USER MOD reduce.3.24.130724 H: found=0, std=0, add=1668, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1668 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: B 92 SER OG : rot 160:sc=-0.00149 USER MOD Set 1.2: B 95 GLN : amide:sc= 0 X(o=-0.0015,f=-0.0015) USER MOD Set 2.1: B 5 SER OG : rot 180:sc= 0 USER MOD Set 2.2: B 40 TYR OH : rot -77:sc= 0.341 USER MOD Set 3.1: A 92 SER OG : rot 170:sc= -0.0846 USER MOD Set 3.2: A 95 GLN : amide:sc= 0 X(o=-0.085,f=-0.085) USER MOD Set 4.1: A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.2: B 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 5 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 40 TYR OH : rot -80:sc= 0.464 USER MOD Single : A 1 ALA N :NH3+ -111:sc= 0.0867 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -163:sc= -0.0172 (180deg=-0.304) USER MOD Single : A 3 LYS NZ :NH3+ -150:sc= -0.0216 (180deg=-0.462) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ -150:sc= -0.11 (180deg=-0.533) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 CYS SG : rot -39:sc= -1.94 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot -36:sc= 1.09 USER MOD Single : A 21 SER OG : rot 99:sc= 0.64 USER MOD Single : A 23 LYS NZ :NH3+ -102:sc= -0.72 (180deg=-2.05!) USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.119 USER MOD Single : A 27 MET CE :methyl -178:sc= 0 (180deg=-0.00253) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.554 USER MOD Single : A 42 LYS NZ :NH3+ 158:sc= -0.0159 (180deg=-0.227) USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.0681) USER MOD Single : A 56 GLN : amide:sc= -1.57 K(o=-1.6,f=-5.4!) USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 THR OG1 : rot 180:sc= -0.533 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 LYS NZ :NH3+ 158:sc= -0.0125 (180deg=-0.19) USER MOD Single : A 74 ASN : amide:sc= -0.149 K(o=-0.15,f=-1.4) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= -1.35 K(o=-1.3,f=-3.9!) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 LYS NZ :NH3+ -144:sc= -0.223 (180deg=-1.25!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= -5.33! C(o=-5.3!,f=-9.7!) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : B 1 ALA N :NH3+ -109:sc= 0.0754 (180deg=0) USER MOD Single : B 2 LYS NZ :NH3+ -163:sc= -0.0306 (180deg=-0.342) USER MOD Single : B 3 LYS NZ :NH3+ -150:sc= -0.0347 (180deg=-0.494) USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 LYS NZ :NH3+ -150:sc= -0.112 (180deg=-0.598) USER MOD Single : B 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 17 CYS SG : rot -31:sc= -2.05 USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot -59:sc= 1.2 USER MOD Single : B 21 SER OG : rot 133:sc= 0.404 USER MOD Single : B 23 LYS NZ :NH3+ -112:sc= -0.862 (180deg=-2.47!) USER MOD Single : B 24 THR OG1 : rot 180:sc= -0.0685 USER MOD Single : B 27 MET CE :methyl 158:sc= -0.0914 (180deg=-0.987) USER MOD Single : B 28 TYR OH : rot 180:sc= 0 USER MOD Single : B 31 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 33 SER OG : rot 180:sc= 0 USER MOD Single : B 34 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 THR OG1 : rot -150:sc= -0.554 USER MOD Single : B 42 LYS NZ :NH3+ 151:sc= -0.102 (180deg=-0.618) USER MOD Single : B 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 45 MET CE :methyl 159:sc= -0.0116 (180deg=-0.284) USER MOD Single : B 52 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 55 LYS NZ :NH3+ 158:sc= -0.0489 (180deg=-0.364) USER MOD Single : B 56 GLN : amide:sc= -0.584 X(o=-0.58,f=-0.98) USER MOD Single : B 57 TYR OH : rot 180:sc= 0 USER MOD Single : B 58 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 60 THR OG1 : rot 168:sc= -0.942 USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 72 LYS NZ :NH3+ 155:sc= -0.0438 (180deg=-0.253) USER MOD Single : B 74 ASN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : B 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 79 ASN : amide:sc= -1.37 K(o=-1.4,f=-5.2!) USER MOD Single : B 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 84 LYS NZ :NH3+ -145:sc= -0.24 (180deg=-1.24!) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 88 ASN : amide:sc= -4.99! C(o=-5!,f=-9.3!) USER MOD Single : B 89 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -10.263 14.789 0.417 1.00 5.35 N ATOM 2 CA ALA A 1 -9.396 13.679 -0.072 1.00 4.76 C ATOM 3 C ALA A 1 -10.234 12.408 -0.227 1.00 4.12 C ATOM 4 O ALA A 1 -11.274 12.260 0.383 1.00 3.94 O ATOM 5 CB ALA A 1 -8.272 13.428 0.936 1.00 4.81 C ATOM 0 H1 ALA A 1 -10.380 15.496 -0.337 1.00 5.35 H new ATOM 0 H2 ALA A 1 -11.194 14.410 0.684 1.00 5.35 H new ATOM 0 H3 ALA A 1 -9.821 15.236 1.245 1.00 5.35 H new ATOM 0 HA ALA A 1 -8.966 13.951 -1.036 1.00 4.76 H new ATOM 0 HB1 ALA A 1 -7.638 12.617 0.579 1.00 4.81 H new ATOM 0 HB2 ALA A 1 -7.675 14.333 1.048 1.00 4.81 H new ATOM 0 HB3 ALA A 1 -8.702 13.155 1.900 1.00 4.81 H new ATOM 13 N LYS A 2 -9.789 11.489 -1.041 1.00 4.22 N ATOM 14 CA LYS A 2 -10.560 10.229 -1.236 1.00 4.07 C ATOM 15 C LYS A 2 -10.714 9.511 0.108 1.00 3.66 C ATOM 16 O LYS A 2 -9.751 9.058 0.694 1.00 4.35 O ATOM 17 CB LYS A 2 -9.814 9.321 -2.215 1.00 4.82 C ATOM 18 CG LYS A 2 -9.323 10.147 -3.406 1.00 5.66 C ATOM 19 CD LYS A 2 -9.212 9.249 -4.639 1.00 6.60 C ATOM 20 CE LYS A 2 -8.652 10.057 -5.811 1.00 7.50 C ATOM 21 NZ LYS A 2 -9.634 11.106 -6.207 1.00 7.90 N ATOM 0 H LYS A 2 -8.925 11.557 -1.579 1.00 4.22 H new ATOM 0 HA LYS A 2 -11.546 10.465 -1.637 1.00 4.07 H new ATOM 0 HB2 LYS A 2 -8.969 8.846 -1.716 1.00 4.82 H new ATOM 0 HB3 LYS A 2 -10.471 8.522 -2.559 1.00 4.82 H new ATOM 0 HG2 LYS A 2 -10.013 10.968 -3.602 1.00 5.66 H new ATOM 0 HG3 LYS A 2 -8.354 10.592 -3.179 1.00 5.66 H new ATOM 0 HD2 LYS A 2 -8.563 8.400 -4.426 1.00 6.60 H new ATOM 0 HD3 LYS A 2 -10.191 8.845 -4.897 1.00 6.60 H new ATOM 0 HE2 LYS A 2 -7.705 10.518 -5.529 1.00 7.50 H new ATOM 0 HE3 LYS A 2 -8.447 9.399 -6.655 1.00 7.50 H new ATOM 0 HZ1 LYS A 2 -9.401 11.459 -7.157 1.00 7.90 H new ATOM 0 HZ2 LYS A 2 -10.592 10.700 -6.213 1.00 7.90 H new ATOM 0 HZ3 LYS A 2 -9.596 11.892 -5.527 1.00 7.90 H new ATOM 35 N LYS A 3 -11.918 9.406 0.601 1.00 2.85 N ATOM 36 CA LYS A 3 -12.129 8.720 1.906 1.00 2.88 C ATOM 37 C LYS A 3 -13.624 8.663 2.199 1.00 2.35 C ATOM 38 O LYS A 3 -14.095 7.815 2.929 1.00 2.83 O ATOM 39 CB LYS A 3 -11.418 9.500 3.015 1.00 3.31 C ATOM 40 CG LYS A 3 -10.386 8.599 3.695 1.00 3.76 C ATOM 41 CD LYS A 3 -9.673 9.383 4.797 1.00 4.46 C ATOM 42 CE LYS A 3 -10.001 8.766 6.158 1.00 5.18 C ATOM 43 NZ LYS A 3 -11.473 8.808 6.382 1.00 5.69 N ATOM 0 H LYS A 3 -12.763 9.765 0.157 1.00 2.85 H new ATOM 0 HA LYS A 3 -11.723 7.709 1.862 1.00 2.88 H new ATOM 0 HB2 LYS A 3 -10.929 10.380 2.598 1.00 3.31 H new ATOM 0 HB3 LYS A 3 -12.144 9.855 3.747 1.00 3.31 H new ATOM 0 HG2 LYS A 3 -10.875 7.721 4.117 1.00 3.76 H new ATOM 0 HG3 LYS A 3 -9.663 8.240 2.963 1.00 3.76 H new ATOM 0 HD2 LYS A 3 -8.596 9.368 4.629 1.00 4.46 H new ATOM 0 HD3 LYS A 3 -9.985 10.427 4.775 1.00 4.46 H new ATOM 0 HE2 LYS A 3 -9.646 7.736 6.197 1.00 5.18 H new ATOM 0 HE3 LYS A 3 -9.486 9.311 6.949 1.00 5.18 H new ATOM 0 HZ1 LYS A 3 -11.667 8.887 7.401 1.00 5.69 H new ATOM 0 HZ2 LYS A 3 -11.876 9.630 5.888 1.00 5.69 H new ATOM 0 HZ3 LYS A 3 -11.905 7.937 6.013 1.00 5.69 H new ATOM 57 N LYS A 4 -14.370 9.564 1.627 1.00 1.83 N ATOM 58 CA LYS A 4 -15.839 9.576 1.855 1.00 1.71 C ATOM 59 C LYS A 4 -16.541 9.979 0.559 1.00 1.52 C ATOM 60 O LYS A 4 -15.911 10.396 -0.393 1.00 2.02 O ATOM 61 CB LYS A 4 -16.178 10.585 2.955 1.00 2.12 C ATOM 62 CG LYS A 4 -15.095 10.549 4.035 1.00 2.54 C ATOM 63 CD LYS A 4 -15.555 11.356 5.250 1.00 3.17 C ATOM 64 CE LYS A 4 -14.546 11.186 6.387 1.00 3.65 C ATOM 65 NZ LYS A 4 -15.115 11.747 7.645 1.00 4.24 N ATOM 0 H LYS A 4 -14.023 10.297 1.008 1.00 1.83 H new ATOM 0 HA LYS A 4 -16.172 8.584 2.162 1.00 1.71 H new ATOM 0 HB2 LYS A 4 -16.252 11.587 2.533 1.00 2.12 H new ATOM 0 HB3 LYS A 4 -17.149 10.350 3.391 1.00 2.12 H new ATOM 0 HG2 LYS A 4 -14.892 9.518 4.326 1.00 2.54 H new ATOM 0 HG3 LYS A 4 -14.164 10.960 3.644 1.00 2.54 H new ATOM 0 HD2 LYS A 4 -15.648 12.410 4.986 1.00 3.17 H new ATOM 0 HD3 LYS A 4 -16.541 11.020 5.571 1.00 3.17 H new ATOM 0 HE2 LYS A 4 -14.308 10.131 6.522 1.00 3.65 H new ATOM 0 HE3 LYS A 4 -13.614 11.694 6.139 1.00 3.65 H new ATOM 0 HZ1 LYS A 4 -14.429 11.631 8.418 1.00 4.24 H new ATOM 0 HZ2 LYS A 4 -15.320 12.758 7.513 1.00 4.24 H new ATOM 0 HZ3 LYS A 4 -15.993 11.244 7.883 1.00 4.24 H new ATOM 79 N SER A 5 -17.838 9.857 0.524 1.00 1.49 N ATOM 80 CA SER A 5 -18.607 10.231 -0.699 1.00 1.72 C ATOM 81 C SER A 5 -18.534 9.106 -1.732 1.00 1.51 C ATOM 82 O SER A 5 -19.105 9.199 -2.800 1.00 1.76 O ATOM 83 CB SER A 5 -18.056 11.516 -1.299 1.00 2.08 C ATOM 84 OG SER A 5 -19.122 12.263 -1.872 1.00 2.67 O ATOM 0 H SER A 5 -18.405 9.511 1.298 1.00 1.49 H new ATOM 0 HA SER A 5 -19.648 10.390 -0.417 1.00 1.72 H new ATOM 0 HB2 SER A 5 -17.557 12.105 -0.530 1.00 2.08 H new ATOM 0 HB3 SER A 5 -17.309 11.285 -2.059 1.00 2.08 H new ATOM 0 HG SER A 5 -18.770 13.092 -2.258 1.00 2.67 H new ATOM 90 N LYS A 6 -17.842 8.045 -1.425 1.00 1.38 N ATOM 91 CA LYS A 6 -17.744 6.920 -2.396 1.00 1.30 C ATOM 92 C LYS A 6 -16.918 5.786 -1.788 1.00 1.16 C ATOM 93 O LYS A 6 -17.085 4.633 -2.130 1.00 1.17 O ATOM 94 CB LYS A 6 -17.067 7.409 -3.679 1.00 1.59 C ATOM 95 CG LYS A 6 -18.022 7.227 -4.862 1.00 2.31 C ATOM 96 CD LYS A 6 -17.353 7.730 -6.144 1.00 2.60 C ATOM 97 CE LYS A 6 -17.825 9.155 -6.442 1.00 3.41 C ATOM 98 NZ LYS A 6 -19.260 9.129 -6.842 1.00 3.78 N ATOM 0 H LYS A 6 -17.342 7.908 -0.547 1.00 1.38 H new ATOM 0 HA LYS A 6 -18.745 6.556 -2.627 1.00 1.30 H new ATOM 0 HB2 LYS A 6 -16.790 8.459 -3.579 1.00 1.59 H new ATOM 0 HB3 LYS A 6 -16.146 6.852 -3.852 1.00 1.59 H new ATOM 0 HG2 LYS A 6 -18.290 6.176 -4.968 1.00 2.31 H new ATOM 0 HG3 LYS A 6 -18.947 7.775 -4.683 1.00 2.31 H new ATOM 0 HD2 LYS A 6 -16.269 7.711 -6.033 1.00 2.60 H new ATOM 0 HD3 LYS A 6 -17.600 7.072 -6.977 1.00 2.60 H new ATOM 0 HE2 LYS A 6 -17.693 9.785 -5.562 1.00 3.41 H new ATOM 0 HE3 LYS A 6 -17.222 9.590 -7.239 1.00 3.41 H new ATOM 0 HZ1 LYS A 6 -19.451 9.912 -7.499 1.00 3.78 H new ATOM 0 HZ2 LYS A 6 -19.474 8.225 -7.309 1.00 3.78 H new ATOM 0 HZ3 LYS A 6 -19.858 9.232 -5.997 1.00 3.78 H new ATOM 112 N LEU A 7 -16.024 6.099 -0.894 1.00 1.10 N ATOM 113 CA LEU A 7 -15.188 5.033 -0.274 1.00 1.09 C ATOM 114 C LEU A 7 -15.804 4.589 1.055 1.00 1.01 C ATOM 115 O LEU A 7 -16.226 3.459 1.213 1.00 0.97 O ATOM 116 CB LEU A 7 -13.783 5.580 -0.018 1.00 1.23 C ATOM 117 CG LEU A 7 -12.870 5.217 -1.189 1.00 1.37 C ATOM 118 CD1 LEU A 7 -13.476 5.742 -2.492 1.00 2.05 C ATOM 119 CD2 LEU A 7 -11.495 5.853 -0.975 1.00 1.67 C ATOM 0 H LEU A 7 -15.835 7.046 -0.565 1.00 1.10 H new ATOM 0 HA LEU A 7 -15.139 4.179 -0.950 1.00 1.09 H new ATOM 0 HB2 LEU A 7 -13.820 6.662 0.105 1.00 1.23 H new ATOM 0 HB3 LEU A 7 -13.384 5.167 0.909 1.00 1.23 H new ATOM 0 HG LEU A 7 -12.767 4.133 -1.248 1.00 1.37 H new ATOM 0 HD11 LEU A 7 -12.825 5.483 -3.327 1.00 2.05 H new ATOM 0 HD12 LEU A 7 -14.457 5.292 -2.644 1.00 2.05 H new ATOM 0 HD13 LEU A 7 -13.579 6.826 -2.435 1.00 2.05 H new ATOM 0 HD21 LEU A 7 -10.841 5.596 -1.809 1.00 1.67 H new ATOM 0 HD22 LEU A 7 -11.600 6.936 -0.917 1.00 1.67 H new ATOM 0 HD23 LEU A 7 -11.062 5.480 -0.047 1.00 1.67 H new ATOM 131 N GLU A 8 -15.838 5.466 2.017 1.00 1.07 N ATOM 132 CA GLU A 8 -16.400 5.082 3.341 1.00 1.16 C ATOM 133 C GLU A 8 -17.925 5.008 3.269 1.00 1.10 C ATOM 134 O GLU A 8 -18.495 3.950 3.370 1.00 1.03 O ATOM 135 CB GLU A 8 -15.991 6.123 4.385 1.00 1.37 C ATOM 136 CG GLU A 8 -16.879 5.981 5.623 1.00 1.46 C ATOM 137 CD GLU A 8 -16.164 6.576 6.837 1.00 1.74 C ATOM 138 OE1 GLU A 8 -15.065 6.132 7.129 1.00 2.13 O ATOM 139 OE2 GLU A 8 -16.726 7.465 7.454 1.00 2.33 O ATOM 0 H GLU A 8 -15.503 6.427 1.946 1.00 1.07 H new ATOM 0 HA GLU A 8 -16.012 4.103 3.621 1.00 1.16 H new ATOM 0 HB2 GLU A 8 -14.944 5.988 4.658 1.00 1.37 H new ATOM 0 HB3 GLU A 8 -16.085 7.126 3.970 1.00 1.37 H new ATOM 0 HG2 GLU A 8 -17.829 6.490 5.462 1.00 1.46 H new ATOM 0 HG3 GLU A 8 -17.107 4.930 5.801 1.00 1.46 H new ATOM 146 N ILE A 9 -18.574 6.127 3.088 1.00 1.18 N ATOM 147 CA ILE A 9 -20.073 6.124 3.027 1.00 1.23 C ATOM 148 C ILE A 9 -20.520 4.799 2.396 1.00 1.11 C ATOM 149 O ILE A 9 -21.437 4.147 2.857 1.00 1.20 O ATOM 150 CB ILE A 9 -20.582 7.300 2.180 1.00 1.31 C ATOM 151 CG1 ILE A 9 -19.996 8.627 2.697 1.00 1.91 C ATOM 152 CG2 ILE A 9 -22.110 7.353 2.248 1.00 1.86 C ATOM 153 CD1 ILE A 9 -20.829 9.163 3.867 1.00 2.19 C ATOM 0 H ILE A 9 -18.137 7.042 2.980 1.00 1.18 H new ATOM 0 HA ILE A 9 -20.483 6.229 4.031 1.00 1.23 H new ATOM 0 HB ILE A 9 -20.264 7.155 1.147 1.00 1.31 H new ATOM 0 HG12 ILE A 9 -18.965 8.476 3.016 1.00 1.91 H new ATOM 0 HG13 ILE A 9 -19.976 9.361 1.891 1.00 1.91 H new ATOM 0 HG21 ILE A 9 -22.472 8.187 1.647 1.00 1.86 H new ATOM 0 HG22 ILE A 9 -22.524 6.421 1.862 1.00 1.86 H new ATOM 0 HG23 ILE A 9 -22.424 7.488 3.283 1.00 1.86 H new ATOM 0 HD11 ILE A 9 -20.400 10.101 4.219 1.00 2.19 H new ATOM 0 HD12 ILE A 9 -21.853 9.334 3.536 1.00 2.19 H new ATOM 0 HD13 ILE A 9 -20.827 8.435 4.679 1.00 2.19 H new ATOM 165 N ILE A 10 -19.851 4.397 1.353 1.00 0.96 N ATOM 166 CA ILE A 10 -20.193 3.107 0.683 1.00 0.91 C ATOM 167 C ILE A 10 -19.989 1.963 1.674 1.00 0.82 C ATOM 168 O ILE A 10 -20.888 1.192 1.936 1.00 0.85 O ATOM 169 CB ILE A 10 -19.324 2.911 -0.571 1.00 0.92 C ATOM 170 CG1 ILE A 10 -20.137 3.371 -1.789 1.00 1.11 C ATOM 171 CG2 ILE A 10 -18.940 1.429 -0.736 1.00 0.92 C ATOM 172 CD1 ILE A 10 -19.277 3.342 -3.056 1.00 1.39 C ATOM 0 H ILE A 10 -19.076 4.909 0.931 1.00 0.96 H new ATOM 0 HA ILE A 10 -21.236 3.121 0.366 1.00 0.91 H new ATOM 0 HB ILE A 10 -18.407 3.492 -0.478 1.00 0.92 H new ATOM 0 HG12 ILE A 10 -21.005 2.725 -1.918 1.00 1.11 H new ATOM 0 HG13 ILE A 10 -20.513 4.380 -1.622 1.00 1.11 H new ATOM 0 HG21 ILE A 10 -18.325 1.310 -1.628 1.00 0.92 H new ATOM 0 HG22 ILE A 10 -18.379 1.099 0.138 1.00 0.92 H new ATOM 0 HG23 ILE A 10 -19.844 0.828 -0.835 1.00 0.92 H new ATOM 0 HD11 ILE A 10 -19.872 3.672 -3.907 1.00 1.39 H new ATOM 0 HD12 ILE A 10 -18.423 4.007 -2.931 1.00 1.39 H new ATOM 0 HD13 ILE A 10 -18.923 2.326 -3.232 1.00 1.39 H new ATOM 184 N GLN A 11 -18.813 1.847 2.231 1.00 0.77 N ATOM 185 CA GLN A 11 -18.568 0.752 3.207 1.00 0.74 C ATOM 186 C GLN A 11 -19.727 0.713 4.206 1.00 0.80 C ATOM 187 O GLN A 11 -20.208 -0.340 4.575 1.00 0.78 O ATOM 188 CB GLN A 11 -17.259 1.013 3.953 1.00 0.77 C ATOM 189 CG GLN A 11 -16.824 -0.259 4.682 1.00 1.36 C ATOM 190 CD GLN A 11 -15.641 0.057 5.599 1.00 1.62 C ATOM 191 OE1 GLN A 11 -14.504 -0.184 5.246 1.00 2.31 O ATOM 192 NE2 GLN A 11 -15.862 0.593 6.768 1.00 1.94 N ATOM 0 H GLN A 11 -18.018 2.460 2.052 1.00 0.77 H new ATOM 0 HA GLN A 11 -18.497 -0.201 2.683 1.00 0.74 H new ATOM 0 HB2 GLN A 11 -16.485 1.326 3.252 1.00 0.77 H new ATOM 0 HB3 GLN A 11 -17.391 1.827 4.666 1.00 0.77 H new ATOM 0 HG2 GLN A 11 -17.654 -0.658 5.266 1.00 1.36 H new ATOM 0 HG3 GLN A 11 -16.544 -1.026 3.961 1.00 1.36 H new ATOM 0 HE21 GLN A 11 -16.817 0.795 7.064 1.00 1.94 H new ATOM 0 HE22 GLN A 11 -15.080 0.810 7.386 1.00 1.94 H new ATOM 201 N ALA A 12 -20.196 1.858 4.627 1.00 0.90 N ATOM 202 CA ALA A 12 -21.342 1.892 5.578 1.00 0.98 C ATOM 203 C ALA A 12 -22.582 1.312 4.893 1.00 0.94 C ATOM 204 O ALA A 12 -23.406 0.674 5.514 1.00 0.94 O ATOM 205 CB ALA A 12 -21.620 3.336 5.999 1.00 1.11 C ATOM 0 H ALA A 12 -19.834 2.771 4.352 1.00 0.90 H new ATOM 0 HA ALA A 12 -21.100 1.301 6.461 1.00 0.98 H new ATOM 0 HB1 ALA A 12 -22.459 3.357 6.695 1.00 1.11 H new ATOM 0 HB2 ALA A 12 -20.736 3.750 6.484 1.00 1.11 H new ATOM 0 HB3 ALA A 12 -21.863 3.931 5.119 1.00 1.11 H new ATOM 211 N ILE A 13 -22.709 1.523 3.609 1.00 0.90 N ATOM 212 CA ILE A 13 -23.887 0.972 2.881 1.00 0.86 C ATOM 213 C ILE A 13 -23.734 -0.546 2.772 1.00 0.75 C ATOM 214 O ILE A 13 -24.680 -1.295 2.934 1.00 0.72 O ATOM 215 CB ILE A 13 -23.975 1.592 1.486 1.00 0.87 C ATOM 216 CG1 ILE A 13 -24.591 2.990 1.597 1.00 1.03 C ATOM 217 CG2 ILE A 13 -24.859 0.719 0.592 1.00 0.85 C ATOM 218 CD1 ILE A 13 -23.936 3.934 0.586 1.00 1.06 C ATOM 0 H ILE A 13 -22.050 2.051 3.036 1.00 0.90 H new ATOM 0 HA ILE A 13 -24.801 1.210 3.424 1.00 0.86 H new ATOM 0 HB ILE A 13 -22.977 1.660 1.052 1.00 0.87 H new ATOM 0 HG12 ILE A 13 -25.665 2.938 1.416 1.00 1.03 H new ATOM 0 HG13 ILE A 13 -24.456 3.376 2.607 1.00 1.03 H new ATOM 0 HG21 ILE A 13 -24.921 1.162 -0.402 1.00 0.85 H new ATOM 0 HG22 ILE A 13 -24.428 -0.280 0.518 1.00 0.85 H new ATOM 0 HG23 ILE A 13 -25.858 0.652 1.022 1.00 0.85 H new ATOM 0 HD11 ILE A 13 -24.381 4.925 0.673 1.00 1.06 H new ATOM 0 HD12 ILE A 13 -22.867 3.997 0.787 1.00 1.06 H new ATOM 0 HD13 ILE A 13 -24.094 3.553 -0.423 1.00 1.06 H new ATOM 230 N LEU A 14 -22.542 -1.000 2.509 1.00 0.74 N ATOM 231 CA LEU A 14 -22.298 -2.462 2.393 1.00 0.65 C ATOM 232 C LEU A 14 -22.491 -3.119 3.760 1.00 0.67 C ATOM 233 O LEU A 14 -23.078 -4.174 3.881 1.00 0.64 O ATOM 234 CB LEU A 14 -20.857 -2.686 1.933 1.00 0.65 C ATOM 235 CG LEU A 14 -20.841 -3.515 0.650 1.00 0.67 C ATOM 236 CD1 LEU A 14 -19.405 -3.626 0.135 1.00 0.61 C ATOM 237 CD2 LEU A 14 -21.388 -4.913 0.943 1.00 1.04 C ATOM 0 H LEU A 14 -21.719 -0.414 2.368 1.00 0.74 H new ATOM 0 HA LEU A 14 -22.994 -2.897 1.676 1.00 0.65 H new ATOM 0 HB2 LEU A 14 -20.368 -1.727 1.762 1.00 0.65 H new ATOM 0 HB3 LEU A 14 -20.293 -3.197 2.713 1.00 0.65 H new ATOM 0 HG LEU A 14 -21.461 -3.032 -0.105 1.00 0.67 H new ATOM 0 HD11 LEU A 14 -19.392 -4.217 -0.781 1.00 0.61 H new ATOM 0 HD12 LEU A 14 -19.014 -2.629 -0.071 1.00 0.61 H new ATOM 0 HD13 LEU A 14 -18.785 -4.110 0.889 1.00 0.61 H new ATOM 0 HD21 LEU A 14 -21.378 -5.507 0.029 1.00 1.04 H new ATOM 0 HD22 LEU A 14 -20.766 -5.396 1.697 1.00 1.04 H new ATOM 0 HD23 LEU A 14 -22.410 -4.834 1.313 1.00 1.04 H new ATOM 249 N GLU A 15 -21.985 -2.504 4.786 1.00 0.75 N ATOM 250 CA GLU A 15 -22.121 -3.091 6.144 1.00 0.80 C ATOM 251 C GLU A 15 -23.588 -3.093 6.577 1.00 0.83 C ATOM 252 O GLU A 15 -24.073 -4.045 7.152 1.00 0.85 O ATOM 253 CB GLU A 15 -21.295 -2.280 7.141 1.00 0.87 C ATOM 254 CG GLU A 15 -20.247 -3.189 7.779 1.00 0.89 C ATOM 255 CD GLU A 15 -19.550 -2.444 8.919 1.00 1.01 C ATOM 256 OE1 GLU A 15 -20.221 -1.692 9.606 1.00 1.43 O ATOM 257 OE2 GLU A 15 -18.357 -2.638 9.085 1.00 1.53 O ATOM 0 H GLU A 15 -21.482 -1.618 4.744 1.00 0.75 H new ATOM 0 HA GLU A 15 -21.758 -4.118 6.120 1.00 0.80 H new ATOM 0 HB2 GLU A 15 -20.810 -1.444 6.636 1.00 0.87 H new ATOM 0 HB3 GLU A 15 -21.942 -1.856 7.909 1.00 0.87 H new ATOM 0 HG2 GLU A 15 -20.719 -4.096 8.158 1.00 0.89 H new ATOM 0 HG3 GLU A 15 -19.516 -3.499 7.032 1.00 0.89 H new ATOM 264 N ALA A 16 -24.304 -2.042 6.313 1.00 0.85 N ATOM 265 CA ALA A 16 -25.727 -2.015 6.726 1.00 0.88 C ATOM 266 C ALA A 16 -26.460 -3.122 5.989 1.00 0.83 C ATOM 267 O ALA A 16 -27.374 -3.729 6.509 1.00 0.86 O ATOM 268 CB ALA A 16 -26.350 -0.670 6.361 1.00 0.91 C ATOM 0 H ALA A 16 -23.969 -1.207 5.833 1.00 0.85 H new ATOM 0 HA ALA A 16 -25.802 -2.159 7.804 1.00 0.88 H new ATOM 0 HB1 ALA A 16 -27.396 -0.658 6.668 1.00 0.91 H new ATOM 0 HB2 ALA A 16 -25.813 0.130 6.871 1.00 0.91 H new ATOM 0 HB3 ALA A 16 -26.286 -0.520 5.283 1.00 0.91 H new ATOM 274 N CYS A 17 -26.069 -3.391 4.776 1.00 0.76 N ATOM 275 CA CYS A 17 -26.750 -4.453 4.019 1.00 0.72 C ATOM 276 C CYS A 17 -26.234 -5.827 4.468 1.00 0.71 C ATOM 277 O CYS A 17 -26.816 -6.844 4.165 1.00 0.71 O ATOM 278 CB CYS A 17 -26.506 -4.243 2.527 1.00 0.65 C ATOM 279 SG CYS A 17 -24.894 -4.912 2.057 1.00 0.81 S ATOM 0 H CYS A 17 -25.310 -2.919 4.285 1.00 0.76 H new ATOM 0 HA CYS A 17 -27.822 -4.413 4.210 1.00 0.72 H new ATOM 0 HB2 CYS A 17 -27.292 -4.731 1.951 1.00 0.65 H new ATOM 0 HB3 CYS A 17 -26.550 -3.180 2.290 1.00 0.65 H new ATOM 0 HG CYS A 17 -24.031 -4.667 2.998 1.00 0.81 H new ATOM 285 N LYS A 18 -25.144 -5.882 5.184 1.00 0.72 N ATOM 286 CA LYS A 18 -24.621 -7.208 5.630 1.00 0.73 C ATOM 287 C LYS A 18 -25.730 -8.043 6.295 1.00 0.83 C ATOM 288 O LYS A 18 -25.503 -9.171 6.682 1.00 0.87 O ATOM 289 CB LYS A 18 -23.476 -7.005 6.624 1.00 0.78 C ATOM 290 CG LYS A 18 -24.031 -6.882 8.047 1.00 1.34 C ATOM 291 CD LYS A 18 -22.985 -6.226 8.947 1.00 1.96 C ATOM 292 CE LYS A 18 -21.752 -7.128 9.044 1.00 2.36 C ATOM 293 NZ LYS A 18 -20.866 -6.640 10.137 1.00 2.97 N ATOM 0 H LYS A 18 -24.596 -5.074 5.478 1.00 0.72 H new ATOM 0 HA LYS A 18 -24.260 -7.744 4.752 1.00 0.73 H new ATOM 0 HB2 LYS A 18 -22.782 -7.843 6.567 1.00 0.78 H new ATOM 0 HB3 LYS A 18 -22.914 -6.107 6.365 1.00 0.78 H new ATOM 0 HG2 LYS A 18 -24.945 -6.289 8.042 1.00 1.34 H new ATOM 0 HG3 LYS A 18 -24.292 -7.867 8.433 1.00 1.34 H new ATOM 0 HD2 LYS A 18 -22.705 -5.252 8.546 1.00 1.96 H new ATOM 0 HD3 LYS A 18 -23.401 -6.054 9.940 1.00 1.96 H new ATOM 0 HE2 LYS A 18 -22.055 -8.157 9.239 1.00 2.36 H new ATOM 0 HE3 LYS A 18 -21.213 -7.128 8.097 1.00 2.36 H new ATOM 0 HZ1 LYS A 18 -20.028 -7.252 10.204 1.00 2.97 H new ATOM 0 HZ2 LYS A 18 -20.567 -5.665 9.933 1.00 2.97 H new ATOM 0 HZ3 LYS A 18 -21.383 -6.662 11.039 1.00 2.97 H new ATOM 307 N SER A 19 -26.919 -7.514 6.448 1.00 0.88 N ATOM 308 CA SER A 19 -27.994 -8.315 7.102 1.00 0.99 C ATOM 309 C SER A 19 -29.376 -7.809 6.675 1.00 1.05 C ATOM 310 O SER A 19 -30.336 -7.913 7.413 1.00 1.21 O ATOM 311 CB SER A 19 -27.861 -8.191 8.620 1.00 1.07 C ATOM 312 OG SER A 19 -28.988 -8.798 9.241 1.00 1.10 O ATOM 0 H SER A 19 -27.187 -6.575 6.152 1.00 0.88 H new ATOM 0 HA SER A 19 -27.891 -9.357 6.799 1.00 0.99 H new ATOM 0 HB2 SER A 19 -26.943 -8.672 8.957 1.00 1.07 H new ATOM 0 HB3 SER A 19 -27.795 -7.141 8.906 1.00 1.07 H new ATOM 0 HG SER A 19 -29.788 -8.632 8.700 1.00 1.10 H new ATOM 318 N GLY A 20 -29.497 -7.276 5.489 1.00 0.94 N ATOM 319 CA GLY A 20 -30.826 -6.785 5.028 1.00 1.01 C ATOM 320 C GLY A 20 -31.258 -5.599 5.886 1.00 1.07 C ATOM 321 O GLY A 20 -31.675 -5.762 7.015 1.00 1.15 O ATOM 0 H GLY A 20 -28.735 -7.160 4.821 1.00 0.94 H new ATOM 0 HA2 GLY A 20 -30.772 -6.489 3.980 1.00 1.01 H new ATOM 0 HA3 GLY A 20 -31.564 -7.584 5.096 1.00 1.01 H new ATOM 325 N SER A 21 -31.137 -4.403 5.375 1.00 1.06 N ATOM 326 CA SER A 21 -31.514 -3.211 6.182 1.00 1.14 C ATOM 327 C SER A 21 -32.069 -2.108 5.257 1.00 1.14 C ATOM 328 O SER A 21 -31.465 -1.805 4.249 1.00 1.07 O ATOM 329 CB SER A 21 -30.255 -2.697 6.871 1.00 1.14 C ATOM 330 OG SER A 21 -29.547 -3.795 7.430 1.00 1.09 O ATOM 0 H SER A 21 -30.794 -4.202 4.436 1.00 1.06 H new ATOM 0 HA SER A 21 -32.277 -3.477 6.914 1.00 1.14 H new ATOM 0 HB2 SER A 21 -29.625 -2.169 6.156 1.00 1.14 H new ATOM 0 HB3 SER A 21 -30.519 -1.983 7.652 1.00 1.14 H new ATOM 0 HG SER A 21 -28.823 -4.060 6.825 1.00 1.09 H new ATOM 336 N PRO A 22 -33.203 -1.495 5.580 1.00 1.23 N ATOM 337 CA PRO A 22 -33.770 -0.408 4.728 1.00 1.26 C ATOM 338 C PRO A 22 -32.762 0.723 4.501 1.00 1.26 C ATOM 339 O PRO A 22 -31.802 0.862 5.232 1.00 1.25 O ATOM 340 CB PRO A 22 -34.967 0.132 5.516 1.00 1.35 C ATOM 341 CG PRO A 22 -35.293 -0.887 6.555 1.00 1.47 C ATOM 342 CD PRO A 22 -34.056 -1.765 6.755 1.00 1.34 C ATOM 0 HA PRO A 22 -34.039 -0.789 3.743 1.00 1.26 H new ATOM 0 HB2 PRO A 22 -34.726 1.090 5.976 1.00 1.35 H new ATOM 0 HB3 PRO A 22 -35.819 0.300 4.858 1.00 1.35 H new ATOM 0 HG2 PRO A 22 -35.573 -0.402 7.491 1.00 1.47 H new ATOM 0 HG3 PRO A 22 -36.144 -1.492 6.243 1.00 1.47 H new ATOM 0 HD2 PRO A 22 -33.541 -1.516 7.683 1.00 1.34 H new ATOM 0 HD3 PRO A 22 -34.325 -2.820 6.813 1.00 1.34 H new ATOM 350 N LYS A 23 -32.977 1.538 3.506 1.00 1.27 N ATOM 351 CA LYS A 23 -32.034 2.665 3.249 1.00 1.28 C ATOM 352 C LYS A 23 -31.948 3.542 4.509 1.00 1.33 C ATOM 353 O LYS A 23 -30.941 4.168 4.771 1.00 1.35 O ATOM 354 CB LYS A 23 -32.559 3.498 2.067 1.00 1.31 C ATOM 355 CG LYS A 23 -31.451 4.395 1.494 1.00 1.27 C ATOM 356 CD LYS A 23 -32.059 5.744 1.101 1.00 1.83 C ATOM 357 CE LYS A 23 -33.212 5.519 0.122 1.00 1.76 C ATOM 358 NZ LYS A 23 -34.510 5.645 0.845 1.00 2.13 N ATOM 0 H LYS A 23 -33.764 1.474 2.860 1.00 1.27 H new ATOM 0 HA LYS A 23 -31.043 2.280 3.008 1.00 1.28 H new ATOM 0 HB2 LYS A 23 -32.935 2.835 1.288 1.00 1.31 H new ATOM 0 HB3 LYS A 23 -33.398 4.113 2.394 1.00 1.31 H new ATOM 0 HG2 LYS A 23 -30.662 4.538 2.232 1.00 1.27 H new ATOM 0 HG3 LYS A 23 -30.993 3.921 0.626 1.00 1.27 H new ATOM 0 HD2 LYS A 23 -32.418 6.265 1.988 1.00 1.83 H new ATOM 0 HD3 LYS A 23 -31.299 6.378 0.645 1.00 1.83 H new ATOM 0 HE2 LYS A 23 -33.163 6.247 -0.688 1.00 1.76 H new ATOM 0 HE3 LYS A 23 -33.131 4.531 -0.332 1.00 1.76 H new ATOM 0 HZ1 LYS A 23 -34.895 4.698 1.035 1.00 2.13 H new ATOM 0 HZ2 LYS A 23 -34.359 6.144 1.745 1.00 2.13 H new ATOM 0 HZ3 LYS A 23 -35.183 6.181 0.260 1.00 2.13 H new ATOM 372 N THR A 24 -33.000 3.587 5.289 1.00 1.35 N ATOM 373 CA THR A 24 -32.999 4.416 6.537 1.00 1.41 C ATOM 374 C THR A 24 -32.042 3.847 7.599 1.00 1.43 C ATOM 375 O THR A 24 -31.336 4.582 8.259 1.00 1.48 O ATOM 376 CB THR A 24 -34.417 4.455 7.112 1.00 1.40 C ATOM 377 OG1 THR A 24 -34.871 3.128 7.334 1.00 1.42 O ATOM 378 CG2 THR A 24 -35.350 5.159 6.126 1.00 1.42 C ATOM 0 H THR A 24 -33.868 3.081 5.114 1.00 1.35 H new ATOM 0 HA THR A 24 -32.658 5.418 6.277 1.00 1.41 H new ATOM 0 HB THR A 24 -34.413 5.001 8.056 1.00 1.40 H new ATOM 0 HG1 THR A 24 -35.778 3.150 7.704 1.00 1.42 H new ATOM 0 HG21 THR A 24 -36.359 5.186 6.536 1.00 1.42 H new ATOM 0 HG22 THR A 24 -34.999 6.177 5.957 1.00 1.42 H new ATOM 0 HG23 THR A 24 -35.357 4.616 5.181 1.00 1.42 H new ATOM 386 N ARG A 25 -32.027 2.553 7.784 1.00 1.40 N ATOM 387 CA ARG A 25 -31.134 1.943 8.821 1.00 1.43 C ATOM 388 C ARG A 25 -29.671 2.225 8.472 1.00 1.44 C ATOM 389 O ARG A 25 -28.765 1.918 9.220 1.00 1.47 O ATOM 390 CB ARG A 25 -31.367 0.427 8.834 1.00 1.39 C ATOM 391 CG ARG A 25 -32.183 0.010 10.064 1.00 1.72 C ATOM 392 CD ARG A 25 -31.243 -0.190 11.253 1.00 1.56 C ATOM 393 NE ARG A 25 -32.030 -0.615 12.444 1.00 2.13 N ATOM 394 CZ ARG A 25 -31.422 -0.870 13.572 1.00 2.45 C ATOM 395 NH1 ARG A 25 -30.126 -0.747 13.656 1.00 2.53 N ATOM 396 NH2 ARG A 25 -32.112 -1.247 14.614 1.00 3.15 N ATOM 0 H ARG A 25 -32.596 1.887 7.261 1.00 1.40 H new ATOM 0 HA ARG A 25 -31.357 2.369 9.799 1.00 1.43 H new ATOM 0 HB2 ARG A 25 -31.891 0.128 7.926 1.00 1.39 H new ATOM 0 HB3 ARG A 25 -30.409 -0.092 8.835 1.00 1.39 H new ATOM 0 HG2 ARG A 25 -32.925 0.773 10.298 1.00 1.72 H new ATOM 0 HG3 ARG A 25 -32.727 -0.911 9.858 1.00 1.72 H new ATOM 0 HD2 ARG A 25 -30.492 -0.942 11.013 1.00 1.56 H new ATOM 0 HD3 ARG A 25 -30.710 0.736 11.468 1.00 1.56 H new ATOM 0 HE ARG A 25 -33.044 -0.707 12.379 1.00 2.13 H new ATOM 0 HH11 ARG A 25 -29.588 -0.452 12.841 1.00 2.53 H new ATOM 0 HH12 ARG A 25 -29.651 -0.946 14.536 1.00 2.53 H new ATOM 0 HH21 ARG A 25 -33.125 -1.342 14.547 1.00 3.15 H new ATOM 0 HH22 ARG A 25 -31.638 -1.446 15.495 1.00 3.15 H new ATOM 410 N ILE A 26 -29.449 2.798 7.331 1.00 1.41 N ATOM 411 CA ILE A 26 -28.060 3.096 6.910 1.00 1.41 C ATOM 412 C ILE A 26 -27.634 4.462 7.476 1.00 1.49 C ATOM 413 O ILE A 26 -26.464 4.783 7.550 1.00 1.50 O ATOM 414 CB ILE A 26 -27.998 3.028 5.384 1.00 1.34 C ATOM 415 CG1 ILE A 26 -28.631 1.693 4.957 1.00 1.28 C ATOM 416 CG2 ILE A 26 -26.544 3.104 4.915 1.00 1.34 C ATOM 417 CD1 ILE A 26 -28.038 1.198 3.635 1.00 0.96 C ATOM 0 H ILE A 26 -30.173 3.075 6.668 1.00 1.41 H new ATOM 0 HA ILE A 26 -27.354 2.365 7.304 1.00 1.41 H new ATOM 0 HB ILE A 26 -28.536 3.864 4.937 1.00 1.34 H new ATOM 0 HG12 ILE A 26 -28.469 0.946 5.734 1.00 1.28 H new ATOM 0 HG13 ILE A 26 -29.709 1.816 4.852 1.00 1.28 H new ATOM 0 HG21 ILE A 26 -26.510 3.055 3.827 1.00 1.34 H new ATOM 0 HG22 ILE A 26 -26.102 4.042 5.250 1.00 1.34 H new ATOM 0 HG23 ILE A 26 -25.982 2.269 5.334 1.00 1.34 H new ATOM 0 HD11 ILE A 26 -28.505 0.253 3.358 1.00 0.96 H new ATOM 0 HD12 ILE A 26 -28.223 1.936 2.854 1.00 0.96 H new ATOM 0 HD13 ILE A 26 -26.964 1.053 3.750 1.00 0.96 H new ATOM 429 N MET A 27 -28.581 5.245 7.930 1.00 1.55 N ATOM 430 CA MET A 27 -28.249 6.568 8.551 1.00 1.64 C ATOM 431 C MET A 27 -27.552 6.325 9.884 1.00 1.70 C ATOM 432 O MET A 27 -26.598 6.996 10.222 1.00 1.74 O ATOM 433 CB MET A 27 -29.535 7.383 8.715 1.00 1.72 C ATOM 434 CG MET A 27 -29.230 8.784 9.239 1.00 2.02 C ATOM 435 SD MET A 27 -30.551 9.305 10.360 1.00 2.29 S ATOM 436 CE MET A 27 -31.794 9.681 9.098 1.00 1.90 C ATOM 0 H MET A 27 -29.576 5.025 7.898 1.00 1.55 H new ATOM 0 HA MET A 27 -27.573 7.139 7.915 1.00 1.64 H new ATOM 0 HB2 MET A 27 -30.050 7.453 7.757 1.00 1.72 H new ATOM 0 HB3 MET A 27 -30.209 6.872 9.403 1.00 1.72 H new ATOM 0 HG2 MET A 27 -28.272 8.789 9.760 1.00 2.02 H new ATOM 0 HG3 MET A 27 -29.145 9.485 8.408 1.00 2.02 H new ATOM 0 HE1 MET A 27 -32.696 10.061 9.578 1.00 1.90 H new ATOM 0 HE2 MET A 27 -31.402 10.434 8.414 1.00 1.90 H new ATOM 0 HE3 MET A 27 -32.033 8.775 8.541 1.00 1.90 H new ATOM 446 N TYR A 28 -27.985 5.355 10.639 1.00 1.72 N ATOM 447 CA TYR A 28 -27.292 5.075 11.927 1.00 1.80 C ATOM 448 C TYR A 28 -25.791 4.944 11.638 1.00 1.78 C ATOM 449 O TYR A 28 -24.965 4.968 12.528 1.00 2.09 O ATOM 450 CB TYR A 28 -27.817 3.768 12.519 1.00 1.82 C ATOM 451 CG TYR A 28 -27.149 3.516 13.849 1.00 2.02 C ATOM 452 CD1 TYR A 28 -27.530 4.256 14.975 1.00 2.64 C ATOM 453 CD2 TYR A 28 -26.147 2.544 13.957 1.00 2.25 C ATOM 454 CE1 TYR A 28 -26.910 4.024 16.209 1.00 3.00 C ATOM 455 CE2 TYR A 28 -25.527 2.311 15.190 1.00 2.48 C ATOM 456 CZ TYR A 28 -25.908 3.051 16.316 1.00 2.69 C ATOM 457 OH TYR A 28 -25.296 2.821 17.531 1.00 3.10 O ATOM 0 H TYR A 28 -28.778 4.751 10.424 1.00 1.72 H new ATOM 0 HA TYR A 28 -27.473 5.880 12.639 1.00 1.80 H new ATOM 0 HB2 TYR A 28 -28.898 3.822 12.647 1.00 1.82 H new ATOM 0 HB3 TYR A 28 -27.618 2.941 11.837 1.00 1.82 H new ATOM 0 HD1 TYR A 28 -28.302 5.006 14.892 1.00 2.64 H new ATOM 0 HD2 TYR A 28 -25.852 1.974 13.088 1.00 2.25 H new ATOM 0 HE1 TYR A 28 -27.204 4.595 17.077 1.00 3.00 H new ATOM 0 HE2 TYR A 28 -24.755 1.561 15.273 1.00 2.48 H new ATOM 0 HH TYR A 28 -24.625 2.114 17.431 1.00 3.10 H new ATOM 467 N GLY A 29 -25.447 4.839 10.380 1.00 1.51 N ATOM 468 CA GLY A 29 -24.015 4.742 9.981 1.00 1.48 C ATOM 469 C GLY A 29 -23.514 6.133 9.575 1.00 1.54 C ATOM 470 O GLY A 29 -22.440 6.554 9.957 1.00 1.61 O ATOM 0 H GLY A 29 -26.108 4.816 9.604 1.00 1.51 H new ATOM 0 HA2 GLY A 29 -23.420 4.354 10.807 1.00 1.48 H new ATOM 0 HA3 GLY A 29 -23.902 4.044 9.151 1.00 1.48 H new ATOM 474 N ALA A 30 -24.291 6.849 8.799 1.00 1.57 N ATOM 475 CA ALA A 30 -23.872 8.213 8.361 1.00 1.67 C ATOM 476 C ALA A 30 -25.098 9.137 8.297 1.00 1.71 C ATOM 477 O ALA A 30 -26.141 8.833 8.834 1.00 1.72 O ATOM 478 CB ALA A 30 -23.214 8.129 6.979 1.00 1.66 C ATOM 0 H ALA A 30 -25.200 6.545 8.450 1.00 1.57 H new ATOM 0 HA ALA A 30 -23.157 8.618 9.077 1.00 1.67 H new ATOM 0 HB1 ALA A 30 -22.909 9.126 6.660 1.00 1.66 H new ATOM 0 HB2 ALA A 30 -22.339 7.481 7.031 1.00 1.66 H new ATOM 0 HB3 ALA A 30 -23.926 7.721 6.261 1.00 1.66 H new ATOM 484 N ASN A 31 -24.976 10.267 7.650 1.00 1.82 N ATOM 485 CA ASN A 31 -26.131 11.216 7.563 1.00 1.87 C ATOM 486 C ASN A 31 -26.976 10.908 6.318 1.00 1.82 C ATOM 487 O ASN A 31 -27.606 11.785 5.758 1.00 2.17 O ATOM 488 CB ASN A 31 -25.592 12.647 7.465 1.00 2.00 C ATOM 489 CG ASN A 31 -26.348 13.551 8.440 1.00 2.22 C ATOM 490 OD1 ASN A 31 -26.173 13.453 9.639 1.00 2.79 O ATOM 491 ND2 ASN A 31 -27.186 14.435 7.973 1.00 2.38 N ATOM 0 H ASN A 31 -24.127 10.576 7.177 1.00 1.82 H new ATOM 0 HA ASN A 31 -26.754 11.108 8.451 1.00 1.87 H new ATOM 0 HB2 ASN A 31 -24.526 12.661 7.693 1.00 2.00 H new ATOM 0 HB3 ASN A 31 -25.705 13.019 6.447 1.00 2.00 H new ATOM 0 HD21 ASN A 31 -27.695 15.044 8.614 1.00 2.38 H new ATOM 0 HD22 ASN A 31 -27.333 14.517 6.967 1.00 2.38 H new ATOM 498 N LEU A 32 -26.985 9.674 5.885 1.00 1.81 N ATOM 499 CA LEU A 32 -27.771 9.282 4.672 1.00 1.70 C ATOM 500 C LEU A 32 -27.724 10.368 3.600 1.00 1.72 C ATOM 501 O LEU A 32 -28.581 11.218 3.491 1.00 1.84 O ATOM 502 CB LEU A 32 -29.226 8.972 5.048 1.00 1.75 C ATOM 503 CG LEU A 32 -29.629 7.564 4.558 1.00 1.74 C ATOM 504 CD1 LEU A 32 -29.482 7.430 3.040 1.00 1.67 C ATOM 505 CD2 LEU A 32 -28.743 6.515 5.204 1.00 1.69 C ATOM 0 H LEU A 32 -26.474 8.909 6.326 1.00 1.81 H new ATOM 0 HA LEU A 32 -27.313 8.383 4.260 1.00 1.70 H new ATOM 0 HB2 LEU A 32 -29.349 9.035 6.129 1.00 1.75 H new ATOM 0 HB3 LEU A 32 -29.887 9.719 4.608 1.00 1.75 H new ATOM 0 HG LEU A 32 -30.673 7.416 4.834 1.00 1.74 H new ATOM 0 HD11 LEU A 32 -29.775 6.426 2.733 1.00 1.67 H new ATOM 0 HD12 LEU A 32 -30.122 8.161 2.547 1.00 1.67 H new ATOM 0 HD13 LEU A 32 -28.444 7.607 2.758 1.00 1.67 H new ATOM 0 HD21 LEU A 32 -29.035 5.525 4.852 1.00 1.69 H new ATOM 0 HD22 LEU A 32 -27.703 6.703 4.937 1.00 1.69 H new ATOM 0 HD23 LEU A 32 -28.854 6.562 6.287 1.00 1.69 H new ATOM 517 N SER A 33 -26.743 10.285 2.767 1.00 1.63 N ATOM 518 CA SER A 33 -26.609 11.216 1.621 1.00 1.66 C ATOM 519 C SER A 33 -27.789 10.947 0.674 1.00 1.68 C ATOM 520 O SER A 33 -27.764 11.325 -0.466 1.00 1.69 O ATOM 521 CB SER A 33 -25.282 10.965 0.901 1.00 1.58 C ATOM 522 OG SER A 33 -24.421 12.078 1.106 1.00 1.75 O ATOM 0 H SER A 33 -26.001 9.588 2.831 1.00 1.63 H new ATOM 0 HA SER A 33 -26.618 12.253 1.957 1.00 1.66 H new ATOM 0 HB2 SER A 33 -24.816 10.055 1.279 1.00 1.58 H new ATOM 0 HB3 SER A 33 -25.455 10.815 -0.165 1.00 1.58 H new ATOM 0 HG SER A 33 -23.569 11.921 0.648 1.00 1.75 H new ATOM 528 N TYR A 34 -28.757 10.181 1.143 1.00 1.70 N ATOM 529 CA TYR A 34 -29.919 9.709 0.311 1.00 1.73 C ATOM 530 C TYR A 34 -30.153 10.553 -0.930 1.00 1.77 C ATOM 531 O TYR A 34 -30.342 10.008 -2.000 1.00 1.71 O ATOM 532 CB TYR A 34 -31.191 9.764 1.158 1.00 1.92 C ATOM 533 CG TYR A 34 -31.755 11.164 1.165 1.00 1.73 C ATOM 534 CD1 TYR A 34 -32.598 11.590 0.132 1.00 1.94 C ATOM 535 CD2 TYR A 34 -31.437 12.034 2.212 1.00 2.49 C ATOM 536 CE1 TYR A 34 -33.121 12.887 0.148 1.00 2.57 C ATOM 537 CE2 TYR A 34 -31.959 13.330 2.228 1.00 3.01 C ATOM 538 CZ TYR A 34 -32.801 13.759 1.197 1.00 2.95 C ATOM 539 OH TYR A 34 -33.315 15.038 1.213 1.00 3.85 O ATOM 0 H TYR A 34 -28.787 9.852 2.108 1.00 1.70 H new ATOM 0 HA TYR A 34 -29.680 8.696 -0.013 1.00 1.73 H new ATOM 0 HB2 TYR A 34 -31.931 9.069 0.761 1.00 1.92 H new ATOM 0 HB3 TYR A 34 -30.971 9.448 2.178 1.00 1.92 H new ATOM 0 HD1 TYR A 34 -32.844 10.918 -0.677 1.00 1.94 H new ATOM 0 HD2 TYR A 34 -30.787 11.704 3.009 1.00 2.49 H new ATOM 0 HE1 TYR A 34 -33.772 13.217 -0.648 1.00 2.57 H new ATOM 0 HE2 TYR A 34 -31.712 14.001 3.037 1.00 3.01 H new ATOM 0 HH TYR A 34 -32.995 15.509 2.010 1.00 3.85 H new ATOM 549 N ALA A 35 -30.130 11.843 -0.849 1.00 1.88 N ATOM 550 CA ALA A 35 -30.332 12.607 -2.102 1.00 1.95 C ATOM 551 C ALA A 35 -29.300 12.082 -3.101 1.00 1.82 C ATOM 552 O ALA A 35 -29.589 11.811 -4.249 1.00 1.78 O ATOM 553 CB ALA A 35 -30.107 14.100 -1.849 1.00 2.11 C ATOM 0 H ALA A 35 -29.985 12.391 -0.001 1.00 1.88 H new ATOM 0 HA ALA A 35 -31.347 12.484 -2.481 1.00 1.95 H new ATOM 0 HB1 ALA A 35 -30.258 14.653 -2.776 1.00 2.11 H new ATOM 0 HB2 ALA A 35 -30.814 14.452 -1.097 1.00 2.11 H new ATOM 0 HB3 ALA A 35 -29.089 14.259 -1.493 1.00 2.11 H new ATOM 559 N LEU A 36 -28.097 11.910 -2.628 1.00 1.76 N ATOM 560 CA LEU A 36 -26.994 11.368 -3.473 1.00 1.66 C ATOM 561 C LEU A 36 -26.795 9.857 -3.227 1.00 1.48 C ATOM 562 O LEU A 36 -26.748 9.070 -4.151 1.00 1.40 O ATOM 563 CB LEU A 36 -25.697 12.108 -3.140 1.00 1.73 C ATOM 564 CG LEU A 36 -25.240 12.910 -4.360 1.00 1.83 C ATOM 565 CD1 LEU A 36 -24.036 13.773 -3.980 1.00 2.23 C ATOM 566 CD2 LEU A 36 -24.843 11.948 -5.482 1.00 2.42 C ATOM 0 H LEU A 36 -27.826 12.127 -1.669 1.00 1.76 H new ATOM 0 HA LEU A 36 -27.257 11.514 -4.521 1.00 1.66 H new ATOM 0 HB2 LEU A 36 -25.853 12.774 -2.291 1.00 1.73 H new ATOM 0 HB3 LEU A 36 -24.924 11.397 -2.849 1.00 1.73 H new ATOM 0 HG LEU A 36 -26.054 13.550 -4.700 1.00 1.83 H new ATOM 0 HD11 LEU A 36 -23.710 14.345 -4.849 1.00 2.23 H new ATOM 0 HD12 LEU A 36 -24.317 14.457 -3.180 1.00 2.23 H new ATOM 0 HD13 LEU A 36 -23.222 13.133 -3.640 1.00 2.23 H new ATOM 0 HD21 LEU A 36 -24.517 12.518 -6.352 1.00 2.42 H new ATOM 0 HD22 LEU A 36 -24.029 11.308 -5.142 1.00 2.42 H new ATOM 0 HD23 LEU A 36 -25.700 11.331 -5.753 1.00 2.42 H new ATOM 578 N THR A 37 -26.625 9.471 -1.976 1.00 1.43 N ATOM 579 CA THR A 37 -26.363 8.029 -1.625 1.00 1.30 C ATOM 580 C THR A 37 -27.140 7.085 -2.535 1.00 1.23 C ATOM 581 O THR A 37 -26.602 6.097 -2.987 1.00 1.15 O ATOM 582 CB THR A 37 -26.730 7.765 -0.157 1.00 1.36 C ATOM 583 OG1 THR A 37 -25.578 7.948 0.652 1.00 1.49 O ATOM 584 CG2 THR A 37 -27.254 6.335 0.029 1.00 1.33 C ATOM 0 H THR A 37 -26.657 10.102 -1.175 1.00 1.43 H new ATOM 0 HA THR A 37 -25.300 7.838 -1.770 1.00 1.30 H new ATOM 0 HB THR A 37 -27.514 8.463 0.136 1.00 1.36 H new ATOM 0 HG1 THR A 37 -25.807 7.782 1.590 1.00 1.49 H new ATOM 0 HG21 THR A 37 -27.507 6.174 1.077 1.00 1.33 H new ATOM 0 HG22 THR A 37 -28.143 6.190 -0.585 1.00 1.33 H new ATOM 0 HG23 THR A 37 -26.485 5.624 -0.273 1.00 1.33 H new ATOM 592 N GLY A 38 -28.386 7.360 -2.802 1.00 1.26 N ATOM 593 CA GLY A 38 -29.163 6.447 -3.700 1.00 1.21 C ATOM 594 C GLY A 38 -28.267 6.069 -4.885 1.00 1.17 C ATOM 595 O GLY A 38 -28.406 5.027 -5.493 1.00 1.12 O ATOM 0 H GLY A 38 -28.899 8.166 -2.445 1.00 1.26 H new ATOM 0 HA2 GLY A 38 -29.474 5.554 -3.158 1.00 1.21 H new ATOM 0 HA3 GLY A 38 -30.070 6.939 -4.050 1.00 1.21 H new ATOM 599 N ARG A 39 -27.333 6.929 -5.188 1.00 1.22 N ATOM 600 CA ARG A 39 -26.373 6.683 -6.305 1.00 1.23 C ATOM 601 C ARG A 39 -25.371 5.591 -5.901 1.00 1.13 C ATOM 602 O ARG A 39 -24.939 4.795 -6.714 1.00 1.10 O ATOM 603 CB ARG A 39 -25.617 7.983 -6.591 1.00 1.33 C ATOM 604 CG ARG A 39 -24.737 7.826 -7.835 1.00 1.36 C ATOM 605 CD ARG A 39 -23.399 8.534 -7.601 1.00 1.39 C ATOM 606 NE ARG A 39 -22.700 8.721 -8.904 1.00 1.58 N ATOM 607 CZ ARG A 39 -22.061 7.723 -9.450 1.00 2.13 C ATOM 608 NH1 ARG A 39 -22.045 6.556 -8.865 1.00 2.75 N ATOM 609 NH2 ARG A 39 -21.438 7.890 -10.584 1.00 2.58 N ATOM 0 H ARG A 39 -27.191 7.812 -4.697 1.00 1.22 H new ATOM 0 HA ARG A 39 -26.915 6.357 -7.193 1.00 1.23 H new ATOM 0 HB2 ARG A 39 -26.325 8.798 -6.739 1.00 1.33 H new ATOM 0 HB3 ARG A 39 -25.000 8.249 -5.733 1.00 1.33 H new ATOM 0 HG2 ARG A 39 -24.571 6.770 -8.046 1.00 1.36 H new ATOM 0 HG3 ARG A 39 -25.238 8.250 -8.705 1.00 1.36 H new ATOM 0 HD2 ARG A 39 -23.565 9.500 -7.124 1.00 1.39 H new ATOM 0 HD3 ARG A 39 -22.778 7.947 -6.924 1.00 1.39 H new ATOM 0 HE ARG A 39 -22.721 9.629 -9.369 1.00 1.58 H new ATOM 0 HH11 ARG A 39 -22.533 6.423 -7.979 1.00 2.75 H new ATOM 0 HH12 ARG A 39 -21.545 5.777 -9.294 1.00 2.75 H new ATOM 0 HH21 ARG A 39 -21.451 8.801 -11.044 1.00 2.58 H new ATOM 0 HH22 ARG A 39 -20.938 7.110 -11.011 1.00 2.58 H new ATOM 623 N TYR A 40 -25.007 5.545 -4.648 1.00 1.10 N ATOM 624 CA TYR A 40 -24.040 4.510 -4.181 1.00 1.01 C ATOM 625 C TYR A 40 -24.752 3.166 -4.081 1.00 0.91 C ATOM 626 O TYR A 40 -24.237 2.145 -4.491 1.00 0.85 O ATOM 627 CB TYR A 40 -23.487 4.898 -2.803 1.00 1.04 C ATOM 628 CG TYR A 40 -23.020 6.349 -2.767 1.00 1.24 C ATOM 629 CD1 TYR A 40 -22.725 7.076 -3.943 1.00 1.92 C ATOM 630 CD2 TYR A 40 -22.876 6.974 -1.521 1.00 1.74 C ATOM 631 CE1 TYR A 40 -22.294 8.406 -3.855 1.00 2.17 C ATOM 632 CE2 TYR A 40 -22.446 8.303 -1.440 1.00 2.01 C ATOM 633 CZ TYR A 40 -22.156 9.018 -2.606 1.00 1.89 C ATOM 634 OH TYR A 40 -21.731 10.328 -2.523 1.00 2.27 O ATOM 0 H TYR A 40 -25.339 6.183 -3.924 1.00 1.10 H new ATOM 0 HA TYR A 40 -23.216 4.439 -4.891 1.00 1.01 H new ATOM 0 HB2 TYR A 40 -24.257 4.745 -2.047 1.00 1.04 H new ATOM 0 HB3 TYR A 40 -22.655 4.242 -2.548 1.00 1.04 H new ATOM 0 HD1 TYR A 40 -22.832 6.606 -4.909 1.00 1.92 H new ATOM 0 HD2 TYR A 40 -23.098 6.426 -0.617 1.00 1.74 H new ATOM 0 HE1 TYR A 40 -22.068 8.960 -4.754 1.00 2.17 H new ATOM 0 HE2 TYR A 40 -22.338 8.777 -0.476 1.00 2.01 H new ATOM 0 HH TYR A 40 -20.756 10.362 -2.619 1.00 2.27 H new ATOM 644 N ILE A 41 -25.935 3.156 -3.541 1.00 0.89 N ATOM 645 CA ILE A 41 -26.683 1.881 -3.417 1.00 0.80 C ATOM 646 C ILE