689 11.690 5.716 1.00 0.00 H new ATOM 501 N LEU A 30 -10.305 9.469 4.555 1.00 0.00 N ATOM 502 CA LEU A 30 -10.843 8.765 3.335 1.00 0.00 C ATOM 503 C LEU A 30 -12.201 9.386 2.959 1.00 0.00 C ATOM 504 O LEU A 30 -12.535 9.482 1.794 1.00 0.00 O ATOM 505 CB LEU A 30 -11.011 7.276 3.704 1.00 0.00 C ATOM 506 CG LEU A 30 -10.471 6.398 2.566 1.00 0.00 C ATOM 507 CD1 LEU A 30 -9.638 5.250 3.149 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.641 5.822 1.762 1.00 0.00 C ATOM 0 H LEU A 30 -10.226 8.895 5.395 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.171 8.865 2.483 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -10.478 7.058 4.629 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -12.063 7.052 3.882 1.00 0.00 H new ATOM 0 HG LEU A 30 -9.844 7.004 1.912 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.257 4.629 2.338 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.802 5.659 3.717 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -10.262 4.645 3.807 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -11.256 5.199 0.955 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -12.271 5.219 2.417 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.230 6.637 1.342 1.00 0.00 H new ATOM 520 N ARG A 31 -12.987 9.824 3.933 1.00 0.00 N ATOM 521 CA ARG A 31 -14.317 10.451 3.600 1.00 0.00 C ATOM 522 C ARG A 31 -14.113 11.648 2.659 1.00 0.00 C ATOM 523 O ARG A 31 -14.889 11.856 1.746 1.00 0.00 O ATOM 524 CB ARG A 31 -14.925 10.943 4.926 1.00 0.00 C ATOM 525 CG ARG A 31 -15.698 9.809 5.603 1.00 0.00 C ATOM 526 CD ARG A 31 -15.779 10.075 7.113 1.00 0.00 C ATOM 527 NE ARG A 31 -17.208 9.821 7.475 1.00 0.00 N ATOM 528 CZ ARG A 31 -18.162 10.681 7.157 1.00 0.00 C ATOM 529 NH1 ARG A 31 -17.894 11.794 6.511 1.00 0.00 N ATOM 530 NH2 ARG A 31 -19.401 10.425 7.490 1.00 0.00 N ATOM 0 H ARG A 31 -12.766 9.774 4.928 1.00 0.00 H new ATOM 0 HA ARG A 31 -14.970 9.732 3.105 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -14.135 11.300 5.587 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -15.590 11.786 4.739 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -16.701 9.736 5.182 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -15.203 8.856 5.417 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -15.109 9.417 7.666 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -15.488 11.098 7.350 1.00 0.00 H new ATOM 0 HE ARG A 31 -17.452 8.967 7.977 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -16.934 12.010 6.244 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -18.646 12.442 6.277 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -19.627 9.566 7.992 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -20.141 11.084 7.248 1.00 0.00 H new ATOM 544 N ASP A 32 -13.078 12.442 2.872 1.00 0.00 N ATOM 545 CA ASP A 32 -12.859 13.626 1.965 1.00 0.00 C ATOM 546 C ASP A 32 -12.604 13.138 0.535 1.00 0.00 C ATOM 547 O ASP A 32 -13.232 13.601 -0.399 1.00 0.00 O ATOM 548 CB ASP A 32 -11.632 14.381 2.500 1.00 0.00 C ATOM 549 CG ASP A 32 -12.075 15.376 3.575 1.00 0.00 C ATOM 550 OD1 ASP A 32 -12.322 14.943 4.689 1.00 0.00 O ATOM 551 OD2 ASP A 32 -12.157 16.553 3.267 1.00 0.00 O ATOM 0 H ASP A 32 -12.391 12.325 3.617 1.00 0.00 H new ATOM 0 HA ASP A 32 -13.732 14.279 1.947 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -10.911 13.677 2.916 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -11.132 14.907 1.687 1.00 0.00 H new ATOM 556 N ALA A 33 -11.701 12.198 0.350 1.00 0.00 N ATOM 557 CA ALA A 33 -11.443 11.687 -1.042 1.00 0.00 C ATOM 558 C ALA A 33 -12.661 10.887 -1.524 1.00 0.00 C ATOM 559 O ALA A 33 -13.051 10.983 -2.673 1.00 0.00 O ATOM 560 CB ALA A 33 -10.211 10.774 -0.962 1.00 0.00 C ATOM 0 H ALA A 33 -11.141 11.769 1.086 1.00 0.00 H new ATOM 0 HA ALA A 33 -11.272 12.506 -1.741 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.986 10.379 -1.953 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -9.358 11.345 -0.597 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.414 9.948 -0.280 1.00 0.00 H new ATOM 566 N GLN A 34 -13.275 10.105 -0.656 1.00 0.00 N ATOM 567 CA GLN A 34 -14.480 9.315 -1.092 1.00 0.00 C ATOM 568 C GLN A 34 -15.675 10.254 -1.350 1.00 0.00 C ATOM 569 O GLN A 34 -16.510 9.970 -2.188 1.00 0.00 O ATOM 570 CB GLN A 34 -14.813 8.339 0.049 1.00 0.00 C ATOM 571 CG GLN A 34 -14.028 7.040 -0.145 1.00 0.00 C ATOM 572 CD GLN A 34 -14.836 6.081 -1.030 1.00 0.00 C ATOM 573 OE1 GLN A 34 -15.800 5.496 -0.580 1.00 0.00 O ATOM 574 NE2 GLN A 34 -14.485 5.892 -2.279 1.00 0.00 N ATOM 0 H GLN A 34 -12.999 9.981 0.318 1.00 0.00 H new ATOM 0 HA GLN A 34 -14.275 8.779 -2.019 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -14.562 8.788 1.010 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -15.883 8.131 0.063 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -13.063 7.251 -0.606 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -13.826 6.577 0.821 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -13.676 6.382 -2.661 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -15.021 5.255 -2.869 1.00 0.00 H new ATOM 583 N LYS A 35 -15.774 11.371 -0.643 1.00 0.00 N ATOM 584 CA LYS A 35 -16.934 12.299 -0.879 1.00 0.00 C ATOM 585 C LYS A 35 -16.564 13.413 -1.875 1.00 0.00 C ATOM 586 O LYS A 35 -17.413 13.883 -2.610 1.00 0.00 O ATOM 587 CB LYS A 35 -17.284 12.901 0.489 1.00 0.00 C ATOM 588 CG LYS A 35 -17.861 11.811 1.394 1.00 0.00 C ATOM 589 CD LYS A 35 -18.907 12.423 2.328 1.00 0.00 C ATOM 590 CE LYS A 35 -20.203 12.667 1.553 1.00 0.00 C ATOM 591 NZ LYS A 35 -20.814 13.865 2.193 1.00 0.00 N ATOM 0 H LYS A 35 -15.112 11.671 0.073 1.00 0.00 H new ATOM 0 HA LYS A 35 -17.778 11.762 -1.311 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -16.394 13.334 0.946 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -18.006 13.709 0.369 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -18.313 11.024 0.790 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -17.065 11.348 1.977 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -19.094 11.755 3.169 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -18.536 13.361 2.742 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -20.004 12.843 0.496 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -20.867 11.805 1.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -21.709 14.095 1.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -20.999 13.666 3.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -20.162 14.671 2.114 1.00 0.00 H new ATOM 605 N ASP A 36 -15.317 13.845 -1.917 1.00 0.00 N ATOM 606 CA ASP A 36 -14.940 14.937 -2.891 1.00 0.00 C ATOM 607 C ASP A 36 -15.295 14.516 -4.328 1.00 0.00 C ATOM 608 O ASP A 36 -15.714 15.332 -5.127 1.00 0.00 O ATOM 609 CB ASP A 36 -13.423 15.147 -2.763 1.00 0.00 C ATOM 610 CG ASP A 36 -13.131 16.074 -1.582 1.00 0.00 C ATOM 611 OD1 ASP A 36 -13.858 16.003 -0.603 1.00 0.00 O ATOM 612 OD2 ASP A 36 -12.186 16.841 -1.674 1.00 0.00 O ATOM 0 H ASP A 36 -14.557 13.498 -1.332 1.00 0.00 H new ATOM 0 HA ASP A 36 -15.482 15.857 -2.671 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -12.924 14.189 -2.618 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -13.026 15.577 -3.683 1.00 0.00 H new ATOM 617 N LYS A 37 -15.136 13.248 -4.668 1.00 0.00 N ATOM 618 CA LYS A 37 -15.478 12.798 -6.070 1.00 0.00 C ATOM 619 C LYS A 37 -16.919 13.206 -6.432 1.00 0.00 C ATOM 620 O LYS A 37 -17.195 13.569 -7.560 1.00 0.00 O ATOM 621 CB LYS A 37 -15.347 11.267 -6.088 1.00 0.00 C ATOM 622 CG LYS A 37 -15.564 10.753 -7.514 1.00 0.00 C ATOM 623 CD LYS A 37 -15.000 9.336 -7.637 1.00 0.00 C ATOM 624 CE LYS A 37 -13.488 9.406 -7.863 1.00 0.00 C ATOM 625 NZ LYS A 37 -13.145 8.133 -8.557 1.00 0.00 N ATOM 0 H LYS A 37 -14.790 12.516 -4.047 1.00 0.00 H new ATOM 0 HA LYS A 37 -14.812 13.261 -6.797 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -14.361 10.971 -5.730 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -16.078 10.821 -5.414 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -16.627 10.755 -7.755 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -15.074 11.414 -8.229 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -15.217 8.767 -6.733 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -15.478 8.813 -8.465 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -13.219 10.271 -8.469 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -12.951 9.498 -6.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -12.415 8.315 -9.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -12.786 7.446 -7.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -13.995 7.749 -9.017 1.00 0.00 H new ATOM 639 N SER A 38 -17.841 13.156 -5.488 1.00 0.00 N ATOM 640 CA SER A 38 -19.252 13.553 -5.801 1.00 0.00 C ATOM 641 C SER A 38 -19.568 14.921 -5.174 1.00 0.00 C ATOM 642 O SER A 38 -20.654 15.137 -4.670 1.00 0.00 O ATOM 643 CB SER A 38 -20.132 12.463 -5.184 1.00 0.00 C ATOM 644 OG SER A 38 -21.458 12.597 -5.678 1.00 0.00 O ATOM 0 H SER A 38 -17.675 12.860 -4.526 1.00 0.00 H new ATOM 0 HA SER A 38 -19.421 13.645 -6.874 1.00 0.00 H new ATOM 0 HB2 SER A 38 -19.737 11.477 -5.431 1.00 0.00 H new ATOM 0 HB3 SER A 38 -20.126 12.546 -4.097 1.00 0.00 H new ATOM 0 HG SER A 38 -21.775 13.511 -5.520 1.00 0.00 H new ATOM 650 N SER A 39 -18.631 15.850 -5.204 1.00 0.00 N ATOM 651 CA SER A 39 -18.893 17.197 -4.608 1.00 0.00 C ATOM 652 C SER A 39 -18.076 18.274 -5.343 1.00 0.00 C ATOM 653 O SER A 39 -18.629 19.208 -5.892 1.00 0.00 O ATOM 654 CB SER A 39 -18.440 17.081 -3.153 1.00 0.00 C ATOM 655 OG SER A 39 -19.575 16.876 -2.323 1.00 0.00 O ATOM 0 H SER A 39 -17.705 15.729 -5.614 1.00 0.00 H new ATOM 0 HA SER A 39 -19.941 17.486 -4.687 1.00 0.00 H new ATOM 0 HB2 SER A 39 -17.740 16.253 -3.043 1.00 0.00 H new ATOM 0 HB3 SER A 39 -17.913 17.986 -2.851 1.00 0.00 H new ATOM 0 HG SER A 39 -20.205 16.276 -2.773 1.00 0.00 H new ATOM 661 N LYS A 40 -16.764 18.149 -5.363 1.00 0.00 N ATOM 662 CA LYS A 40 -15.925 19.165 -6.067 1.00 0.00 C ATOM 663 C LYS A 40 -15.065 18.482 -7.142 1.00 0.00 C ATOM 664 O LYS A 40 -14.040 17.900 -6.842 1.00 0.00 O ATOM 665 CB LYS A 40 -15.039 19.772 -4.978 1.00 0.00 C ATOM 666 CG LYS A 40 -14.854 21.266 -5.246 1.00 0.00 C ATOM 667 CD LYS A 40 -14.276 21.942 -4.000 1.00 0.00 C ATOM 668 CE LYS A 40 -13.356 23.090 -4.421 1.00 0.00 C ATOM 669 NZ LYS A 40 -13.498 24.109 -3.343 1.00 0.00 N ATOM 0 H LYS A 40 -16.246 17.389 -4.923 1.00 0.00 H new ATOM 0 HA LYS A 40 -16.526 19.922 -6.570 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -15.493 19.621 -3.999 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -14.071 19.272 -4.961 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -14.187 21.414 -6.095 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -15.810 21.720 -5.509 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -15.082 22.320 -3.372 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -13.721 21.217 -3.405 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -12.323 22.755 -4.514 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -13.648 23.496 -5.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -12.896 24.929 -3.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -14.490 24.414 -3.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -13.206 23.696 -2.434 1.00 0.00 H new ATOM 683 N LEU A 41 -15.472 18.544 -8.395 1.00 0.00 N ATOM 684 CA LEU A 41 -14.671 17.894 -9.476 1.00 0.00 C ATOM 685 C LEU A 41 -14.175 18.953 -10.475 1.00 0.00 C ATOM 686 O LEU A 41 -14.622 18.999 -11.607 1.00 0.00 O ATOM 687 CB LEU A 41 -15.639 16.921 -10.153 1.00 0.00 C ATOM 688 CG LEU A 41 -14.873 15.681 -10.616 1.00 0.00 C ATOM 689 CD1 LEU A 41 -15.865 14.579 -10.992 1.00 0.00 C ATOM 690 CD2 LEU A 41 -14.019 16.035 -11.835 1.00 0.00 C ATOM 0 H LEU A 41 -16.321 19.016 -8.708 1.00 0.00 H new ATOM 0 HA LEU A 41 -13.787 17.385 -9.091 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -16.429 16.635 -9.459 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -16.121 17.403 -11.004 1.00 0.00 H new ATOM 0 HG LEU A 41 -14.229 15.330 -9.810 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -15.319 13.695 -11.322 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -16.474 14.326 -10.124 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -16.510 14.929 -11.798 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -13.473 15.152 -12.165 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -14.663 16.386 -12.641 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -13.312 16.820 -11.568 1.00 0.00 H new ATOM 702 N ALA A 42 -13.255 19.805 -10.069 1.00 0.00 N ATOM 703 CA ALA A 42 -12.742 20.852 -11.006 1.00 0.00 C ATOM 704 C ALA A 42 -11.272 20.574 -11.362 1.00 0.00 C ATOM 705 O ALA A 42 -10.922 20.485 -12.523 1.00 0.00 O ATOM 706 CB ALA A 42 -12.867 22.173 -10.242 1.00 0.00 C ATOM 0 H ALA A 42 -12.843 19.817 -9.136 1.00 0.00 H new ATOM 0 HA ALA A 42 -13.299 20.871 -11.943 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -12.508 22.990 -10.868 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -13.911 22.346 -9.982 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -12.270 22.124 -9.331 1.00 0.00 H new ATOM 712 N ALA A 43 -10.407 20.433 -10.376 1.00 0.00 N ATOM 713 CA ALA A 43 -8.969 20.163 -10.677 1.00 0.00 C ATOM 714 C ALA A 43 -8.431 19.054 -9.758 1.00 0.00 C ATOM 715 O ALA A 43 -8.989 18.787 -8.711 1.00 0.00 O ATOM 716 CB ALA A 43 -8.252 21.484 -10.398 1.00 0.00 C ATOM 0 H ALA A 43 -10.639 20.494 -9.385 1.00 0.00 H new ATOM 0 HA ALA A 43 -8.819 19.825 -11.702 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.186 21.369 -10.596 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.659 22.262 -11.044 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -8.399 21.764 -9.355 1.00 0.00 H new ATOM 722 N LYS A 44 -7.346 18.402 -10.139 1.00 0.00 N ATOM 723 CA LYS A 44 -6.770 17.311 -9.284 1.00 0.00 C ATOM 724 C LYS A 44 -7.843 16.265 -8.930 1.00 0.00 C ATOM 725 O LYS A 44 -8.584 16.434 -7.979 1.00 0.00 O ATOM 726 CB LYS A 44 -6.264 18.009 -8.018 1.00 0.00 C ATOM 727 CG LYS A 44 -5.138 18.978 -8.386 1.00 0.00 C ATOM 728 CD LYS A 44 -3.792 18.254 -8.301 1.00 0.00 C ATOM 729 CE LYS A 44 -2.657 19.259 -8.502 1.00 0.00 C ATOM 730 NZ LYS A 44 -1.408 18.470 -8.320 1.00 0.00 N ATOM 0 H LYS A 44 -6.839 18.582 -11.005 1.00 0.00 H new ATOM 0 HA LYS A 44 -5.973 16.777 -9.801 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -7.080 18.548 -7.536 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -5.903 17.271 -7.302 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -5.292 19.365 -9.393 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -5.146 19.834 -7.711 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.691 17.765 -7.332 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -3.739 17.473 -9.060 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -2.699 19.709 -9.494 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -2.718 20.073 -7.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -0.893 18.823 -7.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -1.648 17.468 -8.