A 41 -26.990 1.331 -4.810 1.00 0.77 C ATOM 647 O ILE A 41 -26.642 0.220 -5.137 1.00 0.70 O ATOM 648 CB ILE A 41 -27.991 2.138 -2.667 1.00 0.82 C ATOM 649 CG1 ILE A 41 -27.707 2.204 -1.163 1.00 0.92 C ATOM 650 CG2 ILE A 41 -28.977 1.004 -2.950 1.00 0.77 C ATOM 651 CD1 ILE A 41 -28.907 2.822 -0.442 1.00 0.95 C ATOM 0 H ILE A 41 -26.417 3.979 -3.179 1.00 0.89 H new ATOM 0 HA ILE A 41 -26.083 1.155 -2.868 1.00 0.80 H new ATOM 0 HB ILE A 41 -28.422 3.082 -3.001 1.00 0.82 H new ATOM 0 HG12 ILE A 41 -27.512 1.204 -0.775 1.00 0.92 H new ATOM 0 HG13 ILE A 41 -26.812 2.798 -0.977 1.00 0.92 H new ATOM 0 HG21 ILE A 41 -29.908 1.189 -2.415 1.00 0.77 H new ATOM 0 HG22 ILE A 41 -29.177 0.955 -4.020 1.00 0.77 H new ATOM 0 HG23 ILE A 41 -28.549 0.058 -2.617 1.00 0.77 H new ATOM 0 HD11 ILE A 41 -28.704 2.869 0.628 1.00 0.95 H new ATOM 0 HD12 ILE A 41 -29.081 3.828 -0.822 1.00 0.95 H new ATOM 0 HD13 ILE A 41 -29.792 2.210 -0.617 1.00 0.95 H new ATOM 663 N LYS A 42 -27.633 2.109 -5.633 1.00 0.85 N ATOM 664 CA LYS A 42 -27.968 1.633 -7.004 1.00 0.86 C ATOM 665 C LYS A 42 -26.697 1.167 -7.720 1.00 0.85 C ATOM 666 O LYS A 42 -26.690 0.158 -8.398 1.00 0.82 O ATOM 667 CB LYS A 42 -28.606 2.782 -7.791 1.00 0.98 C ATOM 668 CG LYS A 42 -29.583 2.227 -8.834 1.00 1.09 C ATOM 669 CD LYS A 42 -28.831 1.350 -9.840 1.00 1.05 C ATOM 670 CE LYS A 42 -29.581 1.344 -11.173 1.00 1.07 C ATOM 671 NZ LYS A 42 -29.358 2.638 -11.876 1.00 1.81 N ATOM 0 H LYS A 42 -27.942 3.056 -5.416 1.00 0.85 H new ATOM 0 HA LYS A 42 -28.665 0.798 -6.938 1.00 0.86 H new ATOM 0 HB2 LYS A 42 -29.131 3.452 -7.110 1.00 0.98 H new ATOM 0 HB3 LYS A 42 -27.832 3.370 -8.283 1.00 0.98 H new ATOM 0 HG2 LYS A 42 -30.362 1.644 -8.342 1.00 1.09 H new ATOM 0 HG3 LYS A 42 -30.079 3.047 -9.353 1.00 1.09 H new ATOM 0 HD2 LYS A 42 -27.818 1.728 -9.982 1.00 1.05 H new ATOM 0 HD3 LYS A 42 -28.741 0.334 -9.457 1.00 1.05 H new ATOM 0 HE2 LYS A 42 -29.235 0.517 -11.793 1.00 1.07 H new ATOM 0 HE3 LYS A 42 -30.646 1.190 -11.002 1.00 1.07 H new ATOM 0 HZ1 LYS A 42 -29.532 2.514 -12.894 1.00 1.81 H new ATOM 0 HZ2 LYS A 42 -30.010 3.355 -11.498 1.00 1.81 H new ATOM 0 HZ3 LYS A 42 -28.377 2.949 -11.727 1.00 1.81 H new ATOM 685 N MET A 43 -25.621 1.887 -7.575 1.00 0.90 N ATOM 686 CA MET A 43 -24.357 1.473 -8.255 1.00 0.93 C ATOM 687 C MET A 43 -23.932 0.107 -7.727 1.00 0.80 C ATOM 688 O MET A 43 -23.587 -0.785 -8.473 1.00 0.79 O ATOM 689 CB MET A 43 -23.243 2.496 -7.992 1.00 1.02 C ATOM 690 CG MET A 43 -21.904 1.909 -8.446 1.00 1.13 C ATOM 691 SD MET A 43 -21.177 0.951 -7.093 1.00 2.14 S ATOM 692 CE MET A 43 -19.748 2.023 -6.800 1.00 2.36 C ATOM 0 H MET A 43 -25.559 2.740 -7.019 1.00 0.90 H new ATOM 0 HA MET A 43 -24.532 1.420 -9.330 1.00 0.93 H new ATOM 0 HB2 MET A 43 -23.449 3.422 -8.529 1.00 1.02 H new ATOM 0 HB3 MET A 43 -23.204 2.745 -6.931 1.00 1.02 H new ATOM 0 HG2 MET A 43 -22.051 1.273 -9.319 1.00 1.13 H new ATOM 0 HG3 MET A 43 -21.226 2.709 -8.745 1.00 1.13 H new ATOM 0 HE1 MET A 43 -19.147 1.614 -5.988 1.00 2.36 H new ATOM 0 HE2 MET A 43 -19.144 2.080 -7.706 1.00 2.36 H new ATOM 0 HE3 MET A 43 -20.092 3.022 -6.530 1.00 2.36 H new ATOM 702 N LEU A 44 -23.955 -0.061 -6.439 1.00 0.73 N ATOM 703 CA LEU A 44 -23.550 -1.360 -5.845 1.00 0.61 C ATOM 704 C LEU A 44 -24.506 -2.463 -6.325 1.00 0.57 C ATOM 705 O LEU A 44 -24.148 -3.622 -6.411 1.00 0.54 O ATOM 706 CB LEU A 44 -23.600 -1.227 -4.320 1.00 0.57 C ATOM 707 CG LEU A 44 -22.392 -0.411 -3.837 1.00 0.69 C ATOM 708 CD1 LEU A 44 -22.579 -0.031 -2.369 1.00 1.14 C ATOM 709 CD2 LEU A 44 -21.101 -1.227 -3.978 1.00 0.67 C ATOM 0 H LEU A 44 -24.239 0.651 -5.767 1.00 0.73 H new ATOM 0 HA LEU A 44 -22.539 -1.626 -6.154 1.00 0.61 H new ATOM 0 HB2 LEU A 44 -24.526 -0.739 -4.017 1.00 0.57 H new ATOM 0 HB3 LEU A 44 -23.594 -2.214 -3.858 1.00 0.57 H new ATOM 0 HG LEU A 44 -22.318 0.488 -4.449 1.00 0.69 H new ATOM 0 HD11 LEU A 44 -21.720 0.548 -2.031 1.00 1.14 H new ATOM 0 HD12 LEU A 44 -23.484 0.566 -2.260 1.00 1.14 H new ATOM 0 HD13 LEU A 44 -22.667 -0.936 -1.767 1.00 1.14 H new ATOM 0 HD21 LEU A 44 -20.255 -0.633 -3.631 1.00 0.67 H new ATOM 0 HD22 LEU A 44 -21.177 -2.135 -3.379 1.00 0.67 H new ATOM 0 HD23 LEU A 44 -20.952 -1.494 -5.024 1.00 0.67 H new ATOM 721 N MET A 45 -25.716 -2.107 -6.660 1.00 0.60 N ATOM 722 CA MET A 45 -26.687 -3.128 -7.158 1.00 0.58 C ATOM 723 C MET A 45 -26.374 -3.408 -8.621 1.00 0.62 C ATOM 724 O MET A 45 -26.279 -4.538 -9.059 1.00 0.59 O ATOM 725 CB MET A 45 -28.113 -2.576 -7.071 1.00 0.64 C ATOM 726 CG MET A 45 -28.407 -2.088 -5.657 1.00 1.07 C ATOM 727 SD MET A 45 -29.360 -3.351 -4.783 1.00 1.19 S ATOM 728 CE MET A 45 -30.999 -2.650 -5.097 1.00 1.04 C ATOM 0 H MET A 45 -26.076 -1.154 -6.611 1.00 0.60 H new ATOM 0 HA MET A 45 -26.607 -4.033 -6.556 1.00 0.58 H new ATOM 0 HB2 MET A 45 -28.237 -1.756 -7.779 1.00 0.64 H new ATOM 0 HB3 MET A 45 -28.827 -3.350 -7.352 1.00 0.64 H new ATOM 0 HG2 MET A 45 -27.476 -1.886 -5.128 1.00 1.07 H new ATOM 0 HG3 MET A 45 -28.964 -1.152 -5.690 1.00 1.07 H new ATOM 0 HE1 MET A 45 -31.759 -3.282 -4.637 1.00 1.04 H new ATOM 0 HE2 MET A 45 -31.054 -1.648 -4.671 1.00 1.04 H new ATOM 0 HE3 MET A 45 -31.172 -2.597 -6.172 1.00 1.04 H new ATOM 738 N ASP A 46 -26.194 -2.361 -9.365 1.00 0.69 N ATOM 739 CA ASP A 46 -25.861 -2.505 -10.804 1.00 0.76 C ATOM 740 C ASP A 46 -24.546 -3.276 -10.933 1.00 0.75 C ATOM 741 O ASP A 46 -24.296 -3.943 -11.917 1.00 0.81 O ATOM 742 CB ASP A 46 -25.712 -1.124 -11.434 1.00 0.85 C ATOM 743 CG ASP A 46 -26.261 -1.152 -12.861 1.00 1.03 C ATOM 744 OD1 ASP A 46 -26.202 -2.204 -13.476 1.00 1.71 O ATOM 745 OD2 ASP A 46 -26.730 -0.121 -13.315 1.00 1.26 O ATOM 0 H ASP A 46 -26.264 -1.399 -9.034 1.00 0.69 H new ATOM 0 HA ASP A 46 -26.656 -3.046 -11.317 1.00 0.76 H new ATOM 0 HB2 ASP A 46 -26.248 -0.383 -10.841 1.00 0.85 H new ATOM 0 HB3 ASP A 46 -24.663 -0.828 -11.442 1.00 0.85 H new ATOM 750 N LEU A 47 -23.697 -3.172 -9.944 1.00 0.69 N ATOM 751 CA LEU A 47 -22.387 -3.877 -9.999 1.00 0.70 C ATOM 752 C LEU A 47 -22.504 -5.257 -9.344 1.00 0.62 C ATOM 753 O LEU A 47 -21.586 -6.050 -9.393 1.00 0.63 O ATOM 754 CB LEU A 47 -21.339 -3.032 -9.271 1.00 0.72 C ATOM 755 CG LEU A 47 -20.646 -2.088 -10.265 1.00 0.84 C ATOM 756 CD1 LEU A 47 -21.679 -1.337 -11.110 1.00 0.89 C ATOM 757 CD2 LEU A 47 -19.811 -1.066 -9.494 1.00 0.89 C ATOM 0 H LEU A 47 -23.858 -2.626 -9.098 1.00 0.69 H new ATOM 0 HA LEU A 47 -22.087 -4.015 -11.038 1.00 0.70 H new ATOM 0 HB2 LEU A 47 -21.813 -2.454 -8.477 1.00 0.72 H new ATOM 0 HB3 LEU A 47 -20.602 -3.680 -8.797 1.00 0.72 H new ATOM 0 HG LEU A 47 -20.012 -2.684 -10.921 1.00 0.84 H new ATOM 0 HD11 LEU A 47 -21.166 -0.674 -11.807 1.00 0.89 H new ATOM 0 HD12 LEU A 47 -22.283 -2.053 -11.668 1.00 0.89 H new ATOM 0 HD13 LEU A 47 -22.324 -0.749 -10.458 1.00 0.89 H new ATOM 0 HD21 LEU A 47 -19.318 -0.395 -10.197 1.00 0.89 H new ATOM 0 HD22 LEU A 47 -20.460 -0.489 -8.835 1.00 0.89 H new ATOM 0 HD23 LEU A 47 -19.059 -1.585 -8.899 1.00 0.89 H new ATOM 769 N GLU A 48 -23.629 -5.546 -8.741 1.00 0.55 N ATOM 770 CA GLU A 48 -23.828 -6.877 -8.088 1.00 0.50 C ATOM 771 C GLU A 48 -23.145 -6.893 -6.714 1.00 0.44 C ATOM 772 O GLU A 48 -22.095 -7.475 -6.531 1.00 0.46 O ATOM 773 CB GLU A 48 -23.261 -7.992 -8.980 1.00 0.56 C ATOM 774 CG GLU A 48 -24.080 -9.269 -8.783 1.00 1.22 C ATOM 775 CD GLU A 48 -25.374 -9.176 -9.593 1.00 1.27 C ATOM 776 OE1 GLU A 48 -25.729 -8.076 -9.981 1.00 1.79 O ATOM 777 OE2 GLU A 48 -25.989 -10.208 -9.811 1.00 1.73 O ATOM 0 H GLU A 48 -24.425 -4.912 -8.672 1.00 0.55 H new ATOM 0 HA GLU A 48 -24.895 -7.050 -7.951 1.00 0.50 H new ATOM 0 HB2 GLU A 48 -23.290 -7.686 -10.026 1.00 0.56 H new ATOM 0 HB3 GLU A 48 -22.216 -8.176 -8.731 1.00 0.56 H new ATOM 0 HG2 GLU A 48 -23.502 -10.137 -9.100 1.00 1.22 H new ATOM 0 HG3 GLU A 48 -24.309 -9.407 -7.726 1.00 1.22 H new ATOM 784 N ILE A 49 -23.738 -6.254 -5.743 1.00 0.40 N ATOM 785 CA ILE A 49 -23.137 -6.228 -4.384 1.00 0.37 C ATOM 786 C ILE A 49 -24.274 -6.150 -3.363 1.00 0.37 C ATOM 787 O ILE A 49 -24.265 -6.850 -2.368 1.00 0.40 O ATOM 788 CB ILE A 49 -22.204 -5.002 -4.257 1.00 0.39 C ATOM 789 CG1 ILE A 49 -20.881 -5.242 -5.014 1.00 0.44 C ATOM 790 CG2 ILE A 49 -21.883 -4.716 -2.785 1.00 0.37 C ATOM 791 CD1 ILE A 49 -20.957 -4.679 -6.443 1.00 0.82 C ATOM 0 H ILE A 49 -24.618 -5.747 -5.836 1.00 0.40 H new ATOM 0 HA ILE A 49 -22.546 -7.126 -4.205 1.00 0.37 H new ATOM 0 HB ILE A 49 -22.723 -4.148 -4.691 1.00 0.39 H new ATOM 0 HG12 ILE A 49 -20.059 -4.770 -4.476 1.00 0.44 H new ATOM 0 HG13 ILE A 49 -20.667 -6.310 -5.050 1.00 0.44 H new ATOM 0 HG21 ILE A 49 -21.225 -3.849 -2.718 1.00 0.37 H new ATOM 0 HG22 ILE A 49 -22.807 -4.513 -2.244 1.00 0.37 H new ATOM 0 HG23 ILE A 49 -21.388 -5.582 -2.346 1.00 0.37 H new ATOM 0 HD11 ILE A 49 -20.013 -4.860 -6.956 1.00 0.82 H new ATOM 0 HD12 ILE A 49 -21.765 -5.170 -6.985 1.00 0.82 H new ATOM 0 HD13 ILE A 49 -21.147 -3.607 -6.402 1.00 0.82 H new ATOM 803 N ILE A 50 -25.262 -5.326 -3.610 1.00 0.43 N ATOM 804 CA ILE A 50 -26.407 -5.225 -2.662 1.00 0.48 C ATOM 805 C ILE A 50 -27.610 -5.953 -3.255 1.00 0.43 C ATOM 806 O ILE A 50 -27.969 -5.737 -4.396 1.00 0.49 O ATOM 807 CB ILE A 50 -26.774 -3.758 -2.430 1.00 0.56 C ATOM 808 CG1 ILE A 50 -25.659 -3.072 -1.636 1.00 0.62 C ATOM 809 CG2 ILE A 50 -28.083 -3.668 -1.634 1.00 0.67 C ATOM 810 CD1 ILE A 50 -25.931 -1.565 -1.544 1.00 0.74 C ATOM 0 H ILE A 50 -25.322 -4.720 -4.428 1.00 0.43 H new ATOM 0 HA ILE A 50 -26.124 -5.676 -1.711 1.00 0.48 H new ATOM 0 HB ILE A 50 -26.899 -3.266 -3.394 1.00 0.56 H new ATOM 0 HG12 ILE A 50 -25.597 -3.500 -0.636 1.00 0.62 H new ATOM 0 HG13 ILE A 50 -24.697 -3.248 -2.118 1.00 0.62 H new ATOM 0 HG21 ILE A 50 -28.339 -2.621 -1.472 1.00 0.67 H new ATOM 0 HG22 ILE A 50 -28.883 -4.155 -2.192 1.00 0.67 H new ATOM 0 HG23 ILE A 50 -27.958 -4.164 -0.672 1.00 0.67 H new ATOM 0 HD11 ILE A 50 -25.133 -1.085 -0.978 1.00 0.74 H new ATOM 0 HD12 ILE A 50 -25.970 -1.140 -2.547 1.00 0.74 H new ATOM 0 HD13 ILE A 50 -26.884 -1.397 -1.042 1.00 0.74 H new ATOM 822 N ARG A 51 -28.247 -6.794 -2.489 1.00 0.58 N ATOM 823 CA ARG A 51 -29.441 -7.517 -3.001 1.00 0.56 C ATOM 824 C ARG A 51 -30.704 -6.869 -2.435 1.00 0.53 C ATOM 825 O ARG A 51 -30.657 -6.126 -1.475 1.00 0.53 O ATOM 826 CB ARG A 51 -29.370 -8.976 -2.560 1.00 0.60 C ATOM 827 CG ARG A 51 -29.322 -9.891 -3.780 1.00 0.83 C ATOM 828 CD ARG A 51 -28.854 -11.273 -3.343 1.00 0.87 C ATOM 829 NE ARG A 51 -29.652 -12.315 -4.047 1.00 1.02 N ATOM 830 CZ ARG A 51 -29.581 -12.434 -5.344 1.00 1.06 C ATOM 831 NH1 ARG A 51 -28.814 -11.635 -6.033 1.00 1.47 N ATOM 832 NH2 ARG A 51 -30.282 -13.352 -5.952 1.00 1.39 N ATOM 0 H ARG A 51 -27.990 -7.012 -1.526 1.00 0.58 H new ATOM 0 HA ARG A 51 -29.466 -7.467 -4.090 1.00 0.56 H new ATOM 0 HB2 ARG A 51 -28.486 -9.135 -1.942 1.00 0.60 H new ATOM 0 HB3 ARG A 51 -30.237 -9.221 -1.946 1.00 0.60 H new ATOM 0 HG2 ARG A 51 -30.307 -9.955 -4.242 1.00 0.83 H new ATOM 0 HG3 ARG A 51 -28.644 -9.483 -4.530 1.00 0.83 H new ATOM 0 HD2 ARG A 51 -27.795 -11.398 -3.568 1.00 0.87 H new ATOM 0 HD3 ARG A 51 -28.966 -11.382 -2.264 1.00 0.87 H new ATOM 0 HE ARG A 51 -30.257 -12.938 -3.512 1.00 1.02 H new ATOM 0 HH11 ARG A 51 -28.269 -10.916 -5.558 1.00 1.47 H new ATOM 0 HH12 ARG A 51 -28.760 -11.729 -7.047 1.00 1.47 H new ATOM 0 HH21 ARG A 51 -30.884 -13.975 -5.413 1.00 1.39 H new ATOM 0 HH22 ARG A 51 -30.228 -13.447 -6.966 1.00 1.39 H new ATOM 846 N GLN A 52 -31.830 -7.149 -3.030 1.00 0.59 N ATOM 847 CA GLN A 52 -33.114 -6.560 -2.548 1.00 0.59 C ATOM 848 C GLN A 52 -33.887 -7.601 -1.744 1.00 0.56 C ATOM 849 O GLN A 52 -34.325 -8.600 -2.280 1.00 0.58 O ATOM 850 CB GLN A 52 -33.952 -6.125 -3.751 1.00 0.68 C ATOM 851 CG GLN A 52 -34.926 -5.026 -3.324 1.00 1.47 C ATOM 852 CD GLN A 52 -35.852 -4.684 -4.492 1.00 1.71 C ATOM 853 OE1 GLN A 52 -36.738 -5.446 -4.823 1.00 2.42 O ATOM 854 NE2 GLN A 52 -35.684 -3.561 -5.136 1.00 1.84 N ATOM 0 H GLN A 52 -31.918 -7.766 -3.837 1.00 0.59 H new ATOM 0 HA GLN A 52 -32.903 -5.698 -1.915 1.00 0.59 H new ATOM 0 HB2 GLN A 52 -33.303 -5.761 -4.547 1.00 0.68 H new ATOM 0 HB3 GLN A 52 -34.501 -6.977 -4.152 1.00 0.68 H new ATOM 0 HG2 GLN A 52 -35.512 -5.357 -2.467 1.00 1.47 H new ATOM 0 HG3 GLN A 52 -34.376 -4.139 -3.010 1.00 1.47 H new ATOM 0 HE21 GLN A 52 -34.940 -2.920 -4.859 1.00 1.84 H new ATOM 0 HE22 GLN A 52 -36.297 -3.324 -5.916 1.00 1.84 H new ATOM 863 N GLU A 53 -34.078 -7.364 -0.471 1.00 0.67 N ATOM 864 CA GLU A 53 -34.848 -8.330 0.364 1.00 0.78 C ATOM 865 C GLU A 53 -36.141 -7.668 0.806 1.00 0.77 C ATOM 866 O GLU A 53 -36.162 -6.849 1.698 1.00 0.87 O ATOM 867 CB GLU A 53 -34.031 -8.709 1.596 1.00 1.04 C ATOM 868 CG GLU A 53 -33.794 -10.220 1.617 1.00 0.85 C ATOM 869 CD GLU A 53 -35.134 -10.953 1.726 1.00 1.59 C ATOM 870 OE1 GLU A 53 -36.157 -10.297 1.607 1.00 2.25 O ATOM 871 OE2 GLU A 53 -35.113 -12.156 1.925 1.00 2.30 O ATOM 0 H GLU A 53 -33.733 -6.542 0.025 1.00 0.67 H new ATOM 0 HA GLU A 53 -35.063 -9.228 -0.215 1.00 0.78 H new ATOM 0 HB2 GLU A 53 -33.077 -8.182 1.587 1.00 1.04 H new ATOM 0 HB3 GLU A 53 -34.556 -8.402 2.500 1.00 1.04 H new ATOM 0 HG2 GLU A 53 -33.273 -10.528 0.711 1.00 0.85 H new ATOM 0 HG3 GLU A 53 -33.154 -10.485 2.459 1.00 0.85 H new ATOM 878 N GLY A 54 -37.222 -8.011 0.182 1.00 0.73 N ATOM 879 CA GLY A 54 -38.517 -7.397 0.558 1.00 0.75 C ATOM 880 C GLY A 54 -38.421 -5.876 0.395 1.00 0.83 C ATOM 881 O GLY A 54 -38.983 -5.128 1.170 1.00 1.15 O ATOM 0 H GLY A 54 -37.267 -8.693 -0.575 1.00 0.73 H new ATOM 0 HA2 GLY A 54 -39.316 -7.792 -0.069 1.00 0.75 H new ATOM 0 HA3 GLY A 54 -38.767 -7.649 1.589 1.00 0.75 H new ATOM 885 N LYS A 55 -37.684 -5.418 -0.591 1.00 0.86 N ATOM 886 CA LYS A 55 -37.508 -3.944 -0.804 1.00 1.03 C ATOM 887 C LYS A 55 -36.451 -3.439 0.183 1.00 1.02 C ATOM 888 O LYS A 55 -36.249 -2.254 0.355 1.00 1.27 O ATOM 889 CB LYS A 55 -38.843 -3.210 -0.576 1.00 1.21 C ATOM 890 CG LYS A 55 -39.007 -2.057 -1.577 1.00 1.38 C ATOM 891 CD LYS A 55 -37.984 -0.957 -1.287 1.00 1.67 C ATOM 892 CE LYS A 55 -38.395 0.323 -2.017 1.00 1.89 C ATOM 893 NZ LYS A 55 -39.466 1.011 -1.242 1.00 2.27 N ATOM 0 H LYS A 55 -37.193 -6.008 -1.263 1.00 0.86 H new ATOM 0 HA LYS A 55 -37.186 -3.750 -1.827 1.00 1.03 H new ATOM 0 HB2 LYS A 55 -39.671 -3.910 -0.682 1.00 1.21 H new ATOM 0 HB3 LYS A 55 -38.881 -2.822 0.442 1.00 1.21 H new ATOM 0 HG2 LYS A 55 -38.876 -2.427 -2.594 1.00 1.38 H new ATOM 0 HG3 LYS A 55 -40.017 -1.651 -1.513 1.00 1.38 H new ATOM 0 HD2 LYS A 55 -37.924 -0.774 -0.214 1.00 1.67 H new ATOM 0 HD3 LYS A 55 -36.992 -1.272 -1.612 1.00 1.67 H new ATOM 0 HE2 LYS A 55 -37.534 0.981 -2.133 1.00 1.89 H new ATOM 0 HE3 LYS A 55 -38.751 0.085 -3.019 1.00 1.89 H new ATOM 0 HZ1 LYS A 55 -39.593 1.976 -1.607 1.00 2.27 H new ATOM 0 HZ2 LYS A 55 -40.357 0.484 -1.338 1.00 2.27 H new ATOM 0 HZ3 LYS A 55 -39.196 1.053 -0.239 1.00 2.27 H new ATOM 907 N GLN A 56 -35.788 -4.351 0.837 1.00 0.87 N ATOM 908 CA GLN A 56 -34.753 -3.973 1.832 1.00 0.97 C ATOM 909 C GLN A 56 -33.376 -4.154 1.194 1.00 0.89 C ATOM 910 O GLN A 56 -33.253 -4.793 0.173 1.00 0.86 O ATOM 911 CB GLN A 56 -34.908 -4.892 3.042 1.00 1.04 C ATOM 912 CG GLN A 56 -34.325 -4.244 4.297 1.00 1.44 C ATOM 913 CD GLN A 56 -34.797 -5.025 5.527 1.00 1.38 C ATOM 914 OE1 GLN A 56 -34.109 -5.904 6.005 1.00 1.49 O ATOM 915 NE2 GLN A 56 -35.953 -4.735 6.062 1.00 2.04 N ATOM 0 H GLN A 56 -35.923 -5.355 0.721 1.00 0.87 H new ATOM 0 HA GLN A 56 -34.862 -2.935 2.147 1.00 0.97 H new ATOM 0 HB2 GLN A 56 -35.963 -5.117 3.200 1.00 1.04 H new ATOM 0 HB3 GLN A 56 -34.405 -5.840 2.850 1.00 1.04 H new ATOM 0 HG2 GLN A 56 -33.236 -4.241 4.248 1.00 1.44 H new ATOM 0 HG3 GLN A 56 -34.644 -3.204 4.366 1.00 1.44 H new ATOM 0 HE21 GLN A 56 -36.530 -3.996 5.660 1.00 2.04 H new ATOM 0 HE22 GLN A 56 -36.278 -5.247 6.882 1.00 2.04 H new ATOM 924 N TYR A 57 -32.346 -3.580 1.765 1.00 0.87 N ATOM 925 CA TYR A 57 -30.992 -3.705 1.152 1.00 0.80 C ATOM 926 C TYR A 57 -30.140 -4.708 1.924 1.00 0.79 C ATOM 927 O TYR A 57 -29.862 -4.534 3.093 1.00 0.95 O ATOM 928 CB TYR A 57 -30.324 -2.338 1.182 1.00 0.81 C ATOM 929 CG TYR A 57 -31.234 -1.341 0.500 1.00 0.85 C ATOM 930 CD1 TYR A 57 -32.231 -0.694 1.236 1.00 1.34 C ATOM 931 CD2 TYR A 57 -31.094 -1.076 -0.868 1.00 1.49 C ATOM 932 CE1 TYR A 57 -33.087 0.216 0.611 1.00 1.35 C ATOM 933 CE2 TYR A 57 -31.950 -0.163 -1.494 1.00 1.56 C ATOM 934 CZ TYR A 57 -32.947 0.483 -0.755 1.00 0.98 C ATOM 935 OH TYR A 57 -33.793 1.382 -1.372 1.00 1.06 O ATOM 0 H TYR A 57 -32.386 -3.033 2.625 1.00 0.87 H new ATOM 0 HA TYR A 57 -31.090 -4.061 0.126 1.00 0.80 H new ATOM 0 HB2 TYR A 57 -30.132 -2.033 2.211 1.00 0.81 H new ATOM 0 HB3 TYR A 57 -29.359 -2.377 0.676 1.00 0.81 H new ATOM 0 HD1 TYR A 57 -32.340 -0.898 2.291 1.00 1.34 H new ATOM 0 HD2 TYR A 57 -30.326 -1.576 -1.439 1.00 1.49 H new ATOM 0 HE1 TYR A 57 -33.857 0.713 1.182 1.00 1.35 H new ATOM 0 HE2 TYR A 57 -31.841 0.043 -2.549 1.00 1.56 H new ATOM 0 HH TYR A 57 -33.560 1.452 -2.321 1.00 1.06 H new ATOM 945 N MET A 58 -29.734 -5.759 1.258 1.00 0.66 N ATOM 946 CA MET A 58 -28.905 -6.811 1.906 1.00 0.67 C ATOM 947 C MET A 58 -27.670 -7.074 1.042 1.00 0.57 C ATOM 948 O MET A 58 -27.510 -6.487 -0.008 1.00 0.51 O ATOM 949 CB MET A 58 -29.723 -8.092 2.137 1.00 0.73 C ATOM 950 CG MET A 58 -29.411 -9.142 1.069 1.00 0.90 C ATOM 951 SD MET A 58 -30.643 -10.465 1.153 1.00 1.22 S ATOM 952 CE MET A 58 -29.494 -11.855 0.990 1.00 1.60 C ATOM 0 H MET A 58 -29.948 -5.932 0.276 1.00 0.66 H new ATOM 0 HA MET A 58 -28.579 -6.467 2.888 1.00 0.67 H new ATOM 0 HB2 MET A 58 -29.501 -8.496 3.125 1.00 0.73 H new ATOM 0 HB3 MET A 58 -30.787 -7.856 2.120 1.00 0.73 H new ATOM 0 HG2 MET A 58 -29.419 -8.685 0.080 1.00 0.90 H new ATOM 0 HG3 MET A 58 -28.412 -9.549 1.224 1.00 0.90 H new ATOM 0 HE1 MET A 58 -30.050 -12.792 1.017 1.00 1.60 H new ATOM 0 HE2 MET A 58 -28.960 -11.777 0.043 1.00 1.60 H new ATOM 0 HE3 MET A 58 -28.779 -11.834 1.812 1.00 1.60 H new ATOM 962 N LEU A 59 -26.767 -7.892 1.504 1.00 0.59 N ATOM 963 CA LEU A 59 -25.510 -8.116 0.734 1.00 0.52 C ATOM 964 C LEU A 59 -25.603 -9.370 -0.147 1.00 0.46 C ATOM 965 O LEU A 59 -26.152 -10.385 0.231 1.00 0.53 O ATOM 966 CB LEU A 59 -24.336 -8.274 1.720 1.00 0.63 C ATOM 967 CG LEU A 59 -24.348 -9.655 2.409 1.00 0.71 C ATOM 968 CD1 LEU A 59 -23.178 -9.732 3.391 1.00 1.03 C ATOM 969 CD2 LEU A 59 -25.655 -9.857 3.186 1.00 1.16 C ATOM 0 H LEU A 59 -26.843 -8.414 2.377 1.00 0.59 H new ATOM 0 HA LEU A 59 -25.351 -7.256 0.083 1.00 0.52 H new ATOM 0 HB2 LEU A 59 -23.394 -8.142 1.188 1.00 0.63 H new ATOM 0 HB3 LEU A 59 -24.388 -7.490 2.476 1.00 0.63 H new ATOM 0 HG LEU A 59 -24.262 -10.429 1.646 1.00 0.71 H new ATOM 0 HD11 LEU A 59 -23.179 -10.705 3.882 1.00 1.03 H new ATOM 0 HD12 LEU A 59 -22.240 -9.599 2.851 1.00 1.03 H new ATOM 0 HD13 LEU A 59 -23.280 -8.947 4.140 1.00 1.03 H new ATOM 0 HD21 LEU A 59 -25.646 -10.836 3.665 1.00 1.16 H new ATOM 0 HD22 LEU A 59 -25.750 -9.082 3.946 1.00 1.16 H new ATOM 0 HD23 LEU A 59 -26.499 -9.797 2.499 1.00 1.16 H new ATOM 981 N THR A 60 -25.065 -9.285 -1.336 1.00 0.39 N ATOM 982 CA THR A 60 -25.106 -10.441 -2.277 1.00 0.41 C ATOM 983 C THR A 60 -23.763 -11.182 -2.189 1.00 0.46 C ATOM 984 O THR A 60 -22.796 -10.642 -1.689 1.00 0.43 O ATOM 985 CB THR A 60 -25.308 -9.914 -3.698 1.00 0.40 C ATOM 986 OG1 THR A 60 -26.462 -9.087 -3.734 1.00 1.12 O ATOM 987 CG2 THR A 60 -25.476 -11.072 -4.685 1.00 1.04 C ATOM 0 H THR A 60 -24.595 -8.455 -1.697 1.00 0.39 H new ATOM 0 HA THR A 60 -25.922 -11.117 -2.021 1.00 0.41 H new ATOM 0 HB THR A 60 -24.429 -9.337 -3.986 1.00 0.40 H new ATOM 0 HG1 THR A 60 -26.592 -8.747 -4.644 1.00 1.12 H new ATOM 0 HG21 THR A 60 -25.618 -10.675 -5.690 1.00 1.04 H new ATOM 0 HG22 THR A 60 -24.585 -11.699 -4.665 1.00 1.04 H new ATOM 0 HG23 THR A 60 -26.345 -11.667 -4.403 1.00 1.04 H new ATOM 995 N LYS A 61 -23.691 -12.408 -2.649 1.00 0.54 N ATOM 996 CA LYS A 61 -22.400 -13.164 -2.568 1.00 0.61 C ATOM 997 C LYS A 61 -21.239 -12.244 -2.972 1.00 0.57 C ATOM 998 O LYS A 