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -0.810 18.568 -9.165 1.00 0.00 H new ATOM 744 N SER A 45 -7.932 15.186 -9.682 1.00 0.00 N ATOM 745 CA SER A 45 -8.956 14.141 -9.377 1.00 0.00 C ATOM 746 C SER A 45 -8.276 12.790 -9.126 1.00 0.00 C ATOM 747 O SER A 45 -8.421 12.210 -8.066 1.00 0.00 O ATOM 748 CB SER A 45 -9.847 14.075 -10.617 1.00 0.00 C ATOM 749 OG SER A 45 -9.087 14.444 -11.763 1.00 0.00 O ATOM 0 H SER A 45 -7.340 14.990 -10.489 1.00 0.00 H new ATOM 0 HA SER A 45 -9.530 14.378 -8.481 1.00 0.00 H new ATOM 0 HB2 SER A 45 -10.245 13.068 -10.739 1.00 0.00 H new ATOM 0 HB3 SER A 45 -10.700 14.743 -10.502 1.00 0.00 H new ATOM 0 HG SER A 45 -9.655 14.401 -12.560 1.00 0.00 H new ATOM 755 N ASN A 46 -7.526 12.284 -10.084 1.00 0.00 N ATOM 756 CA ASN A 46 -6.830 10.960 -9.871 1.00 0.00 C ATOM 757 C ASN A 46 -5.962 11.025 -8.602 1.00 0.00 C ATOM 758 O ASN A 46 -5.889 10.071 -7.850 1.00 0.00 O ATOM 759 CB ASN A 46 -5.945 10.719 -11.104 1.00 0.00 C ATOM 760 CG ASN A 46 -6.829 10.557 -12.346 1.00 0.00 C ATOM 761 OD1 ASN A 46 -7.488 11.493 -12.757 1.00 0.00 O ATOM 762 ND2 ASN A 46 -6.878 9.406 -12.970 1.00 0.00 N ATOM 0 H ASN A 46 -7.365 12.720 -10.992 1.00 0.00 H new ATOM 0 HA ASN A 46 -7.551 10.152 -9.745 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.258 11.554 -11.240 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -5.337 9.826 -10.959 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -7.467 9.298 -13.796 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -6.327 8.618 -12.630 1.00 0.00 H new ATOM 769 N GLU A 47 -5.312 12.147 -8.350 1.00 0.00 N ATOM 770 CA GLU A 47 -4.463 12.254 -7.108 1.00 0.00 C ATOM 771 C GLU A 47 -5.320 11.994 -5.855 1.00 0.00 C ATOM 772 O GLU A 47 -4.845 11.425 -4.891 1.00 0.00 O ATOM 773 CB GLU A 47 -3.904 13.686 -7.074 1.00 0.00 C ATOM 774 CG GLU A 47 -3.002 13.912 -8.289 1.00 0.00 C ATOM 775 CD GLU A 47 -1.866 14.864 -7.912 1.00 0.00 C ATOM 776 OE1 GLU A 47 -2.153 16.015 -7.630 1.00 0.00 O ATOM 777 OE2 GLU A 47 -0.727 14.425 -7.912 1.00 0.00 O ATOM 0 H GLU A 47 -5.331 12.979 -8.939 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.659 11.518 -7.121 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.722 14.407 -7.076 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.340 13.846 -6.155 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.595 12.962 -8.634 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.581 14.329 -9.113 1.00 0.00 H new ATOM 784 N GLN A 48 -6.581 12.401 -5.853 1.00 0.00 N ATOM 785 CA GLN A 48 -7.441 12.154 -4.636 1.00 0.00 C ATOM 786 C GLN A 48 -7.487 10.651 -4.323 1.00 0.00 C ATOM 787 O GLN A 48 -7.416 10.254 -3.175 1.00 0.00 O ATOM 788 CB GLN A 48 -8.852 12.662 -4.974 1.00 0.00 C ATOM 789 CG GLN A 48 -9.533 13.160 -3.698 1.00 0.00 C ATOM 790 CD GLN A 48 -10.772 13.981 -4.071 1.00 0.00 C ATOM 791 OE1 GLN A 48 -10.856 15.148 -3.745 1.00 0.00 O ATOM 792 NE2 GLN A 48 -11.747 13.422 -4.746 1.00 0.00 N ATOM 0 H GLN A 48 -7.042 12.883 -6.625 1.00 0.00 H new ATOM 0 HA GLN A 48 -7.039 12.669 -3.763 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.795 13.467 -5.707 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.440 11.862 -5.425 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -9.818 12.315 -3.071 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -8.841 13.769 -3.117 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -11.680 12.442 -5.022 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -12.572 13.967 -4.996 1.00 0.00 H new ATOM 801 N LEU A 49 -7.597 9.809 -5.333 1.00 0.00 N ATOM 802 CA LEU A 49 -7.635 8.326 -5.061 1.00 0.00 C ATOM 803 C LEU A 49 -6.298 7.871 -4.461 1.00 0.00 C ATOM 804 O LEU A 49 -6.267 7.039 -3.574 1.00 0.00 O ATOM 805 CB LEU A 49 -7.864 7.627 -6.409 1.00 0.00 C ATOM 806 CG LEU A 49 -9.258 7.973 -6.940 1.00 0.00 C ATOM 807 CD1 LEU A 49 -9.450 7.340 -8.320 1.00 0.00 C ATOM 808 CD2 LEU A 49 -10.325 7.434 -5.980 1.00 0.00 C ATOM 0 H LEU A 49 -7.661 10.077 -6.315 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.427 8.081 -4.354 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -7.104 7.939 -7.125 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -7.767 6.548 -6.291 1.00 0.00 H new ATOM 0 HG LEU A 49 -9.355 9.056 -7.018 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -10.442 7.586 -8.698 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -8.695 7.725 -9.005 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.350 6.257 -8.241 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.316 7.682 -6.361 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -10.228 6.351 -5.899 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.191 7.885 -4.997 1.00 0.00 H new ATOM 820 N TRP A 50 -5.187 8.411 -4.931 1.00 0.00 N ATOM 821 CA TRP A 50 -3.857 7.989 -4.357 1.00 0.00 C ATOM 822 C TRP A 50 -3.832 8.259 -2.840 1.00 0.00 C ATOM 823 O TRP A 50 -3.220 7.524 -2.091 1.00 0.00 O ATOM 824 CB TRP A 50 -2.765 8.812 -5.084 1.00 0.00 C ATOM 825 CG TRP A 50 -2.822 8.602 -6.582 1.00 0.00 C ATOM 826 CD1 TRP A 50 -3.610 7.705 -7.238 1.00 0.00 C ATOM 827 CD2 TRP A 50 -2.068 9.301 -7.619 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.382 7.817 -8.599 1.00 0.00 N ATOM 829 CE2 TRP A 50 -2.445 8.782 -8.881 1.00 0.00 C ATOM 830 CE3 TRP A 50 -1.101 10.324 -7.591 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -1.892 9.259 -10.064 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -0.539 10.805 -8.787 1.00 0.00 C ATOM 833 CH2 TRP A 50 -0.938 10.270 -10.022 1.00 0.00 C ATOM 0 H TRP A 50 -5.143 9.111 -5.672 1.00 0.00 H new ATOM 0 HA TRP A 50 -3.684 6.923 -4.502 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -2.894 9.871 -4.858 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -1.782 8.524 -4.712 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.301 7.018 -6.772 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -3.852 7.252 -9.306 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -0.789 10.742 -6.645 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -2.202 8.846 -11.012 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 0.203 11.589 -8.755 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -0.505 10.643 -10.938 1.00 0.00 H new ATOM 844 N GLU A 51 -4.511 9.288 -2.367 1.00 0.00 N ATOM 845 CA GLU A 51 -4.517 9.541 -0.884 1.00 0.00 C ATOM 846 C GLU A 51 -5.319 8.435 -0.174 1.00 0.00 C ATOM 847 O GLU A 51 -4.991 8.053 0.935 1.00 0.00 O ATOM 848 CB GLU A 51 -5.178 10.911 -0.664 1.00 0.00 C ATOM 849 CG GLU A 51 -4.866 11.408 0.749 1.00 0.00 C ATOM 850 CD GLU A 51 -5.914 12.440 1.170 1.00 0.00 C ATOM 851 OE1 GLU A 51 -5.819 13.570 0.722 1.00 0.00 O ATOM 852 OE2 GLU A 51 -6.796 12.081 1.934 1.00 0.00 O ATOM 0 H GLU A 51 -5.048 9.948 -2.929 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.506 9.536 -0.477 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -4.812 11.626 -1.401 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -6.256 10.833 -0.804 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -4.863 10.571 1.448 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -3.871 11.852 0.778 1.00 0.00 H new ATOM 859 N ILE A 52 -6.359 7.902 -0.797 1.00 0.00 N ATOM 860 CA ILE A 52 -7.143 6.809 -0.122 1.00 0.00 C ATOM 861 C ILE A 52 -6.316 5.514 -0.121 1.00 0.00 C ATOM 862 O ILE A 52 -6.137 4.904 0.918 1.00 0.00 O ATOM 863 CB ILE A 52 -8.455 6.638 -0.913 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.248 7.949 -0.837 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.280 5.502 -0.296 1.00 0.00 C ATOM 866 CD1 ILE A 52 -10.560 7.836 -1.624 1.00 0.00 C ATOM 0 H ILE A 52 -6.690 8.172 -1.723 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.368 7.055 0.916 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.235 6.396 -1.953 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.462 8.190 0.204 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.648 8.766 -1.237 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.208 5.381 -0.855 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -8.709 4.575 -0.336 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.511 5.742 0.742 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -11.107 8.777 -1.557 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.340 7.618 -2.669 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.167 7.033 -1.206 1.00 0.00 H new ATOM 878 N MET A 53 -5.793 5.088 -1.259 1.00 0.00 N ATOM 879 CA MET A 53 -4.964 3.828 -1.251 1.00 0.00 C ATOM 880 C MET A 53 -3.738 4.019 -0.332 1.00 0.00 C ATOM 881 O MET A 53 -3.300 3.081 0.309 1.00 0.00 O ATOM 882 CB MET A 53 -4.524 3.526 -2.704 1.00 0.00 C ATOM 883 CG MET A 53 -3.652 4.651 -3.256 1.00 0.00 C ATOM 884 SD MET A 53 -1.916 4.327 -2.871 1.00 0.00 S ATOM 885 CE MET A 53 -1.266 5.836 -3.610 1.00 0.00 C ATOM 0 H MET A 53 -5.900 5.543 -2.166 1.00 0.00 H new ATOM 0 HA MET A 53 -5.545 2.989 -0.868 1.00 0.00 H new ATOM 0 HB2 MET A 53 -3.973 2.586 -2.733 1.00 0.00 H new ATOM 0 HB3 MET A 53 -5.403 3.399 -3.335 1.00 0.00 H new ATOM 0 HG2 MET A 53 -3.786 4.731 -4.335 1.00 0.00 H new ATOM 0 HG3 MET A 53 -3.957 5.605 -2.825 1.00 0.00 H new ATOM 0 HE1 MET A 53 -0.178 5.781 -3.653 1.00 0.00 H new ATOM 0 HE2 MET A 53 -1.664 5.948 -4.619 1.00 0.00 H new ATOM 0 HE3 MET A 53 -1.562 6.694 -3.006 1.00 0.00 H new ATOM 895 N GLN A 54 -3.184 5.222 -0.246 1.00 0.00 N ATOM 896 CA GLN A 54 -1.995 5.426 0.659 1.00 0.00 C ATOM 897 C GLN A 54 -2.400 5.145 2.113 1.00 0.00 C ATOM 898 O GLN A 54 -1.637 4.571 2.867 1.00 0.00 O ATOM 899 CB GLN A 54 -1.554 6.892 0.505 1.00 0.00 C ATOM 900 CG GLN A 54 -0.520 7.007 -0.622 1.00 0.00 C ATOM 901 CD GLN A 54 0.882 7.182 -0.023 1.00 0.00 C ATOM 902 OE1 GLN A 54 1.038 7.813 1.003 1.00 0.00 O ATOM 903 NE2 GLN A 54 1.920 6.648 -0.622 1.00 0.00 N ATOM 0 H GLN A 54 -3.498 6.050 -0.752 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.180 4.751 0.396 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.417 7.520 0.285 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -1.128 7.253 1.441 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -0.550 6.115 -1.248 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -0.760 7.855 -1.264 1.00 0.00 H new ATOM 0 HE21 GLN A 54 1.794 6.117 -1.484 1.00 0.00 H new ATOM 0 HE22 GLN A 54 2.853 6.764 -0.226 1.00 0.00 H new ATOM 912 N LEU A 55 -3.600 5.530 2.517 1.00 0.00 N ATOM 913 CA LEU A 55 -4.035 5.257 3.937 1.00 0.00 C ATOM 914 C LEU A 55 -3.877 3.759 4.258 1.00 0.00 C ATOM 915 O LEU A 55 -3.531 3.395 5.368 1.00 0.00 O ATOM 916 CB LEU A 55 -5.517 5.661 4.032 1.00 0.00 C ATOM 917 CG LEU A 55 -5.624 7.171 4.258 1.00 0.00 C ATOM 918 CD1 LEU A 55 -7.065 7.624 4.004 1.00 0.00 C ATOM 919 CD2 LEU A 55 -5.236 7.502 5.702 1.00 0.00 C ATOM 0 H LEU A 55 -4.285 6.013 1.936 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.428 5.818 4.648 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.040 5.382 3.117 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.999 5.126 4.850 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.952 7.688 3.573 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.142 8.699 4.165 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.344 7.390 2.977 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.736 7.106 4.689 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.312 8.577 5.862 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.908 6.985 6.387 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -4.211 7.180 5.886 1.00 0.00 H new ATOM 931 N HIS A 56 -4.111 2.881 3.295 1.00 0.00 N ATOM 932 CA HIS A 56 -3.951 1.407 3.574 1.00 0.00 C ATOM 933 C HIS A 56 -2.531 1.124 4.093 1.00 0.00 C ATOM 934 O HIS A 56 -2.348 0.320 4.989 1.00 0.00 O ATOM 935 CB HIS A 56 -4.181 0.674 2.243 1.00 0.00 C ATOM 936 CG HIS A 56 -4.267 -0.804 2.499 1.00 0.00 C ATOM 937 ND1 HIS A 56 -5.469 -1.437 2.777 1.00 0.00 N ATOM 938 CD2 HIS A 56 -3.310 -1.786 2.529 1.00 0.00 C ATOM 939 CE1 HIS A 56 -5.205 -2.742 2.961 1.00 0.00 C ATOM 940 NE2 HIS A 56 -3.904 -3.009 2.822 1.00 0.00 N ATOM 0 H HIS A 56 -4.400 3.117 2.346 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.659 1.072 4.331 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -5.099 1.028 1.774 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.366 0.888 1.551 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -6.386 -0.993 2.832 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -2.256 -1.633 2.352 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -5.954 -3.485 3.193 1.00 0.00 H new ATOM 948 N HIS A 57 -1.524 1.787 3.551 1.00 0.00 N ATOM 949 CA HIS A 57 -0.122 1.544 4.051 1.00 0.00 C ATOM 950 C HIS A 57 -0.046 1.927 5.533 1.00 0.00 C ATOM 951 O HIS A 57 0.408 1.151 6.354 1.00 0.00 O ATOM 952 CB HIS A 57 0.813 2.445 3.225 1.00 0.00 C ATOM 953 CG HIS A 57 1.224 1.735 1.965 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.308 2.148 1.206 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.706 0.642 1.316 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.407 1.316 0.154 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.454 0.378 0.174 1.00 0.00 N ATOM 0 H HIS A 57 -1.609 2.472 2.800 1.00 0.00 H new ATOM 0 HA HIS A 57 0.164 0.497 3.947 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.308 3.379 2.979 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.695 2.704 3.811 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -0.152 0.073 1.643 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.163 1.396 -0.613 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.307 -0.371 -0.503 1.00 0.00 H new ATOM 965 N GLN A 58 -0.507 3.111 5.889 1.00 0.00 N ATOM 966 CA GLN A 58 -0.474 3.513 7.339 1.00 0.00 C ATOM 967 C GLN A 58 -1.326 2.529 8.158 1.00 0.00 C ATOM 968 O GLN A 58 -0.959 2.157 9.258 1.00 0.00 O ATOM 969 CB GLN A 58 -1.064 4.930 7.424 1.00 0.00 C ATOM 970 CG GLN A 58 -0.696 5.558 8.770 1.00 0.00 C ATOM 971 CD GLN A 58 -1.179 7.014 8.804 1.00 0.00 C ATOM 972 OE1 GLN A 58 -2.323 7.274 9.121 1.00 0.00 O ATOM 973 NE2 GLN A 58 -0.355 7.984 8.491 1.00 0.00 N ATOM 0 H GLN A 58 -0.898 3.804 5.251 1.00 0.00 H new ATOM 0 HA GLN A 58 0.541 3.497 7.736 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.682 5.544 6.608 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -2.148 4.891 7.313 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.152 4.993 9.584 1.00 0.00 H new ATOM 0 HG3 GLN A 58 0.383 5.518 8.919 1.00 0.00 H new ATOM 0 HE21 GLN A 58 0.606 7.771 8.224 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -0.675 8.952 8.514 1.00 0.00 H new ATOM 982 N ARG A 59 -2.456 2.089 7.628 1.00 0.00 N ATOM 983 CA ARG A 59 -3.305 1.112 8.396 1.00 0.00 C ATOM 984 C ARG A 59 -2.512 -0.183 8.621 1.00 0.00 C ATOM 985 O ARG A 59 -2.448 -0.685 9.728 1.00 0.00 O ATOM 986 CB ARG A 59 -4.554 0.829 7.544 1.00 0.00 C ATOM 987 CG ARG A 59 -5.665 1.811 7.924 1.00 0.00 C ATOM 988 CD ARG A 59 -6.465 2.192 6.668 1.00 0.00 C ATOM 989 NE ARG A 59 -7.811 2.672 7.150 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.881 2.612 6.369 1.00 0.00 C ATOM 991 NH1 ARG A 59 -8.809 2.172 5.132 1.00 0.00 N ATOM 992 NH2 ARG A 59 -10.038 3.017 6.827 1.00 0.00 N ATOM 0 H ARG A 59 -2.819 2.360 6.714 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.590 1.513 9.369 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.315 0.926 6.485 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -4.890 -0.196 7.702 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -6.325 1.361 8.666 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.236 2.704 8.379 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -5.954 2.972 6.104 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -6.574 1.336 6.002 1.00 0.00 H new ATOM 0 HE ARG A 59 -7.900 3.049 8.093 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -7.914 1.866 4.751 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -9.648 2.137 4.554 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -10.112 3.376 7.779 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -10.865 2.974 6.232 1.00 0.00 H new ATOM 1006 N SER A 60 -1.890 -0.724 7.587 1.00 0.00 N ATOM 1007 CA SER A 60 -1.090 -1.981 7.785 1.00 0.00 C ATOM 1008 C SER A 60 0.101 -1.680 8.700 1.00 0.00 C ATOM 1009 O SER A 60 0.438 -2.475 9.551 1.00 0.00 O ATOM 1010 CB SER A 60 -0.602 -2.431 6.399 1.00 0.00 C ATOM 1011 OG SER A 60 0.327 -1.481 5.898 1.00 0.00 O ATOM 0 H SER A 60 -1.903 -0.356 6.636 1.00 0.00 H new ATOM 0 HA SER A 60 -1.687 -2.766 8.248 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.135 -3.413 6.466 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.447 -2.526 5.716 1.00 0.00 H new ATOM 0 HG SER A 60 0.013 -0.576 6.105 1.00 0.00 H new ATOM 1017 N ARG A 61 0.733 -0.530 8.552 1.00 0.00 N ATOM 1018 CA ARG A 61 1.891 -0.204 9.457 1.00 0.00 C ATOM 1019 C ARG A 61 1.378 -0.056 10.898 1.00 0.00 C ATOM 1020 O ARG A 61 2.016 -0.503 11.830 1.00 0.00 O ATOM 1021 CB ARG A 61 2.486 1.125 8.962 1.00 0.00 C ATOM 1022 CG ARG A 61 3.891 1.302 9.540 1.00 0.00 C ATOM 1023 CD ARG A 61 4.581 2.483 8.854 1.00 0.00 C ATOM 1024 NE ARG A 61 5.737 2.824 9.739 1.00 0.00 N ATOM 1025 CZ ARG A 61 6.829 2.074 9.763 1.00 0.00 C ATOM 1026 NH1 ARG A 61 6.941 1.002 9.014 1.00 0.00 N ATOM 1027 NH2 ARG A 61 7.821 2.405 10.549 1.00 0.00 N ATOM 0 H ARG A 61 0.503 0.182 7.859 1.00 0.00 H new ATOM 0 HA ARG A 61 2.647 -0.989 9.442 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.526 1.135 7.873 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.849 1.956 9.265 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.834 1.475 10.615 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.473 0.392 9.394 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.917 2.216 7.852 1.00 0.00 H new ATOM 0 HD3 ARG A 61 3.902 3.329 8.748 1.00 0.00 H new ATOM 0 HE ARG A 61 5.684 3.650 10.336 1.00 0.00 H new ATOM 0 HH11 ARG A 61 6.177 0.730 8.395 1.00 0.00 H new ATOM 0 HH12 ARG A 61 7.792 0.441 9.050 1.00 0.00 H new ATOM 0 HH21 ARG A 61 7.750 3.235 11.137 1.00 0.00 H new ATOM 0 HH22 ARG A 61 8.665 1.833 10.573 1.00 0.00 H new ATOM 1041 N TYR A 62 0.224 0.556 11.092 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.314 0.705 12.492 1.00 0.00 C ATOM 1043 C TYR A 62 -0.573 -0.688 13.089 1.00 0.00 C ATOM 1044 O TYR A 62 -0.127 -0.989 14.184 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.632 1.497 12.371 1.00 0.00 C ATOM 1046 CG TYR A 62 -2.285 1.635 13.728 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -3.034 0.574 14.250 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -2.143 2.819 14.461 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.641 0.696 15.504 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.750 2.941 15.716 1.00 0.00 C ATOM 1051 CZ TYR A 62 -3.499 1.879 16.239 1.00 0.00 C ATOM 1052 OH TYR A 62 -4.099 2.000 17.476 1.00 0.00 O ATOM 0 H TYR A 62 -0.359 0.952 10.355 1.00 0.00 H new ATOM 0 HA TYR A 62 0.388 1.223 13.145 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.435 2.484 11.952 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.308 0.989 11.684 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -3.143 -0.339 13.684 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.565 3.638 14.058 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -4.220 -0.123 15.906 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.641 3.855 16.282 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.900 2.883 17.851 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.277 -1.547 12.378 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.540 -2.924 12.929 1.00 0.00 C ATOM 1064 C ILE A 63 -0.237 -3.741 12.896 1.00 0.00 C ATOM 1065 O ILE A 63 0.057 -4.479 13.818 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.615 -3.566 12.033 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.906 -2.745 12.120 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.895 -4.994 12.504 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.933 -3.294 11.126 1.00 0.00 C ATOM 0 H ILE A 63 -1.674 -1.360 11.457 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.885 -2.888 13.962 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.259 -3.587 11.003 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -4.307 -2.786 13.133 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.698 -1.698 11.902 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.656 -5.444 11.867 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.979 -5.582 12.446 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.249 -4.974 13.535 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.850 -2.709 11.190 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.531 -3.230 10.115 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.150 -4.335 11.365 1.00 0.00 H new ATOM 1081 N TYR A 64 0.552 -3.608 11.850 1.00 0.00 N ATOM 1082 CA TYR A 64 1.841 -4.378 11.794 1.00 0.00 C ATOM 1083 C TYR A 64 2.766 -3.886 12.912 1.00 0.00 C ATOM 1084 O TYR A 64 3.407 -4.670 13.579 1.00 0.00 O ATOM 1085 CB TYR A 64 2.477 -4.085 10.423 1.00 0.00 C ATOM 1086 CG TYR A 64 3.686 -4.966 10.222 1.00 0.00 C ATOM 1087 CD1 TYR A 64 4.861 -4.731 10.945 1.00 0.00 C ATOM 1088 CD2 TYR A 64 3.628 -6.024 9.311 1.00 0.00 C ATOM 1089 CE1 TYR A 64 5.977 -5.555 10.754 1.00 0.00 C ATOM 1090 CE2 TYR A 64 4.739 -6.848 9.120 1.00 0.00 C ATOM 1091 CZ TYR A 64 5.916 -6.616 9.842 1.00 0.00 C ATOM 1092 OH TYR A 64 7.014 -7.430 9.654 1.00 0.00 O ATOM 0 H TYR A 64 0.363 -3.010 11.046 1.00 0.00 H new ATOM 0 HA TYR A 64 1.675 -5.448 11.923 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.751 -4.262 9.630 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.766 -3.036 10.363 1.00 0.00 H new ATOM 0 HD1 TYR A 64 4.907 -3.914 11.650 1.00 0.00 H new ATOM 0 HD2 TYR A 64 2.721 -6.205 8.753 1.00 0.00 H new ATOM 0 HE1 TYR A 64 6.885 -5.372 11.310 1.00 0.00 H new ATOM 0 HE2 TYR A 64 4.690 -7.665 8.415 1.00 0.00 H new ATOM 0 HH TYR A 64 7.534 -7.475 10.484 1.00 0.00 H new ATOM 1102 N THR A 65 2.842 -2.588 13.126 1.00 0.00 N ATOM 1103 CA THR A 65 3.747 -2.074 14.209 1.00 0.00 C ATOM 1104 C THR A 65 3.304 -2.613 15.577 1.00 0.00 C ATOM 1105 O THR A 65 4.133 -2.974 16.391 1.00 0.00 O ATOM 1106 CB THR A 65 3.655 -0.535 14.180 1.00 0.00 C ATOM 1107 OG1 THR A 65 4.080 -0.065 12.909 1.00 0.00 O ATOM 1108 CG2 THR A 65 4.555 0.068 15.266 1.00 0.00 C ATOM 0 H THR A 65 2.327 -1.876 12.608 1.00 0.00 H new ATOM 0 HA THR A 65 4.773 -2.403 14.046 1.00 0.00 H new ATOM 0 HB THR A 65 2.623 -0.236 14.364 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.419 -0.314 12.230 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.482 1.155 15.236 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.235 -0.291 16.244 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.588 -0.231 15.090 1.00 0.00 H new ATOM 1116 N LEU A 66 2.017 -2.658 15.857 1.00 0.00 N ATOM 1117 CA LEU A 66 1.583 -3.162 17.207 1.00 0.00 C ATOM 1118 C LEU A 66 1.510 -4.707 17.264 1.00 0.00 C ATOM 1119 O LEU A 66 1.748 -5.287 18.307 1.00 0.00 O ATOM 1120 CB LEU A 66 0.215 -2.511 17.515 1.00 0.00 C ATOM 1121 CG LEU A 66 -0.894 -3.095 16.627 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.475 -4.351 17.288 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -2.004 -2.051 16.451 1.00 0.00 C ATOM 0 H LEU A 66 1.266 -2.376 15.228 1.00 0.00 H new ATOM 0 HA LEU A 66 2.319 -2.885 17.962 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -0.036 -2.667 18.564 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.279 -1.434 17.359 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.480 -3.358 15.654 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.262 -4.764 16.656 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.686 -5.092 17.417 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.890 -4.091 18.262 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.793 -2.462 15.821 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.416 -1.790 17.426 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.592 -1.158 15.981 1.00 0.00 H new ATOM 1135 N TYR A 67 1.177 -5.380 16.178 1.00 0.00 N ATOM 1136 CA TYR A 67 1.095 -6.889 16.241 1.00 0.00 C ATOM 1137 C TYR A 67 2.467 -7.546 15.988 1.00 0.00 C ATOM 1138 O TYR A 67 2.743 -8.605 16.522 1.00 0.00 O ATOM 1139 CB TYR A 67 0.080 -7.327 15.166 1.00 0.00 C ATOM 1140 CG TYR A 67 -0.066 -8.840 15.185 1.00 0.00 C ATOM 1141 CD1 TYR A 67 0.864 -9.636 14.503 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -1.116 -9.446 15.892 1.00 0.00 C ATOM 1143 CE1 TYR A 67 0.743 -11.031 14.524 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -1.235 -10.844 15.915 1.00 0.00 C ATOM 1145 CZ TYR A 67 -0.305 -11.634 15.230 1.00 0.00 C ATOM 1146 OH TYR A 67 -0.421 -13.010 15.252 1.00 0.00 O ATOM 0 H TYR A 67 0.963 -4.965 15.271 1.00 0.00 H new ATOM 0 HA TYR A 67 0.780 -7.206 17.235 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.886 -6.857 15.351 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.413 -6.996 14.182 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.675 -9.173 13.961 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.834 -8.835 16.419 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.459 -11.642 13.995 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -2.043 -11.309 16.460 1.00 0.00 H new ATOM 0 HH TYR A 67 -1.039 -13.275 15.965 1.00 0.00 H new ATOM 1156 N TYR A 68 3.322 -6.957 15.172 1.00 0.00 N ATOM 1157 CA TYR A 68 4.651 -7.610 14.905 1.00 0.00 C ATOM 1158 C TYR A 68 5.786 -7.018 15.773 1.00 0.00 C ATOM 1159 O TYR A 68 6.809 -7.655 15.944 1.00 0.00 O ATOM 1160 CB TYR A 68 4.934 -7.403 13.407 1.00 0.00 C ATOM 1161 CG TYR A 68 4.286 -8.518 12.615 1.00 0.00 C ATOM 1162 CD1 TYR A 68 4.643 -9.847 12.874 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.330 -8.229 11.623 1.00 0.00 C ATOM 1164 CE1 TYR A 68 4.049 -10.887 12.147 1.00 0.00 C ATOM 1165 CE2 TYR A 68 2.740 -9.272 10.900 1.00 0.00 C ATOM 1166 CZ TYR A 68 3.099 -10.599 11.161 1.00 0.00 C ATOM 1167 OH TYR A 68 2.515 -11.626 10.447 1.00 0.00 O ATOM 0 H TYR A 68 3.161 -6.073 14.690 1.00 0.00 H new ATOM 0 HA TYR A 68 4.613 -8.668 15.166 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.546 -6.438 13.082 1.00 0.00 H new ATOM 0 HB3 TYR A 68 6.009 -7.391 13.227 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.377 -10.070 13.635 1.00 0.00 H new ATOM 0 HD2 TYR A 68 3.053 -7.205 11.420 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.325 -11.912 12.348 1.00 0.00 H new ATOM 0 HE2 TYR A 68 2.006 -9.052 10.139 1.00 0.00 H new ATOM 0 HH TYR A 68 1.877 -11.255 9.802 1.00 0.00 H new ATOM 1177 N LYS A 69 5.635 -5.828 16.330 1.00 0.00 N ATOM 1178 CA LYS A 69 6.739 -5.264 17.180 1.00 0.00 C ATOM 1179 C LYS A 69 6.246 -5.019 18.615 1.00 0.00 C ATOM 1180 O LYS A 69 6.797 -5.553 19.560 1.00 0.00 O ATOM 1181 CB LYS A 69 7.140 -3.929 16.542 1.00 0.00 C ATOM 1182 CG LYS A 69 7.510 -4.115 15.070 1.00 0.00 C ATOM 1183 CD LYS A 69 7.299 -2.788 14.342 1.00 0.00 C ATOM 1184 CE LYS A 69 6.897 -3.057 12.890 1.00 0.00 C ATOM 1185 NZ LYS A 69 8.148 -2.864 12.103 1.00 0.00 N ATOM 0 H LYS A 69 4.810 -5.236 16.233 1.00 0.00 H new ATOM 0 HA LYS A 69 7.579 -5.957 17.231 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.317 -3.219 16.627 1.00 0.00 H new ATOM 0 HB3 LYS A 69 7.985 -3.503 17.082 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.548 -4.436 14.979 1.00 0.00 H new ATOM 0 HG3 LYS A 69 6.895 -4.895 14.621 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.525 -2.206 14.842 1.00 0.00 H new ATOM 0 HD3 LYS A 69 8.213 -2.195 14.373 1.00 0.00 H new ATOM 0 HE2 LYS A 69 6.506 -4.067 12.769 1.00 0.00 H new ATOM 0 HE3 LYS A 69 6.115 -2.372 12.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 7.953 -3.031 11.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 8.493 -1.891 12.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 8.872 -3.535 12.432 1.00 0.00 H new ATOM 1199 N ARG A 70 5.220 -4.208 18.793 1.00 0.00 N ATOM 1200 CA ARG A 70 4.716 -3.934 20.188 1.00 0.00 C ATOM 1201 C ARG A 70 4.142 -5.211 20.824 1.00 0.00 C ATOM 1202 O ARG A 70 4.202 -5.380 22.027 1.00 0.00 O ATOM 1203 CB ARG A 70 3.616 -2.870 20.062 1.00 0.00 C ATOM 1204 CG ARG A 70 3.492 -2.102 21.379 1.00 0.00 C ATOM 1205 CD ARG A 70 2.830 -0.746 21.121 1.00 0.00 C ATOM 1206 NE ARG A 70 3.030 0.028 22.384 1.00 0.00 N ATOM 1207 CZ ARG A 70 2.315 -0.230 23.468 1.00 0.00 C ATOM 1208 NH1 ARG A 70 1.403 -1.175 23.479 1.00 0.00 N ATOM 1209 NH2 ARG A 70 2.517 0.469 24.556 1.00 0.00 N ATOM 0 H ARG A 70 4.716 -3.730 18.046 1.00 0.00 H new ATOM 0 HA ARG A 70 5.530 -3.590 20.827 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.852 -2.183 19.249 1.00 0.00 H new ATOM 0 HB3 ARG A 70 2.666 -3.343 19.814 1.00 0.00 H new ATOM 0 HG2 ARG A 70 2.902 -2.677 22.093 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.477 -1.959 21.823 1.00 0.00 H new ATOM 0 HD2 ARG A 70 3.287 -0.239 20.271 1.00 0.00 H new ATOM 0 HD3 ARG A 70 1.771 -0.861 20.892 1.00 0.00 H new ATOM 0 HE ARG A 70 3.731 0.769 22.411 1.00 0.00 H new ATOM 0 HH11 ARG A 70 1.233 -1.729 22.640 1.00 0.00 H new ATOM 0 HH12 ARG A 70 0.865 -1.355 24.327 1.00 0.00 H new ATOM 0 HH21 ARG A 70 3.221 1.207 24.565 1.00 0.00 H new ATOM 0 HH22 ARG A 70 1.970 0.276 25.395 1.00 0.00 H new ATOM 1223 N LYS A 71 3.575 -6.112 20.039 1.00 0.00 N ATOM 1224 CA LYS A 71 2.992 -7.366 20.619 1.00 0.00 C ATOM 1225 C LYS A 71 1.925 -7.015 21.665 1.00 0.00 C ATOM 1226 O LYS A 71 1.848 -7.632 22.711 1.00 0.00 O ATOM 1227 CB LYS A 71 4.162 -8.121 21.263 1.00 0.00 C ATOM 1228 CG LYS A 71 3.955 -9.627 21.091 1.00 0.00 C ATOM 1229 CD LYS A 71 4.511 -10.067 19.735 1.00 0.00 C ATOM 1230 CE LYS A 71 4.485 -11.595 19.644 1.00 0.00 C ATOM 1231 NZ LYS A 71 5.673 -11.952 18.820 1.00 0.00 N ATOM 0 H LYS A 71 3.494 -6.028 19.026 1.00 0.00 H new ATOM 0 HA LYS A 71 2.506 -7.976 19.858 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.102 -7.818 20.802 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.231 -7.871 22.322 1.00 0.00 H new ATOM 0 HG2 LYS A 71 4.456 -10.168 21.894 1.00 0.00 H new ATOM 0 HG3 LYS A 71 2.894 -9.869 21.157 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.918 -9.634 18.929 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.531 -9.702 19.612 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.539 -12.050 20.633 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.563 -11.947 19.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 5.723 -12.985 18.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 5.590 -11.510 17.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 6.536 -11.610 19.289 1.00 0.00 H new ATOM 1245 N ALA A 72 1.089 -6.037 21.383 1.00 0.00 N ATOM 1246 CA ALA A 72 0.017 -5.661 22.354 1.00 0.00 C ATOM 1247 C ALA A 72 -1.361 -6.048 21.786 1.00 0.00 C ATOM 1248 O ALA A 72 -2.339 -5.358 22.003 1.00 0.00 O ATOM 1249 CB ALA A 72 0.126 -4.142 22.513 1.00 0.00 C ATOM 0 H ALA A 72 1.107 -5.488 20.524 1.00 0.00 H new ATOM 0 HA ALA A 72 0.128 -6.172 23.310 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.633 -3.794 23.214 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.115 -3.886 22.893 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -0.027 -3.663 21.546 1.00 0.00 H new ATOM 1255 N ILE A 73 -1.446 -7.146 21.060 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.760 -7.570 20.482 1.00 0.00 C ATOM 1257 C ILE A 73 -2.768 -9.095 20.265 1.00 0.00 C ATOM 1258 O ILE A 73 -1.722 -9.719 20.247 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.868 -6.819 19.145 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -4.179 -7.195 18.445 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.686 -7.182 18.238 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -4.357 -6.342 17.187 1.00 0.00 C ATOM 0 H ILE A 73 -0.661 -7.762 20.846 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.601 -7.341 21.137 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.852 -5.747 19.342 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -4.171 -8.252 18.181 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -5.020 -7.042 19.121 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.773 -6.644 17.294 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.753 -6.905 18.728 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.691 -8.255 18.046 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.290 -6.613 16.693 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -4.385 -5.288 17.463 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.523 -6.517 16.508 1.00 0.00 H new ATOM 1274 N SER A 74 -3.923 -9.700 20.100 1.00 0.00 N ATOM 1275 CA SER A 74 -3.959 -11.179 19.887 1.00 0.00 C ATOM 1276 C SER A 74 -4.344 -11.499 18.435 1.00 0.00 C ATOM 1277 O SER A 74 -5.098 -10.771 17.819 1.00 0.00 O ATOM 1278 CB SER A 74 -5.023 -11.705 20.852 1.00 0.00 C ATOM 1279 OG SER A 74 -4.690 -13.031 21.241 1.00 0.00 O ATOM 0 H SER A 74 -4.832 -9.237 20.104 1.00 0.00 H new ATOM 0 HA SER A 74 -2.988 -11.640 20.068 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.085 -11.061 21.729 1.00 0.00 H new ATOM 0 HB3 SER A 74 -6.003 -11.689 20.375 1.00 0.00 H new ATOM 0 HG SER A 74 -5.369 -13.370 21.861 1.00 0.00 H new ATOM 1285 N LYS A 75 -3.827 -12.583 17.878 1.00 0.00 N ATOM 1286 CA LYS A 75 -4.166 -12.954 16.448 1.00 0.00 C ATOM 1287 C LYS A 75 -5.680 -12.839 16.175 1.00 0.00 C ATOM 1288 O LYS A 75 -6.078 -12.517 15.074 1.00 0.00 O ATOM 1289 CB LYS A 75 -3.717 -14.411 16.260 1.00 0.00 C ATOM 1290 CG LYS A 75 -3.491 -14.687 14.771 1.00 0.00 C ATOM 1291 CD LYS A 75 -3.600 -16.191 14.508 1.00 0.00 C ATOM 1292 CE LYS A 75 -2.221 -16.837 14.666 1.00 0.00 C ATOM 1293 NZ LYS A 75 -2.153 -17.863 13.588 1.00 0.00 N ATOM 0 H LYS A 75 -3.188 -13.225 18.348 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.665 -12.277 15.755 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.799 -14.595 16.818 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.472 -15.090 16.656 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.227 -14.148 14.175 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.509 -14.324 14.468 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -4.307 -16.643 15.204 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -3.984 -16.369 13.503 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -1.425 -16.100 14.561 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -2.107 -17.290 15.