61 -20.206 -12.200 -2.335 1.00 0.56 O ATOM 999 CB LYS A 61 -22.440 -14.388 -3.495 1.00 0.70 C ATOM 1000 CG LYS A 61 -23.125 -14.039 -4.821 1.00 1.39 C ATOM 1001 CD LYS A 61 -24.523 -14.656 -4.853 1.00 0.99 C ATOM 1002 CE LYS A 61 -25.208 -14.302 -6.176 1.00 1.84 C ATOM 1003 NZ LYS A 61 -26.686 -14.369 -6.002 1.00 2.26 N ATOM 0 H LYS A 61 -24.466 -12.916 -3.075 1.00 0.54 H new ATOM 0 HA LYS A 61 -22.254 -13.506 -1.543 1.00 0.61 H new ATOM 0 HB2 LYS A 61 -21.426 -14.740 -3.685 1.00 0.70 H new ATOM 0 HB3 LYS A 61 -22.974 -15.203 -3.007 1.00 0.70 H new ATOM 0 HG2 LYS A 61 -23.191 -12.957 -4.934 1.00 1.39 H new ATOM 0 HG3 LYS A 61 -22.533 -14.411 -5.657 1.00 1.39 H new ATOM 0 HD2 LYS A 61 -24.457 -15.739 -4.744 1.00 0.99 H new ATOM 0 HD3 LYS A 61 -25.114 -14.287 -4.015 1.00 0.99 H new ATOM 0 HE2 LYS A 61 -24.913 -13.302 -6.495 1.00 1.84 H new ATOM 0 HE3 LYS A 61 -24.891 -14.992 -6.958 1.00 1.84 H new ATOM 0 HZ1 LYS A 61 -27.153 -14.129 -6.900 1.00 2.26 H new ATOM 0 HZ2 LYS A 61 -26.959 -15.331 -5.717 1.00 2.26 H new ATOM 0 HZ3 LYS A 61 -26.980 -13.694 -5.268 1.00 2.26 H new ATOM 1017 N LYS A 62 -21.406 -11.513 -4.031 1.00 0.57 N ATOM 1018 CA LYS A 62 -20.329 -10.591 -4.484 1.00 0.56 C ATOM 1019 C LYS A 62 -20.087 -9.517 -3.420 1.00 0.50 C ATOM 1020 O LYS A 62 -18.983 -9.040 -3.247 1.00 0.58 O ATOM 1021 CB LYS A 62 -20.741 -9.927 -5.799 1.00 0.59 C ATOM 1022 CG LYS A 62 -20.134 -10.699 -6.974 1.00 0.78 C ATOM 1023 CD LYS A 62 -20.586 -12.161 -6.911 1.00 1.25 C ATOM 1024 CE LYS A 62 -20.652 -12.739 -8.326 1.00 1.29 C ATOM 1025 NZ LYS A 62 -21.096 -14.160 -8.261 1.00 2.14 N ATOM 0 H LYS A 62 -22.247 -11.512 -4.608 1.00 0.57 H new ATOM 0 HA LYS A 62 -19.411 -11.158 -4.638 1.00 0.56 H new ATOM 0 HB2 LYS A 62 -21.827 -9.909 -5.885 1.00 0.59 H new ATOM 0 HB3 LYS A 62 -20.402 -8.891 -5.817 1.00 0.59 H new ATOM 0 HG2 LYS A 62 -20.446 -10.251 -7.917 1.00 0.78 H new ATOM 0 HG3 LYS A 62 -19.046 -10.641 -6.938 1.00 0.78 H new ATOM 0 HD2 LYS A 62 -19.892 -12.741 -6.302 1.00 1.25 H new ATOM 0 HD3 LYS A 62 -21.563 -12.230 -6.433 1.00 1.25 H new ATOM 0 HE2 LYS A 62 -21.344 -12.158 -8.936 1.00 1.29 H new ATOM 0 HE3 LYS A 62 -19.674 -12.674 -8.803 1.00 1.29 H new ATOM 0 HZ1 LYS A 62 -21.141 -14.554 -9.222 1.00 2.14 H new ATOM 0 HZ2 LYS A 62 -20.420 -14.709 -7.693 1.00 2.14 H new ATOM 0 HZ3 LYS A 62 -22.037 -14.210 -7.822 1.00 2.14 H new ATOM 1039 N GLY A 63 -21.117 -9.114 -2.719 1.00 0.43 N ATOM 1040 CA GLY A 63 -20.947 -8.052 -1.687 1.00 0.38 C ATOM 1041 C GLY A 63 -20.122 -8.557 -0.501 1.00 0.40 C ATOM 1042 O GLY A 63 -19.246 -7.869 -0.016 1.00 0.39 O ATOM 0 H GLY A 63 -22.066 -9.475 -2.818 1.00 0.43 H new ATOM 0 HA2 GLY A 63 -20.457 -7.185 -2.131 1.00 0.38 H new ATOM 0 HA3 GLY A 63 -21.925 -7.721 -1.338 1.00 0.38 H new ATOM 1046 N GLU A 64 -20.375 -9.746 -0.029 1.00 0.46 N ATOM 1047 CA GLU A 64 -19.573 -10.258 1.123 1.00 0.51 C ATOM 1048 C GLU A 64 -18.119 -10.442 0.684 1.00 0.51 C ATOM 1049 O GLU A 64 -17.192 -10.140 1.414 1.00 0.50 O ATOM 1050 CB GLU A 64 -20.136 -11.588 1.624 1.00 0.60 C ATOM 1051 CG GLU A 64 -21.358 -11.957 0.800 1.00 0.65 C ATOM 1052 CD GLU A 64 -21.947 -13.273 1.310 1.00 0.80 C ATOM 1053 OE1 GLU A 64 -21.300 -13.913 2.122 1.00 1.40 O ATOM 1054 OE2 GLU A 64 -23.035 -13.619 0.880 1.00 1.25 O ATOM 0 H GLU A 64 -21.092 -10.380 -0.383 1.00 0.46 H new ATOM 0 HA GLU A 64 -19.624 -9.536 1.938 1.00 0.51 H new ATOM 0 HB2 GLU A 64 -19.380 -12.369 1.545 1.00 0.60 H new ATOM 0 HB3 GLU A 64 -20.404 -11.509 2.678 1.00 0.60 H new ATOM 0 HG2 GLU A 64 -22.104 -11.165 0.864 1.00 0.65 H new ATOM 0 HG3 GLU A 64 -21.084 -12.053 -0.251 1.00 0.65 H new ATOM 1061 N GLU A 65 -17.914 -10.937 -0.507 1.00 0.55 N ATOM 1062 CA GLU A 65 -16.522 -11.145 -0.997 1.00 0.58 C ATOM 1063 C GLU A 65 -15.772 -9.814 -0.966 1.00 0.52 C ATOM 1064 O GLU A 65 -14.691 -9.712 -0.420 1.00 0.53 O ATOM 1065 CB GLU A 65 -16.558 -11.678 -2.431 1.00 0.64 C ATOM 1066 CG GLU A 65 -17.005 -13.142 -2.423 1.00 0.72 C ATOM 1067 CD GLU A 65 -17.030 -13.677 -3.856 1.00 1.15 C ATOM 1068 OE1 GLU A 65 -16.441 -13.043 -4.715 1.00 1.82 O ATOM 1069 OE2 GLU A 65 -17.637 -14.714 -4.069 1.00 1.69 O ATOM 0 H GLU A 65 -18.650 -11.206 -1.161 1.00 0.55 H new ATOM 0 HA GLU A 65 -16.014 -11.866 -0.357 1.00 0.58 H new ATOM 0 HB2 GLU A 65 -17.242 -11.082 -3.034 1.00 0.64 H new ATOM 0 HB3 GLU A 65 -15.572 -11.591 -2.887 1.00 0.64 H new ATOM 0 HG2 GLU A 65 -16.325 -13.737 -1.813 1.00 0.72 H new ATOM 0 HG3 GLU A 65 -17.995 -13.229 -1.974 1.00 0.72 H new ATOM 1076 N LEU A 66 -16.338 -8.789 -1.542 1.00 0.50 N ATOM 1077 CA LEU A 66 -15.655 -7.466 -1.537 1.00 0.48 C ATOM 1078 C LEU A 66 -15.428 -7.023 -0.089 1.00 0.44 C ATOM 1079 O LEU A 66 -14.397 -6.475 0.245 1.00 0.45 O ATOM 1080 CB LEU A 66 -16.527 -6.437 -2.265 1.00 0.46 C ATOM 1081 CG LEU A 66 -15.766 -5.115 -2.415 1.00 0.62 C ATOM 1082 CD1 LEU A 66 -15.044 -5.093 -3.760 1.00 0.77 C ATOM 1083 CD2 LEU A 66 -16.756 -3.948 -2.352 1.00 1.54 C ATOM 0 H LEU A 66 -17.242 -8.811 -2.015 1.00 0.50 H new ATOM 0 HA LEU A 66 -14.695 -7.545 -2.047 1.00 0.48 H new ATOM 0 HB2 LEU A 66 -16.809 -6.817 -3.247 1.00 0.46 H new ATOM 0 HB3 LEU A 66 -17.450 -6.273 -1.710 1.00 0.46 H new ATOM 0 HG LEU A 66 -15.038 -5.021 -1.609 1.00 0.62 H new ATOM 0 HD11 LEU A 66 -14.503 -4.153 -3.867 1.00 0.77 H new ATOM 0 HD12 LEU A 66 -14.341 -5.924 -3.809 1.00 0.77 H new ATOM 0 HD13 LEU A 66 -15.772 -5.186 -4.566 1.00 0.77 H new ATOM 0 HD21 LEU A 66 -16.216 -3.007 -2.459 1.00 1.54 H new ATOM 0 HD22 LEU A 66 -17.482 -4.043 -3.159 1.00 1.54 H new ATOM 0 HD23 LEU A 66 -17.275 -3.962 -1.393 1.00 1.54 H new ATOM 1095 N LEU A 67 -16.373 -7.266 0.779 1.00 0.43 N ATOM 1096 CA LEU A 67 -16.190 -6.867 2.201 1.00 0.43 C ATOM 1097 C LEU A 67 -14.855 -7.416 2.694 1.00 0.46 C ATOM 1098 O LEU A 67 -14.090 -6.735 3.345 1.00 0.48 O ATOM 1099 CB LEU A 67 -17.328 -7.446 3.047 1.00 0.46 C ATOM 1100 CG LEU A 67 -17.704 -6.454 4.149 1.00 0.61 C ATOM 1101 CD1 LEU A 67 -18.640 -5.388 3.578 1.00 0.89 C ATOM 1102 CD2 LEU A 67 -18.413 -7.199 5.282 1.00 1.39 C ATOM 0 H LEU A 67 -17.260 -7.722 0.565 1.00 0.43 H new ATOM 0 HA LEU A 67 -16.200 -5.780 2.287 1.00 0.43 H new ATOM 0 HB2 LEU A 67 -18.194 -7.652 2.418 1.00 0.46 H new ATOM 0 HB3 LEU A 67 -17.021 -8.395 3.487 1.00 0.46 H new ATOM 0 HG LEU A 67 -16.802 -5.978 4.533 1.00 0.61 H new ATOM 0 HD11 LEU A 67 -18.908 -4.681 4.363 1.00 0.89 H new ATOM 0 HD12 LEU A 67 -18.137 -4.858 2.769 1.00 0.89 H new ATOM 0 HD13 LEU A 67 -19.543 -5.864 3.195 1.00 0.89 H new ATOM 0 HD21 LEU A 67 -18.682 -6.494 6.069 1.00 1.39 H new ATOM 0 HD22 LEU A 67 -19.315 -7.674 4.896 1.00 1.39 H new ATOM 0 HD23 LEU A 67 -17.748 -7.960 5.689 1.00 1.39 H new ATOM 1114 N GLU A 68 -14.569 -8.648 2.384 1.00 0.50 N ATOM 1115 CA GLU A 68 -13.278 -9.244 2.826 1.00 0.55 C ATOM 1116 C GLU A 68 -12.144 -8.645 1.993 1.00 0.52 C ATOM 1117 O GLU A 68 -11.128 -8.231 2.515 1.00 0.52 O ATOM 1118 CB GLU A 68 -13.317 -10.760 2.620 1.00 0.62 C ATOM 1119 CG GLU A 68 -14.408 -11.368 3.502 1.00 1.34 C ATOM 1120 CD GLU A 68 -14.988 -12.606 2.816 1.00 1.80 C ATOM 1121 OE1 GLU A 68 -14.298 -13.612 2.772 1.00 2.26 O ATOM 1122 OE2 GLU A 68 -16.111 -12.528 2.347 1.00 2.26 O ATOM 0 H GLU A 68 -15.172 -9.268 1.844 1.00 0.50 H new ATOM 0 HA GLU A 68 -13.115 -9.029 3.882 1.00 0.55 H new ATOM 0 HB2 GLU A 68 -13.511 -10.990 1.572 1.00 0.62 H new ATOM 0 HB3 GLU A 68 -12.349 -11.196 2.868 1.00 0.62 H new ATOM 0 HG2 GLU A 68 -13.996 -11.638 4.474 1.00 1.34 H new ATOM 0 HG3 GLU A 68 -15.196 -10.636 3.681 1.00 1.34 H new ATOM 1129 N ASP A 69 -12.309 -8.601 0.699 1.00 0.51 N ATOM 1130 CA ASP A 69 -11.242 -8.036 -0.175 1.00 0.51 C ATOM 1131 C ASP A 69 -10.903 -6.609 0.261 1.00 0.46 C ATOM 1132 O ASP A 69 -9.772 -6.306 0.585 1.00 0.48 O ATOM 1133 CB ASP A 69 -11.727 -8.016 -1.627 1.00 0.53 C ATOM 1134 CG ASP A 69 -12.566 -9.264 -1.904 1.00 0.62 C ATOM 1135 OD1 ASP A 69 -12.479 -10.198 -1.123 1.00 1.34 O ATOM 1136 OD2 ASP A 69 -13.280 -9.266 -2.892 1.00 1.13 O ATOM 0 H ASP A 69 -13.139 -8.933 0.208 1.00 0.51 H new ATOM 0 HA ASP A 69 -10.351 -8.658 -0.090 1.00 0.51 H new ATOM 0 HB2 ASP A 69 -12.319 -7.119 -1.811 1.00 0.53 H new ATOM 0 HB3 ASP A 69 -10.875 -7.980 -2.305 1.00 0.53 H new ATOM 1141 N ILE A 70 -11.864 -5.722 0.262 1.00 0.43 N ATOM 1142 CA ILE A 70 -11.568 -4.318 0.667 1.00 0.43 C ATOM 1143 C ILE A 70 -10.977 -4.300 2.079 1.00 0.42 C ATOM 1144 O ILE A 70 -10.093 -3.521 2.377 1.00 0.43 O ATOM 1145 CB ILE A 70 -12.852 -3.479 0.615 1.00 0.48 C ATOM 1146 CG1 ILE A 70 -12.516 -2.000 0.836 1.00 0.89 C ATOM 1147 CG2 ILE A 70 -13.818 -3.944 1.701 1.00 0.78 C ATOM 1148 CD1 ILE A 70 -13.807 -1.209 1.048 1.00 1.29 C ATOM 0 H ILE A 70 -12.833 -5.908 0.002 1.00 0.43 H new ATOM 0 HA ILE A 70 -10.842 -3.889 -0.023 1.00 0.43 H new ATOM 0 HB ILE A 70 -13.317 -3.604 -0.363 1.00 0.48 H new ATOM 0 HG12 ILE A 70 -11.863 -1.890 1.702 1.00 0.89 H new ATOM 0 HG13 ILE A 70 -11.973 -1.607 -0.024 1.00 0.89 H new ATOM 0 HG21 ILE A 70 -14.728 -3.345 1.660 1.00 0.78 H new ATOM 0 HG22 ILE A 70 -14.067 -4.993 1.542 1.00 0.78 H new ATOM 0 HG23 ILE A 70 -13.350 -3.826 2.679 1.00 0.78 H new ATOM 0 HD11 ILE A 70 -13.568 -0.157 1.205 1.00 1.29 H new ATOM 0 HD12 ILE A 70 -14.443 -1.309 0.169 1.00 1.29 H new ATOM 0 HD13 ILE A 70 -14.332 -1.596 1.921 1.00 1.29 H new ATOM 1160 N ARG A 71 -11.448 -5.147 2.952 1.00 0.43 N ATOM 1161 CA ARG A 71 -10.901 -5.167 4.332 1.00 0.47 C ATOM 1162 C ARG A 71 -9.378 -5.326 4.282 1.00 0.48 C ATOM 1163 O ARG A 71 -8.647 -4.597 4.920 1.00 0.51 O ATOM 1164 CB ARG A 71 -11.506 -6.343 5.096 1.00 0.51 C ATOM 1165 CG ARG A 71 -12.474 -5.822 6.160 1.00 0.81 C ATOM 1166 CD ARG A 71 -11.686 -5.149 7.285 1.00 1.02 C ATOM 1167 NE ARG A 71 -11.757 -5.990 8.513 1.00 1.58 N ATOM 1168 CZ ARG A 71 -11.005 -5.710 9.541 1.00 2.24 C ATOM 1169 NH1 ARG A 71 -10.188 -4.692 9.494 1.00 2.68 N ATOM 1170 NH2 ARG A 71 -11.067 -6.447 10.616 1.00 3.04 N ATOM 0 H ARG A 71 -12.188 -5.825 2.767 1.00 0.43 H new ATOM 0 HA ARG A 71 -11.150 -4.232 4.834 1.00 0.47 H new ATOM 0 HB2 ARG A 71 -12.030 -7.006 4.407 1.00 0.51 H new ATOM 0 HB3 ARG A 71 -10.716 -6.930 5.565 1.00 0.51 H new ATOM 0 HG2 ARG A 71 -13.171 -5.112 5.715 1.00 0.81 H new ATOM 0 HG3 ARG A 71 -13.068 -6.644 6.560 1.00 0.81 H new ATOM 0 HD2 ARG A 71 -10.647 -5.012 6.985 1.00 1.02 H new ATOM 0 HD3 ARG A 71 -12.093 -4.158 7.486 1.00 1.02 H new ATOM 0 HE ARG A 71 -12.394 -6.785 8.550 1.00 1.58 H new ATOM 0 HH11 ARG A 71 -10.138 -4.116 8.653 1.00 2.68 H new ATOM 0 HH12 ARG A 71 -9.600 -4.473 10.298 1.00 2.68 H new ATOM 0 HH21 ARG A 71 -11.704 -7.243 10.653 1.00 3.04 H new ATOM 0 HH22 ARG A 71 -10.478 -6.227 11.420 1.00 3.04 H new ATOM 1184 N LYS A 72 -8.900 -6.286 3.537 1.00 0.49 N ATOM 1185 CA LYS A 72 -7.428 -6.513 3.454 1.00 0.52 C ATOM 1186 C LYS A 72 -6.724 -5.283 2.870 1.00 0.49 C ATOM 1187 O LYS A 72 -5.778 -4.777 3.439 1.00 0.50 O ATOM 1188 CB LYS A 72 -7.153 -7.725 2.562 1.00 0.57 C ATOM 1189 CG LYS A 72 -7.835 -8.961 3.153 1.00 0.69 C ATOM 1190 CD LYS A 72 -7.345 -10.213 2.423 1.00 0.93 C ATOM 1191 CE LYS A 72 -6.163 -10.817 3.182 1.00 1.44 C ATOM 1192 NZ LYS A 72 -6.660 -11.513 4.403 1.00 1.87 N ATOM 0 H LYS A 72 -9.468 -6.925 2.980 1.00 0.49 H new ATOM 0 HA LYS A 72 -7.044 -6.692 4.458 1.00 0.52 H new ATOM 0 HB2 LYS A 72 -7.524 -7.539 1.554 1.00 0.57 H new ATOM 0 HB3 LYS A 72 -6.079 -7.893 2.481 1.00 0.57 H new ATOM 0 HG2 LYS A 72 -7.613 -9.038 4.217 1.00 0.69 H new ATOM 0 HG3 LYS A 72 -8.917 -8.872 3.059 1.00 0.69 H new ATOM 0 HD2 LYS A 72 -8.152 -10.942 2.347 1.00 0.93 H new ATOM 0 HD3 LYS A 72 -7.046 -9.960 1.406 1.00 0.93 H new ATOM 0 HE2 LYS A 72 -5.627 -11.519 2.543 1.00 1.44 H new ATOM 0 HE3 LYS A 72 -5.456 -10.034 3.459 1.00 1.44 H new ATOM 0 HZ1 LYS A 72 -5.959 -12.217 4.711 1.00 1.87 H new ATOM 0 HZ2 LYS A 72 -6.809 -10.818 5.162 1.00 1.87 H new ATOM 0 HZ3 LYS A 72 -7.559 -11.990 4.189 1.00 1.87 H new ATOM 1206 N PHE A 73 -7.166 -4.809 1.734 1.00 0.48 N ATOM 1207 CA PHE A 73 -6.507 -3.622 1.109 1.00 0.47 C ATOM 1208 C PHE A 73 -6.258 -2.556 2.177 1.00 0.46 C ATOM 1209 O PHE A 73 -5.148 -2.112 2.381 1.00 0.46 O ATOM 1210 CB PHE A 73 -7.414 -3.055 0.016 1.00 0.45 C ATOM 1211 CG PHE A 73 -7.398 -1.546 0.070 1.00 0.46 C ATOM 1212 CD1 PHE A 73 -6.406 -0.837 -0.614 1.00 1.35 C ATOM 1213 CD2 PHE A 73 -8.373 -0.857 0.802 1.00 1.20 C ATOM 1214 CE1 PHE A 73 -6.386 0.562 -0.567 1.00 1.34 C ATOM 1215 CE2 PHE A 73 -8.354 0.542 0.848 1.00 1.27 C ATOM 1216 CZ PHE A 73 -7.360 1.252 0.165 1.00 0.58 C ATOM 0 H PHE A 73 -7.954 -5.192 1.212 1.00 0.48 H new ATOM 0 HA PHE A 73 -5.555 -3.921 0.670 1.00 0.47 H new ATOM 0 HB2 PHE A 73 -7.077 -3.397 -0.963 1.00 0.45 H new ATOM 0 HB3 PHE A 73 -8.432 -3.422 0.149 1.00 0.45 H new ATOM 0 HD1 PHE A 73 -5.655 -1.369 -1.179 1.00 1.35 H new ATOM 0 HD2 PHE A 73 -9.139 -1.405 1.331 1.00 1.20 H new ATOM 0 HE1 PHE A 73 -5.619 1.109 -1.095 1.00 1.34 H new ATOM 0 HE2 PHE A 73 -9.107 1.074 1.411 1.00 1.27 H new ATOM 0 HZ PHE A 73 -7.344 2.331 0.202 1.00 0.58 H new ATOM 1226 N ASN A 74 -7.284 -2.151 2.862 1.00 0.47 N ATOM 1227 CA ASN A 74 -7.106 -1.122 3.923 1.00 0.48 C ATOM 1228 C ASN A 74 -6.164 -1.676 4.985 1.00 0.50 C ATOM 1229 O ASN A 74 -5.401 -0.954 5.596 1.00 0.52 O ATOM 1230 CB ASN A 74 -8.460 -0.791 4.555 1.00 0.48 C ATOM 1231 CG ASN A 74 -8.302 0.380 5.526 1.00 0.67 C ATOM 1232 OD1 ASN A 74 -7.727 0.231 6.586 1.00 1.58 O ATOM 1233 ND2 ASN A 74 -8.793 1.546 5.208 1.00 1.06 N ATOM 0 H ASN A 74 -8.239 -2.486 2.736 1.00 0.47 H new ATOM 0 HA ASN A 74 -6.687 -0.213 3.492 1.00 0.48 H new ATOM 0 HB2 ASN A 74 -9.182 -0.538 3.779 1.00 0.48 H new ATOM 0 HB3 ASN A 74 -8.850 -1.662 5.081 1.00 0.48 H new ATOM 0 HD21 ASN A 74 -8.694 2.333 5.849 1.00 1.06 H new ATOM 0 HD22 ASN A 74 -9.276 1.671 4.318 1.00 1.06 H new ATOM 1240 N GLU A 75 -6.220 -2.955 5.215 1.00 0.51 N ATOM 1241 CA GLU A 75 -5.348 -3.568 6.237 1.00 0.55 C ATOM 1242 C GLU A 75 -3.910 -3.658 5.718 1.00 0.55 C ATOM 1243 O GLU A 75 -2.972 -3.634 6.489 1.00 0.65 O ATOM 1244 CB GLU A 75 -5.873 -4.965 6.551 1.00 0.59 C ATOM 1245 CG GLU A 75 -5.453 -5.374 7.962 1.00 0.87 C ATOM 1246 CD GLU A 75 -6.015 -6.761 8.279 1.00 1.22 C ATOM 1247 OE1 GLU A 75 -5.806 -7.661 7.481 1.00 1.79 O ATOM 1248 OE2 GLU A 75 -6.646 -6.900 9.313 1.00 1.77 O ATOM 0 H GLU A 75 -6.840 -3.604 4.731 1.00 0.51 H new ATOM 0 HA GLU A 75 -5.353 -2.956 7.139 1.00 0.55 H new ATOM 0 HB2 GLU A 75 -6.960 -4.982 6.466 1.00 0.59 H new ATOM 0 HB3 GLU A 75 -5.486 -5.680 5.825 1.00 0.59 H new ATOM 0 HG2 GLU A 75 -4.366 -5.384 8.041 1.00 0.87 H new ATOM 0 HG3 GLU A 75 -5.819 -4.647 8.687 1.00 0.87 H new ATOM 1255 N MET A 76 -3.713 -3.741 4.423 1.00 0.52 N ATOM 1256 CA MET A 76 -2.332 -3.811 3.883 1.00 0.51 C ATOM 1257 C MET A 76 -1.928 -2.407 3.462 1.00 0.51 C ATOM 1258 O MET A 76 -0.783 -2.013 3.565 1.00 0.52 O ATOM 1259 CB MET A 76 -2.305 -4.738 2.665 1.00 0.50 C ATOM 1260 CG MET A 76 -2.463 -6.190 3.123 1.00 0.52 C ATOM 1261 SD MET A 76 -0.915 -7.084 2.844 1.00 0.55 S ATOM 1262 CE MET A 76 -1.300 -8.527 3.866 1.00 0.65 C ATOM 0 H MET A 76 -4.454 -3.763 3.722 1.00 0.52 H new ATOM 0 HA MET A 76 -1.645 -4.199 4.635 1.00 0.51 H new ATOM 0 HB2 MET A 76 -3.107 -4.474 1.976 1.00 0.50 H new ATOM 0 HB3 MET A 76 -1.367 -4.617 2.123 1.00 0.50 H new ATOM 0 HG2 MET A 76 -2.728 -6.222 4.180 1.00 0.52 H new ATOM 0 HG3 MET A 76 -3.275 -6.669 2.576 1.00 0.52 H new ATOM 0 HE1 MET A 76 -0.464 -9.226 3.839 1.00 0.65 H new ATOM 0 HE2 MET A 76 -1.474 -8.209 4.894 1.00 0.65 H new ATOM 0 HE3 MET A 76 -2.195 -9.017 3.482 1.00 0.65 H new ATOM 1272 N ARG A 77 -2.875 -1.643 2.987 1.00 0.50 N ATOM 1273 CA ARG A 77 -2.575 -0.259 2.555 1.00 0.50 C ATOM 1274 C ARG A 77 -1.994 0.528 3.729 1.00 0.51 C ATOM 1275 O ARG A 77 -0.972 1.175 3.615 1.00 0.52 O ATOM 1276 CB ARG A 77 -3.860 0.417 2.074 1.00 0.49 C ATOM 1277 CG ARG A 77 -3.540 1.823 1.563 1.00 0.52 C ATOM 1278 CD ARG A 77 -4.259 2.854 2.435 1.00 0.54 C ATOM 1279 NE ARG A 77 -3.920 4.227 1.966 1.00 0.85 N ATOM 1280 CZ ARG A 77 -4.151 5.254 2.737 1.00 1.35 C ATOM 1281 NH1 ARG A 77 -4.676 5.077 3.919 1.00 1.85 N ATOM 1282 NH2 ARG A 77 -3.857 6.458 2.327 1.00 1.84 N ATOM 0 H ARG A 77 -3.849 -1.926 2.881 1.00 0.50 H new ATOM 0 HA ARG A 77 -1.851 -0.283 1.740 1.00 0.50 H new ATOM 0 HB2 ARG A 77 -4.319 -0.174 1.281 1.00 0.49 H new ATOM 0 HB3 ARG A 77 -4.582 0.471 2.889 1.00 0.49 H new ATOM 0 HG2 ARG A 77 -2.464 1.995 1.588 1.00 0.52 H new ATOM 0 HG3 ARG A 77 -3.855 1.925 0.524 1.00 0.52 H new ATOM 0 HD2 ARG A 77 -5.337 2.698 2.387 1.00 0.54 H new ATOM 0 HD3 ARG A 77 -3.965 2.732 3.478 1.00 0.54 H new ATOM 0 HE ARG A 77 -3.508 4.364 1.043 1.00 0.85 H new ATOM 0 HH11 ARG A 77 -4.905 4.136 4.239 1.00 1.85 H new ATOM 0 HH12 ARG A 77 -4.857 5.879 4.522 1.00 1.85 H new ATOM 0 HH21 ARG A 77 -3.447 6.596 1.404 1.00 1.84 H new ATOM 0 HH22 ARG A 77 -4.038 7.260 2.930 1.00 1.84 H new ATOM 1296 N LYS A 78 -2.631 0.455 4.868 1.00 0.51 N ATOM 1297 CA LYS A 78 -2.108 1.172 6.057 1.00 0.52 C ATOM 1298 C LYS A 78 -0.805 0.505 6.471 1.00 0.53 C ATOM 1299 O LYS A 78 0.105 1.141 6.959 1.00 0.55 O ATOM 1300 CB LYS A 78 -3.114 1.083 7.204 1.00 0.52 C ATOM 1301 CG LYS A 78 -2.376 1.278 8.530 1.00 0.90 C ATOM 1302 CD LYS A 78 -3.354 1.733 9.614 1.00 1.04 C ATOM 1303 CE LYS A 78 -3.574 3.247 9.521 1.00 1.45 C ATOM 1304 NZ LYS A 78 -2.700 3.934 10.513 1.00 2.15 N ATOM 0 H LYS A 78 -3.491 -0.072 5.022 1.00 0.51 H new ATOM 0 HA LYS A 78 -1.943 2.223 5.820 1.00 0.52 H new ATOM 0 HB2 LYS A 78 -3.886 1.844 7.087 1.00 0.52 H new ATOM 0 HB3 LYS A 78 -3.615 0.115 7.191 1.00 0.52 H new ATOM 0 HG2 LYS A 78 -1.897 0.346 8.829 1.00 0.90 H new ATOM 0 HG3 LYS A 78 -1.585 2.018 8.409 1.00 0.90 H new ATOM 0 HD2 LYS A 78 -4.304 1.212 9.500 1.00 1.04 H new ATOM 0 HD3 LYS A 78 -2.965 1.474 10.599 1.00 1.04 H new ATOM 0 HE2 LYS A 78 -3.347 3.598 8.514 1.00 1.45 H new ATOM 0 HE3 LYS A 78 -4.620 3.486 9.713 1.00 1.45 H new ATOM 0 HZ1 LYS A 78 -2.847 4.962 10.452 1.00 2.15 H new ATOM 0 HZ2 LYS A 78 -2.938 3.606 11.471 1.00 2.15 H new ATOM 0 HZ3 LYS A 78 -1.704 3.714 10.309 1.00 2.15 H new ATOM 1318 N ASN A 79 -0.699 -0.775 6.248 1.00 0.52 N ATOM 1319 CA ASN A 79 0.561 -1.478 6.602 1.00 0.53 C ATOM 1320 C ASN A 79 1.672 -0.914 5.727 1.00 0.54 C ATOM 1321 O ASN A 79 2.725 -0.536 6.198 1.00 0.54 O ATOM 1322 CB ASN A 79 0.414 -2.977 6.348 1.00 0.54 C ATOM 1323 CG ASN A 79 1.322 -3.748 7.307 1.00 0.60 C ATOM 1324 OD1 ASN A 79 2.530 -3.706 7.185 1.00 1.17 O ATOM 1325 ND2 ASN A 79 0.787 -4.457 8.263 1.00 1.14 N ATOM 0 H ASN A 79 -1.427 -1.360 5.838 1.00 0.52 H new ATOM 0 HA ASN A 79 0.792 -1.330 7.657 1.00 0.53 H new ATOM 0 HB2 ASN A 79 -0.623 -3.281 6.489 1.00 0.54 H new ATOM 0 HB3 ASN A 79 0.676 -3.209 5.316 1.00 0.54 H new ATOM 0 HD21 ASN A 79 1.383 -4.976 8.908 1.00 1.14 H new ATOM 0 HD22 ASN A 79 -0.227 -4.492 8.365 1.00 1.14 H new ATOM 1332 N MET A 80 1.425 -0.834 4.449 1.00 0.56 N ATOM 1333 CA MET A 80 2.445 -0.276 3.529 1.00 0.58 C ATOM 1334 C MET A 80 2.869 1.092 4.064 1.00 0.57 C ATOM 1335 O MET A 80 4.035 1.341 4.299 1.00 0.56 O ATOM 1336 CB MET A 80 1.833 -0.155 2.122 1.00 0.60 C ATOM 1337 CG MET A 80 2.436 1.031 1.358 1.00 0.64 C ATOM 1338 SD MET A 80 1.883 0.985 -0.364 1.00 1.38 S ATOM 1339 CE MET A 80 2.069 2.750 -0.711 1.00 1.16 C ATOM 0 H MET A 80 0.557 -1.133 4.004 1.00 0.56 H new ATOM 0 HA MET A 80 3.320 -0.923 3.468 1.00 0.58 H new ATOM 0 HB2 MET A 80 2.007 -1.076 1.566 1.00 0.60 H new ATOM 0 HB3 MET A 80 0.753 -0.030 2.201 1.00 0.60 H new ATOM 0 HG2 MET A 80 2.133 1.969 1.823 1.00 0.64 H new ATOM 0 HG3 MET A 80 3.524 0.990 1.403 1.00 0.64 H new ATOM 0 HE1 MET A 80 1.776 2.951 -1.742 1.00 1.16 H new ATOM 0 HE2 MET A 80 1.434 3.323 -0.035 1.00 1.16 H new ATOM 0 HE3 MET A 80 3.109 3.042 -0.566 1.00 1.16 H new ATOM 1349 N ASP A 81 1.931 1.980 4.275 1.00 0.58 N ATOM 1350 CA ASP A 81 2.274 3.326 4.812 1.00 0.58 C ATOM 1351 C ASP A 81 2.973 3.188 6.166 1.00 0.56 C ATOM 1352 O ASP A 81 3.947 3.862 6.440 1.00 0.56 O ATOM 1353 CB ASP A 81 0.987 4.136 4.979 1.00 