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -1.235 -18.351 13.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -2.919 -18.555 13.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -2.257 -17.401 12.662 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.528 -13.088 17.159 1.00 0.00 N ATOM 1308 CA ASP A 76 -8.008 -12.967 16.902 1.00 0.00 C ATOM 1309 C ASP A 76 -8.339 -11.516 16.526 1.00 0.00 C ATOM 1310 O ASP A 76 -8.962 -11.267 15.510 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.725 -13.357 18.206 1.00 0.00 C ATOM 1312 CG ASP A 76 -8.813 -14.882 18.302 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -7.886 -15.538 17.856 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -9.807 -15.366 18.819 1.00 0.00 O ATOM 0 H ASP A 76 -6.266 -13.363 18.106 1.00 0.00 H new ATOM 0 HA ASP A 76 -8.326 -13.614 16.084 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.184 -12.958 19.064 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.724 -12.922 18.229 1.00 0.00 H new ATOM 1319 N LEU A 77 -7.907 -10.551 17.317 1.00 0.00 N ATOM 1320 CA LEU A 77 -8.193 -9.118 16.954 1.00 0.00 C ATOM 1321 C LEU A 77 -7.428 -8.779 15.667 1.00 0.00 C ATOM 1322 O LEU A 77 -7.962 -8.152 14.772 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.702 -8.241 18.120 1.00 0.00 C ATOM 1324 CG LEU A 77 -7.957 -6.763 17.797 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -9.463 -6.487 17.805 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -7.266 -5.875 18.841 1.00 0.00 C ATOM 0 H LEU A 77 -7.380 -10.690 18.179 1.00 0.00 H new ATOM 0 HA LEU A 77 -9.256 -8.948 16.785 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -8.220 -8.517 19.039 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.638 -8.408 18.291 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.553 -6.538 16.810 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.642 -5.437 17.575 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.951 -7.110 17.056 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.870 -6.717 18.790 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.451 -4.827 18.606 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.663 -6.101 19.831 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -6.193 -6.066 18.828 1.00 0.00 H new ATOM 1338 N TYR A 78 -6.181 -9.203 15.560 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.400 -8.908 14.308 1.00 0.00 C ATOM 1340 C TYR A 78 -6.101 -9.565 13.104 1.00 0.00 C ATOM 1341 O TYR A 78 -6.193 -8.975 12.042 1.00 0.00 O ATOM 1342 CB TYR A 78 -3.988 -9.495 14.517 1.00 0.00 C ATOM 1343 CG TYR A 78 -3.142 -9.298 13.275 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -3.143 -8.068 12.606 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.350 -10.350 12.796 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.358 -7.888 11.463 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.562 -10.170 11.653 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.566 -8.940 10.986 1.00 0.00 C ATOM 1349 OH TYR A 78 -0.790 -8.763 9.858 1.00 0.00 O ATOM 0 H TYR A 78 -5.679 -9.732 16.274 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.337 -7.838 14.110 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.510 -9.013 15.370 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -4.060 -10.557 14.750 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.752 -7.256 12.974 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.347 -11.300 13.309 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.362 -6.938 10.948 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.951 -10.981 11.286 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.302 -9.590 9.664 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.621 -10.770 13.262 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.337 -11.425 12.112 1.00 0.00 C ATOM 1361 C ASP A 79 -8.673 -10.702 11.887 1.00 0.00 C ATOM 1362 O ASP A 79 -9.050 -10.425 10.765 1.00 0.00 O ATOM 1363 CB ASP A 79 -7.579 -12.889 12.510 1.00 0.00 C ATOM 1364 CG ASP A 79 -8.017 -13.688 11.280 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -7.171 -13.970 10.449 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -9.193 -14.003 11.192 1.00 0.00 O ATOM 0 H ASP A 79 -6.581 -11.317 14.122 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.757 -11.376 11.190 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.669 -13.318 12.930 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -8.344 -12.945 13.284 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.384 -10.373 12.951 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.693 -9.639 12.784 1.00 0.00 C ATOM 1373 C TRP A 80 -10.462 -8.337 11.992 1.00 0.00 C ATOM 1374 O TRP A 80 -11.286 -7.949 11.186 1.00 0.00 O ATOM 1375 CB TRP A 80 -11.198 -9.322 14.205 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.519 -8.623 14.142 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.712 -9.228 13.939 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -12.803 -7.202 14.289 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.708 -8.268 13.951 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.198 -7.004 14.163 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -11.992 -6.075 14.516 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -14.767 -5.733 14.260 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.562 -4.796 14.613 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -13.946 -4.626 14.485 1.00 0.00 C ATOM 0 H TRP A 80 -9.120 -10.577 13.915 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.422 -10.236 12.235 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -11.294 -10.244 14.779 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.472 -8.697 14.725 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -13.862 -10.287 13.792 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.699 -8.470 13.819 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -10.923 -6.195 14.616 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.835 -5.607 14.162 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -11.930 -3.938 14.787 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.378 -3.639 14.560 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.340 -7.670 12.200 1.00 0.00 N ATOM 1396 CA LEU A 81 -9.077 -6.407 11.425 1.00 0.00 C ATOM 1397 C LEU A 81 -8.835 -6.768 9.952 1.00 0.00 C ATOM 1398 O LEU A 81 -9.442 -6.202 9.062 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.812 -5.766 12.023 1.00 0.00 C ATOM 1400 CG LEU A 81 -8.049 -5.410 13.493 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -6.705 -5.304 14.212 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -8.775 -4.067 13.578 1.00 0.00 C ATOM 0 H LEU A 81 -8.610 -7.940 12.859 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.920 -5.718 11.483 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.971 -6.454 11.938 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.548 -4.870 11.461 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.655 -6.185 13.963 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -6.871 -5.051 15.259 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.182 -6.258 14.148 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -6.101 -4.527 13.742 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -8.945 -3.811 14.624 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -8.166 -3.294 13.110 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.732 -4.137 13.061 1.00 0.00 H new ATOM 1414 N ILE A 82 -7.961 -7.722 9.685 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.699 -8.122 8.252 1.00 0.00 C ATOM 1416 C ILE A 82 -9.022 -8.546 7.572 1.00 0.00 C ATOM 1417 O ILE A 82 -9.198 -8.339 6.385 1.00 0.00 O ATOM 1418 CB ILE A 82 -6.702 -9.308 8.294 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.341 -8.841 8.846 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -6.500 -9.888 6.887 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -4.755 -7.726 7.968 1.00 0.00 C ATOM 0 H ILE A 82 -7.425 -8.234 10.385 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.286 -7.293 7.678 1.00 0.00 H new ATOM 0 HB ILE A 82 -7.116 -10.077 8.946 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.461 -8.481 9.868 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -4.650 -9.683 8.884 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.797 -10.720 6.934 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.455 -10.241 6.499 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.104 -9.115 6.228 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.794 -7.410 8.374 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.615 -8.098 6.953 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -5.439 -6.878 7.953 1.00 0.00 H new ATOM 1433 N LYS A 83 -9.952 -9.137 8.303 1.00 0.00 N ATOM 1434 CA LYS A 83 -11.248 -9.562 7.663 1.00 0.00 C ATOM 1435 C LYS A 83 -12.316 -8.444 7.707 1.00 0.00 C ATOM 1436 O LYS A 83 -13.309 -8.529 7.008 1.00 0.00 O ATOM 1437 CB LYS A 83 -11.733 -10.784 8.457 1.00 0.00 C ATOM 1438 CG LYS A 83 -10.718 -11.920 8.316 1.00 0.00 C ATOM 1439 CD LYS A 83 -11.367 -13.240 8.734 1.00 0.00 C ATOM 1440 CE LYS A 83 -12.342 -13.697 7.646 1.00 0.00 C ATOM 1441 NZ LYS A 83 -11.537 -14.574 6.751 1.00 0.00 N ATOM 0 H LYS A 83 -9.870 -9.340 9.299 1.00 0.00 H new ATOM 0 HA LYS A 83 -11.089 -9.789 6.609 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -11.858 -10.522 9.508 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -12.708 -11.106 8.091 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -10.369 -11.984 7.285 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -9.844 -11.720 8.936 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -10.601 -13.999 8.893 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -11.894 -13.115 9.680 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -13.186 -14.238 8.074 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -12.752 -12.847 7.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -12.138 -14.927 5.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -10.745 -14.030 6.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -11.165 -15.378 7.296 1.00 0.00 H new ATOM 1455 N GLU A 84 -12.144 -7.406 8.509 1.00 0.00 N ATOM 1456 CA GLU A 84 -13.189 -6.322 8.552 1.00 0.00 C ATOM 1457 C GLU A 84 -12.726 -5.039 7.822 1.00 0.00 C ATOM 1458 O GLU A 84 -13.237 -3.967 8.083 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.396 -6.029 10.031 1.00 0.00 C ATOM 1460 CG GLU A 84 -13.909 -7.276 10.743 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.437 -7.307 10.686 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -15.972 -7.196 9.595 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -16.046 -7.444 11.735 1.00 0.00 O ATOM 0 H GLU A 84 -11.341 -7.266 9.123 1.00 0.00 H new ATOM 0 HA GLU A 84 -14.101 -6.644 8.050 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.458 -5.704 10.480 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -14.108 -5.212 10.152 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.499 -8.170 10.273 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -13.574 -7.279 11.780 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.774 -5.137 6.906 1.00 0.00 N ATOM 1471 CA LYS A 85 -11.268 -3.944 6.129 1.00 0.00 C ATOM 1472 C LYS A 85 -10.351 -3.055 6.978 1.00 0.00 C ATOM 1473 O LYS A 85 -10.712 -1.957 7.356 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.492 -3.157 5.630 1.00 0.00 C ATOM 1475 CG LYS A 85 -12.199 -2.579 4.244 1.00 0.00 C ATOM 1476 CD LYS A 85 -13.478 -2.583 3.405 1.00 0.00 C ATOM 1477 CE LYS A 85 -13.757 -4.003 2.908 1.00 0.00 C ATOM 1478 NZ LYS A 85 -14.913 -3.862 1.977 1.00 0.00 N ATOM 0 H LYS A 85 -11.318 -6.016 6.661 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.665 -4.285 5.288 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -13.364 -3.810 5.586 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.730 -2.354 6.327 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -11.816 -1.563 4.336 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -11.426 -3.167 3.750 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -14.317 -2.223 4.000 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -13.373 -1.904 2.559 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -12.889 -4.422 2.399 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -13.995 -4.672 3.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -15.165 -4.795 1.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -15.726 -3.467 2.491 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -14.655 -3.225 1.197 1.00 0.00 H new ATOM 1492 N TYR A 86 -9.154 -3.523 7.267 1.00 0.00 N ATOM 1493 CA TYR A 86 -8.194 -2.716 8.074 1.00 0.00 C ATOM 1494 C TYR A 86 -6.818 -2.754 7.397 1.00 0.00 C ATOM 1495 O TYR A 86 -6.305 -1.742 6.960 1.00 0.00 O ATOM 1496 CB TYR A 86 -8.136 -3.407 9.437 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.377 -3.079 10.225 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.612 -3.644 9.873 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -9.290 -2.204 11.314 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -11.757 -3.328 10.621 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.433 -1.892 12.056 1.00 0.00 C ATOM 1502 CZ TYR A 86 -11.665 -2.453 11.710 1.00 0.00 C ATOM 1503 OH TYR A 86 -12.793 -2.144 12.442 1.00 0.00 O ATOM 0 H TYR A 86 -8.806 -4.436 6.973 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.493 -1.672 8.168 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -8.052 -4.486 9.305 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -7.250 -3.082 9.983 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.681 -4.318 9.032 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.338 -1.769 11.581 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.710 -3.761 10.356 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.364 -1.217 12.897 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.980 -2.868 13.075 1.00 0.00 H new ATOM 1513 N ALA A 87 -6.226 -3.923 7.293 1.00 0.00 N ATOM 1514 CA ALA A 87 -4.895 -4.044 6.632 1.00 0.00 C ATOM 1515 C ALA A 87 -4.919 -5.235 5.662 1.00 0.00 C ATOM 1516 O ALA A 87 -5.791 -6.080 5.745 1.00 0.00 O ATOM 1517 CB ALA A 87 -3.904 -4.291 7.770 1.00 0.00 C ATOM 0 H ALA A 87 -6.614 -4.800 7.641 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.626 -3.158 6.056 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -2.898 -4.391 7.361 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -3.931 -3.452 8.465 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.175 -5.206 8.296 1.00 0.00 H new ATOM 1523 N ASP A 88 -3.981 -5.314 4.741 1.00 0.00 N ATOM 1524 CA ASP A 88 -3.981 -6.460 3.779 1.00 0.00 C ATOM 1525 C ASP A 88 -2.773 -7.374 4.032 1.00 0.00 C ATOM 1526 O ASP A 88 -1.643 -6.991 3.790 1.00 0.00 O ATOM 1527 CB ASP A 88 -3.890 -5.823 2.390 1.00 0.00 C ATOM 1528 CG ASP A 88 -4.066 -6.901 1.319 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -3.424 -7.931 1.431 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -4.841 -6.677 0.403 1.00 0.00 O ATOM 0 H ASP A 88 -3.225 -4.640 4.618 1.00 0.00 H new ATOM 0 HA ASP A 88 -4.872 -7.078 3.884 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -4.658 -5.057 2.279 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -2.926 -5.329 2.268 1.00 0.00 H new ATOM 1535 N LYS A 89 -2.998 -8.582 4.511 1.00 0.00 N ATOM 1536 CA LYS A 89 -1.838 -9.514 4.764 1.00 0.00 C ATOM 1537 C LYS A 89 -1.044 -9.736 3.464 1.00 0.00 C ATOM 1538 O LYS A 89 0.168 -9.835 3.488 1.00 0.00 O ATOM 1539 CB LYS A 89 -2.433 -10.845 5.251 1.00 0.00 C ATOM 1540 CG LYS A 89 -2.590 -10.810 6.773 1.00 0.00 C ATOM 1541 CD LYS A 89 -2.790 -12.232 7.299 1.00 0.00 C ATOM 1542 CE LYS A 89 -3.694 -12.199 8.533 1.00 0.00 C ATOM 1543 NZ LYS A 89 -3.671 -13.590 9.064 1.00 0.00 N ATOM 0 H LYS A 89 -3.919 -8.960 4.735 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.156 -9.096 5.505 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -3.400 -11.017 4.779 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -1.785 -11.672 4.961 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -1.707 -10.363 7.230 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -3.441 -10.187 7.047 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -3.236 -12.858 6.526 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -1.827 -12.676 7.552 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -3.326 -11.488 9.273 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -4.707 -11.893 8.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -4.269 -13.648 9.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -4.033 -14.244 8.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -2.695 -13.852 9.310 1.00 0.00 H new ATOM 1557 N LEU A 90 -1.713 -9.813 2.326 1.00 0.00 N ATOM 1558 CA LEU A 90 -0.967 -10.028 1.034 1.00 0.00 C ATOM 1559 C LEU A 90 0.062 -8.905 0.822 1.00 0.00 C ATOM 1560 O LEU A 90 1.155 -9.153 0.345 1.00 0.00 O ATOM 1561 CB LEU A 90 -2.011 -10.010 -0.094 1.00 0.00 C ATOM 1562 CG LEU A 90 -1.371 -10.504 -1.392 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -1.151 -12.015 -1.310 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -2.298 -10.189 -2.568 1.00 0.00 C ATOM 0 H LEU A 90 -2.726 -9.738 2.238 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.427 -10.975 1.050 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -2.858 -10.644 0.170 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.398 -9.000 -0.229 1.00 0.00 H new ATOM 0 HG LEU A 90 -0.413 -10.004 -1.538 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -0.695 -12.367 -2.235 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.492 -12.242 -0.472 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -2.109 -12.515 -1.165 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -1.843 -10.541 -3.494 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.255 -10.689 -2.421 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.457 -9.112 -2.628 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.260 -7.676 1.186 1.00 0.00 N ATOM 1577 CA LEU A 91 0.743 -6.570 1.005 1.00 0.00 C ATOM 1578 C LEU A 91 1.848 -6.739 2.053 1.00 0.00 C ATOM 1579 O LEU A 91 3.021 -6.707 1.730 1.00 0.00 O ATOM 1580 CB LEU A 91 -0.001 -5.238 1.204 1.00 0.00 C ATOM 1581 CG LEU A 91 0.978 -4.065 1.048 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.572 -4.061 -0.365 1.00 0.00 C ATOM 1583 CD2 LEU A 91 0.234 -2.749 1.287 1.00 0.00 C ATOM 0 H LEU A 91 -1.154 -7.398 1.591 1.00 0.00 H new ATOM 0 HA LEU A 91 1.198 -6.591 0.015 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.807 -5.149 0.476 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.460 -5.212 2.192 1.00 0.00 H new ATOM 0 HG LEU A 91 1.783 -4.173 1.775 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.265 -3.226 -0.466 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.104 -4.997 -0.539 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.770 -3.958 -1.096 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.926 -1.914 1.177 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.572 -2.650 0.560 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.183 -2.744 2.294 1.00 0.00 H new ATOM 1595 N ILE A 92 1.489 -6.953 3.307 1.00 0.00 N ATOM 1596 CA ILE A 92 2.551 -7.162 4.355 1.00 0.00 C ATOM 1597 C ILE A 92 3.381 -8.407 3.975 1.00 0.00 C ATOM 1598 O ILE A 92 4.583 -8.429 4.164 1.00 0.00 O ATOM 1599 CB ILE A 92 1.814 -7.355 5.706 1.00 0.00 C ATOM 1600 CG1 ILE A 92 1.200 -6.011 6.134 1.00 0.00 C ATOM 1601 CG2 ILE A 92 2.798 -7.826 6.784 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.436 -6.167 7.457 1.00 0.00 C ATOM 0 H ILE A 92 0.527 -6.991 3.643 1.00 0.00 H new ATOM 0 HA ILE A 92 3.236 -6.317 4.430 1.00 0.00 H new ATOM 0 HB ILE A 92 1.034 -8.106 5.586 1.00 0.00 H new ATOM 0 HG12 ILE A 92 1.986 -5.265 6.247 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.526 -5.649 5.358 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.268 -7.958 7.728 1.00 0.00 H new ATOM 0 HG22 ILE A 92 3.242 -8.774 6.482 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.584 -7.081 6.910 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.008 -5.207 7.745 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.363 -6.898 7.332 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.120 -6.507 8.234 1.00 0.00 H new ATOM 1614 N ALA A 93 2.758 -9.433 3.417 1.00 0.00 N ATOM 1615 CA ALA A 93 3.550 -10.645 3.008 1.00 0.00 C ATOM 1616 C ALA A 93 4.476 -10.275 1.838 1.00 0.00 C ATOM 1617 O ALA A 93 5.611 -10.709 1.786 1.00 0.00 O ATOM 1618 CB ALA A 93 2.538 -11.715 2.569 1.00 0.00 C ATOM 0 H ALA A 93 1.756 -9.481 3.232 1.00 0.00 H new ATOM 0 HA ALA A 93 4.166 -11.015 3.827 1.00 0.00 H new ATOM 0 HB1 ALA A 93 3.070 -12.615 2.263 1.00 0.00 H new ATOM 0 HB2 ALA A 93 1.874 -11.951 3.401 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.950 -11.338 1.732 1.00 0.00 H new ATOM 1624 N LYS A 94 4.011 -9.462 0.900 1.00 0.00 N ATOM 1625 CA LYS A 94 4.901 -9.068 -0.254 1.00 0.00 C ATOM 1626 C LYS A 94 6.169 -8.388 0.287 1.00 0.00 C ATOM 1627 O LYS A 94 7.263 -8.656 -0.173 1.00 0.00 O ATOM 1628 CB LYS A 94 4.112 -8.069 -1.121 1.00 0.00 C ATOM 1629 CG LYS A 94 3.183 -8.808 -2.090 1.00 0.00 C ATOM 1630 CD LYS A 94 4.002 -9.697 -3.029 1.00 0.00 C ATOM 1631 CE LYS A 94 3.292 -9.797 -4.383 1.00 0.00 C ATOM 1632 NZ LYS A 94 3.387 -11.234 -4.763 1.00 0.00 N ATOM 0 H LYS A 94 3.073 -9.063 0.885 1.00 0.00 H new ATOM 0 HA LYS A 94 5.193 -9.942 -0.837 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.527 -7.408 -0.482 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.804 -7.440 -1.681 1.00 0.00 H new ATOM 0 HG2 LYS A 94 2.471 -9.415 -1.531 1.00 0.00 H new ATOM 0 HG3 LYS A 94 2.604 -8.090 -2.670 1.00 0.00 H new ATOM 0 HD2 LYS A 94 5.002 -9.283 -3.160 1.00 0.00 H new ATOM 0 HD3 LYS A 94 4.123 -10.690 -2.595 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.253 -9.476 -4.308 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.770 -9.160 -5.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 2.782 -11.415 -5.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 4.373 -11.466 -4.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 3.072 -11.825 -3.967 1.00 0.00 H new ATOM 1646 N TRP A 95 6.033 -7.515 1.269 1.00 0.00 N ATOM 1647 CA TRP A 95 7.254 -6.836 1.833 1.00 0.00 C ATOM 1648 C TRP A 95 8.121 -7.859 2.583 1.00 0.00 C ATOM 1649 O TRP A 95 9.336 -7.819 2.505 1.00 0.00 O ATOM 1650 CB TRP A 95 6.754 -5.746 2.799 1.00 0.00 C ATOM 1651 CG TRP A 95 6.396 -4.504 2.036 1.00 0.00 C ATOM 1652 CD1 TRP A 95 7.092 -4.000 0.988 1.00 0.00 C ATOM 1653 CD2 TRP A 95 5.272 -3.600 2.247 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.468 -2.848 0.547 1.00 0.00 N ATOM 1655 CE2 TRP A 95 5.342 -2.560 1.289 1.00 0.00 C ATOM 1656 CE3 TRP A 95 4.209 -3.579 3.168 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.394 -1.538 1.245 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 3.250 -2.551 3.126 1.00 0.00 C ATOM 1659 CH2 TRP A 95 3.344 -1.534 2.165 1.00 0.00 C ATOM 0 H TRP A 95 5.146 -7.248 1.697 1.00 0.00 H new ATOM 0 HA TRP A 95 7.864 -6.400 1.042 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.885 -6.107 3.349 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.525 -5.520 3.535 1.00 0.00 H new ATOM 0 HD1 TRP A 95 7.989 -4.429 0.566 1.00 0.00 H new ATOM 0 HE1 TRP A 95 6.800 -2.280 -0.232 1.00 0.00 H new ATOM 0 HE3 TRP A 95 4.129 -4.357 3.912 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.472 -0.755 0.505 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 2.437 -2.545 3.837 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.604 -0.748 2.137 1.00 0.00 H new ATOM 1670 N ARG A 96 7.513 -8.783 3.297 1.00 0.00 N ATOM 1671 CA ARG A 96 8.328 -9.815 4.037 1.00 0.00 C ATOM 1672 C ARG A 96 8.956 -10.815 3.049 1.00 0.00 C ATOM 1673 O ARG A 96 10.033 -11.328 3.292 1.00 0.00 O ATOM 1674 CB ARG A 96 7.363 -10.540 4.989 1.00 0.00 C ATOM 1675 CG ARG A 96 7.153 -9.696 6.253 1.00 0.00 C ATOM 1676 CD ARG A 96 5.668 -9.701 6.644 1.00 0.00 C ATOM 1677 NE ARG A 96 5.632 -10.254 8.035 1.00 0.00 N ATOM 1678 CZ ARG A 96 5.762 -11.553 8.264 1.00 0.00 C ATOM 1679 NH1 ARG A 96 5.923 -12.410 7.282 1.00 0.00 N ATOM 1680 NH2 ARG A 96 5.729 -11.997 9.493 1.00 0.00 N ATOM 0 H ARG A 96 6.502 -8.870 3.401 1.00 0.00 H new ATOM 0 HA ARG A 96 9.144 -9.346 4.587 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.408 -10.713 4.492 1.00 0.00 H new ATOM 0 HB3 ARG A 96 7.765 -11.517 5.255 1.00 0.00 H new ATOM 0 HG2 ARG A 96 7.755 -10.094 7.070 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.489 -8.674 6.078 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.248 -8.696 6.609 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.082 -10.316 5.960 1.00 0.00 H new ATOM 0 HE ARG A 96 5.505 -9.618 8.822 1.00 0.00 H new ATOM 0 HH11 ARG A 96 5.950 -12.081 6.317 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.021 -13.405 7.484 1.00 0.00 H new ATOM 0 HH21 ARG A 96 5.604 -11.345 10.268 1.00 0.00 H new ATOM 0 HH22 ARG A 96 5.828 -12.995 9.677 1.00 0.00 H new ATOM 1694 N LYS A 97 8.300 -11.105 1.937 1.00 0.00 N ATOM 1695 CA LYS A 97 8.889 -12.084 0.946 1.00 0.00 C ATOM 1696 C LYS A 97 10.309 -11.652 0.541 1.00 0.00 C ATOM 1697 O LYS A 97 10.827 -10.670 1.040 1.00 0.00 O ATOM 1698 CB LYS A 97 7.980 -12.050 -0.293 1.00 0.00 C ATOM 1699 CG LYS A 97 6.868 -13.085 -0.161 1.00 0.00 C ATOM 1700 CD LYS A 97 7.471 -14.491 -0.125 1.00 0.00 C ATOM 1701 CE LYS A 97 6.436 -15.504 -0.622 1.00 0.00 C ATOM 1702 NZ LYS A 97 5.788 -16.028 0.612 1.00 0.00 N ATOM 0 H LYS A 97 7.396 -10.713 1.675 1.00 0.00 H new ATOM 0 HA LYS A 97 8.950 -13.082 1.381 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.549 -11.056 -0.409 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.567 -12.249 -1.189 1.00 0.00 H new ATOM 0 HG2 LYS A 97 6.294 -12.902 0.747 1.00 0.00 H new ATOM 0 HG3 LYS A 97 6.176 -12.997 -0.998 1.00 0.00 H new ATOM 0 HD2 LYS A 97 8.364 -14.531 -0.749 1.00 0.00 H new ATOM 0 HD3 LYS A 97 7.780 -14.740 0.890 1.00 0.00 H new ATOM 0 HE2 LYS A 97 5.707 -15.033 -1.281 1.00 0.00 H new ATOM 0 HE3 LYS A 97 6.909 -16.305 -1.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 5.065 -16.729 0.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 6.505 -16.477 1.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 5.341 -15.244 1.129 1.00 0.00 H new ATOM 1716 N THR A 98 10.937 -12.365 -0.373 1.00 0.00 N ATOM 1717 CA THR A 98 12.313 -11.973 -0.810 1.00 0.00 C ATOM 1718 C THR A 98 12.252 -11.319 -2.196 1.00 0.00 C ATOM 1719 O THR A 98 11.587 -11.810 -3.089 1.00 0.00 O ATOM 1720 CB THR A 98 13.125 -13.273 -0.860 1.00 0.00 C ATOM 1721 OG1 THR A 98 12.244 -14.378 -1.025 1.00 0.00 O ATOM 1722 CG2 THR A 98 13.911 -13.434 0.442 1.00 0.00 C ATOM 0 H THR A 98 10.556 -13.194 -0.829 1.00 0.00 H new ATOM 0 HA THR A 98 12.767 -11.252 -0.130 1.00 0.00 H new ATOM 0 HB THR A 98 13.819 -13.236 -1.700 1.00 0.00 H new ATOM 0 HG1 THR A 98 11.753 -14.282 -1.868 1.00 0.00 H new ATOM 0 HG21 THR A 98 14.488 -14.358 0.407 1.00 0.00 H new ATOM 0 HG22 THR A 98 14.587 -12.588 0.566 1.00 0.00 H new ATOM 0 HG23 THR A 98 13.218 -13.471 1.283 1.00 0.00 H new ATOM 1730 N GLY A 99 12.933 -10.208 -2.385 1.00 0.00 N ATOM 1731 CA GLY A 99 12.899 -9.523 -3.711 1.00 0.00 C ATOM 1732 C GLY A 99 11.856 -8.381 -3.722 1.00 0.00 C ATOM 1733 O GLY A 99 11.565 -7.836 -4.770 1.00 0.00 O ATOM 0 H GLY A 99 13.508 -9.752 -1.677 1.00 0.00 H new ATOM 0 HA2 GLY A 99 13.886 -9.121 -3.941 1.00 0.00 H new ATOM 0 HA3 GLY A 99 12.660 -10.246 -4.491 1.00 0.00 H new ATOM 1737 N TYR A 100 11.291 -8.003 -2.585 1.00 0.00 N ATOM 1738 CA TYR A 100 10.286 -6.896 -2.584 1.00 0.00 C ATOM 1739 C TYR A 100 10.836 -5.685 -1.810 1.00 0.00 C ATOM 1740 O TYR A 100 10.348 -5.348 -0.747 1.00 0.00 O ATOM 1741 CB TYR A 100 9.054 -7.468 -1.880 1.00 0.00 C ATOM 1742 CG TYR A 100 8.329 -8.402 -2.817 1.00 0.00 C ATOM 1743 CD1 TYR A 100 7.707 -7.898 -3.966 1.00 0.00 C ATOM 1744 CD2 TYR A 100 8.277 -9.770 -2.537 1.00 0.00 C ATOM 1745 CE1 TYR A 100 7.035 -8.766 -4.834 1.00 0.00 C ATOM 1746 CE2 TYR A 100 7.606 -10.638 -3.402 1.00 0.00 C ATOM 1747 CZ TYR A 100 6.984 -10.137 -4.552 1.00 0.00 C ATOM 1748 OH TYR A 100 6.322 -10.993 -5.408 1.00 0.00 O ATOM 0 H TYR A 100 11.486 -8.414 -1.672 1.00 0.00 H new ATOM 0 HA TYR A 100 10.051 -6.553 -3.592 1.00 0.00 H new ATOM 0 HB2 TYR A 100 9.352 -8.001 -0.977 1.00 0.00 H new ATOM 0 HB3 TYR A 100 8.391 -6.660 -1.569 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.746 -6.841 -4.182 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.756 -10.157 -1.650 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.556 -8.379 -5.721 1.00 0.00 H new ATOM 0 HE2 TYR A 100 7.567 -11.695 -3.184 1.00 0.00 H new ATOM 0 HH TYR A 100 6.383 -11.909 -5.066 1.00 0.00 H new ATOM 1758 N GLU A 101 11.844 -5.020 -2.339 1.00 0.00 N ATOM 1759 CA GLU A 101 12.407 -3.825 -1.621 1.00 0.00 C ATOM 1760 C GLU A 101 11.676 -2.550 -2.071 1.00 0.00 C ATOM 1761 O GLU A 101 11.406 -1.675 -1.271 1.00 0.00 O ATOM 1762 CB GLU A 101 13.893 -3.754 -2.002 1.00 0.00 C ATOM 1763 CG GLU A 101 14.680 -3.098 -0.867 1.00 0.00 C ATOM 1764 CD GLU A 101 16.148 -2.960 -1.278 1.00 0.00 C ATOM 1765 OE1 GLU A 101 16.401 -2.342 -2.298 1.00 0.00 O ATOM 1766 OE2 GLU A 101 16.993 -3.475 -0.565 1.00 0.00 O ATOM 0 H GLU A 101 12.295 -5.250 -3.225 1.00 0.00 H new ATOM 0 HA GLU A 101 12.282 -3.911 -0.542 1.00 0.00 H new ATOM 0 HB2 GLU A 101 14.278 -4.755 -2.194 1.00 0.00 H new ATOM 0 HB3 GLU A 101 14.017 -3.183 -2.922 1.00 0.00 H new ATOM 0 HG2 GLU A 101 14.261 -2.118 -0.639 1.00 0.00 H new ATOM 0 HG3 GLU A 101 14.600 -3.698 0.040 1.00 0.00 H new ATOM 1773 N LYS A 102 11.346 -2.437 -3.344 1.00 0.00 N ATOM 1774 CA LYS A 102 10.625 -1.219 -3.825 1.00 0.00 C ATOM 1775 C LYS A 102 9.197 -1.596 -4.252 1.00 0.00 C ATOM 1776 O LYS A 102 8.939 -1.841 -5.415 1.00 0.00 O ATOM 1777 CB LYS A 102 11.442 -0.719 -5.021 1.00 0.00 C ATOM 1778 CG LYS A 102 12.814 -0.225 -4.538 1.00 0.00 C ATOM 1779 CD LYS A 102 12.858 1.310 -4.567 1.00 0.00 C ATOM 1780 CE LYS A 102 13.625 1.782 -5.807 1.00 0.00 C ATOM 1781 NZ LYS A 102 14.470 2.911 -5.329 1.00 0.00 N ATOM 0 H LYS A 102 11.546 -3.134 -4.061 1.00 0.00 H new ATOM 0 HA LYS A 102 10.534 -0.452 -3.055 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.568 -1.521 -5.748 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.911 0.088 -5.525 1.00 0.00 H new ATOM 0 HG2 LYS A 102 13.004 -0.584 -3.526 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.601 -0.632 -5.173 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.845 1.712 -4.579 1.00 0.00 H new ATOM 0 HD3 LYS A 102 13.340 1.687 -3.665 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.235 0.980 -6.223 1.00 0.00 H new ATOM 0 HE3 LYS A 102 12.943 2.105 -6.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 15.026 3.288 -6.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.861 3.662 -4.