0.59 C ATOM 1354 CG ASP A 81 1.248 5.597 4.606 1.00 0.61 C ATOM 1355 OD1 ASP A 81 1.764 5.827 3.524 1.00 1.12 O ATOM 1356 OD2 ASP A 81 0.928 6.459 5.406 1.00 1.22 O ATOM 0 H ASP A 81 0.938 1.827 4.097 1.00 0.58 H new ATOM 0 HA ASP A 81 2.946 3.834 4.120 1.00 0.58 H new ATOM 0 HB2 ASP A 81 0.201 3.723 4.346 1.00 0.59 H new ATOM 0 HB3 ASP A 81 0.635 4.070 6.008 1.00 0.59 H new ATOM 1361 N GLN A 82 2.507 2.302 7.008 1.00 0.56 N ATOM 1362 CA GLN A 82 3.177 2.111 8.326 1.00 0.54 C ATOM 1363 C GLN A 82 4.609 1.672 8.045 1.00 0.53 C ATOM 1364 O GLN A 82 5.566 2.203 8.573 1.00 0.55 O ATOM 1365 CB GLN A 82 2.461 1.008 9.114 1.00 0.55 C ATOM 1366 CG GLN A 82 1.039 1.440 9.464 1.00 1.12 C ATOM 1367 CD GLN A 82 0.961 1.775 10.954 1.00 0.77 C ATOM 1368 OE1 GLN A 82 1.299 2.869 11.360 1.00 1.13 O ATOM 1369 NE2 GLN A 82 0.529 0.874 11.793 1.00 1.43 N ATOM 0 H GLN A 82 1.696 1.706 6.840 1.00 0.56 H new ATOM 0 HA GLN A 82 3.153 3.033 8.907 1.00 0.54 H new ATOM 0 HB2 GLN A 82 2.435 0.091 8.526 1.00 0.55 H new ATOM 0 HB3 GLN A 82 3.015 0.786 10.026 1.00 0.55 H new ATOM 0 HG2 GLN A 82 0.754 2.308 8.870 1.00 1.12 H new ATOM 0 HG3 GLN A 82 0.335 0.643 9.222 1.00 1.12 H new ATOM 0 HE21 GLN A 82 0.245 -0.045 11.453 1.00 1.43 H new ATOM 0 HE22 GLN A 82 0.475 1.088 12.789 1.00 1.43 H new ATOM 1378 N LEU A 83 4.736 0.702 7.190 1.00 0.51 N ATOM 1379 CA LEU A 83 6.084 0.202 6.821 1.00 0.51 C ATOM 1380 C LEU A 83 6.835 1.347 6.145 1.00 0.52 C ATOM 1381 O LEU A 83 7.983 1.611 6.440 1.00 0.53 O ATOM 1382 CB LEU A 83 5.954 -0.992 5.874 1.00 0.49 C ATOM 1383 CG LEU A 83 5.356 -2.177 6.643 1.00 0.47 C ATOM 1384 CD1 LEU A 83 5.061 -3.321 5.678 1.00 0.52 C ATOM 1385 CD2 LEU A 83 6.338 -2.666 7.716 1.00 0.48 C ATOM 0 H LEU A 83 3.959 0.231 6.728 1.00 0.51 H new ATOM 0 HA LEU A 83 6.629 -0.130 7.705 1.00 0.51 H new ATOM 0 HB2 LEU A 83 5.318 -0.733 5.027 1.00 0.49 H new ATOM 0 HB3 LEU A 83 6.930 -1.260 5.470 1.00 0.49 H new ATOM 0 HG LEU A 83 4.433 -1.850 7.123 1.00 0.47 H new ATOM 0 HD11 LEU A 83 4.636 -4.161 6.228 1.00 0.52 H new ATOM 0 HD12 LEU A 83 4.350 -2.986 4.923 1.00 0.52 H new ATOM 0 HD13 LEU A 83 5.985 -3.635 5.193 1.00 0.52 H new ATOM 0 HD21 LEU A 83 5.900 -3.507 8.254 1.00 0.48 H new ATOM 0 HD22 LEU A 83 7.267 -2.982 7.242 1.00 0.48 H new ATOM 0 HD23 LEU A 83 6.545 -1.856 8.416 1.00 0.48 H new ATOM 1397 N LYS A 84 6.183 2.050 5.259 1.00 0.53 N ATOM 1398 CA LYS A 84 6.846 3.202 4.588 1.00 0.56 C ATOM 1399 C LYS A 84 7.466 4.102 5.660 1.00 0.56 C ATOM 1400 O LYS A 84 8.594 4.549 5.548 1.00 0.57 O ATOM 1401 CB LYS A 84 5.807 4.002 3.801 1.00 0.57 C ATOM 1402 CG LYS A 84 6.516 5.043 2.931 1.00 0.58 C ATOM 1403 CD LYS A 84 5.479 5.858 2.156 1.00 0.75 C ATOM 1404 CE LYS A 84 5.998 7.284 1.954 1.00 0.77 C ATOM 1405 NZ LYS A 84 6.184 7.939 3.279 1.00 1.42 N ATOM 0 H LYS A 84 5.220 1.876 4.972 1.00 0.53 H new ATOM 0 HA LYS A 84 7.616 2.841 3.907 1.00 0.56 H new ATOM 0 HB2 LYS A 84 5.214 3.333 3.177 1.00 0.57 H new ATOM 0 HB3 LYS A 84 5.116 4.494 4.486 1.00 0.57 H new ATOM 0 HG2 LYS A 84 7.119 5.703 3.555 1.00 0.58 H new ATOM 0 HG3 LYS A 84 7.197 4.549 2.238 1.00 0.58 H new ATOM 0 HD2 LYS A 84 5.281 5.391 1.191 1.00 0.75 H new ATOM 0 HD3 LYS A 84 4.535 5.877 2.700 1.00 0.75 H new ATOM 0 HE2 LYS A 84 6.943 7.265 1.410 1.00 0.77 H new ATOM 0 HE3 LYS A 84 5.294 7.856 1.350 1.00 0.77 H new ATOM 0 HZ1 LYS A 84 5.935 8.946 3.206 1.00 1.42 H new ATOM 0 HZ2 LYS A 84 5.570 7.481 3.982 1.00 1.42 H new ATOM 0 HZ3 LYS A 84 7.177 7.848 3.575 1.00 1.42 H new ATOM 1419 N GLU A 85 6.731 4.373 6.703 1.00 0.55 N ATOM 1420 CA GLU A 85 7.260 5.242 7.787 1.00 0.55 C ATOM 1421 C GLU A 85 8.461 4.567 8.451 1.00 0.57 C ATOM 1422 O GLU A 85 9.412 5.213 8.841 1.00 0.57 O ATOM 1423 CB GLU A 85 6.168 5.475 8.835 1.00 0.55 C ATOM 1424 CG GLU A 85 6.816 5.766 10.194 1.00 0.56 C ATOM 1425 CD GLU A 85 5.802 6.454 11.109 1.00 0.56 C ATOM 1426 OE1 GLU A 85 4.886 5.783 11.557 1.00 1.18 O ATOM 1427 OE2 GLU A 85 5.960 7.640 11.349 1.00 1.12 O ATOM 0 H GLU A 85 5.783 4.027 6.850 1.00 0.55 H new ATOM 0 HA GLU A 85 7.570 6.197 7.362 1.00 0.55 H new ATOM 0 HB2 GLU A 85 5.535 6.310 8.536 1.00 0.55 H new ATOM 0 HB3 GLU A 85 5.525 4.598 8.907 1.00 0.55 H new ATOM 0 HG2 GLU A 85 7.161 4.838 10.650 1.00 0.56 H new ATOM 0 HG3 GLU A 85 7.692 6.401 10.062 1.00 0.56 H new ATOM 1434 N LYS A 86 8.429 3.272 8.578 1.00 0.58 N ATOM 1435 CA LYS A 86 9.573 2.560 9.211 1.00 0.61 C ATOM 1436 C LYS A 86 10.814 2.764 8.345 1.00 0.62 C ATOM 1437 O LYS A 86 11.919 2.871 8.839 1.00 0.63 O ATOM 1438 CB LYS A 86 9.257 1.067 9.319 1.00 0.62 C ATOM 1439 CG LYS A 86 9.492 0.593 10.756 1.00 0.65 C ATOM 1440 CD LYS A 86 9.122 -0.888 10.872 1.00 0.83 C ATOM 1441 CE LYS A 86 8.903 -1.247 12.343 1.00 1.01 C ATOM 1442 NZ LYS A 86 7.498 -0.936 12.728 1.00 1.24 N ATOM 0 H LYS A 86 7.661 2.675 8.271 1.00 0.58 H new ATOM 0 HA LYS A 86 9.749 2.955 10.211 1.00 0.61 H new ATOM 0 HB2 LYS A 86 8.223 0.882 9.029 1.00 0.62 H new ATOM 0 HB3 LYS A 86 9.886 0.501 8.632 1.00 0.62 H new ATOM 0 HG2 LYS A 86 10.536 0.741 11.033 1.00 0.65 H new ATOM 0 HG3 LYS A 86 8.892 1.184 11.448 1.00 0.65 H new ATOM 0 HD2 LYS A 86 8.218 -1.094 10.298 1.00 0.83 H new ATOM 0 HD3 LYS A 86 9.915 -1.506 10.450 1.00 0.83 H new ATOM 0 HE2 LYS A 86 9.110 -2.305 12.504 1.00 1.01 H new ATOM 0 HE3 LYS A 86 9.596 -0.687 12.972 1.00 1.01 H new ATOM 0 HZ1 LYS A 86 7.350 -1.180 13.728 1.00 1.24 H new ATOM 0 HZ2 LYS A 86 7.316 0.079 12.589 1.00 1.24 H new ATOM 0 HZ3 LYS A 86 6.845 -1.489 12.136 1.00 1.24 H new ATOM 1456 N ILE A 87 10.635 2.830 7.055 1.00 0.64 N ATOM 1457 CA ILE A 87 11.799 3.039 6.153 1.00 0.67 C ATOM 1458 C ILE A 87 12.379 4.426 6.407 1.00 0.65 C ATOM 1459 O ILE A 87 13.568 4.583 6.595 1.00 0.63 O ATOM 1460 CB ILE A 87 11.347 2.931 4.696 1.00 0.71 C ATOM 1461 CG1 ILE A 87 11.228 1.454 4.307 1.00 0.79 C ATOM 1462 CG2 ILE A 87 12.370 3.614 3.784 1.00 0.80 C ATOM 1463 CD1 ILE A 87 10.147 1.290 3.237 1.00 0.84 C ATOM 0 H ILE A 87 9.732 2.748 6.587 1.00 0.64 H new ATOM 0 HA ILE A 87 12.557 2.280 6.348 1.00 0.67 H new ATOM 0 HB ILE A 87 10.379 3.420 4.583 1.00 0.71 H new ATOM 0 HG12 ILE A 87 12.184 1.088 3.932 1.00 0.79 H new ATOM 0 HG13 ILE A 87 10.980 0.856 5.184 1.00 0.79 H new ATOM 0 HG21 ILE A 87 12.043 3.534 2.747 1.00 0.80 H new ATOM 0 HG22 ILE A 87 12.456 4.666 4.057 1.00 0.80 H new ATOM 0 HG23 ILE A 87 13.340 3.129 3.897 1.00 0.80 H new ATOM 0 HD11 ILE A 87 10.064 0.239 2.962 1.00 0.84 H new ATOM 0 HD12 ILE A 87 9.192 1.639 3.629 1.00 0.84 H new ATOM 0 HD13 ILE A 87 10.414 1.875 2.357 1.00 0.84 H new ATOM 1475 N ASN A 88 11.553 5.437 6.439 1.00 0.66 N ATOM 1476 CA ASN A 88 12.079 6.801 6.709 1.00 0.65 C ATOM 1477 C ASN A 88 12.726 6.828 8.092 1.00 0.62 C ATOM 1478 O ASN A 88 13.649 7.574 8.340 1.00 0.62 O ATOM 1479 CB ASN A 88 10.931 7.816 6.666 1.00 0.69 C ATOM 1480 CG ASN A 88 10.323 7.974 8.064 1.00 1.66 C ATOM 1481 OD1 ASN A 88 9.229 7.513 8.317 1.00 2.38 O ATOM 1482 ND2 ASN A 88 10.984 8.614 8.989 1.00 2.46 N ATOM 0 H ASN A 88 10.546 5.376 6.291 1.00 0.66 H new ATOM 0 HA ASN A 88 12.818 7.060 5.951 1.00 0.65 H new ATOM 0 HB2 ASN A 88 11.298 8.778 6.308 1.00 0.69 H new ATOM 0 HB3 ASN A 88 10.167 7.485 5.963 1.00 0.69 H new ATOM 0 HD21 ASN A 88 10.581 8.725 9.919 1.00 2.46 H new ATOM 0 HD22 ASN A 88 11.904 9.003 8.782 1.00 2.46 H new ATOM 1489 N SER A 89 12.229 6.037 9.004 1.00 0.61 N ATOM 1490 CA SER A 89 12.794 6.034 10.382 1.00 0.61 C ATOM 1491 C SER A 89 14.230 5.502 10.390 1.00 0.63 C ATOM 1492 O SER A 89 15.139 6.164 10.850 1.00 0.71 O ATOM 1493 CB SER A 89 11.927 5.148 11.276 1.00 0.62 C ATOM 1494 OG SER A 89 12.120 5.522 12.634 1.00 1.29 O ATOM 0 H SER A 89 11.454 5.391 8.853 1.00 0.61 H new ATOM 0 HA SER A 89 12.804 7.059 10.753 1.00 0.61 H new ATOM 0 HB2 SER A 89 10.877 5.253 11.003 1.00 0.62 H new ATOM 0 HB3 SER A 89 12.190 4.100 11.134 1.00 0.62 H new ATOM 0 HG SER A 89 11.564 4.957 13.211 1.00 1.29 H new ATOM 1500 N VAL A 90 14.450 4.312 9.899 1.00 0.58 N ATOM 1501 CA VAL A 90 15.827 3.740 9.892 1.00 0.60 C ATOM 1502 C VAL A 90 16.651 4.387 8.785 1.00 0.59 C ATOM 1503 O VAL A 90 17.798 4.742 8.973 1.00 0.63 O ATOM 1504 CB VAL A 90 15.748 2.237 9.649 1.00 0.61 C ATOM 1505 CG1 VAL A 90 17.055 1.578 10.090 1.00 0.52 C ATOM 1506 CG2 VAL A 90 14.584 1.651 10.451 1.00 0.81 C ATOM 0 H VAL A 90 13.731 3.708 9.500 1.00 0.58 H new ATOM 0 HA VAL A 90 16.302 3.934 10.854 1.00 0.60 H new ATOM 0 HB VAL A 90 15.588 2.049 8.587 1.00 0.61 H new ATOM 0 HG11 VAL A 90 16.998 0.504 9.916 1.00 0.52 H new ATOM 0 HG12 VAL A 90 17.884 1.995 9.518 1.00 0.52 H new ATOM 0 HG13 VAL A 90 17.217 1.765 11.151 1.00 0.52 H new ATOM 0 HG21 VAL A 90 14.527 0.576 10.278 1.00 0.81 H new ATOM 0 HG22 VAL A 90 14.743 1.839 11.513 1.00 0.81 H new ATOM 0 HG23 VAL A 90 13.652 2.119 10.135 1.00 0.81 H new ATOM 1516 N LEU A 91 16.066 4.552 7.633 1.00 0.57 N ATOM 1517 CA LEU A 91 16.805 5.187 6.517 1.00 0.61 C ATOM 1518 C LEU A 91 16.943 6.664 6.846 1.00 0.67 C ATOM 1519 O LEU A 91 17.618 7.401 6.163 1.00 0.70 O ATOM 1520 CB LEU A 91 16.020 5.017 5.212 1.00 0.62 C ATOM 1521 CG LEU A 91 16.959 5.183 4.011 1.00 0.72 C ATOM 1522 CD1 LEU A 91 17.949 4.014 3.941 1.00 0.91 C ATOM 1523 CD2 LEU A 91 16.130 5.219 2.725 1.00 0.97 C ATOM 0 H LEU A 91 15.108 4.274 7.419 1.00 0.57 H new ATOM 0 HA LEU A 91 17.785 4.727 6.391 1.00 0.61 H new ATOM 0 HB2 LEU A 91 15.552 4.033 5.185 1.00 0.62 H new ATOM 0 HB3 LEU A 91 15.218 5.753 5.162 1.00 0.62 H new ATOM 0 HG LEU A 91 17.517 6.113 4.124 1.00 0.72 H new ATOM 0 HD11 LEU A 91 18.608 4.147 3.083 1.00 0.91 H new ATOM 0 HD12 LEU A 91 18.543 3.985 4.854 1.00 0.91 H new ATOM 0 HD13 LEU A 91 17.400 3.078 3.835 1.00 0.91 H new ATOM 0 HD21 LEU A 91 16.793 5.337 1.868 1.00 0.97 H new ATOM 0 HD22 LEU A 91 15.571 4.288 2.626 1.00 0.97 H new ATOM 0 HD23 LEU A 91 15.435 6.057 2.764 1.00 0.97 H new ATOM 1535 N SER A 92 16.312 7.083 7.913 1.00 0.71 N ATOM 1536 CA SER A 92 16.392 8.514 8.337 1.00 0.81 C ATOM 1537 C SER A 92 16.383 9.430 7.114 1.00 0.88 C ATOM 1538 O SER A 92 16.870 10.536 7.166 1.00 1.04 O ATOM 1539 CB SER A 92 17.690 8.734 9.111 1.00 0.85 C ATOM 1540 OG SER A 92 17.425 9.522 10.263 1.00 0.94 O ATOM 0 H SER A 92 15.740 6.490 8.514 1.00 0.71 H new ATOM 0 HA SER A 92 15.532 8.747 8.965 1.00 0.81 H new ATOM 0 HB2 SER A 92 18.119 7.775 9.403 1.00 0.85 H new ATOM 0 HB3 SER A 92 18.424 9.232 8.477 1.00 0.85 H new ATOM 0 HG SER A 92 18.215 9.530 10.843 1.00 0.94 H new ATOM 1546 N ILE A 93 15.807 8.979 6.027 1.00 0.85 N ATOM 1547 CA ILE A 93 15.733 9.824 4.783 1.00 0.92 C ATOM 1548 C ILE A 93 17.048 10.583 4.548 1.00 1.05 C ATOM 1549 O ILE A 93 17.884 10.167 3.772 1.00 1.13 O ATOM 1550 CB ILE A 93 14.586 10.828 4.906 1.00 1.02 C ATOM 1551 CG1 ILE A 93 13.314 10.094 5.331 1.00 1.07 C ATOM 1552 CG2 ILE A 93 14.356 11.504 3.552 1.00 1.16 C ATOM 1553 CD1 ILE A 93 12.182 11.104 5.540 1.00 1.65 C ATOM 0 H ILE A 93 15.381 8.056 5.943 1.00 0.85 H new ATOM 0 HA ILE A 93 15.559 9.161 3.935 1.00 0.92 H new ATOM 0 HB ILE A 93 14.838 11.582 5.651 1.00 1.02 H new ATOM 0 HG12 ILE A 93 13.030 9.367 4.570 1.00 1.07 H new ATOM 0 HG13 ILE A 93 13.493 9.538 6.251 1.00 1.07 H new ATOM 0 HG21 ILE A 93 13.539 12.220 3.637 1.00 1.16 H new ATOM 0 HG22 ILE A 93 15.264 12.024 3.246 1.00 1.16 H new ATOM 0 HG23 ILE A 93 14.101 10.750 2.807 1.00 1.16 H new ATOM 0 HD11 ILE A 93 11.277 10.578 5.843 1.00 1.65 H new ATOM 0 HD12 ILE A 93 12.466 11.814 6.317 1.00 1.65 H new ATOM 0 HD13 ILE A 93 11.996 11.640 4.609 1.00 1.65 H new ATOM 1565 N ARG A 94 17.231 11.699 5.202 1.00 1.20 N ATOM 1566 CA ARG A 94 18.484 12.484 5.019 1.00 1.42 C ATOM 1567 C ARG A 94 18.783 13.254 6.311 1.00 1.49 C ATOM 1568 O ARG A 94 19.474 14.252 6.314 1.00 1.74 O ATOM 1569 CB ARG A 94 18.311 13.469 3.860 1.00 1.79 C ATOM 1570 CG ARG A 94 19.375 13.208 2.789 1.00 2.10 C ATOM 1571 CD ARG A 94 20.768 13.343 3.409 1.00 2.55 C ATOM 1572 NE ARG A 94 21.664 14.134 2.510 1.00 3.16 N ATOM 1573 CZ ARG A 94 21.395 15.381 2.229 1.00 3.74 C ATOM 1574 NH1 ARG A 94 20.325 15.950 2.711 1.00 3.85 N ATOM 1575 NH2 ARG A 94 22.202 16.060 1.459 1.00 4.56 N ATOM 0 H ARG A 94 16.562 12.102 5.858 1.00 1.20 H new ATOM 0 HA ARG A 94 19.310 11.810 4.792 1.00 1.42 H new ATOM 0 HB2 ARG A 94 17.315 13.365 3.429 1.00 1.79 H new ATOM 0 HB3 ARG A 94 18.394 14.492 4.226 1.00 1.79 H new ATOM 0 HG2 ARG A 94 19.247 12.210 2.370 1.00 2.10 H new ATOM 0 HG3 ARG A 94 19.261 13.916 1.968 1.00 2.10 H new ATOM 0 HD2 ARG A 94 20.695 13.831 4.381 1.00 2.55 H new ATOM 0 HD3 ARG A 94 21.194 12.355 3.580 1.00 2.55 H new ATOM 0 HE ARG A 94 22.494 13.695 2.112 1.00 3.16 H new ATOM 0 HH11 ARG A 94 19.692 15.421 3.311 1.00 3.85 H new ATOM 0 HH12 ARG A 94 20.121 16.924 2.488 1.00 3.85 H new ATOM 0 HH21 ARG A 94 23.038 15.616 1.080 1.00 4.56 H new ATOM 0 HH22 ARG A 94 21.996 17.034 1.237 1.00 4.56 H new ATOM 1589 N GLN A 95 18.258 12.786 7.407 1.00 1.46 N ATOM 1590 CA GLN A 95 18.488 13.469 8.715 1.00 1.61 C ATOM 1591 C GLN A 95 18.326 14.981 8.542 1.00 2.21 C ATOM 1592 O GLN A 95 17.196 15.425 8.420 1.00 2.75 O ATOM 1593 CB GLN A 95 19.905 13.163 9.215 1.00 1.83 C ATOM 1594 CG GLN A 95 19.931 11.785 9.881 1.00 2.35 C ATOM 1595 CD GLN A 95 19.826 11.945 11.399 1.00 2.88 C ATOM 1596 OE1 GLN A 95 18.741 11.962 11.947 1.00 3.43 O ATOM 1597 NE2 GLN A 95 20.915 12.063 12.107 1.00 3.20 N ATOM 1598 OXT GLN A 95 19.334 15.669 8.537 1.00 2.78 O ATOM 0 H GLN A 95 17.673 11.952 7.456 1.00 1.46 H new ATOM 0 HA GLN A 95 17.760 13.106 9.441 1.00 1.61 H new ATOM 0 HB2 GLN A 95 20.608 13.188 8.383 1.00 1.83 H new ATOM 0 HB3 GLN A 95 20.223 13.927 9.925 1.00 1.83 H new ATOM 0 HG2 GLN A 95 19.106 11.176 9.512 1.00 2.35 H new ATOM 0 HG3 GLN A 95 20.853 11.263 9.623 1.00 2.35 H new ATOM 0 HE21 GLN A 95 21.826 12.049 11.648 1.00 3.20 H new ATOM 0 HE22 GLN A 95 20.856 12.169 13.120 1.00 3.20 H new TER 1607 GLN A 95 ATOM 1608 N ALA B 1 9.941 6.694 -13.457 1.00 5.31 N ATOM 1609 CA ALA B 1 9.099 6.589 -12.232 1.00 4.73 C ATOM 1610 C ALA B 1 9.965 6.134 -11.056 1.00 4.10 C ATOM 1611 O ALA B 1 11.003 5.528 -11.235 1.00 3.94 O ATOM 1612 CB ALA B 1 7.982 5.570 -12.467 1.00 4.76 C ATOM 0 H1 ALA B 1 10.069 7.696 -13.705 1.00 5.31 H new ATOM 0 H2 ALA B 1 10.869 6.260 -13.278 1.00 5.31 H new ATOM 0 H3 ALA B 1 9.473 6.199 -14.243 1.00 5.31 H new ATOM 0 HA ALA B 1 8.662 7.562 -12.007 1.00 4.73 H new ATOM 0 HB1 ALA B 1 7.366 5.493 -11.571 1.00 4.76 H new ATOM 0 HB2 ALA B 1 7.365 5.893 -13.305 1.00 4.76 H new ATOM 0 HB3 ALA B 1 8.419 4.597 -12.692 1.00 4.76 H new ATOM 1620 N LYS B 2 9.548 6.423 -9.854 1.00 4.19 N ATOM 1621 CA LYS B 2 10.347 6.007 -8.667 1.00 4.06 C ATOM 1622 C LYS B 2 10.521 4.487 -8.676 1.00 3.61 C ATOM 1623 O LYS B 2 9.568 3.742 -8.554 1.00 4.29 O ATOM 1624 CB LYS B 2 9.622 6.429 -7.388 1.00 4.79 C ATOM 1625 CG LYS B 2 9.098 7.858 -7.547 1.00 5.69 C ATOM 1626 CD LYS B 2 8.990 8.518 -6.169 1.00 6.62 C ATOM 1627 CE LYS B 2 8.407 9.924 -6.321 1.00 7.56 C ATOM 1628 NZ LYS B 2 9.365 10.781 -7.075 1.00 7.96 N ATOM 0 H LYS B 2 8.688 6.929 -9.643 1.00 4.19 H new ATOM 0 HA LYS B 2 11.326 6.486 -8.704 1.00 4.06 H new ATOM 0 HB2 LYS B 2 8.796 5.748 -7.184 1.00 4.79 H new ATOM 0 HB3 LYS B 2 10.300 6.372 -6.537 1.00 4.79 H new ATOM 0 HG2 LYS B 2 9.768 8.433 -8.186 1.00 5.69 H new ATOM 0 HG3 LYS B 2 8.123 7.847 -8.034 1.00 5.69 H new ATOM 0 HD2 LYS B 2 8.356 7.919 -5.516 1.00 6.62 H new ATOM 0 HD3 LYS B 2 9.973 8.569 -5.700 1.00 6.62 H new ATOM 0 HE2 LYS B 2 7.453 9.879 -6.846 1.00 7.56 H new ATOM 0 HE3 LYS B 2 8.211 10.356 -5.340 1.00 7.56 H new ATOM 0 HZ1 LYS B 2 9.120 11.782 -6.935 1.00 7.96 H new ATOM 0 HZ2 LYS B 2 10.331 10.610 -6.729 1.00 7.96 H new ATOM 0 HZ3 LYS B 2 9.314 10.550 -8.088 1.00 7.96 H new ATOM 1642 N LYS B 3 11.731 4.020 -8.821 1.00 2.84 N ATOM 1643 CA LYS B 3 11.965 2.549 -8.837 1.00 2.84 C ATOM 1644 C LYS B 3 13.464 2.293 -8.957 1.00 2.25 C ATOM 1645 O LYS B 3 13.966 1.261 -8.560 1.00 2.75 O ATOM 1646 CB LYS B 3 11.240 1.928 -10.034 1.00 3.27 C ATOM 1647 CG LYS B 3 10.234 0.886 -9.539 1.00 3.74 C ATOM 1648 CD LYS B 3 9.507 0.269 -10.736 1.00 4.47 C ATOM 1649 CE LYS B 3 9.855 -1.219 -10.835 1.00 5.15 C ATOM 1650 NZ LYS B 3 11.327 -1.375 -11.008 1.00 5.62 N ATOM 0 H LYS B 3 12.567 4.594 -8.929 1.00 2.84 H new ATOM 0 HA LYS B 3 11.585 2.102 -7.919 1.00 2.84 H new ATOM 0 HB2 LYS B 3 10.726 2.703 -10.603 1.00 3.27 H new ATOM 0 HB3 LYS B 3 11.960 1.462 -10.707 1.00 3.27 H new ATOM 0 HG2 LYS B 3 10.748 0.109 -8.972 1.00 3.74 H new ATOM 0 HG3 LYS B 3 9.516 1.351 -8.864 1.00 3.74 H new ATOM 0 HD2 LYS B 3 8.430 0.395 -10.625 1.00 4.47 H new ATOM 0 HD3 LYS B 3 9.795 0.782 -11.654 1.00 4.47 H new ATOM 0 HE2 LYS B 3 9.526 -1.741 -9.936 1.00 5.15 H new ATOM 0 HE3 LYS B 3 9.329 -1.671 -11.676 1.00 5.15 H new ATOM 0 HZ1 LYS B 3 11.523 -2.235 -11.558 1.00 5.62 H new ATOM 0 HZ2 LYS B 3 11.707 -0.548 -11.511 1.00 5.62 H new ATOM 0 HZ3 LYS B 3 11.780 -1.450 -10.075 1.00 5.62 H new ATOM 1664 N LYS B 4 14.178 3.238 -9.499 1.00 1.66 N ATOM 1665 CA LYS B 4 15.648 3.079 -9.647 1.00 1.45 C ATOM 1666 C LYS B 4 16.319 4.430 -9.407 1.00 1.21 C ATOM 1667 O LYS B 4 15.660 5.445 -9.285 1.00 1.74 O ATOM 1668 CB LYS B 4 15.973 2.588 -11.060 1.00 1.77 C ATOM 1669 CG LYS B 4 14.915 1.574 -11.505 1.00 2.27 C ATOM 1670 CD LYS B 4 15.370 0.890 -12.796 1.00 2.87 C ATOM 1671 CE LYS B 4 14.369 -0.205 -13.172 1.00 3.35 C ATOM 1672 NZ LYS B 4 14.933 -1.038 -14.271 1.00 3.94 N ATOM 0 H LYS B 4 13.802 4.120 -9.848 1.00 1.66 H new ATOM 0 HA LYS B 4 16.015 2.351 -8.924 1.00 1.45 H new ATOM 0 HB2 LYS B 4 15.999 3.430 -11.752 1.00 1.77 H new ATOM 0 HB3 LYS B 4 16.962 2.130 -11.079 1.00 1.77 H new ATOM 0 HG2 LYS B 4 14.758 0.831 -10.724 1.00 2.27 H new ATOM 0 HG3 LYS B 4 13.960 2.076 -11.664 1.00 2.27 H new ATOM 0 HD2 LYS B 4 15.445 1.621 -13.601 1.00 2.87 H new ATOM 0 HD3 LYS B 4 16.363 0.460 -12.662 1.00 2.87 H new ATOM 0 HE2 LYS B 4 14.152 -0.828 -12.304 1.00 3.35 H new ATOM 0 HE3 LYS B 4 13.426 0.242 -13.487 1.00 3.35 H new ATOM 0 HZ1 LYS B 4 14.253 -1.782 -14.527 1.00 3.94 H new ATOM 0 HZ2 LYS B 4 15.119 -0.439 -15.101 1.00 3.94 H new ATOM 0 HZ3 LYS B 4 15.822 -1.475 -13.954 1.00 3.94 H new ATOM 1686 N SER B 5 17.620 4.448 -9.337 1.00 1.06 N ATOM 1687 CA SER B 5 18.354 5.725 -9.107 1.00 1.29 C ATOM 1688 C SER B 5 18.317 6.090 -7.624 1.00 1.14 C ATOM 1689 O SER B 5 18.870 7.089 -7.209 1.00 1.52 O ATOM 1690 CB SER B 5 17.737 6.844 -9.930 1.00 1.71 C ATOM 1691 OG SER B 5 18.761 7.733 -10.358 1.00 2.58 O ATOM 0 H SER B 5 18.214 3.624 -9.430 1.00 1.06 H new ATOM 0 HA SER B 5 19.391 5.592 -9.416 1.00 1.29 H new ATOM 0 HB2 SER B 5 17.214 6.431 -10.793 1.00 1.71 H new ATOM 0 HB3 SER B 5 16.997 7.382 -9.337 1.00 1.71 H new ATOM 0 HG SER B 5 18.366 8.455 -10.890 1.00 2.58 H new ATOM 1697 N LYS B 6 17.673 5.291 -6.819 1.00 1.03 N ATOM 1698 CA LYS B 6 17.609 5.598 -5.363 1.00 1.04 C ATOM 1699 C LYS B 6 16.823 4.504 -4.641 1.00 0.96 C ATOM 1700 O LYS B 6 17.013 4.268 -3.466 1.00 1.02 O ATOM 1701 CB LYS B 6 16.907 6.943 -5.153 1.00 1.37 C ATOM 1702 CG LYS B 6 17.861 7.911 -4.449 1.00 2.21 C ATOM 1703 CD LYS B 6 17.169 9.263 -4.260 1.00 2.52 C ATOM 1704 CE LYS B 6 17.594 10.214 -5.378 1.00 3.33 C ATOM 1705 NZ LYS B 6 19.028 10.578 -5.202 1.00 3.75 N ATOM 0 H LYS B 6 17.189 4.440 -7.106 1.00 1.03 H new ATOM 0 HA LYS B 6 18.621 5.646 -4.962 1.00 1.04 H new ATOM 0 HB2 LYS B 6 16.595 7.356 -6.112 1.00 1.37 H new ATOM 0 HB3 LYS B 6 16.005 6.806 -4.556 1.00 1.37 H new ATOM 0 HG2 LYS B 6 18.160 7.505 -3.482 1.00 2.21 H new ATOM 0 HG3 LYS B 6 18.770 8.035 -5.038 1.00 2.21 H new ATOM 0 HD2 LYS B 6 16.087 9.134 -4.270 1.00 2.52 H new ATOM 0 HD3 LYS B 6 17.431 9.685 -3.290 1.00 2.52 H new ATOM 0 HE2 LYS B 6 17.444 9.741 -6.349 1.00 3.33 H new ATOM 0 HE3 LYS B 6 16.975 11.111 -5.362 1.00 3.33 H new ATOM 0 HZ1 LYS B 6 19.193 11.533 -5.579 1.00 3.75 H new ATOM 0 HZ2 LYS B 6 19.269 10.559 -4.191 1.00 3.75 H new ATOM 0 HZ3 LYS B 6 19.624 9.896 -5.713 1.00 3.75 H new ATOM 1719 N LEU B 7 15.936 3.842 -5.328 1.00 0.91 N ATOM 1720 CA LEU B 7 15.133 2.772 -4.670 1.00 0.98 C ATOM 1721 C LEU B 7 15.773 1.402 -4.914 1.00 0.86 C ATOM 1722 O LEU B 7 16.201 0.729 -3.994 1.00 0.86 O ATOM 1723 CB LEU B 7 13.718 2.778 -5.251 1.00 1.15 C ATOM 1724 CG LEU B 7 12.799 3.602 -4.348 1.00 1.40 C ATOM 1725 CD1 LEU B 7 13.371 5.011 -4.187 1.00 2.06 C ATOM 1726 CD2 LEU B 7 11.408 3.687 -4.981 1.00 1.70 C ATOM 0 H LEU B 7 15.731 3.994 -6.316 1.00 0.91 H new ATOM 0 HA LEU B 7 15.099 2.961 -3.597 1.00 0.98 H new ATOM 0 HB2 LEU B 7 13.728 3.197 -6.257 1.00 1.15 H new ATOM 0 HB3 LEU B 7 13.344 1.758 -5.335 1.00 1.15 H new ATOM 0 HG LEU B 7 12.727 3.125 -3.370 1.00 1.40 H new ATOM 0 HD11 LEU B 7 12.716 5.598 -3.543 1.00 2.06 H new ATOM 0 HD12 LEU B 7 14.363 4.952 -3.738 1.00 2.06 H new ATOM 0 HD13 LEU B 7 13.443 5.488 -5.164 1.00 2.06 H new ATOM 0 HD21 LEU B 7 10.751 4.274 -4.339 1.00 1.70 H new ATOM 0 HD22 LEU B 7 11.481 4.164 -5.958 1.00 1.70 H new ATOM 0 HD23 LEU B 7 10.999 2.683 -5.097 1.00 1.70 H new ATOM 1738 N GLU B 8 15.822 0.975 -6.145 1.00 0.85 N ATOM 1739 CA GLU B 8 16.406 -0.364 -6.436 1.00 0.91 C ATOM 1740 C GLU B 8 17.932 -0.316 -6.341 1.00 0.79 C ATOM 1741 O GLU B 8 18.510 -0.894 -5.452 1.00 0.74 O ATOM 1742 CB GLU B 8 15.998 -0.792 -7.847 1.00 1.08 C ATOM 1743 CG GLU B 8 16.871 -1.964 -8.300 1.00 1.20 C ATOM 1744 CD GLU B 8 16.136 -2.757 -9.383 1.00 1.47 C ATOM 1745 OE1 GLU B 8 15.046 -3.229 -9.106 1.00 1.97 O ATOM 1746 OE2 GLU B 8 16.677 -2.878 -10.469 1.00 2.06 O ATOM 0 H GLU B 8 15.485 1.491 -6.958 1.00 0.85 H new ATOM 0 HA GLU B 8 16.033 -1.080 -5.704 1.00 0.91 H new ATOM 0 HB2 GLU B 8 14.947 -1.081 -7.861 1.00 1.08 H new ATOM 0 HB3 GLU B 8 16.107 0.044 -8.538 1.00 1.08 H new ATOM 0 HG2 GLU B 8 17.822 -1.596 -8.686 1.00 1.20 H new ATOM 0 HG3 GLU B 8 17.100 -2.610 -7.453 1.00 1.20 H new ATOM 1753 N ILE B 9 18.573 0.379 -7.244 1.00 0.80 N ATOM 1754 CA ILE B 9 20.074 0.454 -7.210 1.00 0.81 C ATOM 1755 C ILE B 9 20.522 0.388 -5.745 1.00 0.71 C ATOM 1756 O ILE B 9 21.448 -0.314 -5.390 1.00 0.82 O ATOM 1757 CB ILE B 9 20.544 1.766 -7.837 1.00 0.85 C ATOM 1758 CG1 ILE B 9 19.907 1.932 -9.225 1.00 1.52 C ATOM 1759 CG2 ILE B 9 22.071 1.758 -7.960 1.00 1.50 C ATOM 1760 CD1 ILE B 9 20.214 0.717 -10.112 1.00 1.88 C ATOM 0 H ILE B 9 18.130 0.897 -8.002 1.00 0.80 H new ATOM 0 HA ILE B 9 20.505 -0.373 -7.774 1.00 0.81 H new ATOM 0 HB ILE B 9 20.241 2.600 -7.204 1.00 0.85 H new ATOM 0 HG12 ILE B 9 18.828 2.051 -9.124 1.00 1.52 H new ATOM 0 HG13 ILE B 9 20.285 2.838 -9.698 1.00 1.52 H new ATOM 0 HG21 ILE B 9 22.405 2.694 -8.407 1.00 1.50 H new ATOM 0 HG22 ILE B 9 22.515 1.650 -6.970 1.00 1.50 H new ATOM 0 HG23 ILE B 9 22.381 0.924 -8.590 1.00 1.50 H new ATOM 0 HD11 ILE B 9 19.754 0.855 -11.090 1.00 1.88 H new ATOM 0 HD12 ILE B 9 21.293 0.616 -10.230 1.00 1.88 H new ATOM 0 HD13 ILE B 9 19.814 -0.184 -9.647 1.00 1.88 H new ATOM 1772 N ILE B 10 19.842 1.106 -4.899 1.00 0.59 N ATOM 1773 CA ILE B 10 20.182 1.094 -3.445 1.00 0.59 C ATOM 1774 C ILE B 10 19.995 -0.322 -2.901 1.00 0.51 C ATOM 1775 O ILE B 10 20.903 -0.907 -2.347 1.00 0.54 O ATOM 1776 CB ILE B 10 19.294 2.098 -2.685 1.00 0.67 C ATOM 1777 CG1 ILE B 10 20.081 3.408 -2.521 1.00 0.85 C ATOM 1778 CG2 ILE B 10 18.917 1.540 -1.300 1.00 0.74 C ATOM 1779 CD1 ILE B 10 19.200 4.489 -1.886 1.00 1.31 C ATOM 0 H ILE B 10 19.058 1.707 -5.152 1.00 0.59 H new ATOM 0 HA ILE B 10 21.221 1.393 -3.305 1.00 0.59 H new ATOM 0 HB ILE B 10 18.375 2.274 -3.244 1.00 0.67 H new ATOM 0 HG12 ILE B 10 20.960 3.236 -1.899 1.00 0.85 H new ATOM 0 HG13 ILE B 10 20.440 3.748 -3.493 1.00 0.85 H new ATOM 0 HG21 ILE B 10 18.290 2.261 -0.776 1.00 0.74 H new ATOM 0 HG22 ILE B 10 18.371 0.604 -1.421 1.00 0.74 H new ATOM 0 HG23 ILE B 10 19.823 1.359 -0.722 1.00 0.74 H new ATOM 0 HD11 ILE B 10 19.774 5.409 -1.778 1.00 1.31 H new ATOM 0 HD12 ILE B 10 18.335 4.674 -2.523 1.00 1.31 H new ATOM 0 HD13 ILE B 10 18.863 4.154 -0.905 1.00 1.31 H new ATOM 1791 N GLN B 11 18.822 -0.877 -3.049 1.00 0.50 N ATOM 1792 CA GLN B 11 18.590 -2.254 -2.534 1.00 0.50 C ATOM 1793 C GLN B 11 19.750 -3.153 -2.967 1.00 0.52 C ATOM 1794 O GLN B 11 20.238 -3.962 -2.204 1.00 0.52 O ATOM 1795 CB GLN B 11 17.279 -2.803 -3.102 1.00 0.55 C ATOM 1796 CG GLN B 11 16.869 -4.052 -2.320 1.00 1.24 C ATOM 1797 CD GLN B 11 15.686 -4.726 -3.018 1.00 1.53 C ATOM 1798 OE1 GLN B 11 14.551 -4.542 -2.628 1.00 2.22 O ATOM 1799 NE2 GLN B 11 15.906 -5.506 -4.041 1.00 1.91 N ATOM 0 H GLN B 11 18.020 -0.438 -3.502 1.00 0.50 H new ATOM 0 HA GLN B 11 18.527 -2.231 -1.446 1.00 0.50 H new ATOM 0 HB2 GLN B 11 16.497 -2.047 -3.037 1.00 0.55 H new ATOM 0 HB3 GLN B 11 17.401 -3.045 -4.158 1.00 0.55 H new ATOM 0 HG2 GLN B 11 17.708 -4.744 -2.254 1.00 1.24 H new ATOM 0 HG3 GLN B 11 16.597 -3.782 -1.300 1.00 1.24 H new ATOM 0 HE21 GLN B 11 16.859 -5.661 -4.369 1.00 1.91 H new ATOM 0 HE22 GLN B 11 15.124 -5.961 -4.513 1.00 1.91 H new ATOM 1808 N ALA B 12 20.211 -3.001 -4.180 1.00 0.57 N ATOM 1809 CA ALA B 12 21.356 -3.829 -4.653 1.00 0.62 C ATOM 1810 C ALA B 12 22.604 -3.484 -3.837 1.00 0.57 C ATOM 1811 O ALA B 12 23.427 -4.331 -3.553 1.00 0.57 O ATOM 1812 CB ALA B 12 21.619 -3.541 -6.132 1.00 0.71 C ATOM 0 H ALA B 12 19.843 -2.339 -4.863 1.00 0.57 H new ATOM 0 HA ALA B 12 21.117 -4.885 -4.526 1.00 0.62 H new ATOM 0 HB1 ALA B 12 22.457 -4.147 -6.477 1.00 0.71 H new ATOM 0 HB2 ALA B 12 20.730 -3.785 -6.714 1.00 0.71 H new ATOM 0 HB3 ALA B 12 21.858 -2.485 -6.260 1.00 0.71 H new ATOM 1818 N ILE B 13 22.744 -2.244 -3.448 1.00 0.55 N ATOM 1819 CA ILE B 13 23.932 -1.852 -2.640 1.00 0.51 C ATOM 1820 C ILE B 13 23.793 -2.465 -1.246 1.00 0.44 C ATOM 1821 O ILE B 13 24.762 -2.839 -0.613 1.00 0.45 O ATOM 1822 CB ILE B 13 24.010 -0.328 -2.537 1.00 0.52 C ATOM 1823 CG1 ILE B 13 24.587 0.236 -3.840 1.00 0.65 C ATOM 1824 CG2 ILE B 13 24.919 0.061 -1.370 1.00 0.52 C ATOM 1825 CD1 ILE B 13 23.984 1.613 -4.125 1.00 0.84 C ATOM 0 H ILE B 13 22.089 -1.490 -3.655 1.00 0.55 H new ATOM 0 HA ILE B 13 24.844 -2.214 -3.115 1.00 0.51 H new ATOM 0 HB ILE B 13 23.012 0.078 -2.369 1.00 0.52 H new ATOM 0 HG12 ILE B 13 25.672 0.313 -3.764 1.00 0.65 H new ATOM 0 HG13 ILE B 13 24.373 -0.442 -4.666 1.00 0.65 H new ATOM 0 HG21 ILE B 13 24.974 1.147 -1.298 1.00 0.52 H new ATOM 0 HG22 ILE B 13 24.514 -0.344 -0.443 1.00 0.52 H new ATOM 0 HG23 ILE B 13 25.918 -0.342 -1.537 1.00 0.52 H new ATOM 0 HD11 ILE B 13 24.399 2.007 -5.053 1.00 0.84 H new ATOM 0 HD12 ILE B 13 22.902 1.524 -4.221 1.00 0.84 H new ATOM 0 HD13 ILE B 13 24.221 2.291 -3.305 1.00 0.84 H new ATOM 1837 N LEU B 14 22.584 -2.576 -0.775 1.00 0.45 N ATOM 1838 CA LEU B 14 22.346 -3.168 0.569 1.00 0.41 C ATOM 1839 C LEU B 14 22.590 -4.678 0.507 1.00 0.42 C ATOM 1840 O LEU B 14 23.201 -5.259 1.382 1.00 0.41 O ATOM 1841 CB LEU B 14 20.896 -2.904 0.979 1.00 0.45 C ATOM 1842 CG LEU B 14 20.865 -2.057 2.251 1.00 0.57 C ATOM 1843 CD1 LEU B 14 19.422 -1.660 2.566 1.00 0.54 C ATOM 1844 CD2 LEU B 14 21.438 -2.870 3.413 1.00 1.01 C ATOM 0 H LEU B 14 21.742 -2.279 -1.269 1.00 0.45 H new ATOM 0 HA LEU B 14 23.023 -2.720 1.297 1.00 0.41 H new ATOM 0 HB2 LEU B 14 20.369 -2.390 0.175 1.00 0.45 H new ATOM 0 HB3 LEU B 14 20.378 -3.848 1.147 1.00 0.45 H new ATOM 0 HG LEU B 14 21.463 -1.157 2.106 1.00 0.57 H new ATOM 0 HD11 LEU B 14 19.401 -1.056 3.473 1.00 0.54 H new ATOM 0 HD12 LEU B 14 19.014 -1.083 1.736 1.00 0.54 H new ATOM 0 HD13 LEU B 14 18.822 -2.558 2.714 1.00 0.54 H new ATOM 0 HD21 LEU B 14 21.418 -2.269 4.322 1.00 1.01 H new ATOM 0 HD22 LEU B 14 20.839 -3.769 3.558 1.00 1.01 H new ATOM 0 HD23 LEU B 14 22.466 -3.152 3.187 1.00 1.01 H new ATOM 1856 N GLU B 15 22.115 -5.316 -0.525 1.00 0.47 N ATOM 1857 CA GLU B 15 22.317 -6.787 -0.655 1.00 0.52 C ATOM 1858 C GLU B 15 23.801 -7.084 -0.863 1.00 0.53 C ATOM 1859 O GLU B 15 24.322 -8.069 -0.385 1.00 0.60 O ATOM 1860 CB GLU B 15 21.527 -7.315 -1.858 1.00 0.59 C ATOM 1861 CG GLU B 15 20.036 -7.402 -1.520 1.00 0.80 C ATOM 1862 CD GLU B 15 19.358 -8.388 -2.473 1.00 0.73 C ATOM 1863 OE1 GLU B 15 19.977 -8.745 -3.462 1.00 1.29 O ATOM 1864 OE2 GLU B 15 18.233 -8.770 -2.198 1.00 1.28 O ATOM 0 H GLU B 15 21.594 -4.882 -1.287 1.00 0.47 H new ATOM 0 HA GLU B 15 21.967 -7.276 0.254 1.00 0.52 H new ATOM 0 HB2 GLU B 15 21.675 -6.658 -2.715 1.00 0.59 H new ATOM 0 HB3 GLU B 15 21.900 -8.299 -2.143 1.00 0.59 H new ATOM 0 HG2 GLU B 15 19.904 -7.727 -0.488 1.00 0.80 H new ATOM 0 HG3 GLU B 15 19.574 -6.419 -1.607 1.00 0.80 H new ATOM 1871 N ALA B 16 24.493 -6.246 -1.574 1.00 0.49 N ATOM 1872 CA ALA B 16 25.932 -6.502 -1.800 1.00 0.52 C ATOM 1873 C ALA B 16 26.672 -6.347 -0.480 1.00 0.50 C ATOM 1874 O ALA B 16 27.605 -7.067 -0.191 1.00 0.54 O ATOM 1875 CB ALA B 16 26.480 -5.505 -2.815 1.00 0.53 C ATOM 0 H ALA B 16 24.125 -5.399 -2.006 1.00 0.49 H new ATOM 0 HA ALA B 16 26.070 -7.512 -2.186 1.00 0.52 H new ATOM 0 HB1 ALA B 16 27.540 -5.698 -2.978 1.00 0.53 H new ATOM 0 HB2 ALA B 16 25.943 -5.612 -3.757 1.00 0.53 H new ATOM 0 HB3 ALA B 16 26.349 -4.491 -2.436 1.00 0.53 H new ATOM 1881 N CYS B 17 26.275 -5.402 0.326 1.00 0.46 N ATOM 1882 CA CYS B 17 26.973 -5.203 1.610 1.00 0.46 C ATOM 1883 C CYS B 17 26.553 -6.285 2.610 1.00 0.47 C ATOM 1884 O CYS B 17 27.221 -6.526 3.596 1.00 0.49 O ATOM 1885 CB CYS B 17 26.634 -3.823 2.161 1.00 0.42 C ATOM 1886 SG CYS B 17 24.955 -3.824 2.835 1.00 0.42 S ATOM 0 H CYS B 17 25.499 -4.765 0.145 1.00 0.46 H new ATOM 0 HA CYS B 17 28.049 -5.274 1.451 1.00 0.46 H new ATOM 0 HB2 CYS B 17 27.347 -3.547 2.938 1.00 0.42 H new ATOM 0 HB3 CYS B 17 26.718 -3.076 1.372 1.00 0.42 H new ATOM 0 HG CYS B 17 24.222 -4.669 2.173 1.00 0.42 H new ATOM 1892 N LYS B 18 25.447 -6.932 2.363 1.00 0.49 N ATOM 1893 CA LYS B 18 24.967 -8.001 3.292 1.00 0.51 C ATOM 1894 C LYS B 18 26.088 -9.003 3.610 1.00 0.55 C ATOM 1895 O LYS B 18 25.900 -9.913 4.391 1.00 0.58 O ATOM 1896 CB LYS B 18 23.777 -8.737 2.667 1.00 0.56 C ATOM 1897 CG LYS B 18 24.265 -9.912 1.810 1.00 1.18 C ATOM 1898 CD LYS B 18 23.136 -10.381 0.882 1.00 1.89 C ATOM 1899 CE LYS B 18 22.049 -11.082 1.700 1.00 2.29 C ATOM 1900 NZ LYS B 18 21.077 -11.732 0.777 1.00 2.90 N ATOM 0 H LYS B 18 24.850 -6.767 1.553 1.00 0.49 H new ATOM 0 HA LYS B 18 24.657 -7.528 4.224 1.00 0.51 H new ATOM 0 HB2 LYS B 18 23.114 -9.102 3.452 1.00 0.56 H new ATOM 0 HB3 LYS B 18 23.196 -8.048 2.054 1.00 0.56 H new ATOM 0 HG2 LYS B 18 25.131 -9.610 1.221 1.00 1.18 H new ATOM 0 HG3 LYS B 18 24.586 -10.733 2.451 1.00 1.18 H new ATOM 0 HD2 LYS B 18 22.712 -9.529 0.351 1.00 1.89 H new ATOM 0 HD3 LYS B 18 23.532 -11.061 0.128 1.00 1.89 H new ATOM 0 HE2 LYS B 18 22.497 -11.827 2.358 1.00 2.29 H new ATOM 0 HE3 LYS B 18 21.536 -10.361 2.337 1.00 2.29 H new ATOM 0 HZ1 LYS B 18 20.337 -12.209 1.331 1.00 2.90 H new ATOM 0 HZ2 LYS B 18 20.642 -11.011 0.167 1.00 2.90 H new ATOM 0 HZ3 LYS B 18 21.572 -12.431 0.187 1.00 2.90 H new ATOM 1914 N SER B 19 27.246 -8.858 3.023 1.00 0.57 N ATOM 1915 CA SER B 19 28.340 -9.828 3.322 1.00 0.63 C ATOM 1916 C SER B 19 29.706 -9.176 3.086 1.00 0.66 C ATOM 1917 O SER B 19 30.675 -9.843 2.780 1.00 0.84 O ATOM 1918 CB SER B 19 28.195 -11.049 2.414 1.00 0.70 C ATOM 1919 OG SER B 19 29.324 -11.897 2.587 1.00 0.93 O ATOM 0 H SER B 19 27.480 -8.121 2.358 1.00 0.57 H new ATOM 0 HA SER B 19 28.270 -10.133 4.366 1.00 0.63 H new ATOM 0 HB2 SER B 19 27.279 -11.589 2.654 1.00 0.70 H new ATOM 0 HB3 SER B 19 28.117 -10.736 1.373 1.00 0.70 H new ATOM 0 HG SER B 19 30.141 -11.401 2.372 1.00 0.93 H new ATOM 1925 N GLY B 20 29.797 -7.883 3.238 1.00 0.65 N ATOM 1926 CA GLY B 20 31.108 -7.199 3.037 1.00 0.66 C ATOM 1927 C GLY B 20 31.589 -7.419 1.603 1.00 0.70 C ATOM 1928 O GLY B 20 32.036 -8.490 1.246 1.00 0.77 O ATOM 0 H GLY B 20 29.022 -7.271 3.492 1.00 0.65 H new ATOM 0 HA2 GLY B 20 31.007 -6.132 3.237 1.00 0.66 H new ATOM 0 HA3 GLY B 20 31.844 -7.588 3.741 1.00 0.66 H new ATOM 1932 N SER B 21 31.477 -6.421 0.773 1.00 0.67 N ATOM 1933 CA SER B 21 31.902 -6.582 -0.645 1.00 0.74 C ATOM 1934 C SER B 21 32.348 -5.212 -1.201 1.00 0.72 C ATOM 1935 O SER B 21 31.662 -4.228 -1.005 1.00 0.63 O ATOM 1936 CB SER B 21 30.709 -7.093 -1.447 1.00 0.74 C ATOM 1937 OG SER B 21 29.816 -7.770 -0.573 1.00 0.72 O ATOM 0 H SER B 21 31.110 -5.501 1.015 1.00 0.67 H new ATOM 0 HA SER B 21 32.732 -7.286 -0.716 1.00 0.74 H new ATOM 0 HB2 SER B 21 30.200 -6.262 -1.934 1.00 0.74 H new ATOM 0 HB3 SER B 21 31.046 -7.766 -2.235 1.00 0.74 H new ATOM 0 HG SER B 21 28.900 -7.463 -0.739 1.00 0.72 H new ATOM 1943 N PRO B 22 33.480 -5.128 -1.887 1.00 0.82 N ATOM 1944 CA PRO B 22 33.957 -3.831 -2.458 1.00 0.83 C ATOM 1945 C PRO B 22 32.902 -3.171 -3.353 1.00 0.81 C ATOM 1946 O PRO B 22 31.950 -3.797 -3.766 1.00 0.80 O ATOM 1947 CB PRO B 22 35.181 -4.194 -3.303 1.00 0.93 C ATOM 1948 CG PRO B 22 35.586 -5.579 -2.918 1.00 1.08 C ATOM 1949 CD PRO B 22 34.417 -6.231 -2.181 1.00 0.95 C ATOM 0 HA PRO B 22 34.176 -3.119 -1.662 1.00 0.83 H new ATOM 0 HB2 PRO B 22 34.944 -4.143 -4.366 1.00 0.93 H new ATOM 0 HB3 PRO B 22 35.995 -3.491 -3.124 1.00 0.93 H new ATOM 0 HG2 PRO B 22 35.848 -6.158 -3.803 1.00 1.08 H new ATOM 0 HG3 PRO B 22 36.470 -5.553 -2.281 1.00 1.08 H new ATOM 0 HD2 PRO B 22 33.943 -6.997 -2.795 1.00 0.95 H new ATOM 0 HD3 PRO B 22 34.752 -6.718 -1.265 1.00 0.95 H new ATOM 1957 N LYS B 23 33.077 -1.912 -3.664 1.00 0.80 N ATOM 1958 CA LYS B 23 32.094 -1.214 -4.543 1.00 0.80 C ATOM 1959 C LYS B 23 32.020 -1.953 -5.886 1.00 0.79 C ATOM 1960 O LYS B 23 31.004 -1.953 -6.551 1.00 0.79 O ATOM 1961 CB LYS B 23 32.552 0.235 -4.774 1.00 0.82 C ATOM 1962 CG LYS B 23 31.364 1.112 -5.212 1.00 0.78 C ATOM 1963 CD LYS B 23 31.833 2.079 -6.299 1.00 1.42 C ATOM 1964 CE LYS B 23 33.026 2.887 -5.782 1.00 1.27 C ATOM 1965 NZ LYS B 23 34.287 2.333 -6.351 1.00 1.83 N ATOM 0 H LYS B 23 33.858 -1.338 -3.347 1.00 0.80 H new ATOM 0 HA LYS B 23 31.111 -1.207 -4.071 1.00 0.80 H new ATOM 0 HB2 LYS B 23 32.989 0.635 -3.859 1.00 0.82 H new ATOM 0 HB3 LYS B 23 33.331 0.260 -5.536 1.00 0.82 H new ATOM 0 HG2 LYS B 23 30.554 0.488 -5.588 1.00 0.78 H new ATOM 0 HG3 LYS B 23 30.971 1.666 -4.360 1.00 0.78 H new ATOM 0 HD2 LYS B 23 32.115 1.527 -7.195 1.00 1.42 H new ATOM 0 HD3 LYS B 23 31.021 2.749 -6.580 1.00 1.42 H new ATOM 0 HE2 LYS B 23 32.918 3.935 -6.062 1.00 1.27 H new ATOM 0 HE3 LYS B 23 33.059 2.850 -4.693 1.00 1.27 H new ATOM 0 HZ1 LYS B 23 34.847 1.895 -5.592 1.00 1.83 H new ATOM 0 HZ2 LYS B 23 34.058 1.617 -7.070 1.00 1.83 H new ATOM 0 HZ3 LYS B 23 34.836 3.100 -6.789 1.00 1.83 H new ATOM 1979 N THR B 24 33.093 -2.593 -6.284 1.00 0.79 N ATOM 1980 CA THR B 24 33.103 -3.347 -7.576 1.00 0.79 C ATOM 1981 C THR B 24 32.201 -4.588 -7.500 1.00 0.82 C ATOM 1982 O THR B 24 31.481 -4.896 -8.429 1.00 0.84 O ATOM 1983 CB THR B 24 34.534 -3.785 -7.891 1.00 0.78 C ATOM 1984 OG1 THR B 24 35.037 -4.562 -6.814 1.00 0.85 O ATOM 1985 CG2 THR B 24 35.414 -2.551 -8.090 1.00 0.82 C ATOM 0 H THR B 24 33.970 -2.625 -5.764 1.00 0.79 H new ATOM 0 HA THR B 24 32.724 -2.692 -8.361 1.00 0.79 H new ATOM 0 HB THR B 24 34.540 -4.382 -8.803 1.00 0.78 H new ATOM 0 HG1 THR B 24 35.953 -4.845 -7.015 1.00 0.85 H new ATOM 0 HG21 THR B 24 36.434 -2.864 -8.314 1.00 0.82 H new ATOM 0 HG22 THR B 24 35.026 -1.957 -8.918 1.00 0.82 H new ATOM 0 HG23 THR B 24 35.410 -1.951 -7.180 1.00 0.82 H new ATOM 1993 N ARG B 25 32.237 -5.307 -6.406 1.00 0.84 N ATOM 1994 CA ARG B 25 31.387 -6.533 -6.276 1.00 0.89 C ATOM 1995 C ARG B 25 29.920 -6.133 -6.408 1.00 0.90 C ATOM 1996 O ARG B 25 29.044 -6.950 -6.609 1.00 0.96 O ATOM 1997 CB ARG B 25 31.630 -7.149 -4.892 1.00 0.90 C ATOM 1998 CG ARG B 25 32.383 -8.479 -5.014 1.00 1.33 C ATOM 1999 CD ARG B 25 31.395 -9.595 -5.350 1.00 1.07 C ATOM 2000 NE ARG B 25 32.145 -10.853 -5.633 1.00 1.67 N ATOM 2001 CZ ARG B 25 31.516 -11.903 -6.088 1.00 2.00 C ATOM 2002 NH1 ARG B 25 30.231 -11.854 -6.301 1.00 2.14 N ATOM 2003 NH2 ARG B 25 32.177 -13.003 -6.331 1.00 2.74 N ATOM 0 H ARG B 25 32.819 -5.098 -5.595 1.00 0.84 H new ATOM 0 HA ARG B 25 31.637 -7.256 -7.052 1.00 0.89 H new ATOM 0 HB2 ARG B 25 32.203 -6.456 -4.276 1.00 0.90 H new ATOM 0 HB3 ARG B 25 30.677 -7.310 -4.388 1.00 0.90 H new ATOM 0 HG2 ARG B 25 33.145 -8.408 -5.790 1.00 1.33 H new ATOM 0 HG3 ARG B 25 32.899 -8.704 -4.080 1.00 1.33 H new ATOM 0 HD2 ARG B 25 30.706 -9.748 -4.519 1.00 1.07 H new ATOM 0 HD3 ARG B 25 30.794 -9.315 -6.215 1.00 1.07 H new ATOM 0 HE ARG B 25 33.151 -10.893 -5.471 1.00 1.67 H new ATOM 0 HH11 ARG B 25 29.715 -10.995 -6.112 1.00 2.14 H new ATOM 0 HH12 ARG B 25 29.741 -12.675 -6.656 1.00 2.14 H new ATOM 0 HH21 ARG B 25 33.183 -13.041 -6.165 1.00 2.74 H new ATOM 0 HH22 ARG B 25 31.687 -13.824 -6.686 1.00 2.74 H new ATOM 2017 N ILE B 26 29.673 -4.869 -6.309 1.00 0.86 N ATOM 2018 CA ILE B 26 28.284 -4.369 -6.439 1.00 0.89 C ATOM 2019 C ILE B 26 27.959 -4.223 -7.924 1.00 0.93 C ATOM 2020 O ILE B 26 26.815 -4.287 -8.329 1.00 0.96 O ATOM 2021 CB ILE B 26 28.155 -3.037 -5.703 1.00 0.86 C ATOM 2022 CG1 ILE B 26 28.754 -3.218 -4.304 1.00 0.92 C ATOM 2023 CG2 ILE B 26 26.677 -2.650 -5.597 1.00 0.90 C ATOM 2024 CD1 ILE B 26 28.143 -2.221 -3.315 1.00 0.62 C ATOM 0 H ILE B 26 30.378 -4.151 -6.142 1.00 0.86 H new ATOM 0 HA ILE B 26 27.575 -5.067 -5.993 1.00 0.89 H new ATOM 0 HB ILE B 26 28.680 -2.246 -6.239 1.00 0.86 H new ATOM 0 HG12 ILE B 26 28.576 -4.236 -3.957 1.00 0.92 H new ATOM 0 HG13 ILE B 26 29.834 -3.079 -4.346 1.00 0.92 H new ATOM 0 HG21 ILE B 26 26.587 -1.699 -5.072 1.00 0.90 H new ATOM 0 HG22 ILE B 26 26.253 -2.554 -6.597 1.00 0.90 H new ATOM 0 HG23 ILE B 26 26.137 -3.421 -5.047 1.00 0.90 H new ATOM 0 HD11 ILE B 26 28.584 -2.369 -2.329 1.00 0.62 H new ATOM 0 HD12 ILE B 26 28.343 -1.204 -3.653 1.00 0.62 H new ATOM 0 HD13 ILE B 26 27.066 -2.379 -3.258 1.00 0.62 H new ATOM 2036 N MET B 27 28.963 -4.037 -8.742 1.00 0.94 N ATOM 2037 CA MET B 27 28.713 -3.898 -10.205 1.00 0.99 C ATOM 2038 C MET B 27 27.901 -5.110 -10.671 1.00 1.06 C ATOM 2039 O MET B 27 26.952 -4.986 -11.419 1.00 1.10 O ATOM 2040 CB MET B 27 30.048 -3.835 -10.956 1.00 0.98 C ATOM 2041 CG MET B 27 30.756 -2.498 -10.679 1.00 1.55 C ATOM 2042 SD MET B 27 32.460 -2.596 -11.279 1.00 1.89 S ATOM 2043 CE MET B 27 32.078 -2.790 -13.039 1.00 1.25 C ATOM 0 H MET B 27 29.941 -3.976 -8.460 1.00 0.94 H new ATOM 0 HA MET B 27 28.160 -2.981 -10.409 1.00 0.99 H new ATOM 0 HB2 MET B 27 30.686 -4.663 -10.647 1.00 0.98 H new ATOM 0 HB3 MET B 27 29.876 -3.948 -12.026 1.00 0.98 H new ATOM 0 HG2 MET B 27 30.229 -1.683 -11.175 1.00 1.55 H new ATOM 0 HG3 MET B 27 30.745 -2.281 -9.611 1.00 1.55 H new ATOM 0 HE1 MET B 27 32.939 -2.485 -13.634 1.00 1.25 H new ATOM 0 HE2 MET B 27 31.844 -3.834 -13.248 1.00 1.25 H new ATOM 0 HE3 MET B 27 31.221 -2.168 -13.296 1.00 1.25 H new ATOM 2053 N TYR B 28 28.260 -6.280 -10.212 1.00 1.07 N ATOM 2054 CA TYR B 28 27.506 -7.511 -10.597 1.00 1.14 C ATOM 2055 C TYR B 28 26.024 -7.323 -10.249 1.00 1.09 C ATOM 2056 O TYR B 28 25.195 -8.163 -10.535 1.00 1.20 O ATOM 2057 CB TYR B 28 28.063 -8.706 -9.818 1.00 1.17 C ATOM 2058 CG TYR B 28 27.327 -9.967 -10.214 1.00 1.43 C ATOM 2059 CD1 TYR B 28 27.645 -10.617 -11.412 1.00 2.20 C ATOM 2060 CD2 TYR B 28 26.330 -10.487 -9.379 1.00 1.71 C ATOM 2061 CE1 TYR B 28 26.965 -11.787 -11.776 1.00 2.58 C ATOM 2062 CE2 TYR B 28 25.651 -11.657 -9.743 1.00 1.98 C ATOM 2063 CZ TYR B 28 25.968 -12.306 -10.941 1.00 2.21 C ATOM 2064 OH TYR B 28 25.299 -13.459 -11.299 1.00 2.65 O ATOM 0 H TYR B 28 29.048 -6.437 -9.583 1.00 1.07 H new ATOM 0 HA TYR B 28 27.611 -7.690 -11.667 1.00 1.14 H new ATOM 0 HB2 TYR B 28 29.128 -8.818 -10.019 1.00 1.17 H new ATOM 0 HB3 TYR B 28 27.957 -8.534 -8.747 1.00 1.17 H new ATOM 0 HD1 TYR B 28 28.414 -10.217 -12.056 1.00 2.20 H new ATOM 0 HD2 TYR B 28 26.085 -9.986 -8.454 1.00 1.71 H new ATOM 0 HE1 TYR B 28 27.210 -12.288 -12.701 1.00 2.58 H new ATOM 0 HE2 TYR B 28 24.883 -12.058 -9.099 1.00 1.98 H new ATOM 0 HH TYR B 28 24.640 -13.683 -10.609 1.00 2.65 H new ATOM 2074 N GLY B 29 25.692 -6.217 -9.639 1.00 1.05 N ATOM 2075 CA GLY B 29 24.271 -5.955 -9.276 1.00 1.02 C ATOM 2076 C GLY B 29 23.611 -5.105 -10.366 1.00 1.05 C ATOM 2077 O GLY B 29 22.504 -5.373 -10.787 1.00 1.10 O ATOM 0 H GLY B 29 26.347 -5.481 -9.376 1.00 1.05 H new ATOM 0 HA2 GLY B 29 23.735 -6.897 -9.161 1.00 1.02 H new ATOM 0 HA3 GLY B 29 24.219 -5.439 -8.317 1.00 1.02 H new ATOM 2081 N ALA B 30 24.279 -4.077 -10.822 1.00 1.06 N ATOM 2082 CA ALA B 30 23.680 -3.211 -11.881 1.00 1.10 C ATOM 2083 C ALA B 30 24.791 -2.550 -12.702 1.00 1.16 C ATOM 2084 O ALA B 30 25.957 -2.845 -12.535 1.00 1.24 O ATOM 2085 CB ALA B 30 22.824 -2.126 -11.221 1.00 1.13 C ATOM 0 H ALA B 30 25.209 -3.801 -10.508 1.00 1.06 H new ATOM 0 HA ALA B 30 23.062 -3.821 -12.539 1.00 1.10 H new ATOM 0 HB1 ALA B 30 22.385 -1.491 -11.990 1.00 1.13 H new ATOM 0 HB2 ALA B 30 22.030 -2.593 -10.639 1.00 1.13 H new ATOM 0 HB3 ALA B 30 23.448 -1.520 -10.563 1.00 1.13 H new ATOM 2091 N ASN B 31 24.440 -1.637 -13.577 1.00 1.19 N ATOM 2092 CA ASN B 31 25.484 -0.940 -14.387 1.00 1.26 C ATOM 2093 C ASN B 31 26.211 0.049 -13.478 1.00 1.28 C ATOM 2094 O ASN B 31 26.912 0.937 -13.918 1.00 1.73 O ATOM 2095 CB ASN B 31 24.831 -0.192 -15.549 1.00 1.34 C ATOM 2096 CG ASN B 31 25.606 -0.484 -16.834 1.00 1.68 C ATOM 2097 OD1 ASN B 31 25.292 -1.413 -17.550 1.00 2.40 O ATOM 2098 ND2 ASN B 31 26.617 0.277 -17.158 1.00 1.85 N ATOM 0 H ASN B 31 23.480 -1.347 -13.763 1.00 1.19 H new ATOM 0 HA ASN B 31 26.188 -1.666 -14.795 1.00 1.26 H new ATOM 0 HB2 ASN B 31 23.792 -0.502 -15.659 1.00 1.34 H new ATOM 0 HB3 ASN B 31 24.825 0.880 -15.350 1.00 1.34 H new ATOM 0 HD21 ASN B 31 27.142 0.091 -18.012 1.00 1.85 H new ATOM 0 HD22 ASN B 31 26.881 1.058 -16.557 1.00 1.85 H new ATOM 2105 N LEU B 32 26.068 -0.157 -12.204 1.00 1.11 N ATOM 2106 CA LEU B 32 26.744 0.672 -11.183 1.00 1.05 C ATOM 2107 C LEU B 32 26.930 2.122 -11.585 1.00 1.03 C ATOM 2108 O LEU B 32 27.815 2.498 -12.329 1.00 1.08 O ATOM 2109 CB LEU B 32 28.086 0.042 -10.851 1.00 1.08 C ATOM 2110 CG LEU B 32 28.224 -0.194 -9.334 1.00 1.11 C ATOM 2111 CD1 LEU B 32 28.224 1.139 -8.593 1.00 1.07 C ATOM 2112 CD2 LEU B 32 27.065 -1.050 -8.811 1.00 1.16 C ATOM 0 H LEU B 32 25.485 -0.898 -11.816 1.00 1.11 H new ATOM 0 HA LEU B 32 26.093 0.694 -10.309 1.00 1.05 H new ATOM 0 HB2 LEU B 32 28.188 -0.905 -11.381 1.00 1.08 H new ATOM 0 HB3 LEU B 32 28.892 0.690 -11.197 1.00 1.08 H new ATOM 0 HG LEU B 32 29.165 -0.716 -9.159 1.00 1.11 H new ATOM 0 HD11 LEU B 32 28.322 0.960 -7.522 1.00 1.07 H new ATOM 0 HD12 LEU B 32 29.061 1.747 -8.937 1.00 1.07 H new ATOM 0 HD13 LEU B 32 27.289 1.664 -8.789 1.00 1.07 H new ATOM 0 HD21 LEU B 32 27.182 -1.204 -7.738 1.00 1.16 H new ATOM 0 HD22 LEU B 32 26.121 -0.541 -9.003 1.00 1.16 H new ATOM 0 HD23 LEU B 32 27.067 -2.014 -9.319 1.00 1.16 H new ATOM 2124 N SER B 33 26.124 2.928 -10.987 1.00 0.99 N ATOM 2125 CA SER B 33 26.187 4.393 -11.142 1.00 1.01 C ATOM 2126 C SER B 33 27.500 4.874 -10.510 1.00 0.96 C ATOM 2127 O SER B 33 27.625 6.017 -10.178 1.00 0.96 O ATOM 2128 CB SER B 33 24.988 5.039 -10.443 1.00 0.99 C ATOM 2129 OG SER B 33 23.955 5.255 -11.395 1.00 1.33 O ATOM 0 H SER B 33 25.382 2.613 -10.362 1.00 0.99 H new ATOM 0 HA SER B 33 26.155 4.672 -12.195 1.00 1.01 H new ATOM 0 HB2 SER B 33 24.630 4.396 -9.639 1.00 0.99 H new ATOM 0 HB3 SER B 33 25.283 5.984 -9.987 1.00 0.99 H new ATOM 0 HG SER B 33 23.184 5.667 -10.953 1.00 1.33 H new ATOM 2135 N TYR B 34 28.417 3.958 -10.238 1.00 0.95 N ATOM 2136 CA TYR B 34 29.697 4.273 -9.500 1.00 0.94 C ATOM 2137 C TYR B 34 30.030 5.770 -9.508 1.00 0.96 C ATOM 2138 O TYR B 34 30.348 6.329 -8.477 1.00 0.89 O ATOM 2139 CB TYR B 34 30.852 3.540 -10.184 1.00 1.10 C ATOM 2140 CG TYR B 34 31.352 4.335 -11.367 1.00 1.01 C ATOM 2141 CD1 TYR B 34 32.310 5.341 -11.180 1.00 1.77 C ATOM 2142 CD2 TYR B 34 30.861 4.068 -12.649 1.00 1.81 C ATOM 2143 CE1 TYR B 34 32.776 6.078 -12.275 1.00 2.53 C ATOM 2144 CE2 TYR B 34 31.328 4.805 -13.745 1.00 2.56 C ATOM 2145 CZ TYR B 34 32.285 5.810 -13.557 1.00 2.75 C ATOM 2146 OH TYR B 34 32.745 6.536 -14.637 1.00 3.76 O ATOM 0 H TYR B 34 28.326 2.978 -10.506 1.00 0.95 H new ATOM 0 HA TYR B 34 29.560 3.956 -8.466 1.00 0.94 H new ATOM 0 HB2 TYR B 34 31.664 3.384 -9.473 1.00 1.10 H new ATOM 0 HB3 TYR B 34 30.522 2.555 -10.513 1.00 1.10 H new ATOM 0 HD1 TYR B 34 32.689 5.548 -10.190 1.00 1.77 H new ATOM 0 HD2 TYR B 34 30.122 3.294 -12.794 1.00 1.81 H new ATOM 0 HE1 TYR B 34 33.514 6.853 -12.130 1.00 2.53 H new ATOM 0 HE2 TYR B 34 30.950 4.598 -14.735 1.00 2.56 H new ATOM 0 HH TYR B 34 32.303 6.223 -15.454 1.00 3.76 H new ATOM 2156 N ALA B 35 29.937 6.442 -10.614 1.00 1.07 N ATOM 2157 CA ALA B 35 30.229 7.900 -10.584 1.00 1.15 C ATOM 2158 C ALA B 35 29.214 8.558 -9.642 1.00 1.05 C ATOM 2159 O ALA B 35 29.548 9.376 -8.807 1.00 1.03 O ATOM 2160 CB ALA B 35 30.083 8.487 -11.990 1.00 1.30 C ATOM 0 H ALA B 35 29.677 6.058 -11.522 1.00 1.07 H new ATOM 0 HA ALA B 35 31.247 8.079 -10.238 1.00 1.15 H new ATOM 0 HB1 ALA B 35 30.298 9.555 -11.962 1.00 1.30 H new ATOM 0 HB2 ALA B 35 30.782 7.993 -12.665 1.00 1.30 H new ATOM 0 HB3 ALA B 35 29.064 8.331 -12.345 1.00 1.30 H new ATOM 2166 N LEU B 36 27.977 8.173 -9.775 1.00 1.02 N ATOM 2167 CA LEU B 36 26.891 8.717 -8.906 1.00 0.96 C ATOM 2168 C LEU B 36 26.647 7.791 -7.702 1.00 0.83 C ATOM 2169 O LEU B 36 26.496 8.245 -6.584 1.00 0.79 O ATOM 2170 CB LEU B 36 25.599 8.825 -9.722 1.00 1.03 C ATOM 2171 CG LEU B 36 25.113 10.277 -9.740 1.00 1.16 C ATOM 2172 CD1 LEU B 36 23.894 10.394 -10.656 1.00 1.74 C ATOM 2173 CD2 LEU B 36 24.725 10.703 -8.321 1.00 1.99 C ATOM 0 H LEU B 36 27.664 7.489 -10.464 1.00 1.02 H new ATOM 0 HA LEU B 36 27.192 9.699 -8.542 1.00 0.96 H new ATOM 0 HB2 LEU B 36 25.772 8.478 -10.741 1.00 1.03 H new ATOM 0 HB3 LEU B 36 24.832 8.181 -9.292 1.00 1.03 H new ATOM 0 HG LEU B 36 25.910 10.922 -10.109 1.00 1.16 H new ATOM 0 HD11 LEU B 36 23.547 11.427 -10.670 1.00 1.74 H new ATOM 0 HD12 LEU B 36 24.167 10.090 -11.666 1.00 1.74 H new ATOM 0 HD13 LEU B 36 23.097 9.749 -10.286 1.00 1.74 H new ATOM 0 HD21 LEU B 36 24.379 11.737 -8.333 1.00 1.99 H new ATOM 0 HD22 LEU B 36 23.928 10.058 -7.953 1.00 1.99 H new ATOM 0 HD23 LEU B 36 25.592 10.618 -7.666 1.00 1.99 H new ATOM 2185 N THR B 37 26.562 6.497 -7.935 1.00 0.80 N ATOM 2186 CA THR B 37 26.279 5.530 -6.821 1.00 0.71 C ATOM 2187 C THR B 37 27.031 5.926 -5.554 1.00 0.66 C ATOM 2188 O THR B 37 26.499 5.823 -4.470 1.00 0.61 O ATOM 2189 CB THR B 37 26.667 4.102 -7.237 1.00 0.80 C ATOM 2190 OG1 THR B 37 25.515 3.431 -7.727 1.00 0.93 O ATOM 2191 CG2 THR B 37 27.230 3.319 -6.038 1.00 0.81 C ATOM 0 H THR B 37 26.677 6.069 -8.854 1.00 0.80 H new ATOM 0 HA THR B 37 25.209 5.559 -6.613 1.00 0.71 H new ATOM 0 HB THR B 37 27.433 4.159 -8.011 1.00 0.80 H new ATOM 0 HG1 THR B 37 25.595 2.471 -7.548 1.00 0.93 H new ATOM 0 HG21 THR B 37 27.498 2.311 -6.355 1.00 0.81 H new ATOM 0 HG22 THR B 37 28.115 3.827 -5.655 1.00 0.81 H new ATOM 0 HG23 THR B 37 26.476 3.264 -5.253 1.00 0.81 H new ATOM 2199 N GLY B 38 28.256 6.360 -5.669 1.00 0.69 N ATOM 2200 CA GLY B 38 29.009 6.754 -4.439 1.00 0.68 C ATOM 2201 C GLY B 38 28.077 7.595 -3.565 1.00 0.65 C ATOM 2202 O GLY B 38 28.203 7.653 -2.360 1.00 0.64 O ATOM 0 H GLY B 38 28.765 6.459 -6.547 1.00 0.69 H new ATOM 0 HA2 GLY B 38 29.344 5.869 -3.898 1.00 0.68 H new ATOM 0 HA3 GLY B 38 29.900 7.323 -4.703 1.00 0.68 H new ATOM 2206 N ARG B 39 27.129 8.230 -4.193 1.00 0.67 N ATOM 2207 CA ARG B 39 26.137 9.070 -3.460 1.00 0.69 C ATOM 2208 C ARG B 39 25.169 8.172 -2.678 1.00 0.64 C ATOM 2209 O ARG B 39 24.695 8.527 -1.617 1.00 0.64 O ATOM 2210 CB ARG B 39 25.350 9.898 -4.477 1.00 0.76 C ATOM 2211 CG ARG B 39 24.471 10.920 -3.754 1.00 0.80 C ATOM 2212 CD ARG B 39 23.125 11.026 -4.474 1.00 0.82 C ATOM 2213 NE ARG B 39 22.404 12.240 -3.998 1.00 1.17 N ATOM 2214 CZ ARG B 39 21.830 12.241 -2.826 1.00 1.79 C ATOM 2215 NH1 ARG B 39 21.890 11.180 -2.069 1.00 2.44 N ATOM 2216 NH2 ARG B 39 21.197 13.305 -2.411 1.00 2.34 N ATOM 0 H ARG B 39 26.996 8.203 -5.204 1.00 0.67 H new ATOM 0 HA ARG B 39 26.656 9.726 -2.761 1.00 0.69 H new ATOM 0 HB2 ARG B 39 26.037 10.410 -5.151 1.00 0.76 H new ATOM 0 HB3 ARG B 39 24.731 9.243 -5.090 1.00 0.76 H new ATOM 0 HG2 ARG B 39 24.320 10.618 -2.718 1.00 0.80 H new ATOM 0 HG3 ARG B 39 24.964 11.892 -3.734 1.00 0.80 H new ATOM 0 HD2 ARG B 39 23.280 11.080 -5.552 1.00 0.82 H new ATOM 0 HD3 ARG B 39 22.526 10.135 -4.283 1.00 0.82 H new ATOM 0 HE ARG B 39 22.359 13.071 -4.588 1.00 1.17 H new ATOM 0 HH11 ARG B 39 22.386 10.350 -2.393 1.00 2.44 H new ATOM 0 HH12 ARG B 39 21.441 11.181 -1.153 1.00 2.44 H new ATOM 0 HH21 ARG B 39 21.151 14.135 -3.003 1.00 2.34 H new ATOM 0 HH22 ARG B 39 20.748 13.307 -1.495 1.00 2.34 H new ATOM 2230 N TYR B 40 24.878 7.010 -3.198 1.00 0.60 N ATOM 2231 CA TYR B 40 23.948 6.083 -2.491 1.00 0.56 C ATOM 2232 C TYR B 40 24.692 5.385 -1.357 1.00 0.48 C ATOM 2233 O TYR B 40 24.198 5.269 -0.254 1.00 0.47 O ATOM 2234 CB TYR B 40 23.407 5.038 -3.476 1.00 0.58 C ATOM 2235 CG TYR B 40 22.913 5.683 -4.768 1.00 0.81 C ATOM 2236 CD1 TYR B 40 22.550 7.048 -4.836 1.00 1.61 C ATOM 2237 CD2 TYR B 40 22.811 4.889 -5.918 1.00 1.51 C ATOM 2238 CE1 TYR B 40 22.097 7.591 -6.043 1.00 1.88 C ATOM 2239 CE2 TYR B 40 22.359 5.441 -7.122 1.00 1.79 C ATOM 2240 CZ TYR B 40 22.002 6.790 -7.184 1.00 1.59 C ATOM 2241 OH TYR B 40 21.554 7.330 -8.373 1.00 2.01 O ATOM 0 H TYR B 40 25.245 6.662 -4.084 1.00 0.60 H new ATOM 0 HA TYR B 40 23.113 6.652 -2.081 1.00 0.56 H new ATOM 0 HB2 TYR B 40 24.190 4.315 -3.706 1.00 0.58 H new ATOM 0 HB3 TYR B 40 22.591 4.486 -3.009 1.00 0.58 H new ATOM 0 HD1 TYR B 40 22.622 7.671 -3.957 1.00 1.61 H new ATOM 0 HD2 TYR B 40 23.083 3.845 -5.875 1.00 1.51 H new ATOM 0 HE1 TYR B 40 21.820 8.634 -6.093 1.00 1.88 H new ATOM 0 HE2 TYR B 40 22.286 4.823 -8.005 1.00 1.79 H new ATOM 0 HH TYR B 40 20.579 7.424 -8.343 1.00 2.01 H new ATOM 2251 N ILE B 41 25.879 4.918 -1.619 1.00 0.44 N ATOM 2252 CA ILE B 41 26.656 4.227 -0.559 1.00 0.40 C ATOM 2253 C ILE B 41 26.950 5.204 0.583 1.00 0.41 C ATOM 2254 O ILE B 41 26.692 4.923 1.736 1.00 0.41 O ATOM 2255 CB ILE B 41 27.967 3.713 -1.155 1.00 0.41 C ATOM 2256 CG1 ILE B 41 27.693 2.427 -1.939 1.00 0.53 C ATOM 2257 CG2 ILE B 41 28.962 3.421 -0.034 1.00 0.47 C ATOM 2258 CD1 ILE B 41 28.893 2.107 -2.833 1.00 0.54 C ATOM 0 H ILE B 41 26.344 4.986 -2.524 1.00 0.44 H new ATOM 0 HA ILE B 41 26.081 3.388 -0.168 1.00 0.40 H new ATOM 0 HB ILE B 41 28.385 4.469 -1.820 1.00 0.41 H new ATOM 0 HG12 ILE B 41 27.509 1.602 -1.251 1.00 0.53 H new ATOM 0 HG13 ILE B 41 26.795 2.543 -2.546 1.00 0.53 H new ATOM 0 HG21 ILE B 41 29.895 3.055 -0.462 1.00 0.47 H new ATOM 0 HG22 ILE B 41 29.155 4.334 0.529 1.00 0.47 H new ATOM 0 HG23 ILE B 41 28.547 2.665 0.633 1.00 0.47 H new ATOM 0 HD11 ILE B 41 28.697 1.191 -3.391 1.00 0.54 H new ATOM 0 HD12 ILE B 41 29.057 2.929 -3.530 1.00 0.54 H new ATOM 0 HD13 ILE B 41 29.781 1.973 -2.216 1.00 0.54 H new ATOM 2270 N LYS B 42 27.482 6.352 0.267 1.00 0.46 N ATOM 2271 CA LYS B 42 27.786 7.350 1.328 1.00 0.50 C ATOM 2272 C LYS B 42 26.496 7.697 2.077 1.00 0.51 C ATOM 2273 O LYS B 42 26.450 7.688 3.291 1.00 0.53 O ATOM 2274 CB LYS B 42 28.366 8.609 0.682 1.00 0.59 C ATOM 2275 CG LYS B 42 29.342 9.288 1.647 1.00 0.89 C ATOM 2276 CD LYS B 42 28.608 9.689 2.928 1.00 0.61 C ATOM 2277 CE LYS B 42 29.339 10.860 3.589 1.00 0.65 C ATOM 2278 NZ LYS B 42 29.171 12.085 2.756 1.00 1.61 N ATOM 0 H LYS B 42 27.719 6.642 -0.682 1.00 0.46 H new ATOM 0 HA LYS B 42 28.511 6.938 2.030 1.00 0.50 H new ATOM 0 HB2 LYS B 42 28.878 8.350 -0.244 1.00 0.59 H new ATOM 0 HB3 LYS B 42 27.562 9.297 0.420 1.00 0.59 H new ATOM 0 HG2 LYS B 42 30.163 8.612 1.884 1.00 0.89 H new ATOM 0 HG3 LYS B 42 29.780 10.169 1.177 1.00 0.89 H new ATOM 0 HD2 LYS B 42 27.580 9.971 2.698 1.00 0.61 H new ATOM 0 HD3 LYS B 42 28.561 8.842 3.613 1.00 0.61 H new ATOM 0 HE2 LYS B 42 28.943 11.031 4.590 1.00 0.65 H new ATOM 0 HE3 LYS B 42 30.398 10.625 3.700 1.00 0.65 H new ATOM 0 HZ1 LYS B 42 29.206 12.927 3.366 1.00 1.61 H new ATOM 0 HZ2 LYS B 42 29.936 12.134 2.053 1.00 1.61 H new ATOM 0 HZ3 LYS B 42 28.254 12.049 2.267 1.00 1.61 H new ATOM 2292 N MET B 43 25.448 8.002 1.359 1.00 0.55 N ATOM 2293 CA MET B 43 24.159 8.350 2.025 1.00 0.60 C ATOM 2294 C MET B 43 23.766 7.236 2.997 1.00 0.50 C ATOM 2295 O MET B 43 23.434 7.484 4.137 1.00 0.52 O ATOM 2296 CB MET B 43 23.064 8.515 0.961 1.00 0.68 C ATOM 2297 CG MET B 43 21.684 8.570 1.630 1.00 0.78 C ATOM 2298 SD MET B 43 20.446 9.086 0.416 1.00 1.39 S ATOM 2299 CE MET B 43 19.327 7.678 0.628 1.00 2.16 C ATOM 0 H MET B 43 25.429 8.025 0.339 1.00 0.55 H new ATOM 0 HA MET B 43 24.275 9.283 2.576 1.00 0.60 H new ATOM 0 HB2 MET B 43 23.236 9.427 0.389 1.00 0.68 H new ATOM 0 HB3 MET B 43 23.102 7.684 0.256 1.00 0.68 H new ATOM 0 HG2 MET B 43 21.425 7.592 2.036 1.00 0.78 H new ATOM 0 HG3 MET B 43 21.701 9.268 2.467 1.00 0.78 H new ATOM 0 HE1 MET B 43 18.472 7.789 -0.039 1.00 2.16 H new ATOM 0 HE2 MET B 43 19.855 6.755 0.390 1.00 2.16 H new ATOM 0 HE3 MET B 43 18.979 7.642 1.660 1.00 2.16 H new ATOM 2309 N LEU B 44 23.792 6.011 2.552 1.00 0.43 N ATOM 2310 CA LEU B 44 23.405 4.884 3.449 1.00 0.35 C ATOM 2311 C LEU B 44 24.370 4.812 4.635 1.00 0.32 C ATOM 2312 O LEU B 44 23.959 4.743 5.778 1.00 0.35 O ATOM 2313 CB LEU B 44 23.468 3.576 2.661 1.00 0.33 C ATOM 2314 CG LEU B 44 22.279 3.488 1.698 1.00 0.49 C ATOM 2315 CD1 LEU B 44 22.580 2.442 0.625 1.00 0.90 C ATOM 2316 CD2 LEU B 44 21.004 3.081 2.452 1.00 0.68 C ATOM 0 H LEU B 44 24.064 5.740 1.607 1.00 0.43 H new ATOM 0 HA LEU B 44 22.393 5.044 3.821 1.00 0.35 H new ATOM 0 HB2 LEU B 44 24.403 3.522 2.104 1.00 0.33 H new ATOM 0 HB3 LEU B 44 23.456 2.728 3.346 1.00 0.33 H new ATOM 0 HG LEU B 44 22.123 4.465 1.241 1.00 0.49 H new ATOM 0 HD11 LEU B 44 21.738 2.374 -0.064 1.00 0.90 H new ATOM 0 HD12 LEU B 44 23.476 2.732 0.076 1.00 0.90 H new ATOM 0 HD13 LEU B 44 22.742 1.473 1.097 1.00 0.90 H new ATOM 0 HD21 LEU B 44 20.170 3.024 1.752 1.00 0.68 H new ATOM 0 HD22 LEU B 44 21.153 2.108 2.920 1.00 0.68 H new ATOM 0 HD23 LEU B 44 20.783 3.822 3.220 1.00 0.68 H new ATOM 2328 N MET B 45 25.647 4.835 4.378 1.00 0.40 N ATOM 2329 CA MET B 45 26.631 4.779 5.495 1.00 0.42 C ATOM 2330 C MET B 45 26.423 6.004 6.386 1.00 0.44 C ATOM 2331 O MET B 45 26.347 5.915 7.596 1.00 0.43 O ATOM 2332 CB MET B 45 28.048 4.801 4.912 1.00 0.52 C ATOM 2333 CG MET B 45 29.070 4.631 6.032 1.00 1.13 C ATOM 2334 SD MET B 45 30.183 3.259 5.635 1.00 0.80 S ATOM 2335 CE MET B 45 30.971 4.001 4.184 1.00 0.83 C ATOM 0 H MET B 45 26.052 4.890 3.444 1.00 0.40 H new ATOM 0 HA MET B 45 26.494 3.869 6.079 1.00 0.42 H new ATOM 0 HB2 MET B 45 28.162 4.002 4.179 1.00 0.52 H new ATOM 0 HB3 MET B 45 28.221 5.741 4.389 1.00 0.52 H new ATOM 0 HG2 MET B 45 29.641 5.551 6.160 1.00 1.13 H new ATOM 0 HG3 MET B 45 28.561 4.438 6.976 1.00 1.13 H new ATOM 0 HE1 MET B 45 31.927 3.512 3.999 1.00 0.83 H new ATOM 0 HE2 MET B 45 30.325 3.875 3.315 1.00 0.83 H new ATOM 0 HE3 MET B 45 31.136 5.064 4.363 1.00 0.83 H new ATOM 2345 N ASP B 46 26.309 7.143 5.772 1.00 0.48 N ATOM 2346 CA ASP B 46 26.076 8.393 6.545 1.00 0.53 C ATOM 2347 C ASP B 46 24.779 8.245 7.342 1.00 0.51 C ATOM 2348 O ASP B 46 24.552 8.931 8.319 1.00 0.55 O ATOM 2349 CB ASP B 46 25.944 9.578 5.590 1.00 0.59 C ATOM 2350 CG ASP B 46 26.199 10.881 6.351 1.00 0.71 C ATOM 2351 OD1 ASP B 46 26.036 10.879 7.560 1.00 1.30 O ATOM 2352 OD2 ASP B 46 26.551 11.858 5.710 1.00 1.26 O ATOM 0 H ASP B 46 26.367 7.265 4.761 1.00 0.48 H new ATOM 0 HA ASP B 46 26.916 8.567 7.218 1.00 0.53 H new ATOM 0 HB2 ASP B 46 26.656 9.479 4.770 1.00 0.59 H new ATOM 0 HB3 ASP B 46 24.948 9.592 5.148 1.00 0.59 H new ATOM 2357 N LEU B 47 23.920 7.359 6.914 1.00 0.48 N ATOM 2358 CA LEU B 47 22.623 7.162 7.621 1.00 0.50 C ATOM 2359 C LEU B 47 22.729 5.982 8.587 1.00 0.46 C ATOM 2360 O LEU B 47 21.815 5.706 9.337 1.00 0.50 O ATOM 2361 CB LEU B 47 21.530 6.881 6.589 1.00 0.51 C ATOM 2362 CG LEU B 47 20.749 8.161 6.256 1.00 0.59 C ATOM 2363 CD1 LEU B 47 21.696 9.350 6.043 1.00 0.59 C ATOM 2364 CD2 LEU B 47 19.955 7.930 4.975 1.00 0.62 C ATOM 0 H LEU B 47 24.063 6.760 6.101 1.00 0.48 H new ATOM 0 HA LEU B 47 22.377 8.061 8.186 1.00 0.50 H new ATOM 0 HB2 LEU B 47 21.977 6.476 5.681 1.00 0.51 H new ATOM 0 HB3 LEU B 47 20.847 6.123 6.973 1.00 0.51 H new ATOM 0 HG LEU B 47 20.087 8.391 7.091 1.00 0.59 H new ATOM 0 HD11 LEU B 47 21.114 10.241 5.809 1.00 0.59 H new ATOM 0 HD12 LEU B 47 22.274 9.522 6.951 1.00 0.59 H new ATOM 0 HD13 LEU B 47 22.374 9.132 5.218 1.00 0.59 H new ATOM 0 HD21 LEU B 47 19.395 8.832 4.726 1.00 0.62 H new ATOM 0 HD22 LEU B 47 20.639 7.692 4.161 1.00 0.62 H new ATOM 0 HD23 LEU B 47 19.262 7.101 5.121 1.00 0.62 H new ATOM 2376 N GLU B 48 23.835 5.286 8.569 1.00 0.42 N ATOM 2377 CA GLU B 48 24.019 4.117 9.482 1.00 0.42 C ATOM 2378 C GLU B 48 23.306 2.894 8.898 1.00 0.39 C ATOM 2379 O GLU B 48 22.490 2.272 9.543 1.00 0.47 O ATOM 2380 CB GLU B 48 23.463 4.437 10.875 1.00 0.47 C ATOM 2381 CG GLU B 48 24.281 3.690 11.931 1.00 1.16 C ATOM 2382 CD GLU B 48 25.571 4.460 12.219 1.00 1.19 C ATOM 2383 OE1 GLU B 48 25.902 5.336 11.437 1.00 1.69 O ATOM 2384 OE2 GLU B 48 26.207 4.161 13.217 1.00 1.72 O ATOM 0 H GLU B 48 24.627 5.479 7.955 1.00 0.42 H new ATOM 0 HA GLU B 48 25.083 3.902 9.576 1.00 0.42 H new ATOM 0 HB2 GLU B 48 23.506 5.511 11.058 1.00 0.47 H new ATOM 0 HB3 GLU B 48 22.415 4.144 10.937 1.00 0.47 H new ATOM 0 HG2 GLU B 48 23.699 3.580 12.846 1.00 1.16 H new ATOM 0 HG3 GLU B 48 24.516 2.685 11.580 1.00 1.16 H new ATOM 2391 N ILE B 49 23.625 2.542 7.680 1.00 0.32 N ATOM 2392 CA ILE B 49 22.989 1.357 7.037 1.00 0.30 C ATOM 2393 C ILE B 49 24.093 0.514 6.419 1.00 0.30 C ATOM 2394 O ILE B 49 24.011 -0.698 6.367 1.00 0.31 O ATOM 2395 CB ILE B 49 22.031 1.814 5.930 1.00 0.29 C ATOM 2396 CG1 ILE B 49 20.650 2.137 6.518 1.00 0.35 C ATOM 2397 CG2 ILE B 49 21.879 0.699 4.891 1.00 0.29 C ATOM 2398 CD1 ILE B 49 20.713 3.410 7.369 1.00 0.51 C ATOM 0 H ILE B 49 24.306 3.031 7.099 1.00 0.32 H new ATOM 0 HA ILE B 49 22.428 0.786 7.777 1.00 0.30 H new ATOM 0 HB ILE B 49 22.441 2.709 5.462 1.00 0.29 H new ATOM 0 HG12 ILE B 49 19.927 2.266 5.713 1.00 0.35 H new ATOM 0 HG13 ILE B 49 20.303 1.302 7.127 1.00 0.35 H new ATOM 0 HG21 ILE B 49 21.198 1.025 4.105 1.00 0.29 H new ATOM 0 HG22 ILE B 49 22.852 0.471 4.457 1.00 0.29 H new ATOM 0 HG23 ILE B 49 21.478 -0.194 5.371 1.00 0.29 H new ATOM 0 HD11 ILE B 49 19.725 3.624 7.778 1.00 0.51 H new ATOM 0 HD12 ILE B 49 21.421 3.267 8.186 1.00 0.51 H new ATOM 0 HD13 ILE B 49 21.038 4.246 6.750 1.00 0.51 H new ATOM 2410 N ILE B 50 25.134 1.158 5.963 1.00 0.30 N ATOM 2411 CA ILE B 50 26.261 0.416 5.354 1.00 0.31 C ATOM 2412 C ILE B 50 27.368 0.332 6.392 1.00 0.36 C ATOM 2413 O ILE B 50 27.312 0.993 7.410 1.00 0.57 O ATOM 2414 CB ILE B 50 26.733 1.142 4.088 1.00 0.31 C ATOM 2415 CG1 ILE B 50 25.843 0.702 2.918 1.00 0.35 C ATOM 2416 CG2 ILE B 50 28.188 0.778 3.779 1.00 0.36 C ATOM 2417 CD1 ILE B 50 26.177 1.508 1.663 1.00 0.70 C ATOM 0 H ILE B 50 25.247 2.171 5.989 1.00 0.30 H new ATOM 0 HA ILE B 50 25.960 -0.590 5.060 1.00 0.31 H new ATOM 0 HB ILE B 50 26.666 2.220 4.238 1.00 0.31 H new ATOM 0 HG12 ILE B 50 25.986 -0.361 2.724 1.00 0.35 H new ATOM 0 HG13 ILE B 50 24.794 0.841 3.179 1.00 0.35 H new ATOM 0 HG21 ILE B 50 28.510 1.300 2.878 1.00 0.36 H new ATOM 0 HG22 ILE B 50 28.822 1.072 4.615 1.00 0.36 H new ATOM 0 HG23 ILE B 50 28.269 -0.298 3.623 1.00 0.36 H new ATOM 0 HD11 ILE B 50 25.537 1.184 0.842 1.00 0.70 H new ATOM 0 HD12 ILE B 50 26.011 2.568 1.856 1.00 0.70 H new ATOM 0 HD13 ILE B 50 27.221 1.347 1.395 1.00 0.70 H new ATOM 2429 N ARG B 51 28.354 -0.488 6.172 1.00 0.42 N ATOM 2430 CA ARG B 51 29.427 -0.615 7.189 1.00 0.44 C ATOM 2431 C ARG B 51 30.756 -0.820 6.473 1.00 0.44 C ATOM 2432 O ARG B 51 30.812 -1.414 5.425 1.00 0.54 O ATOM 2433 CB ARG B 51 29.088 -1.809 8.087 1.00 0.52 C ATOM 2434 CG ARG B 51 30.132 -1.970 9.193 1.00 0.75 C ATOM 2435 CD ARG B 51 30.020 -0.812 10.195 1.00 0.89 C ATOM 2436 NE ARG B 51 30.634 -1.213 11.493 1.00 0.89 N