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 15.113 2.572 -4.585 1.00 0.00 H new ATOM 1795 N LEU A 103 8.270 -1.655 -3.316 1.00 0.00 N ATOM 1796 CA LEU A 103 6.867 -2.028 -3.668 1.00 0.00 C ATOM 1797 C LEU A 103 5.891 -0.944 -3.157 1.00 0.00 C ATOM 1798 O LEU A 103 6.028 -0.456 -2.050 1.00 0.00 O ATOM 1799 CB LEU A 103 6.661 -3.390 -2.965 1.00 0.00 C ATOM 1800 CG LEU A 103 5.174 -3.685 -2.723 1.00 0.00 C ATOM 1801 CD1 LEU A 103 4.435 -3.741 -4.061 1.00 0.00 C ATOM 1802 CD2 LEU A 103 5.037 -5.024 -1.997 1.00 0.00 C ATOM 0 H LEU A 103 8.430 -1.460 -2.328 1.00 0.00 H new ATOM 0 HA LEU A 103 6.684 -2.102 -4.740 1.00 0.00 H new ATOM 0 HB2 LEU A 103 7.095 -4.183 -3.574 1.00 0.00 H new ATOM 0 HB3 LEU A 103 7.192 -3.392 -2.013 1.00 0.00 H new ATOM 0 HG LEU A 103 4.739 -2.895 -2.111 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.380 -3.951 -3.885 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.535 -2.783 -4.572 1.00 0.00 H new ATOM 0 HD13 LEU A 103 4.863 -4.529 -4.680 1.00 0.00 H new ATOM 0 HD21 LEU A 103 3.982 -5.237 -1.823 1.00 0.00 H new ATOM 0 HD22 LEU A 103 5.471 -5.815 -2.608 1.00 0.00 H new ATOM 0 HD23 LEU A 103 5.560 -4.975 -1.042 1.00 0.00 H new ATOM 1814 N CYS A 104 4.910 -0.564 -3.956 1.00 0.00 N ATOM 1815 CA CYS A 104 3.941 0.486 -3.501 1.00 0.00 C ATOM 1816 C CYS A 104 2.523 -0.083 -3.263 1.00 0.00 C ATOM 1817 O CYS A 104 1.872 0.304 -2.312 1.00 0.00 O ATOM 1818 CB CYS A 104 3.963 1.593 -4.573 1.00 0.00 C ATOM 1819 SG CYS A 104 3.466 0.987 -6.214 1.00 0.00 S ATOM 0 H CYS A 104 4.744 -0.934 -4.892 1.00 0.00 H new ATOM 0 HA CYS A 104 4.235 0.887 -2.531 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.296 2.400 -4.270 1.00 0.00 H new ATOM 0 HB3 CYS A 104 4.966 2.015 -4.634 1.00 0.00 H new ATOM 1824 N CYS A 105 2.029 -0.995 -4.079 1.00 0.00 N ATOM 1825 CA CYS A 105 0.654 -1.554 -3.819 1.00 0.00 C ATOM 1826 C CYS A 105 0.656 -3.075 -4.070 1.00 0.00 C ATOM 1827 O CYS A 105 1.703 -3.676 -4.223 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.314 -0.879 -4.804 1.00 0.00 C ATOM 1829 SG CYS A 105 -0.006 0.909 -4.965 1.00 0.00 S ATOM 0 H CYS A 105 2.507 -1.370 -4.898 1.00 0.00 H new ATOM 0 HA CYS A 105 0.354 -1.367 -2.788 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.220 -1.351 -5.782 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.339 -1.040 -4.470 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.506 -3.706 -4.126 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.542 -5.189 -4.382 1.00 0.00 C ATOM 1836 C LEU A 106 -0.820 -5.474 -5.870 1.00 0.00 C ATOM 1837 O LEU A 106 -0.234 -6.372 -6.445 1.00 0.00 O ATOM 1838 CB LEU A 106 -1.669 -5.749 -3.508 1.00 0.00 C ATOM 1839 CG LEU A 106 -1.124 -6.112 -2.124 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -2.278 -6.602 -1.249 1.00 0.00 C ATOM 1841 CD2 LEU A 106 -0.061 -7.218 -2.247 1.00 0.00 C ATOM 0 H LEU A 106 -1.417 -3.263 -4.007 1.00 0.00 H new ATOM 0 HA LEU A 106 0.414 -5.655 -4.140 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.467 -5.013 -3.412 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.103 -6.630 -3.980 1.00 0.00 H new ATOM 0 HG LEU A 106 -0.664 -5.233 -1.673 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -1.900 -6.863 -0.261 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.024 -5.813 -1.155 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.734 -7.480 -1.707 1.00 0.00 H new ATOM 0 HD21 LEU A 106 0.320 -7.468 -1.257 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -0.508 -8.104 -2.699 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.759 -6.866 -2.873 1.00 0.00 H new ATOM 1853 N ARG A 107 -1.677 -4.699 -6.513 1.00 0.00 N ATOM 1854 CA ARG A 107 -1.939 -4.923 -7.978 1.00 0.00 C ATOM 1855 C ARG A 107 -1.167 -3.871 -8.807 1.00 0.00 C ATOM 1856 O ARG A 107 -1.614 -3.444 -9.853 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.451 -4.753 -8.162 1.00 0.00 C ATOM 1858 CG ARG A 107 -3.902 -5.509 -9.413 1.00 0.00 C ATOM 1859 CD ARG A 107 -4.157 -6.976 -9.059 1.00 0.00 C ATOM 1860 NE ARG A 107 -4.528 -7.627 -10.354 1.00 0.00 N ATOM 1861 CZ ARG A 107 -3.612 -7.920 -11.264 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -2.341 -7.650 -11.068 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -3.973 -8.492 -12.383 1.00 0.00 N ATOM 0 H ARG A 107 -2.199 -3.931 -6.090 1.00 0.00 H new ATOM 0 HA ARG A 107 -1.611 -5.908 -8.310 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -3.979 -5.130 -7.286 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -3.700 -3.696 -8.254 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -4.809 -5.058 -9.816 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -3.139 -5.438 -10.188 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -3.270 -7.437 -8.625 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -4.957 -7.072 -8.325 1.00 0.00 H new ATOM 0 HE ARG A 107 -5.506 -7.850 -10.539 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -2.042 -7.205 -10.200 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -1.653 -7.885 -11.784 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -4.955 -8.710 -12.551 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -3.272 -8.720 -13.088 1.00 0.00 H new ATOM 1877 N CYS A 108 -0.015 -3.443 -8.332 1.00 0.00 N ATOM 1878 CA CYS A 108 0.799 -2.415 -9.052 1.00 0.00 C ATOM 1879 C CYS A 108 2.249 -2.952 -9.245 1.00 0.00 C ATOM 1880 O CYS A 108 3.154 -2.192 -9.528 1.00 0.00 O ATOM 1881 CB CYS A 108 0.770 -1.263 -8.037 1.00 0.00 C ATOM 1882 SG CYS A 108 0.849 0.391 -8.760 1.00 0.00 S ATOM 0 H CYS A 108 0.398 -3.772 -7.459 1.00 0.00 H new ATOM 0 HA CYS A 108 0.441 -2.141 -10.044 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.142 -1.342 -7.446 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.607 -1.383 -7.349 1.00 0.00 H new ATOM 1887 N ILE A 109 2.480 -4.258 -9.068 1.00 0.00 N ATOM 1888 CA ILE A 109 3.865 -4.832 -9.207 1.00 0.00 C ATOM 1889 C ILE A 109 3.800 -6.351 -9.496 1.00 0.00 C ATOM 1890 O ILE A 109 4.613 -7.105 -8.989 1.00 0.00 O ATOM 1891 CB ILE A 109 4.525 -4.632 -7.825 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.628 -5.244 -6.723 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.733 -3.141 -7.548 1.00 0.00 C ATOM 1894 CD1 ILE A 109 4.441 -6.203 -5.843 1.00 0.00 C ATOM 0 H ILE A 109 1.759 -4.940 -8.833 1.00 0.00 H new ATOM 0 HA ILE A 109 4.409 -4.353 -10.021 1.00 0.00 H new ATOM 0 HB ILE A 109 5.494 -5.131 -7.823 1.00 0.00 H new ATOM 0 HG12 ILE A 109 3.202 -4.450 -6.110 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.794 -5.777 -7.179 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.199 -3.014 -6.571 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.379 -2.715 -8.316 1.00 0.00 H new ATOM 0 HG23 ILE A 109 3.770 -2.631 -7.560 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.796 -6.625 -5.073 1.00 0.00 H new ATOM 0 HD12 ILE A 109 4.846 -7.007 -6.458 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.260 -5.659 -5.372 1.00 0.00 H new ATOM 1906 N GLN A 110 2.839 -6.817 -10.269 1.00 0.00 N ATOM 1907 CA GLN A 110 2.745 -8.291 -10.526 1.00 0.00 C ATOM 1908 C GLN A 110 2.891 -8.617 -12.020 1.00 0.00 C ATOM 1909 O GLN A 110 2.316 -7.956 -12.861 1.00 0.00 O ATOM 1910 CB GLN A 110 1.352 -8.684 -10.033 1.00 0.00 C ATOM 1911 CG GLN A 110 1.433 -9.126 -8.570 1.00 0.00 C ATOM 1912 CD GLN A 110 1.921 -10.578 -8.499 1.00 0.00 C ATOM 1913 OE1 GLN A 110 2.959 -10.904 -9.039 1.00 0.00 O ATOM 1914 NE2 GLN A 110 1.215 -11.475 -7.854 1.00 0.00 N ATOM 0 H GLN A 110 2.127 -6.247 -10.726 1.00 0.00 H new ATOM 0 HA GLN A 110 3.542 -8.835 -10.019 1.00 0.00 H new ATOM 0 HB2 GLN A 110 0.669 -7.841 -10.132 1.00 0.00 H new ATOM 0 HB3 GLN A 110 0.952 -9.492 -10.646 1.00 0.00 H new ATOM 0 HG2 GLN A 110 2.113 -8.476 -8.020 1.00 0.00 H new ATOM 0 HG3 GLN A 110 0.455 -9.037 -8.098 1.00 0.00 H new ATOM 0 HE21 GLN A 110 0.343 -11.206 -7.399 1.00 0.00 H new ATOM 0 HE22 GLN A 110 1.538 -12.441 -7.807 1.00 0.00 H new ATOM 1923 N LYS A 111 3.647 -9.646 -12.354 1.00 0.00 N ATOM 1924 CA LYS A 111 3.818 -10.020 -13.791 1.00 0.00 C ATOM 1925 C LYS A 111 3.741 -11.548 -13.950 1.00 0.00 C ATOM 1926 O LYS A 111 3.510 -12.261 -12.991 1.00 0.00 O ATOM 1927 CB LYS A 111 5.205 -9.499 -14.183 1.00 0.00 C ATOM 1928 CG LYS A 111 6.277 -10.132 -13.289 1.00 0.00 C ATOM 1929 CD LYS A 111 7.662 -9.861 -13.882 1.00 0.00 C ATOM 1930 CE LYS A 111 8.018 -8.384 -13.695 1.00 0.00 C ATOM 1931 NZ LYS A 111 9.132 -8.134 -14.649 1.00 0.00 N ATOM 0 H LYS A 111 4.149 -10.237 -11.691 1.00 0.00 H new ATOM 0 HA LYS A 111 3.039 -9.596 -14.425 1.00 0.00 H new ATOM 0 HB2 LYS A 111 5.408 -9.732 -15.228 1.00 0.00 H new ATOM 0 HB3 LYS A 111 5.235 -8.414 -14.087 1.00 0.00 H new ATOM 0 HG2 LYS A 111 6.214 -9.721 -12.281 1.00 0.00 H new ATOM 0 HG3 LYS A 111 6.109 -11.206 -13.206 1.00 0.00 H new ATOM 0 HD2 LYS A 111 8.407 -10.490 -13.395 1.00 0.00 H new ATOM 0 HD3 LYS A 111 7.672 -10.117 -14.941 1.00 0.00 H new ATOM 0 HE2 LYS A 111 7.164 -7.742 -13.909 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.323 -8.178 -12.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 9.432 -7.141 -14.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 9.934 -8.755 -14.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 8.810 -8.332 -15.618 1.00 0.00 H new ATOM 1945 N ASN A 112 3.930 -12.060 -15.150 1.00 0.00 N ATOM 1946 CA ASN A 112 3.861 -13.539 -15.350 1.00 0.00 C ATOM 1947 C ASN A 112 4.864 -13.982 -16.428 1.00 0.00 C ATOM 1948 O ASN A 112 5.740 -14.785 -16.168 1.00 0.00 O ATOM 1949 CB ASN A 112 2.427 -13.809 -15.810 1.00 0.00 C ATOM 1950 CG ASN A 112 1.915 -15.103 -15.165 1.00 0.00 C ATOM 1951 OD1 ASN A 112 1.553 -15.110 -14.005 1.00 0.00 O ATOM 1952 ND2 ASN A 112 1.869 -16.210 -15.867 1.00 0.00 N ATOM 0 H ASN A 112 4.127 -11.517 -15.990 1.00 0.00 H new ATOM 0 HA ASN A 112 4.111 -14.088 -14.442 1.00 0.00 H new ATOM 0 HB2 ASN A 112 1.783 -12.974 -15.535 1.00 0.00 H new ATOM 0 HB3 ASN A 112 2.393 -13.894 -16.896 1.00 0.00 H new ATOM 0 HD21 ASN A 112 1.530 -17.072 -15.439 1.00 0.00 H new ATOM 0 HD22 ASN A 112 2.172 -16.209 -16.841 1.00 0.00 H new ATOM 1959 N GLU A 113 4.743 -13.470 -17.637 1.00 0.00 N ATOM 1960 CA GLU A 113 5.692 -13.872 -18.719 1.00 0.00 C ATOM 1961 C GLU A 113 6.449 -12.644 -19.249 1.00 0.00 C ATOM 1962 O GLU A 113 6.360 -11.569 -18.686 1.00 0.00 O ATOM 1963 CB GLU A 113 4.807 -14.471 -19.815 1.00 0.00 C ATOM 1964 CG GLU A 113 5.504 -15.687 -20.431 1.00 0.00 C ATOM 1965 CD GLU A 113 4.460 -16.739 -20.807 1.00 0.00 C ATOM 1966 OE1 GLU A 113 3.560 -16.962 -20.013 1.00 0.00 O ATOM 1967 OE2 GLU A 113 4.578 -17.304 -21.882 1.00 0.00 O ATOM 0 H GLU A 113 4.030 -12.795 -17.914 1.00 0.00 H new ATOM 0 HA GLU A 113 6.444 -14.578 -18.368 1.00 0.00 H new ATOM 0 HB2 GLU A 113 3.843 -14.764 -19.399 1.00 0.00 H new ATOM 0 HB3 GLU A 113 4.608 -13.725 -20.584 1.00 0.00 H new ATOM 0 HG2 GLU A 113 6.068 -15.387 -21.314 1.00 0.00 H new ATOM 0 HG3 GLU A 113 6.219 -16.106 -19.723 1.00 0.00 H new ATOM 1974 N THR A 114 7.193 -12.791 -20.327 1.00 0.00 N ATOM 1975 CA THR A 114 7.949 -11.617 -20.881 1.00 0.00 C ATOM 1976 C THR A 114 7.162 -10.955 -22.026 1.00 0.00 C ATOM 1977 O THR A 114 7.175 -9.746 -22.165 1.00 0.00 O ATOM 1978 CB THR A 114 9.280 -12.178 -21.400 1.00 0.00 C ATOM 1979 OG1 THR A 114 9.948 -12.858 -20.347 1.00 0.00 O ATOM 1980 CG2 THR A 114 10.157 -11.032 -21.906 1.00 0.00 C ATOM 0 H THR A 114 7.308 -13.664 -20.841 1.00 0.00 H new ATOM 0 HA THR A 114 8.106 -10.852 -20.120 1.00 0.00 H new ATOM 0 HB THR A 114 9.087 -12.873 -22.217 1.00 0.00 H new ATOM 0 HG1 THR A 114 10.797 -13.218 -20.677 1.00 0.00 H new ATOM 0 HG21 THR A 114 11.102 -11.432 -22.274 1.00 0.00 H new ATOM 0 HG22 THR A 114 9.644 -10.511 -22.714 1.00 0.00 H new ATOM 0 HG23 THR A 114 10.351 -10.335 -21.091 1.00 0.00 H new ATOM 1988 N ASN A 115 6.475 -11.726 -22.850 1.00 0.00 N ATOM 1989 CA ASN A 115 5.696 -11.108 -23.975 1.00 0.00 C ATOM 1990 C ASN A 115 4.215 -10.966 -23.588 1.00 0.00 C ATOM 1991 O ASN A 115 3.604 -9.946 -23.847 1.00 0.00 O ATOM 1992 CB ASN A 115 5.851 -12.062 -25.167 1.00 0.00 C ATOM 1993 CG ASN A 115 5.253 -11.415 -26.423 1.00 0.00 C ATOM 1994 OD1 ASN A 115 4.382 -10.574 -26.326 1.00 0.00 O ATOM 1995 ND2 ASN A 115 5.685 -11.771 -27.609 1.00 0.00 N ATOM 0 H ASN A 115 6.422 -12.743 -22.791 1.00 0.00 H new ATOM 0 HA ASN A 115 6.061 -10.109 -24.213 1.00 0.00 H new ATOM 0 HB2 ASN A 115 6.905 -12.290 -25.329 1.00 0.00 H new ATOM 0 HB3 ASN A 115 5.349 -13.007 -24.958 1.00 0.00 H new ATOM 0 HD21 ASN A 115 5.290 -11.342 -28.446 1.00 0.00 H new ATOM 0 HD22 ASN A 115 6.416 -12.477 -27.695 1.00 0.00 H new ATOM 2002 N ASN A 116 3.630 -11.974 -22.972 1.00 0.00 N ATOM 2003 CA ASN A 116 2.190 -11.874 -22.578 1.00 0.00 C ATOM 2004 C ASN A 116 2.054 -11.863 -21.048 1.00 0.00 C ATOM 2005 O ASN A 116 1.901 -12.900 -20.430 1.00 0.00 O ATOM 2006 CB ASN A 116 1.524 -13.119 -23.168 1.00 0.00 C ATOM 2007 CG ASN A 116 0.017 -12.872 -23.313 1.00 0.00 C ATOM 2008 OD1 ASN A 116 -0.780 -13.590 -22.745 1.00 0.00 O ATOM 2009 ND2 ASN A 116 -0.414 -11.880 -24.055 1.00 0.00 N ATOM 0 H ASN A 116 4.087 -12.853 -22.729 1.00 0.00 H new ATOM 0 HA ASN A 116 1.729 -10.956 -22.943 1.00 0.00 H new ATOM 0 HB2 ASN A 116 1.960 -13.352 -24.139 1.00 0.00 H new ATOM 0 HB3 ASN A 116 1.702 -13.980 -22.524 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -1.416 -11.714 -24.153 1.00 0.00 H new ATOM 0 HD22 ASN A 116 0.252 -11.274 -24.534 1.00 0.00 H new ATOM 2016 N GLY A 117 2.107 -10.699 -20.428 1.00 0.00 N ATOM 2017 CA GLY A 117 1.979 -10.636 -18.941 1.00 0.00 C ATOM 2018 C GLY A 117 1.168 -9.392 -18.546 1.00 0.00 C ATOM 2019 O GLY A 117 0.899 -8.541 -19.373 1.00 0.00 O ATOM 0 H GLY A 117 2.233 -9.799 -20.891 1.00 0.00 H new ATOM 0 HA2 GLY A 117 1.488 -11.536 -18.570 1.00 0.00 H new ATOM 0 HA3 GLY A 117 2.967 -10.599 -18.482 1.00 0.00 H new ATOM 2023 N SER A 118 0.776 -9.276 -17.294 1.00 0.00 N ATOM 2024 CA SER A 118 -0.015 -8.083 -16.864 1.00 0.00 C ATOM 2025 C SER A 118 0.612 -7.454 -15.610 1.00 0.00 C ATOM 2026 O SER A 118 0.459 -7.966 -14.518 1.00 0.00 O ATOM 2027 CB SER A 118 -1.409 -8.624 -16.553 1.00 0.00 C ATOM 2028 OG SER A 118 -2.152 -8.731 -17.761 1.00 0.00 O ATOM 0 H SER A 118 0.971 -9.955 -16.558 1.00 0.00 H new ATOM 0 HA SER A 118 -0.041 -7.307 -17.629 1.00 0.00 H new ATOM 0 HB2 SER A 118 -1.334 -9.599 -16.071 1.00 0.00 H new ATOM 0 HB3 SER A 118 -1.921 -7.962 -15.855 1.00 0.00 H new ATOM 0 HG SER A 118 -3.047 -9.080 -17.565 1.00 0.00 H new ATOM 2034 N THR A 119 1.318 -6.350 -15.756 1.00 0.00 N ATOM 2035 CA THR A 119 1.951 -5.702 -14.567 1.00 0.00 C ATOM 2036 C THR A 119 1.867 -4.175 -14.685 1.00 0.00 C ATOM 2037 O THR A 119 1.596 -3.650 -15.748 1.00 0.00 O ATOM 2038 CB THR A 119 3.415 -6.148 -14.603 1.00 0.00 C ATOM 2039 OG1 THR A 119 3.479 -7.534 -14.906 1.00 0.00 O ATOM 2040 CG2 THR A 119 4.068 -5.889 -13.243 1.00 0.00 C ATOM 0 H THR A 119 1.479 -5.876 -16.645 1.00 0.00 H new ATOM 0 HA THR A 119 1.455 -5.983 -13.638 1.00 0.00 H new ATOM 0 HB THR A 119 3.946 -5.583 -15.369 1.00 0.00 H new ATOM 0 HG1 THR A 119 2.776 -8.009 -14.415 1.00 0.00 H new ATOM 0 HG21 THR A 119 5.110 -6.208 -13.273 1.00 0.00 H new ATOM 0 HG22 THR A 119 4.021 -4.824 -13.014 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.539 -6.450 -12.473 1.00 0.00 H new ATOM 2048 N CYS A 120 2.118 -3.455 -13.609 1.00 0.00 N ATOM 2049 CA CYS A 120 2.072 -1.958 -13.698 1.00 0.00 C ATOM 2050 C CYS A 120 3.411 -1.446 -14.255 1.00 0.00 C ATOM 2051 O CYS A 120 4.426 -2.103 -14.119 1.00 0.00 O ATOM 2052 CB CYS A 120 1.848 -1.433 -12.277 1.00 0.00 C ATOM 2053 SG CYS A 120 1.637 0.358 -12.354 1.00 0.00 S ATOM 0 H CYS A 120 2.348 -3.833 -12.690 1.00 0.00 H new ATOM 0 HA CYS A 120 1.274 -1.618 -14.358 1.00 0.00 H new ATOM 0 HB2 CYS A 120 0.967 -1.899 -11.835 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.696 -1.687 -11.641 1.00 0.00 H new ATOM 2058 N ILE A 121 3.428 -0.292 -14.889 1.00 0.00 N ATOM 2059 CA ILE A 121 4.724 0.225 -15.456 1.00 0.00 C ATOM 2060 C ILE A 121 5.659 0.714 -14.329 1.00 0.00 C ATOM 2061 O ILE A 121 6.861 0.545 -14.414 1.00 0.00 O ATOM 2062 CB ILE A 121 4.345 1.366 -16.433 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.550 1.717 -17.334 1.00 0.00 C ATOM 2064 CG2 ILE A 121 3.858 2.609 -15.670 1.00 0.00 C ATOM 2065 CD1 ILE A 121 6.682 2.393 -16.541 1.00 0.00 C ATOM 0 H ILE A 121 2.616 0.307 -15.037 1.00 0.00 H new ATOM 0 HA ILE A 121 5.274 -0.557 -15.980 1.00 0.00 H new ATOM 0 HB ILE A 121 3.525 1.020 -17.063 1.00 0.00 H new ATOM 0 HG12 ILE A 121 5.928 0.809 -17.804 1.00 0.00 H new ATOM 0 HG13 ILE A 121 5.223 2.379 -18.136 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.599 3.394 -16.381 1.00 0.00 H new ATOM 0 HG22 ILE A 121 2.980 2.351 -15.078 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.649 2.964 -15.010 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.509 2.623 -17.212 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.312 3.315 -16.092 1.00 0.00 H new ATOM 0 HD13 ILE A 121 7.028 1.721 -15.756 1.00 0.00 H new ATOM 2077 N CYS A 122 5.136 1.329 -13.283 1.00 0.00 N ATOM 2078 CA CYS A 122 6.051 1.828 -12.187 1.00 0.00 C ATOM 2079 C CYS A 122 6.952 0.691 -11.657 1.00 0.00 C ATOM 2080 O CYS A 122 8.090 0.929 -11.295 1.00 0.00 O ATOM 2081 CB CYS A 122 5.152 2.464 -11.088 1.00 0.00 C ATOM 2082 SG CYS A 122 4.450 1.224 -9.948 1.00 0.00 S ATOM 0 H CYS A 122 4.141 1.505 -13.140 1.00 0.00 H new ATOM 0 HA CYS A 122 6.741 2.584 -12.561 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.737 3.185 -10.518 1.00 0.00 H new ATOM 0 HB3 CYS A 122 4.341 3.016 -11.562 1.00 0.00 H new ATOM 2087 N ARG A 123 6.478 -0.541 -11.638 1.00 0.00 N ATOM 2088 CA ARG A 123 7.363 -1.667 -11.157 1.00 0.00 C ATOM 2089 C ARG A 123 8.642 -1.724 -12.016 1.00 0.00 C ATOM 2090 O ARG A 123 9.706 -2.046 -11.522 1.00 0.00 O ATOM 2091 CB ARG A 123 6.566 -2.971 -11.324 1.00 0.00 C ATOM 2092 CG ARG A 123 6.985 -3.967 -10.240 1.00 0.00 C ATOM 2093 CD ARG A 123 6.918 -5.390 -10.801 1.00 0.00 C ATOM 2094 NE ARG A 123 8.200 -5.570 -11.550 1.00 0.00 N ATOM 2095 CZ ARG A 123 9.347 -5.760 -10.916 1.00 0.00 C ATOM 2096 NH1 ARG A 123 9.406 -5.796 -9.604 1.00 0.00 N ATOM 2097 NH2 ARG A 123 10.448 -5.916 -11.604 1.00 0.00 N ATOM 0 H ARG A 123 5.539 -0.813 -11.927 1.00 0.00 H new ATOM 0 HA ARG A 123 7.653 -1.519 -10.117 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.497 -2.768 -11.253 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.745 -3.395 -12.312 1.00 0.00 H new ATOM 0 HG2 ARG A 123 7.997 -3.746 -9.900 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.330 -3.875 -9.374 1.00 0.00 H new ATOM 0 HD2 ARG A 123 6.821 -6.125 -10.002 1.00 0.00 H new ATOM 0 HD3 ARG A 123 6.056 -5.516 -11.457 1.00 0.00 H new ATOM 0 HE ARG A 123 8.191 -5.546 -12.570 1.00 0.00 H new ATOM 0 HH11 ARG A 123 8.557 -5.676 -9.052 1.00 0.00 H new ATOM 0 HH12 ARG A 123 10.301 -5.944 -9.138 1.00 0.00 H new ATOM 0 HH21 ARG A 123 10.420 -5.891 -12.623 1.00 0.00 H new ATOM 0 HH22 ARG A 123 11.335 -6.063 -11.121 1.00 0.00 H new ATOM 2111 N VAL A 124 8.551 -1.405 -13.297 1.00 0.00 N ATOM 2112 CA VAL A 124 9.779 -1.438 -14.164 1.00 0.00 C ATOM 2113 C VAL A 124 10.587 -0.140 -13.971 1.00 0.00 C ATOM 2114 O VAL A 124 10.052 0.937 -14.143 1.00 0.00 O ATOM 2115 CB VAL A 124 9.281 -1.536 -15.618 1.00 0.00 C ATOM 2116 CG1 VAL A 124 10.477 -1.612 -16.569 1.00 0.00 C ATOM 2117 CG2 VAL A 124 8.416 -2.790 -15.785 1.00 0.00 C ATOM 0 H VAL A 124 7.691 -1.128 -13.770 1.00 0.00 H new ATOM 0 HA VAL A 124 10.425 -2.278 -13.910 1.00 0.00 H new ATOM 0 HB VAL A 124 8.687 -0.653 -15.853 1.00 0.00 H new ATOM 0 HG11 VAL A 124 10.121 -1.681 -17.597 1.00 0.00 H new ATOM 0 HG12 VAL A 124 11.089 -0.717 -16.457 1.00 0.00 H new ATOM 0 HG13 VAL A 124 11.075 -2.492 -16.332 1.00 0.00 H new ATOM 0 HG21 VAL A 124 8.066 -2.856 -16.815 1.00 0.00 H new ATOM 0 HG22 VAL A 124 9.007 -3.674 -15.546 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.559 -2.733 -15.113 1.00 0.00 H new ATOM 2127 N PRO A 125 11.852 -0.269 -13.626 1.00 0.00 N ATOM 2128 CA PRO A 125 12.702 0.936 -13.429 1.00 0.00 C ATOM 2129 C PRO A 125 12.896 1.689 -14.755 1.00 0.00 C ATOM 2130 O PRO A 125 12.491 1.220 -15.802 1.00 0.00 O ATOM 2131 CB PRO A 125 14.025 0.366 -12.916 1.00 0.00 C ATOM 2132 CG PRO A 125 14.043 -1.045 -13.403 1.00 0.00 C ATOM 2133 CD PRO A 125 12.611 -1.508 -13.392 1.00 0.00 C ATOM 0 HA PRO A 125 12.264 1.659 -12.741 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.875 0.929 -13.302 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.080 0.410 -11.828 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.465 -1.106 -14.406 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.660 -1.672 -12.759 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.422 -2.248 -14.169 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.345 -1.969 -12.441 1.00 0.00 H new ATOM 2141 N ARG A 126 13.507 2.858 -14.721 1.00 0.00 N ATOM 2142 CA ARG A 126 13.711 3.634 -15.998 1.00 0.00 C ATOM 2143 C ARG A 126 14.837 3.015 -16.842 1.00 0.00 C ATOM 2144 O ARG A 126 14.761 3.003 -18.057 1.00 0.00 O ATOM 2145 CB ARG A 126 14.086 5.067 -15.586 1.00 0.00 C ATOM 2146 CG ARG A 126 14.161 5.953 -16.831 1.00 0.00 C ATOM 2147 CD ARG A 126 12.746 6.241 -17.339 1.00 0.00 C ATOM 2148 NE ARG A 126 12.789 7.659 -17.812 1.00 0.00 N ATOM 2149 CZ ARG A 126 12.865 8.668 -16.958 1.00 0.00 C ATOM 2150 NH1 ARG A 126 12.905 8.465 -15.660 1.00 0.00 N ATOM 2151 NH2 ARG A 126 12.902 9.896 -17.408 1.00 0.00 N ATOM 0 H ARG A 126 13.869 3.303 -13.878 1.00 0.00 H new ATOM 0 HA ARG A 126 12.807 3.618 -16.606 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.346 5.462 -14.890 1.00 0.00 H new ATOM 0 HB3 ARG A 126 15.045 5.069 -15.067 1.00 0.00 H new ATOM 0 HG2 ARG A 126 14.671 6.887 -16.595 1.00 0.00 H new ATOM 0 HG3 ARG A 126 14.744 5.458 -17.608 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.471 5.563 -18.147 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.008 6.111 -16.548 1.00 0.00 H new ATOM 0 HE ARG A 126 12.759 7.853 -18.813 1.00 0.00 H new ATOM 0 HH11 ARG A 126 12.878 7.514 -15.291 1.00 0.00 H new ATOM 0 HH12 ARG A 126 12.964 9.258 -15.021 1.00 0.00 H new ATOM 0 HH21 ARG A 126 12.872 10.072 -18.412 1.00 0.00 H new ATOM 0 HH22 ARG A 126 12.961 10.677 -16.755 1.00 0.00 H new ATOM 2165 N ALA A 127 15.886 2.505 -16.222 1.00 0.00 N ATOM 2166 CA ALA A 127 17.006 1.898 -17.033 1.00 0.00 C ATOM 2167 C ALA A 127 16.466 0.750 -17.896 1.00 0.00 C ATOM 2168 O ALA A 127 16.794 0.645 -19.064 1.00 0.00 O ATOM 2169 CB ALA A 127 18.044 1.366 -16.033 1.00 0.00 C ATOM 0 H ALA A 127 16.015 2.482 -15.210 1.00 0.00 H new ATOM 0 HA ALA A 127 17.452 2.636 -17.700 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.875 0.916 -16.576 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.413 2.188 -15.420 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.581 0.615 -15.393 1.00 0.00 H new ATOM 2175 N GLN A 128 15.632 -0.106 -17.342 1.00 0.00 N ATOM 2176 CA GLN A 128 15.074 -1.235 -18.169 1.00 0.00 C ATOM 2177 C GLN A 128 14.185 -0.661 -19.281 1.00 0.00 C ATOM 2178 O GLN A 128 14.223 -1.122 -20.407 1.00 0.00 O ATOM 2179 CB GLN A 128 14.244 -2.117 -17.223 1.00 0.00 C ATOM 2180 CG GLN A 128 13.715 -3.331 -17.990 1.00 0.00 C ATOM 2181 CD GLN A 128 14.847 -4.347 -18.184 1.00 0.00 C ATOM 2182 OE1 GLN A 128 15.699 -4.164 -19.031 1.00 0.00 O ATOM 2183 NE2 GLN A 128 14.898 -5.421 -17.433 1.00 0.00 N ATOM 0 H GLN A 128 15.318 -0.075 -16.372 1.00 0.00 H new ATOM 0 HA GLN A 128 15.868 -1.818 -18.636 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.856 -2.443 -16.382 1.00 0.00 H new ATOM 0 HB3 GLN A 128 13.414 -1.544 -16.810 1.00 0.00 H new ATOM 0 HG2 GLN A 128 12.891 -3.789 -17.443 1.00 0.00 H new ATOM 0 HG3 GLN A 128 13.322 -3.020 -18.958 1.00 0.00 H new ATOM 0 HE21 GLN A 128 14.185 -5.579 -16.721 1.00 0.00 H new ATOM 0 HE22 GLN A 128 15.650 -6.098 -17.561 1.00 0.00 H new ATOM 2192 N LEU A 129 13.389 0.349 -18.982 1.00 0.00 N ATOM 2193 CA LEU A 129 12.510 0.944 -20.050 1.00 0.00 C ATOM 2194 C LEU A 129 13.380 1.522 -21.176 1.00 0.00 C ATOM 2195 O LEU A 129 13.062 1.372 -22.342 1.00 0.00 O ATOM 2196 CB LEU A 129 11.699 2.067 -19.385 1.00 0.00 C ATOM 2197 CG LEU A 129 10.412 1.488 -18.791 1.00 0.00 C ATOM 2198 CD1 LEU A 129 10.084 2.207 -17.479 1.00 0.00 C ATOM 2199 CD2 LEU A 129 9.260 1.682 -19.782 1.00 0.00 C ATOM 0 H LEU A 129 13.311 0.780 -18.061 1.00 0.00 H new ATOM 0 HA LEU A 129 11.852 0.191 -20.483 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.291 2.543 -18.603 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.459 2.838 -20.117 1.00 0.00 H new ATOM 0 HG LEU A 129 10.549 0.424 -18.596 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.168 1.794 -17.057 1.00 0.00 H new ATOM 0 HD12 LEU A 129 10.903 2.068 -16.773 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.947 3.271 -17.672 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.343 1.270 -19.360 1.00 0.00 H new ATOM 0 HD22 LEU A 129 9.123 2.746 -19.977 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.492 1.169 -20.715 1.00 0.00 H new ATOM 2211 N GLU A 130 14.478 2.178 -20.846 1.00 0.00 N ATOM 2212 CA GLU A 130 15.354 2.758 -21.929 1.00 0.00 C ATOM 2213 C GLU A 130 15.821 1.644 -22.880 1.00 0.00 C ATOM 2214 O GLU A 130 15.866 1.833 -24.081 1.00 0.00 O ATOM 2215 CB GLU A 130 16.563 3.399 -21.230 1.00 0.00 C ATOM 2216 CG GLU A 130 16.153 4.751 -20.641 1.00 0.00 C ATOM 2217 CD GLU A 130 17.369 5.677 -20.592 1.00 0.00 C ATOM 2218 OE1 GLU A 130 18.226 5.454 -19.751 1.00 0.00 O ATOM 2219 OE2 GLU A 130 17.425 6.593 -21.395 1.00 0.00 O ATOM 0 H GLU A 130 14.801 2.335 -19.891 1.00 0.00 H new ATOM 0 HA GLU A 130 14.810 3.495 -22.520 1.00 0.00 H new ATOM 0 HB2 GLU A 130 16.931 2.743 -20.441 1.00 0.00 H new ATOM 0 HB3 GLU A 130 17.379 3.532 -21.940 1.00 0.00 H new ATOM 0 HG2 GLU A 130 15.365 5.199 -21.247 1.00 0.00 H new ATOM 0 HG3 GLU A 130 15.746 4.615 -19.639 1.00 0.00 H new ATOM 2226 N GLU A 131 16.160 0.480 -22.358 1.00 0.00 N ATOM 2227 CA GLU A 131 16.612 -0.634 -23.267 1.00 0.00 C ATOM 2228 C GLU A 131 15.493 -0.992 -24.259 1.00 0.00 C ATOM 2229 O GLU A 131 15.758 -1.301 -25.406 1.00 0.00 O ATOM 2230 CB GLU A 131 16.930 -1.841 -22.368 1.00 0.00 C ATOM 2231 CG GLU A 131 17.718 -2.880 -23.169 1.00 0.00 C ATOM 2232 CD GLU A 131 19.179 -2.440 -23.278 1.00 0.00 C ATOM 2233 OE1 GLU A 131 19.878 -2.523 -22.282 1.00 0.00 O ATOM 2234 OE2 GLU A 131 19.572 -2.027 -24.356 1.00 0.00 O ATOM 0 H GLU A 131 16.144 0.256 -21.363 1.00 0.00 H new ATOM 0 HA GLU A 131 17.487 -0.337 -23.845 1.00 0.00 H new ATOM 0 HB2 GLU A 131 17.507 -1.520 -21.501 1.00 0.00 H new ATOM 0 HB3 GLU A 131 16.007 -2.281 -21.991 1.00 0.00 H new ATOM 0 HG2 GLU A 131 17.656 -3.853 -22.683 1.00 0.00 H new ATOM 0 HG3 GLU A 131 17.286 -2.992 -24.163 1.00 0.00 H new ATOM 2241 N GLU A 132 14.246 -0.953 -23.834 1.00 0.00 N ATOM 2242 CA GLU A 132 13.126 -1.296 -24.782 1.00 0.00 C ATOM 2243 C GLU A 132 13.096 -0.291 -25.943 1.00 0.00 C ATOM 2244 O GLU A 132 13.005 -0.678 -27.093 1.00 0.00 O ATOM 2245 CB GLU A 132 11.818 -1.213 -23.977 1.00 0.00 C ATOM 2246 CG GLU A 132 11.767 -2.358 -22.964 1.00 0.00 C ATOM 2247 CD GLU A 132 11.114 -3.582 -23.610 1.00 0.00 C ATOM 2248 OE1 GLU A 132 11.797 -4.274 -24.346 1.00 0.00 O ATOM 2249 OE2 GLU A 132 9.942 -3.805 -23.355 1.00 0.00 O ATOM 0 H GLU A 132 13.957 -0.703 -22.888 1.00 0.00 H new ATOM 0 HA GLU A 132 13.261 -2.292 -25.204 1.00 0.00 H new ATOM 0 HB2 GLU A 132 11.756 -0.255 -23.461 1.00 0.00 H new ATOM 0 HB3 GLU A 132 10.961 -1.269 -24.649 1.00 0.00 H new ATOM 0 HG2 GLU A 132 12.774 -2.605 -22.627 1.00 0.00 H new ATOM 0 HG3 GLU A 132 11.202 -2.053 -22.083 1.00 0.00 H new ATOM 2256 N ALA A 133 13.174 0.996 -25.660 1.00 0.00 N ATOM 2257 CA ALA A 133 13.150 2.001 -26.784 1.00 0.00 C ATOM 2258 C ALA A 133 14.379 1.804 -27.684 1.00 0.00 C ATOM 2259 O ALA A 133 14.276 1.868 -28.895 1.00 0.00 O ATOM 2260 CB ALA A 133 13.181 3.396 -26.143 1.00 0.00 C ATOM 0 H ALA A 133 13.252 1.388 -24.721 1.00 0.00 H new ATOM 0 HA ALA A 133 12.258 1.880 -27.399 1.00 0.00 H new ATOM 0 HB1 ALA A 133 13.165 4.156 -26.924 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.311 3.520 -25.498 1.00 0.00 H new ATOM 0 HB3 ALA A 133 14.090 3.504 -25.551 1.00 0.00 H new ATOM 2266 N ARG A 134 15.539 1.557 -27.109 1.00 0.00 N ATOM 2267 CA ARG A 134 16.765 1.351 -27.964 1.00 0.00 C ATOM 2268 C ARG A 134 16.616 0.078 -28.817 1.00 0.00 C ATOM 2269 O ARG A 134 17.119 0.016 -29.925 1.00 0.00 O ATOM 2270 CB ARG A 134 17.957 1.206 -27.003 1.00 0.00 C ATOM 2271 CG ARG A 134 19.260 1.439 -27.769 1.00 0.00 C ATOM 2272 CD ARG A 134 20.329 1.971 -26.811 1.00 0.00 C ATOM 2273 NE ARG A 134 21.626 1.484 -27.372 1.00 0.00 N ATOM 2274 CZ ARG A 134 22.153 2.028 -28.458 1.00 0.00 C ATOM 2275 NH1 ARG A 134 21.557 3.015 -29.087 1.00 0.00 N ATOM 2276 NH2 ARG A 134 23.290 1.576 -28.921 1.00 0.00 N ATOM 0 H ARG A 134 15.691 1.490 -26.103 1.00 0.00 H new ATOM 0 HA ARG A 134 16.909 2.190 -28.645 1.00 0.00 H new ATOM 0 HB2 ARG A 134 17.869 1.923 -26.187 1.00 0.00 H new ATOM 0 HB3 ARG A 134 17.958 0.212 -26.555 1.00 0.00 H new ATOM 0 HG2 ARG A 134 19.597 0.508 -28.226 1.00 0.00 H new ATOM 0 HG3 ARG A 134 19.096 2.150 -28.579 1.00 0.00 H new ATOM 0 HD2 ARG A 134 20.305 3.059 -26.758 1.00 0.00 H new ATOM 0 HD3 ARG A 134 20.172 1.599 -25.798 1.00 0.00 H new ATOM 0 HE ARG A 134 22.115 0.718 -26.909 1.00 0.00 H new ATOM 0 HH11 ARG A 134 20.669 3.378 -28.741 1.00 0.00 H new ATOM 0 HH12 ARG A 134 21.982 3.418 -29.922 1.00 0.00 H new ATOM 0 HH21 ARG A 134 23.765 0.809 -28.446 1.00 0.00 H new ATOM 0 HH22 ARG A 134 23.701 1.991 -29.757 1.00 0.00 H new ATOM 2290 N LYS A 135 15.935 -0.941 -28.324 1.00 0.00 N ATOM 2291 CA LYS A 135 15.776 -2.198 -29.139 1.00 0.00 C ATOM 2292 C LYS A 135 14.632 -2.054 -30.163 1.00 0.00 C ATOM 2293 O LYS A 135 14.675 -2.663 -31.216 1.00 0.00 O ATOM 2294 CB LYS A 135 15.458 -3.326 -28.145 1.00 0.00 C ATOM 2295 CG LYS A 135 16.710 -3.652 -27.328 1.00 0.00 C ATOM 2296 CD LYS A 135 16.712 -5.140 -26.969 1.00 0.00 C ATOM 2297 CE LYS A 135 18.116 -5.556 -26.525 1.00 0.00 C ATOM 2298 NZ LYS A 135 17.919 -6.817 -25.758 1.00 0.00 N ATOM 0 H LYS A 135 15.489 -0.957 -27.407 1.00 0.00 H new ATOM 0 HA LYS A 135 16.685 -2.407 -29.703 1.00 0.00 H new ATOM 0 HB2 LYS A 135 14.647 -3.024 -27.483 1.00 0.00 H new ATOM 0 HB3 LYS A 135 15.119 -4.213 -28.681 1.00 0.00 H new ATOM 0 HG2 LYS A 135 17.605 -3.404 -27.899 1.00 0.00 H new ATOM 0 HG3 LYS A 135 16.733 -3.048 -26.421 1.00 0.00 H new ATOM 0 HD2 LYS A 135 15.995 -5.334 -26.172 1.00 0.00 H new ATOM 0 HD3 LYS A 135 16.400 -5.733 -27.829 1.00 0.00 H new ATOM 0 HE2 LYS A 135 18.771 -5.713 -27.382 1.00 0.00 H new ATOM 0 HE3 LYS A 135 18.579 -4.786 -25.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 18.839 -7.165 -25.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 17.297 -6.635 -24.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 17.483 -7.533 -26.373 1.00 0.00 H new ATOM 2312 N LYS A 136 13.610 -1.265 -29.878 1.00 0.00 N ATOM 2313 CA LYS A 136 12.489 -1.118 -30.869 1.00 0.00 C ATOM 2314 C LYS A 136 12.637 0.166 -31.712 1.00 0.00 C ATOM 2315 O LYS A 136 11.662 0.668 -32.237 1.00 0.00 O ATOM 2316 CB LYS A 136 11.202 -1.062 -30.036 1.00 0.00 C ATOM 2317 CG LYS A 136 10.849 -2.467 -29.543 1.00 0.00 C ATOM 2318 CD LYS A 136 9.505 -2.430 -28.815 1.00 0.00 C ATOM 2319 CE LYS A 136 9.369 -3.670 -27.929 1.00 0.00 C ATOM 2320 NZ LYS A 136 8.651 -3.196 -26.712 1.00 0.00 N ATOM 0 H LYS A 136 13.507 -0.727 -29.017 1.00 0.00 H new ATOM 0 HA LYS A 136 12.486 -1.948 -31.575 1.00 0.00 H new ATOM 0 HB2 LYS A 136 11.335 -0.391 -29.188 1.00 0.00 H new ATOM 0 HB3 LYS A 136 10.386 -0.660 -30.636 1.00 0.00 H new ATOM 0 HG2 LYS A 136 10.800 -3.157 -30.385 1.00 0.00 H new ATOM 0 HG3 LYS A 136 11.627 -2.835 -28.874 1.00 0.00 H new ATOM 0 HD2 LYS A 136 9.433 -1.527 -28.209 1.00 0.00 H new ATOM 0 HD3 LYS A 136 8.689 -2.395 -29.537 1.00 0.00 H new ATOM 0 HE2 LYS A 136 8.811 -4.458 -28.435 1.00 0.00 H new ATOM 0 HE3 LYS A 136 10.345 -4.083 -27.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 8.520 -3.991 -26.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 9.209 -2.451 -26.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 7.722 -2.814 -26.983 1.00 0.00 H new ATOM 2334 N GLY A 137 13.840 0.698 -31.868 1.00 0.00 N ATOM 2335 CA GLY A 137 14.025 1.936 -32.695 1.00 0.00 C ATOM 2336 C GLY A 137 13.030 3.036 -32.278 1.00 0.00 C ATOM 2337 O GLY A 137 12.401 3.650 -33.119 1.00 0.00 O ATOM 0 H GLY A 137 14.695 0.324 -31.457 1.00 0.00 H new ATOM 0 HA2 GLY A 137 15.045 2.303 -32.583 1.00 0.00 H new ATOM 0 HA3 GLY A 137 13.886 1.697 -33.749 1.00 0.00 H new ATOM 2341 N THR A 138 12.883 3.295 -30.993 1.00 0.00 N ATOM 2342 CA THR A 138 11.927 4.361 -30.556 1.00 0.00 C ATOM 2343 C THR A 138 12.428 5.036 -29.267 1.00 0.00 C ATOM 2344 O THR A 138 13.579 4.893 -28.901 1.00 0.00 O ATOM 2345 CB THR A 138 10.594 3.638 -30.321 1.00 0.00 C ATOM 2346 OG1 THR A 138 9.616 4.581 -29.905 1.00 0.00 O ATOM 2347 CG2 THR A 138 10.759 2.566 -29.241 1.00 0.00 C ATOM 0 H THR A 138 13.379 2.818 -30.240 1.00 0.00 H new ATOM 0 HA THR A 138 11.826 5.152 -31.299 1.00 0.00 H new ATOM 0 HB THR A 138 10.278 3.161 -31.249 1.00 0.00 H new ATOM 0 HG1 THR A 138 9.372 4.409 -28.972 1.00 0.00 H new ATOM 0 HG21 THR A 138 9.807 2.060 -29.083 1.00 0.00 H new ATOM 0 HG22 THR A 138 11.507 1.840 -29.560 1.00 0.00 H new ATOM 0 HG23 THR A 138 11.080 3.034 -28.310 1.00 0.00 H new ATOM 2355 N GLN A 139 11.579 5.773 -28.578 1.00 0.00 N ATOM 2356 CA GLN A 139 12.024 6.450 -27.323 1.00 0.00 C ATOM 2357 C GLN A 139 11.003 6.213 -26.199 1.00 0.00 C ATOM 2358 O GLN A 139 9.858 5.890 -26.457 1.00 0.00 O ATOM 2359 CB GLN A 139 12.093 7.935 -27.678 1.00 0.00 C ATOM 2360 CG GLN A 139 13.281 8.182 -28.610 1.00 0.00 C ATOM 2361 CD GLN A 139 13.595 9.683 -28.653 1.00 0.00 C ATOM 2362 OE1 GLN A 139 13.717 10.314 -27.622 1.00 0.00 O ATOM 2363 NE2 GLN A 139 13.732 10.289 -29.807 1.00 0.00 N ATOM 0 H GLN A 139 10.604 5.930 -28.834 1.00 0.00 H new ATOM 0 HA GLN A 139 12.981 6.070 -26.967 1.00 0.00 H new ATOM 0 HB2 GLN A 139 11.167 8.248 -28.161 1.00 0.00 H new ATOM 0 HB3 GLN A 139 12.198 8.532 -26.772 1.00 0.00 H new ATOM 0 HG2 GLN A 139 14.152 7.627 -28.261 1.00 0.00 H new ATOM 0 HG3 GLN A 139 13.052 7.819 -29.612 1.00 0.00 H new ATOM 0 HE21 GLN A 139 13.630 9.763 -30.675 1.00 0.00 H new ATOM 0 HE22 GLN A 139 13.940 11.287 -29.837 1.00 0.00 H new ATOM 2372 N VAL A 140 11.404 6.370 -24.955 1.00 0.00 N ATOM 2373 CA VAL A 140 10.448 6.151 -23.824 1.00 0.00 C ATOM 2374 C VAL A 140 10.781 7.095 -22.655 1.00 0.00 C ATOM 2375 O VAL A 140 11.876 7.618 -22.572 1.00 0.00 O ATOM 2376 CB VAL A 140 10.642 4.685 -23.416 1.00 0.00 C ATOM 2377 CG1 VAL A 140 12.096 4.449 -22.992 1.00 0.00 C ATOM 2378 CG2 VAL A 140 9.712 4.354 -22.245 1.00 0.00 C ATOM 0 H VAL A 140 12.348 6.639 -24.678 1.00 0.00 H new ATOM 0 HA VAL A 140 9.416 6.357 -24.108 1.00 0.00 H new ATOM 0 HB VAL A 140 10.407 4.044 -24.265 1.00 0.00 H new ATOM 0 HG11 VAL A 140 12.226 3.406 -22.704 1.00 0.00 H new ATOM 0 HG12 VAL A 140 12.760 4.681 -23.825 1.00 0.00 H new ATOM 0 HG13 VAL A 140 12.337 5.092 -22.146 1.00 0.00 H new ATOM 0 HG21 VAL A 140 9.849 3.312 -21.955 1.00 0.00 H new ATOM 0 HG22 VAL A 140 9.947 5.001 -21.400 1.00 0.00 H new ATOM 0 HG23 VAL A 140 8.677 4.513 -22.546 1.00 0.00 H new ATOM 2388 N SER A 141 9.846 7.318 -21.749 1.00 0.00 N ATOM 2389 CA SER A 141 10.130 8.232 -20.594 1.00 0.00 C ATOM 2390 C SER A 141 9.004 8.169 -19.545 1.00 0.00 C ATOM 2391 O SER A 141 8.113 8.998 -19.541 1.00 0.00 O ATOM 2392 CB SER A 141 10.206 9.626 -21.210 1.00 0.00 C ATOM 2393 OG SER A 141 10.253 10.598 -20.173 1.00 0.00 O ATOM 0 H SER A 141 8.911 6.910 -21.762 1.00 0.00 H new ATOM 0 HA SER A 141 11.047 7.955 -20.075 1.00 0.00 H new ATOM 0 HB2 SER A 141 11.090 9.709 -21.842 1.00 0.00 H new ATOM 0 HB3 SER A 141 9.340 9.801 -21.849 1.00 0.00 H new ATOM 0 HG SER A 141 10.303 11.494 -20.567 1.00 0.00 H new ATOM 2399 N PHE A 142 9.037 7.200 -18.653 1.00 0.00 N ATOM 2400 CA PHE A 142 7.966 7.105 -17.610 1.00 0.00 C ATOM 2401 C PHE A 142 8.421 7.803 -16.312 1.00 0.00 C ATOM 2402 O PHE A 142 9.600 7.979 -16.072 1.00 0.00 O ATOM 2403 CB PHE A 142 7.744 5.594 -17.381 1.00 0.00 C ATOM 2404 CG PHE A 142 6.921 5.354 -16.126 1.00 0.00 C ATOM 2405 CD1 PHE A 142 5.538 5.580 -16.123 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.556 4.922 -14.960 1.00 0.00 C ATOM 2407 CE1 PHE A 142 4.797 5.365 -14.949 1.00 0.00 C ATOM 2408 CE2 PHE A 142 6.822 4.714 -13.798 1.00 0.00 C ATOM 2409 CZ PHE A 142 5.445 4.931 -13.783 1.00 0.00 C ATOM 0 H PHE A 142 9.755 6.477 -18.605 1.00 0.00 H new ATOM 0 HA PHE A 142 7.045 7.597 -17.922 1.00 0.00 H new ATOM 0 HB2 PHE A 142 7.236 5.162 -18.243 1.00 0.00 H new ATOM 0 HB3 PHE A 142 8.706 5.090 -17.292 1.00 0.00 H new ATOM 0 HD1 PHE A 142 5.043 5.919 -17.021 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.622 4.749 -14.961 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.730 5.534 -14.944 1.00 0.00 H new ATOM 0 HE2 PHE A 142 7.322 4.382 -12.900 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.880 4.766 -12.878 1.00 0.00 H new ATOM 2419 N HIS A 143 7.484 8.179 -15.469 1.00 0.00 N ATOM 2420 CA HIS A 143 7.838 8.840 -14.179 1.00 0.00 C ATOM 2421 C HIS A 143 6.989 8.228 -13.054 1.00 0.00 C ATOM 2422 O HIS A 143 7.511 7.652 -12.119 1.00 0.00 O ATOM 2423 CB HIS A 143 7.498 10.320 -14.378 1.00 0.00 C ATOM 2424 CG HIS A 143 8.576 11.175 -13.768 1.00 0.00 C ATOM 2425 ND1 HIS A 143 9.165 10.865 -12.551 1.00 0.00 N ATOM 2426 CD2 HIS A 143 9.180 12.331 -14.194 1.00 0.00 C ATOM 2427 CE1 HIS A 143 10.080 11.817 -12.291 1.00 0.00 C ATOM 2428 NE2 HIS A 143 10.130 12.735 -13.260 1.00 0.00 N ATOM 0 H HIS A 143 6.484 8.053 -15.625 1.00 0.00 H new ATOM 0 HA HIS A 143 8.886 8.711 -13.907 1.00 0.00 H new ATOM 0 HB2 HIS A 143 7.403 10.541 -15.441 1.00 0.00 H new ATOM 0 HB3 HIS A 143 6.536 10.547 -13.918 1.00 0.00 H new ATOM 0 HD2 HIS A 143 8.953 12.849 -15.114 1.00 0.00 H new ATOM 0 HE1 HIS A 143 10.699 11.836 -11.406 1.00 0.00 H new ATOM 0 HE2 HIS A 143 10.734 13.555 -13.306 1.00 0.00 H new ATOM 2436 N GLN A 144 5.681 8.334 -13.150 1.00 0.00 N ATOM 2437 CA GLN A 144 4.793 7.746 -12.104 1.00 0.00 C ATOM 2438 C GLN A 144 3.582 7.077 -12.775 1.00 0.00 C ATOM 2439 O GLN A 144 3.174 7.476 -13.851 1.00 0.00 O ATOM 2440 CB GLN A 144 4.352 8.929 -11.233 1.00 0.00 C ATOM 2441 CG GLN A 144 3.651 9.990 -12.091 1.00 0.00 C ATOM 2442 CD GLN A 144 4.627 11.133 -12.400 1.00 0.00 C ATOM 2443 OE1 GLN A 144 5.454 11.474 -11.578 1.00 0.00 O ATOM 2444 NE2 GLN A 144 4.571 11.746 -13.558 1.00 0.00 N ATOM 0 H GLN A 144 5.194 8.805 -13.912 1.00 0.00 H new ATOM 0 HA GLN A 144 5.295 6.983 -11.509 1.00 0.00 H new ATOM 0 HB2 GLN A 144 3.678 8.581 -10.450 1.00 0.00 H new ATOM 0 HB3 GLN A 144 5.218 9.367 -10.737 1.00 0.00 H new ATOM 0 HG2 GLN A 144 3.294 9.543 -13.019 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.777 10.377 -11.566 1.00 0.00 H new ATOM 0 HE21 GLN A 144 3.879 11.464 -14.252 1.00 0.00 H new ATOM 0 HE22 GLN A 144 5.220 12.505 -13.765 1.00 0.00 H new ATOM 2453 N CYS A 145 3.005 6.065 -12.160 1.00 0.00 N ATOM 2454 CA CYS A 145 1.820 5.391 -12.799 1.00 0.00 C ATOM 2455 C CYS A 145 0.501 6.000 -12.289 1.00 0.00 C ATOM 2456 O CYS A 145 0.451 6.573 -11.216 1.00 0.00 O ATOM 2457 CB CYS A 145 1.920 3.887 -12.460 1.00 0.00 C ATOM 2458 SG CYS A 145 1.688 3.579 -10.682 1.00 0.00 S ATOM 0 H CYS A 145 3.296 5.682 -11.260 1.00 0.00 H new ATOM 0 HA CYS A 145 1.825 5.535 -13.879 1.00 0.00 H new ATOM 0 HB2 CYS A 145 1.168 3.336 -13.026 1.00 0.00 H new ATOM 0 HB3 CYS A 145 2.894 3.508 -12.771 1.00 0.00 H new ATOM 2463 N VAL A 146 -0.567 5.887 -13.057 1.00 0.00 N ATOM 2464 CA VAL A 146 -1.881 6.476 -12.608 1.00 0.00 C ATOM 2465 C VAL A 146 -2.532 5.631 -11.496 1.00 0.00 C ATOM 2466 O VAL A 146 -3.309 6.151 -10.717 1.00 0.00 O ATOM 2467 CB VAL A 146 -2.793 6.541 -13.852 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -3.090 5.130 -14.381 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -4.111 7.226 -13.478 1.00 0.00 C ATOM 0 H VAL A 146 -0.587 5.419 -13.963 1.00 0.00 H new ATOM 0 HA VAL A 146 -1.724 7.468 -12.185 1.00 0.00 H new ATOM 0 HB VAL A 146 -2.282 7.108 -14.630 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -3.734 5.198 -15.258 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -2.156 4.640 -14.654 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -3.591 4.549 -13.607 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -4.758 7.274 -14.354 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -4.607 6.657 -12.692 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -3.908 8.236 -13.122 1.00 0.00 H new ATOM 2479 N HIS A 147 -2.236 4.339 -11.400 1.00 0.00 N ATOM 2480 CA HIS A 147 -2.869 3.502 -10.305 1.00 0.00 C ATOM 2481 C HIS A 147 -2.677 4.206 -8.943 1.00 0.00 C ATOM 2482 O HIS A 147 -3.601 4.321 -8.160 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.145 2.136 -10.307 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.351 1.411 -11.625 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.329 1.775 -12.547 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -1.701 0.329 -12.186 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -3.237 0.931 -13.592 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -2.265 0.033 -13.423 1.00 0.00 N ATOM 0 H HIS A 147 -1.598 3.838 -12.018 1.00 0.00 H new ATOM 0 HA HIS A 147 -3.938 3.371 -10.472 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -1.079 2.285 -10.133 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -2.519 1.522 -9.488 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -0.879 -0.206 -11.733 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.874 0.976 -14.463 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -1.993 -0.712 -14.064 1.00 0.00 H new ATOM 2496 N CYS A 148 -1.482 4.684 -8.667 1.00 0.00 N ATOM 2497 CA CYS A 148 -1.219 5.385 -7.381 1.00 0.00 C ATOM 2498 C CYS A 148 -0.235 6.553 -7.593 1.00 0.00 C ATOM 2499 O CYS A 148 0.274 6.743 -8.683 1.00 0.00 O ATOM 2500 CB CYS A 148 -0.596 4.303 -6.501 1.00 0.00 C ATOM 2501 SG CYS A 148 0.964 3.709 -7.217 1.00 0.00 S ATOM 0 H CYS A 148 -0.676 4.614 -9.288 1.00 0.00 H new ATOM 0 HA CYS A 148 -2.116 5.821 -6.942 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -0.415 4.700 -5.502 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -1.292 3.471 -6.392 1.00 0.00 H new ATOM 2506 N GLY A 149 0.067 7.311 -6.560 1.00 0.00 N ATOM 2507 CA GLY A 149 1.046 8.427 -6.705 1.00 0.00 C ATOM 2508 C GLY A 149 2.452 7.859 -6.457 1.00 0.00 C ATOM 2509 O GLY A 149 3.113 8.217 -5.502 1.00 0.00 O ATOM 0 H GLY A 149 -0.326 7.200 -5.625 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.982 8.864 -7.702 1.00 0.00 H new ATOM 0 HA3 GLY A 149 0.825 9.223 -5.993 1.00 0.00 H new ATOM 2513 N CYS A 150 2.906 6.958 -7.305 1.00 0.00 N ATOM 2514 CA CYS A 150 4.259 6.345 -7.116 1.00 0.00 C ATOM 2515 C CYS A 150 5.236 6.919 -8.151 1.00 0.00 C ATOM 2516 O CYS A 150 4.886 7.090 -9.301 1.00 0.00 O ATOM 2517 CB CYS A 150 4.017 4.839 -7.336 1.00 0.00 C ATOM 2518 SG CYS A 150 5.573 3.907 -7.371 1.00 0.00 S ATOM 0 H CYS A 150 2.393 6.623 -8.121 1.00 0.00 H new ATOM 0 HA CYS A 150 4.698 6.546 -6.139 1.00 0.00 H new ATOM 0 HB2 CYS A 150 3.379 4.453 -6.541 1.00 0.00 H new ATOM 0 HB3 CYS A 150 3.482 4.690 -8.274 1.00 0.00 H new ATOM 2523 N ARG A 151 6.462 7.207 -7.761 1.00 0.00 N ATOM 2524 CA ARG A 151 7.447 7.760 -8.751 1.00 0.00 C ATOM 2525 C ARG A 151 8.249 6.612 -9.383 1.00 0.00 C ATOM 2526 O ARG A 151 9.464 6.592 -9.323 1.00 0.00 O ATOM 2527 CB ARG A 151 8.371 8.696 -7.958 1.00 0.00 C ATOM 2528 CG ARG A 151 7.734 10.083 -7.861 1.00 0.00 C ATOM 2529 CD ARG A 151 8.601 10.982 -6.976 1.00 0.00 C ATOM 2530 NE ARG A 151 7.640 11.925 -6.325 1.00 0.00 N ATOM 2531 CZ ARG A 151 7.108 12.935 -6.995 1.00 0.00 C ATOM 2532 NH1 ARG A 151 7.402 13.152 -8.257 1.00 0.00 N ATOM 2533 NH2 ARG A 151 6.270 13.740 -6.393 1.00 0.00 N ATOM 0 H ARG A 151 6.818 7.085 -6.813 1.00 0.00 H new ATOM 0 HA ARG A 151 6.951 8.296 -9.560 1.00 0.00 H new ATOM 0 HB2 ARG A 151 8.544 8.293 -6.960 1.00 0.00 H new ATOM 0 HB3 ARG A 151 9.343 8.764 -8.447 1.00 0.00 H new ATOM 0 HG2 ARG A 151 7.635 10.520 -8.855 1.00 0.00 H new ATOM 0 HG3 ARG A 151 6.729 10.005 -7.445 1.00 0.00 H new ATOM 0 HD2 ARG A 151 9.146 10.398 -6.234 1.00 0.00 H new ATOM 0 HD3 ARG A 151 9.343 11.520 -7.566 1.00 0.00 H new ATOM 0 HE ARG A 151 7.390 11.787 -5.346 1.00 0.00 H new ATOM 0 HH11 ARG A 151 8.054 12.535 -8.742 1.00 0.00 H new ATOM 0 HH12 ARG A 151 6.979 13.937 -8.752 1.00 0.00 H new ATOM 0 HH21 ARG A 151 6.030 13.587 -5.413 1.00 0.00 H new ATOM 0 HH22 ARG A 151 5.856 14.520 -6.903 1.00 0.00 H new ATOM 2547 N GLY A 152 7.578 5.650 -9.989 1.00 0.00 N ATOM 2548 CA GLY A 152 8.302 4.512 -10.618 1.00 0.00 C ATOM 2549 C GLY A 152 9.099 3.751 -9.551 1.00 0.00 C ATOM 2550 O GLY A 152 10.207 4.128 -9.218 1.00 0.00 O ATOM 0 H GLY A 152 6.562 5.613 -10.069 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.593 3.841 -11.103 1.00 0.00 H new ATOM 0 HA3 GLY A 152 8.974 4.880 -11.393 1.00 0.00 H new ATOM 2554 N CYS A 153 8.551 2.679 -9.015 1.00 0.00 N ATOM 2555 CA CYS A 153 9.297 1.903 -7.973 1.00 0.00 C ATOM 2556 C CYS A 153 9.847 0.593 -8.570 1.00 0.00 C ATOM 2557 O CYS A 153 9.124 -0.160 -9.196 1.00 0.00 O ATOM 2558 CB CYS A 153 8.293 1.638 -6.829 1.00 0.00 C ATOM 2559 SG CYS A 153 6.974 0.497 -7.343 1.00 0.00 S ATOM 0 H CYS A 153 7.629 2.314 -9.253 1.00 0.00 H new ATOM 0 HA CYS A 153 10.161 2.453 -7.599 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.821 1.221 -5.971 1.00 0.00 H new ATOM 0 HB3 CYS A 153 7.853 2.581 -6.505 1.00 0.00 H new ATOM 2564 N ALA A 154 11.122 0.318 -8.387 1.00 0.00 N ATOM 2565 CA ALA A 154 11.709 -0.937 -8.948 1.00 0.00 C ATOM 2566 C ALA A 154 12.759 -1.502 -7.980 1.00 0.00 C ATOM 2567 O ALA A 154 13.542 -0.761 -7.416 1.00 0.00 O ATOM 2568 CB ALA A 154 12.365 -0.514 -10.260 1.00 0.00 C ATOM 0 H ALA A 154 11.776 0.910 -7.874 1.00 0.00 H new ATOM 0 HA ALA A 154 10.961 -1.715 -9.100 1.00 0.00 H new ATOM 0 HB1 ALA A 154 12.821 -1.382 -10.735 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.611 -0.091 -10.924 1.00 0.00 H new ATOM 0 HB3 ALA A 154 13.132 0.234 -10.059 1.00 0.00 H new ATOM 2574 N SER A 155 12.786 -2.803 -7.778 1.00 0.00 N ATOM 2575 CA SER A 155 13.795 -3.389 -6.835 1.00 0.00 C ATOM 2576 C SER A 155 14.948 -4.043 -7.618 1.00 0.00 C ATOM 2577 O SER A 155 16.104 -3.826 -7.310 1.00 0.00 O ATOM 2578 CB SER A 155 13.038 -4.438 -6.016 1.00 0.00 C ATOM 2579 OG SER A 155 11.678 -4.042 -5.888 1.00 0.00 O ATOM 0 H SER A 155 12.160 -3.476 -8.220 1.00 0.00 H new ATOM 0 HA SER A 155 14.239 -2.626 -6.196 1.00 0.00 H new ATOM 0 HB2 SER A 155 13.101 -5.411 -6.503 1.00 0.00 H new ATOM 0 HB3 SER A 155 13.492 -4.544 -5.031 1.00 0.00 H new ATOM 0 HG SER A 155 11.190 -4.712 -5.366 1.00 0.00 H new ATOM 2585 N THR A 156 14.648 -4.846 -8.623 1.00 0.00 N ATOM 2586 CA THR A 156 15.757 -5.508 -9.409 1.00 0.00 C ATOM 2587 C THR A 156 16.726 -4.453 -9.967 1.00 0.00 C ATOM 2588 O THR A 156 17.926 -4.652 -9.972 1.00 0.00 O ATOM 2589 CB THR A 156 15.085 -6.271 -10.568 1.00 0.00 C ATOM 2590 OG1 THR A 156 14.010 -7.076 -10.068 1.00 0.00 O ATOM 2591 CG2 THR A 156 16.124 -7.155 -11.269 1.00 0.00 C ATOM 0 H THR A 156 13.701 -5.070 -8.930 1.00 0.00 H new ATOM 0 HA THR A 156 16.333 -6.180 -8.773 1.00 0.00 H new ATOM 0 HB THR A 156 14.681 -5.555 -11.284 1.00 0.00 H new ATOM 0 HG1 THR A 156 13.588 -7.556 -10.811 1.00 0.00 H new ATOM 0 HG21 THR A 156 15.649 -7.695 -12.088 1.00 0.00 H new ATOM 0 HG22 THR A 156 16.927 -6.531 -11.662 1.00 0.00 H new ATOM 0 HG23 THR A 156 16.536 -7.868 -10.555 1.00 0.00 H new ATOM 2599 N ASP A 157 16.217 -3.334 -10.436 1.00 0.00 N ATOM 2600 CA ASP A 157 17.116 -2.278 -10.991 1.00 0.00 C ATOM 2601 C ASP A 157 16.564 -0.885 -10.669 1.00 0.00 C ATOM 2602 O ASP A 157 15.698 -0.795 -9.815 1.00 0.00 O ATOM 2603 CB ASP A 157 17.120 -2.516 -12.501 1.00 0.00 C ATOM 2604 CG ASP A 157 18.240 -3.493 -12.861 1.00 0.00 C ATOM 2605 OD1 ASP A 157 19.352 -3.284 -12.404 1.00 0.00 O ATOM 2606 OD2 ASP A 157 17.968 -4.436 -13.586 1.00 0.00 O ATOM 2607 OXT ASP A 157 17.018 0.067 -11.284 1.00 0.00 O ATOM 0 H ASP A 157 15.222 -3.111 -10.457 1.00 0.00 H new ATOM 0 HA ASP A 157 18.119 -2.326 -10.566 1.00 0.00 H new ATOM 0 HB2 ASP A 157 16.157 -2.917 -12.819 1.00 0.00 H new ATOM 0 HB3 ASP A 157 17.263 -1.573 -13.028 1.00 0.00 H new TER 2612 ASP A 157 HETATM 2613 ZN ZN A1000 1.295 1.484 -6.785 1.00 0.00 ZN HETATM 2614 ZN ZN A1001 5.048 1.689 -7.754 1.00 0.00 ZN HETATM 2615 ZN ZN A1002 2.190 1.345 -10.369 1.00 0.00 ZN