ATOM 2437 CZ ARG B 51 30.301 -0.591 12.591 1.00 0.95 C ATOM 2438 NH1 ARG B 51 29.432 0.382 12.552 1.00 1.50 N ATOM 2439 NH2 ARG B 51 30.836 -0.942 13.729 1.00 1.24 N ATOM 0 H ARG B 51 28.462 -1.070 5.341 1.00 0.42 H new ATOM 0 HA ARG B 51 29.505 0.281 7.805 1.00 0.44 H new ATOM 0 HB2 ARG B 51 28.102 -1.669 8.529 1.00 0.52 H new ATOM 0 HB3 ARG B 51 29.042 -2.719 7.488 1.00 0.52 H new ATOM 0 HG2 ARG B 51 29.986 -2.921 9.706 1.00 0.75 H new ATOM 0 HG3 ARG B 51 31.132 -1.991 8.760 1.00 0.75 H new ATOM 0 HD2 ARG B 51 30.521 0.072 9.802 1.00 0.89 H new ATOM 0 HD3 ARG B 51 28.973 -0.546 10.343 1.00 0.89 H new ATOM 0 HE ARG B 51 31.314 -1.973 11.523 1.00 0.89 H new ATOM 0 HH11 ARG B 51 29.013 0.656 11.663 1.00 1.50 H new ATOM 0 HH12 ARG B 51 29.172 0.868 13.410 1.00 1.50 H new ATOM 0 HH21 ARG B 51 31.515 -1.703 13.760 1.00 1.24 H new ATOM 0 HH22 ARG B 51 30.575 -0.455 14.587 1.00 1.24 H new ATOM 2453 N GLN B 52 31.819 -0.303 7.019 1.00 0.44 N ATOM 2454 CA GLN B 52 33.146 -0.434 6.343 1.00 0.48 C ATOM 2455 C GLN B 52 33.947 -1.571 6.959 1.00 0.53 C ATOM 2456 O GLN B 52 34.354 -1.508 8.103 1.00 0.65 O ATOM 2457 CB GLN B 52 33.926 0.873 6.501 1.00 0.61 C ATOM 2458 CG GLN B 52 34.918 1.019 5.343 1.00 1.46 C ATOM 2459 CD GLN B 52 35.843 2.209 5.607 1.00 1.70 C ATOM 2460 OE1 GLN B 52 36.710 2.142 6.456 1.00 2.42 O ATOM 2461 NE2 GLN B 52 35.697 3.303 4.910 1.00 1.80 N ATOM 0 H GLN B 52 31.831 0.205 7.903 1.00 0.44 H new ATOM 0 HA GLN B 52 32.982 -0.648 5.287 1.00 0.48 H new ATOM 0 HB2 GLN B 52 33.239 1.719 6.515 1.00 0.61 H new ATOM 0 HB3 GLN B 52 34.458 0.879 7.452 1.00 0.61 H new ATOM 0 HG2 GLN B 52 35.504 0.106 5.236 1.00 1.46 H new ATOM 0 HG3 GLN B 52 34.380 1.164 4.406 1.00 1.46 H new ATOM 0 HE21 GLN B 52 34.970 3.360 4.197 1.00 1.80 H new ATOM 0 HE22 GLN B 52 36.310 4.101 5.078 1.00 1.80 H new ATOM 2470 N GLU B 53 34.183 -2.605 6.194 1.00 0.57 N ATOM 2471 CA GLU B 53 34.971 -3.755 6.707 1.00 0.74 C ATOM 2472 C GLU B 53 36.146 -4.007 5.770 1.00 0.75 C ATOM 2473 O GLU B 53 36.011 -4.599 4.722 1.00 0.76 O ATOM 2474 CB GLU B 53 34.064 -4.987 6.747 1.00 0.90 C ATOM 2475 CG GLU B 53 34.877 -6.244 7.072 1.00 1.02 C ATOM 2476 CD GLU B 53 35.741 -6.007 8.312 1.00 1.37 C ATOM 2477 OE1 GLU B 53 36.781 -5.386 8.173 1.00 1.95 O ATOM 2478 OE2 GLU B 53 35.347 -6.450 9.378 1.00 2.11 O ATOM 0 H GLU B 53 33.860 -2.699 5.231 1.00 0.57 H new ATOM 0 HA GLU B 53 35.348 -3.545 7.708 1.00 0.74 H new ATOM 0 HB2 GLU B 53 33.285 -4.847 7.496 1.00 0.90 H new ATOM 0 HB3 GLU B 53 33.564 -5.109 5.786 1.00 0.90 H new ATOM 0 HG2 GLU B 53 34.206 -7.086 7.242 1.00 1.02 H new ATOM 0 HG3 GLU B 53 35.509 -6.507 6.224 1.00 1.02 H new ATOM 2485 N GLY B 54 37.297 -3.556 6.162 1.00 0.80 N ATOM 2486 CA GLY B 54 38.514 -3.749 5.328 1.00 0.85 C ATOM 2487 C GLY B 54 38.443 -2.865 4.073 1.00 0.74 C ATOM 2488 O GLY B 54 38.980 -3.207 3.038 1.00 0.88 O ATOM 0 H GLY B 54 37.452 -3.054 7.036 1.00 0.80 H new ATOM 0 HA2 GLY B 54 39.404 -3.501 5.907 1.00 0.85 H new ATOM 0 HA3 GLY B 54 38.604 -4.796 5.039 1.00 0.85 H new ATOM 2492 N LYS B 55 37.753 -1.753 4.155 1.00 0.78 N ATOM 2493 CA LYS B 55 37.598 -0.834 2.975 1.00 0.78 C ATOM 2494 C LYS B 55 36.441 -1.334 2.095 1.00 0.69 C ATOM 2495 O LYS B 55 36.078 -0.720 1.113 1.00 0.70 O ATOM 2496 CB LYS B 55 38.904 -0.752 2.160 1.00 0.91 C ATOM 2497 CG LYS B 55 39.145 0.690 1.687 1.00 1.13 C ATOM 2498 CD LYS B 55 38.043 1.120 0.716 1.00 1.34 C ATOM 2499 CE LYS B 55 38.490 2.373 -0.041 1.00 1.60 C ATOM 2500 NZ LYS B 55 39.526 2.004 -1.045 1.00 2.11 N ATOM 0 H LYS B 55 37.282 -1.435 5.002 1.00 0.78 H new ATOM 0 HA LYS B 55 37.373 0.170 3.335 1.00 0.78 H new ATOM 0 HB2 LYS B 55 39.743 -1.088 2.769 1.00 0.91 H new ATOM 0 HB3 LYS B 55 38.847 -1.420 1.300 1.00 0.91 H new ATOM 0 HG2 LYS B 55 39.167 1.363 2.544 1.00 1.13 H new ATOM 0 HG3 LYS B 55 40.117 0.763 1.200 1.00 1.13 H new ATOM 0 HD2 LYS B 55 37.828 0.315 0.013 1.00 1.34 H new ATOM 0 HD3 LYS B 55 37.121 1.321 1.262 1.00 1.34 H new ATOM 0 HE2 LYS B 55 37.636 2.835 -0.537 1.00 1.60 H new ATOM 0 HE3 LYS B 55 38.890 3.109 0.657 1.00 1.60 H new ATOM 0 HZ1 LYS B 55 39.562 2.730 -1.789 1.00 2.11 H new ATOM 0 HZ2 LYS B 55 40.453 1.939 -0.579 1.00 2.11 H new ATOM 0 HZ3 LYS B 55 39.287 1.085 -1.469 1.00 2.11 H new ATOM 2514 N GLN B 56 35.843 -2.434 2.463 1.00 0.70 N ATOM 2515 CA GLN B 56 34.692 -2.964 1.675 1.00 0.70 C ATOM 2516 C GLN B 56 33.424 -2.507 2.374 1.00 0.60 C ATOM 2517 O GLN B 56 33.479 -2.043 3.494 1.00 0.60 O ATOM 2518 CB GLN B 56 34.711 -4.494 1.639 1.00 0.85 C ATOM 2519 CG GLN B 56 36.150 -4.992 1.555 1.00 1.17 C ATOM 2520 CD GLN B 56 36.166 -6.384 0.920 1.00 1.15 C ATOM 2521 OE1 GLN B 56 35.291 -7.189 1.175 1.00 1.54 O ATOM 2522 NE2 GLN B 56 37.126 -6.705 0.100 1.00 1.66 N ATOM 0 H GLN B 56 36.102 -2.991 3.278 1.00 0.70 H new ATOM 0 HA GLN B 56 34.747 -2.599 0.649 1.00 0.70 H new ATOM 0 HB2 GLN B 56 34.230 -4.894 2.532 1.00 0.85 H new ATOM 0 HB3 GLN B 56 34.142 -4.854 0.782 1.00 0.85 H new ATOM 0 HG2 GLN B 56 36.752 -4.302 0.963 1.00 1.17 H new ATOM 0 HG3 GLN B 56 36.593 -5.028 2.550 1.00 1.17 H new ATOM 0 HE21 GLN B 56 37.860 -6.030 -0.115 1.00 1.66 H new ATOM 0 HE22 GLN B 56 37.143 -7.631 -0.328 1.00 1.66 H new ATOM 2531 N TYR B 57 32.288 -2.606 1.735 1.00 0.56 N ATOM 2532 CA TYR B 57 31.044 -2.135 2.396 1.00 0.48 C ATOM 2533 C TYR B 57 30.267 -3.327 2.937 1.00 0.47 C ATOM 2534 O TYR B 57 29.971 -4.274 2.239 1.00 0.53 O ATOM 2535 CB TYR B 57 30.202 -1.354 1.404 1.00 0.46 C ATOM 2536 CG TYR B 57 31.116 -0.424 0.629 1.00 0.49 C ATOM 2537 CD1 TYR B 57 31.951 -0.920 -0.379 1.00 1.27 C ATOM 2538 CD2 TYR B 57 31.151 0.939 0.950 1.00 1.18 C ATOM 2539 CE1 TYR B 57 32.813 -0.054 -1.065 1.00 1.30 C ATOM 2540 CE2 TYR B 57 32.009 1.804 0.261 1.00 1.18 C ATOM 2541 CZ TYR B 57 32.841 1.306 -0.746 1.00 0.57 C ATOM 2542 OH TYR B 57 33.691 2.158 -1.422 1.00 0.63 O ATOM 0 H TYR B 57 32.172 -2.988 0.796 1.00 0.56 H new ATOM 0 HA TYR B 57 31.299 -1.479 3.228 1.00 0.48 H new ATOM 0 HB2 TYR B 57 29.688 -2.034 0.725 1.00 0.46 H new ATOM 0 HB3 TYR B 57 29.434 -0.783 1.925 1.00 0.46 H new ATOM 0 HD1 TYR B 57 31.931 -1.971 -0.628 1.00 1.27 H new ATOM 0 HD2 TYR B 57 30.513 1.324 1.732 1.00 1.18 H new ATOM 0 HE1 TYR B 57 33.457 -0.439 -1.842 1.00 1.30 H new ATOM 0 HE2 TYR B 57 32.028 2.855 0.507 1.00 1.18 H new ATOM 0 HH TYR B 57 33.583 3.069 -1.077 1.00 0.63 H new ATOM 2552 N MET B 58 29.977 -3.272 4.201 1.00 0.44 N ATOM 2553 CA MET B 58 29.255 -4.361 4.898 1.00 0.45 C ATOM 2554 C MET B 58 27.926 -3.800 5.412 1.00 0.42 C ATOM 2555 O MET B 58 27.682 -2.615 5.319 1.00 0.40 O ATOM 2556 CB MET B 58 30.146 -4.866 6.047 1.00 0.50 C ATOM 2557 CG MET B 58 29.332 -5.672 7.056 1.00 1.04 C ATOM 2558 SD MET B 58 30.465 -6.525 8.181 1.00 1.10 S ATOM 2559 CE MET B 58 29.530 -6.244 9.704 1.00 1.52 C ATOM 0 H MET B 58 30.221 -2.485 4.802 1.00 0.44 H new ATOM 0 HA MET B 58 29.040 -5.199 4.235 1.00 0.45 H new ATOM 0 HB2 MET B 58 30.949 -5.484 5.645 1.00 0.50 H new ATOM 0 HB3 MET B 58 30.616 -4.019 6.547 1.00 0.50 H new ATOM 0 HG2 MET B 58 28.669 -5.013 7.617 1.00 1.04 H new ATOM 0 HG3 MET B 58 28.700 -6.394 6.539 1.00 1.04 H new ATOM 0 HE1 MET B 58 30.058 -6.696 10.544 1.00 1.52 H new ATOM 0 HE2 MET B 58 29.426 -5.172 9.875 1.00 1.52 H new ATOM 0 HE3 MET B 58 28.542 -6.694 9.612 1.00 1.52 H new ATOM 2569 N LEU B 59 27.061 -4.631 5.919 1.00 0.44 N ATOM 2570 CA LEU B 59 25.743 -4.120 6.398 1.00 0.43 C ATOM 2571 C LEU B 59 25.783 -3.935 7.917 1.00 0.41 C ATOM 2572 O LEU B 59 26.337 -4.741 8.637 1.00 0.47 O ATOM 2573 CB LEU B 59 24.619 -5.105 6.016 1.00 0.51 C ATOM 2574 CG LEU B 59 24.604 -6.355 6.923 1.00 0.77 C ATOM 2575 CD1 LEU B 59 23.442 -7.259 6.511 1.00 1.05 C ATOM 2576 CD2 LEU B 59 25.914 -7.133 6.778 1.00 1.25 C ATOM 0 H LEU B 59 27.205 -5.635 6.023 1.00 0.44 H new ATOM 0 HA LEU B 59 25.541 -3.159 5.925 1.00 0.43 H new ATOM 0 HB2 LEU B 59 23.656 -4.598 6.083 1.00 0.51 H new ATOM 0 HB3 LEU B 59 24.746 -5.413 4.978 1.00 0.51 H new ATOM 0 HG LEU B 59 24.489 -6.039 7.960 1.00 0.77 H new ATOM 0 HD11 LEU B 59 23.426 -8.144 7.148 1.00 1.05 H new ATOM 0 HD12 LEU B 59 22.503 -6.717 6.620 1.00 1.05 H new ATOM 0 HD13 LEU B 59 23.568 -7.562 5.472 1.00 1.05 H new ATOM 0 HD21 LEU B 59 25.889 -8.011 7.423 1.00 1.25 H new ATOM 0 HD22 LEU B 59 26.038 -7.447 5.742 1.00 1.25 H new ATOM 0 HD23 LEU B 59 26.750 -6.495 7.066 1.00 1.25 H new ATOM 2588 N THR B 60 25.215 -2.863 8.404 1.00 0.38 N ATOM 2589 CA THR B 60 25.235 -2.609 9.873 1.00 0.41 C ATOM 2590 C THR B 60 23.909 -3.070 10.479 1.00 0.44 C ATOM 2591 O THR B 60 22.942 -3.286 9.776 1.00 0.43 O ATOM 2592 CB THR B 60 25.400 -1.112 10.132 1.00 0.40 C ATOM 2593 OG1 THR B 60 26.130 -0.520 9.067 1.00 1.04 O ATOM 2594 CG2 THR B 60 26.138 -0.884 11.454 1.00 1.01 C ATOM 0 H THR B 60 24.739 -2.153 7.848 1.00 0.38 H new ATOM 0 HA THR B 60 26.065 -3.154 10.323 1.00 0.41 H new ATOM 0 HB THR B 60 24.414 -0.652 10.194 1.00 0.40 H new ATOM 0 HG1 THR B 60 26.068 0.456 9.130 1.00 1.04 H new ATOM 0 HG21 THR B 60 26.250 0.186 11.628 1.00 1.01 H new ATOM 0 HG22 THR B 60 25.567 -1.327 12.270 1.00 1.01 H new ATOM 0 HG23 THR B 60 27.123 -1.349 11.406 1.00 1.01 H new ATOM 2602 N LYS B 61 23.857 -3.224 11.777 1.00 0.51 N ATOM 2603 CA LYS B 61 22.592 -3.673 12.432 1.00 0.54 C ATOM 2604 C LYS B 61 21.408 -2.907 11.826 1.00 0.51 C ATOM 2605 O LYS B 61 20.379 -3.464 11.504 1.00 0.50 O ATOM 2606 CB LYS B 61 22.662 -3.410 13.945 1.00 0.61 C ATOM 2607 CG LYS B 61 23.359 -2.071 14.231 1.00 1.28 C ATOM 2608 CD LYS B 61 24.784 -2.324 14.730 1.00 1.04 C ATOM 2609 CE LYS B 61 25.456 -0.987 15.050 1.00 1.73 C ATOM 2610 NZ LYS B 61 26.937 -1.143 14.968 1.00 2.19 N ATOM 0 H LYS B 61 24.637 -3.058 12.413 1.00 0.51 H new ATOM 0 HA LYS B 61 22.459 -4.742 12.266 1.00 0.54 H new ATOM 0 HB2 LYS B 61 21.656 -3.399 14.364 1.00 0.61 H new ATOM 0 HB3 LYS B 61 23.203 -4.219 14.435 1.00 0.61 H new ATOM 0 HG2 LYS B 61 23.383 -1.463 13.327 1.00 1.28 H new ATOM 0 HG3 LYS B 61 22.797 -1.510 14.978 1.00 1.28 H new ATOM 0 HD2 LYS B 61 24.763 -2.955 15.619 1.00 1.04 H new ATOM 0 HD3 LYS B 61 25.357 -2.859 13.973 1.00 1.04 H new ATOM 0 HE2 LYS B 61 25.121 -0.222 14.349 1.00 1.73 H new ATOM 0 HE3 LYS B 61 25.169 -0.653 16.047 1.00 1.73 H new ATOM 0 HZ1 LYS B 61 27.394 -0.235 15.185 1.00 2.19 H new ATOM 0 HZ2 LYS B 61 27.249 -1.860 15.653 1.00 2.19 H new ATOM 0 HZ3 LYS B 61 27.202 -1.443 14.008 1.00 2.19 H new ATOM 2624 N LYS B 62 21.556 -1.625 11.685 1.00 0.51 N ATOM 2625 CA LYS B 62 20.466 -0.792 11.109 1.00 0.49 C ATOM 2626 C LYS B 62 20.213 -1.193 9.653 1.00 0.45 C ATOM 2627 O LYS B 62 19.102 -1.115 9.162 1.00 0.53 O ATOM 2628 CB LYS B 62 20.877 0.680 11.171 1.00 0.54 C ATOM 2629 CG LYS B 62 20.267 1.334 12.412 1.00 0.75 C ATOM 2630 CD LYS B 62 20.755 0.604 13.667 1.00 1.16 C ATOM 2631 CE LYS B 62 20.851 1.592 14.831 1.00 1.17 C ATOM 2632 NZ LYS B 62 21.315 0.875 16.052 1.00 2.08 N ATOM 0 H LYS B 62 22.396 -1.110 11.947 1.00 0.51 H new ATOM 0 HA LYS B 62 19.551 -0.946 11.681 1.00 0.49 H new ATOM 0 HB2 LYS B 62 21.963 0.763 11.201 1.00 0.54 H new ATOM 0 HB3 LYS B 62 20.542 1.199 10.273 1.00 0.54 H new ATOM 0 HG2 LYS B 62 20.549 2.386 12.458 1.00 0.75 H new ATOM 0 HG3 LYS B 62 19.179 1.298 12.357 1.00 0.75 H new ATOM 0 HD2 LYS B 62 20.069 -0.205 13.919 1.00 1.16 H new ATOM 0 HD3 LYS B 62 21.728 0.150 13.481 1.00 1.16 H new ATOM 0 HE2 LYS B 62 21.543 2.397 14.583 1.00 1.17 H new ATOM 0 HE3 LYS B 62 19.880 2.052 15.013 1.00 1.17 H new ATOM 0 HZ1 LYS B 62 21.381 1.545 16.844 1.00 2.08 H new ATOM 0 HZ2 LYS B 62 20.638 0.122 16.291 1.00 2.08 H new ATOM 0 HZ3 LYS B 62 22.250 0.456 15.874 1.00 2.08 H new ATOM 2646 N GLY B 63 21.235 -1.601 8.950 1.00 0.41 N ATOM 2647 CA GLY B 63 21.055 -1.980 7.519 1.00 0.39 C ATOM 2648 C GLY B 63 20.282 -3.293 7.398 1.00 0.38 C ATOM 2649 O GLY B 63 19.398 -3.422 6.575 1.00 0.39 O ATOM 0 H GLY B 63 22.187 -1.688 9.305 1.00 0.41 H new ATOM 0 HA2 GLY B 63 20.521 -1.189 6.993 1.00 0.39 H new ATOM 0 HA3 GLY B 63 22.029 -2.081 7.040 1.00 0.39 H new ATOM 2653 N GLU B 64 20.583 -4.264 8.212 1.00 0.40 N ATOM 2654 CA GLU B 64 19.825 -5.548 8.122 1.00 0.43 C ATOM 2655 C GLU B 64 18.367 -5.288 8.501 1.00 0.43 C ATOM 2656 O GLU B 64 17.448 -5.818 7.904 1.00 0.42 O ATOM 2657 CB GLU B 64 20.424 -6.598 9.056 1.00 0.52 C ATOM 2658 CG GLU B 64 21.648 -6.017 9.746 1.00 0.63 C ATOM 2659 CD GLU B 64 22.278 -7.074 10.656 1.00 0.88 C ATOM 2660 OE1 GLU B 64 21.661 -8.109 10.844 1.00 1.45 O ATOM 2661 OE2 GLU B 64 23.366 -6.828 11.151 1.00 1.51 O ATOM 0 H GLU B 64 21.310 -4.230 8.927 1.00 0.40 H new ATOM 0 HA GLU B 64 19.885 -5.928 7.102 1.00 0.43 H new ATOM 0 HB2 GLU B 64 19.686 -6.905 9.797 1.00 0.52 H new ATOM 0 HB3 GLU B 64 20.699 -7.489 8.492 1.00 0.52 H new ATOM 0 HG2 GLU B 64 22.373 -5.685 9.003 1.00 0.63 H new ATOM 0 HG3 GLU B 64 21.366 -5.141 10.331 1.00 0.63 H new ATOM 2668 N GLU B 65 18.151 -4.466 9.493 1.00 0.46 N ATOM 2669 CA GLU B 65 16.760 -4.158 9.924 1.00 0.49 C ATOM 2670 C GLU B 65 15.992 -3.550 8.749 1.00 0.45 C ATOM 2671 O GLU B 65 14.935 -4.021 8.378 1.00 0.48 O ATOM 2672 CB GLU B 65 16.794 -3.160 11.084 1.00 0.54 C ATOM 2673 CG GLU B 65 17.284 -3.867 12.350 1.00 0.62 C ATOM 2674 CD GLU B 65 17.345 -2.864 13.504 1.00 1.07 C ATOM 2675 OE1 GLU B 65 16.750 -1.807 13.377 1.00 1.68 O ATOM 2676 OE2 GLU B 65 17.987 -3.171 14.496 1.00 1.66 O ATOM 0 H GLU B 65 18.882 -3.994 10.024 1.00 0.46 H new ATOM 0 HA GLU B 65 16.266 -5.073 10.250 1.00 0.49 H new ATOM 0 HB2 GLU B 65 17.453 -2.326 10.842 1.00 0.54 H new ATOM 0 HB3 GLU B 65 15.800 -2.743 11.249 1.00 0.54 H new ATOM 0 HG2 GLU B 65 16.614 -4.688 12.603 1.00 0.62 H new ATOM 0 HG3 GLU B 65 18.269 -4.301 12.179 1.00 0.62 H new ATOM 2683 N LEU B 66 16.516 -2.513 8.155 1.00 0.44 N ATOM 2684 CA LEU B 66 15.813 -1.890 6.999 1.00 0.45 C ATOM 2685 C LEU B 66 15.595 -2.954 5.922 1.00 0.43 C ATOM 2686 O LEU B 66 14.560 -3.001 5.290 1.00 0.45 O ATOM 2687 CB LEU B 66 16.659 -0.737 6.442 1.00 0.46 C ATOM 2688 CG LEU B 66 15.880 0.012 5.353 1.00 0.64 C ATOM 2689 CD1 LEU B 66 15.174 1.218 5.968 1.00 0.72 C ATOM 2690 CD2 LEU B 66 16.855 0.492 4.274 1.00 1.57 C ATOM 0 H LEU B 66 17.397 -2.072 8.419 1.00 0.44 H new ATOM 0 HA LEU B 66 14.849 -1.493 7.317 1.00 0.45 H new ATOM 0 HB2 LEU B 66 16.926 -0.051 7.246 1.00 0.46 H new ATOM 0 HB3 LEU B 66 17.591 -1.125 6.031 1.00 0.46 H new ATOM 0 HG LEU B 66 15.140 -0.655 4.910 1.00 0.64 H new ATOM 0 HD11 LEU B 66 14.621 1.750 5.194 1.00 0.72 H new ATOM 0 HD12 LEU B 66 14.483 0.880 6.741 1.00 0.72 H new ATOM 0 HD13 LEU B 66 15.913 1.886 6.409 1.00 0.72 H new ATOM 0 HD21 LEU B 66 16.305 1.025 3.498 1.00 1.57 H new ATOM 0 HD22 LEU B 66 17.592 1.160 4.720 1.00 1.57 H new ATOM 0 HD23 LEU B 66 17.363 -0.367 3.834 1.00 1.57 H new ATOM 2702 N LEU B 67 16.550 -3.822 5.718 1.00 0.42 N ATOM 2703 CA LEU B 67 16.381 -4.890 4.694 1.00 0.43 C ATOM 2704 C LEU B 67 15.070 -5.627 4.958 1.00 0.45 C ATOM 2705 O LEU B 67 14.298 -5.894 4.060 1.00 0.48 O ATOM 2706 CB LEU B 67 17.548 -5.876 4.784 1.00 0.45 C ATOM 2707 CG LEU B 67 17.892 -6.394 3.386 1.00 0.51 C ATOM 2708 CD1 LEU B 67 18.796 -5.384 2.676 1.00 0.90 C ATOM 2709 CD2 LEU B 67 18.622 -7.734 3.504 1.00 1.26 C ATOM 0 H LEU B 67 17.439 -3.836 6.217 1.00 0.42 H new ATOM 0 HA LEU B 67 16.362 -4.446 3.699 1.00 0.43 H new ATOM 0 HB2 LEU B 67 18.417 -5.388 5.226 1.00 0.45 H new ATOM 0 HB3 LEU B 67 17.284 -6.708 5.436 1.00 0.45 H new ATOM 0 HG LEU B 67 16.975 -6.528 2.813 1.00 0.51 H new ATOM 0 HD11 LEU B 67 19.041 -5.753 1.680 1.00 0.90 H new ATOM 0 HD12 LEU B 67 18.278 -4.428 2.592 1.00 0.90 H new ATOM 0 HD13 LEU B 67 19.713 -5.250 3.250 1.00 0.90 H new ATOM 0 HD21 LEU B 67 18.867 -8.104 2.508 1.00 1.26 H new ATOM 0 HD22 LEU B 67 19.539 -7.599 4.077 1.00 1.26 H new ATOM 0 HD23 LEU B 67 17.980 -8.455 4.011 1.00 1.26 H new ATOM 2721 N GLU B 68 14.810 -5.956 6.192 1.00 0.44 N ATOM 2722 CA GLU B 68 13.546 -6.668 6.518 1.00 0.48 C ATOM 2723 C GLU B 68 12.380 -5.685 6.395 1.00 0.46 C ATOM 2724 O GLU B 68 11.364 -5.979 5.798 1.00 0.47 O ATOM 2725 CB GLU B 68 13.613 -7.208 7.948 1.00 0.52 C ATOM 2726 CG GLU B 68 14.699 -8.282 8.038 1.00 1.26 C ATOM 2727 CD GLU B 68 15.321 -8.263 9.436 1.00 1.77 C ATOM 2728 OE1 GLU B 68 14.666 -8.719 10.359 1.00 2.23 O ATOM 2729 OE2 GLU B 68 16.440 -7.795 9.558 1.00 2.25 O ATOM 0 H GLU B 68 15.418 -5.762 6.988 1.00 0.44 H new ATOM 0 HA GLU B 68 13.403 -7.501 5.830 1.00 0.48 H new ATOM 0 HB2 GLU B 68 13.829 -6.398 8.644 1.00 0.52 H new ATOM 0 HB3 GLU B 68 12.648 -7.626 8.236 1.00 0.52 H new ATOM 0 HG2 GLU B 68 14.273 -9.264 7.831 1.00 1.26 H new ATOM 0 HG3 GLU B 68 15.466 -8.103 7.285 1.00 1.26 H new ATOM 2736 N ASP B 69 12.520 -4.517 6.962 1.00 0.44 N ATOM 2737 CA ASP B 69 11.426 -3.510 6.886 1.00 0.45 C ATOM 2738 C ASP B 69 11.060 -3.240 5.423 1.00 0.45 C ATOM 2739 O ASP B 69 9.927 -3.412 5.020 1.00 0.46 O ATOM 2740 CB ASP B 69 11.886 -2.204 7.540 1.00 0.46 C ATOM 2741 CG ASP B 69 12.759 -2.521 8.757 1.00 0.51 C ATOM 2742 OD1 ASP B 69 12.716 -3.651 9.214 1.00 1.25 O ATOM 2743 OD2 ASP B 69 13.453 -1.626 9.212 1.00 1.12 O ATOM 0 H ASP B 69 13.348 -4.217 7.476 1.00 0.44 H new ATOM 0 HA ASP B 69 10.552 -3.897 7.409 1.00 0.45 H new ATOM 0 HB2 ASP B 69 12.447 -1.604 6.823 1.00 0.46 H new ATOM 0 HB3 ASP B 69 11.022 -1.613 7.843 1.00 0.46 H new ATOM 2748 N ILE B 70 12.000 -2.806 4.624 1.00 0.45 N ATOM 2749 CA ILE B 70 11.676 -2.519 3.196 1.00 0.49 C ATOM 2750 C ILE B 70 11.099 -3.772 2.533 1.00 0.48 C ATOM 2751 O ILE B 70 10.204 -3.693 1.716 1.00 0.50 O ATOM 2752 CB ILE B 70 12.937 -2.063 2.450 1.00 0.56 C ATOM 2753 CG1 ILE B 70 12.540 -1.489 1.088 1.00 0.90 C ATOM 2754 CG2 ILE B 70 13.877 -3.251 2.244 1.00 0.85 C ATOM 2755 CD1 ILE B 70 13.799 -1.184 0.273 1.00 1.29 C ATOM 0 H ILE B 70 12.969 -2.639 4.895 1.00 0.45 H new ATOM 0 HA ILE B 70 10.935 -1.720 3.154 1.00 0.49 H new ATOM 0 HB ILE B 70 13.446 -1.300 3.038 1.00 0.56 H new ATOM 0 HG12 ILE B 70 11.911 -2.200 0.552 1.00 0.90 H new ATOM 0 HG13 ILE B 70 11.952 -0.581 1.222 1.00 0.90 H new ATOM 0 HG21 ILE B 70 14.770 -2.921 1.714 1.00 0.85 H new ATOM 0 HG22 ILE B 70 14.161 -3.662 3.213 1.00 0.85 H new ATOM 0 HG23 ILE B 70 13.371 -4.018 1.658 1.00 0.85 H new ATOM 0 HD11 ILE B 70 13.515 -0.775 -0.697 1.00 1.29 H new ATOM 0 HD12 ILE B 70 14.411 -0.458 0.807 1.00 1.29 H new ATOM 0 HD13 ILE B 70 14.369 -2.102 0.127 1.00 1.29 H new ATOM 2767 N ARG B 71 11.593 -4.928 2.881 1.00 0.47 N ATOM 2768 CA ARG B 71 11.058 -6.174 2.272 1.00 0.50 C ATOM 2769 C ARG B 71 9.544 -6.237 2.492 1.00 0.50 C ATOM 2770 O ARG B 71 8.780 -6.488 1.578 1.00 0.54 O ATOM 2771 CB ARG B 71 11.720 -7.379 2.938 1.00 0.52 C ATOM 2772 CG ARG B 71 12.662 -8.063 1.945 1.00 0.82 C ATOM 2773 CD ARG B 71 11.844 -8.757 0.854 1.00 1.02 C ATOM 2774 NE ARG B 71 11.958 -10.233 1.009 1.00 1.57 N ATOM 2775 CZ ARG B 71 11.213 -11.026 0.287 1.00 2.17 C ATOM 2776 NH1 ARG B 71 10.369 -10.523 -0.571 1.00 2.58 N ATOM 2777 NH2 ARG B 71 11.312 -12.319 0.426 1.00 2.98 N ATOM 0 H ARG B 71 12.343 -5.062 3.560 1.00 0.47 H new ATOM 0 HA ARG B 71 11.269 -6.183 1.203 1.00 0.50 H new ATOM 0 HB2 ARG B 71 12.275 -7.060 3.820 1.00 0.52 H new ATOM 0 HB3 ARG B 71 10.960 -8.083 3.277 1.00 0.52 H new ATOM 0 HG2 ARG B 71 13.332 -7.328 1.499 1.00 0.82 H new ATOM 0 HG3 ARG B 71 13.287 -8.791 2.463 1.00 0.82 H new ATOM 0 HD2 ARG B 71 10.799 -8.454 0.920 1.00 1.02 H new ATOM 0 HD3 ARG B 71 12.202 -8.456 -0.130 1.00 1.02 H new ATOM 0 HE ARG B 71 12.619 -10.625 1.680 1.00 1.57 H new ATOM 0 HH11 ARG B 71 10.292 -9.512 -0.677 1.00 2.58 H new ATOM 0 HH12 ARG B 71 9.786 -11.141 -1.136 1.00 2.58 H new ATOM 0 HH21 ARG B 71 11.971 -12.711 1.099 1.00 2.98 H new ATOM 0 HH22 ARG B 71 10.730 -12.939 -0.138 1.00 2.98 H new ATOM 2791 N LYS B 72 9.108 -6.020 3.702 1.00 0.48 N ATOM 2792 CA LYS B 72 7.648 -6.075 3.996 1.00 0.49 C ATOM 2793 C LYS B 72 6.903 -5.016 3.176 1.00 0.48 C ATOM 2794 O LYS B 72 5.924 -5.306 2.517 1.00 0.51 O ATOM 2795 CB LYS B 72 7.421 -5.815 5.487 1.00 0.49 C ATOM 2796 CG LYS B 72 8.103 -6.914 6.305 1.00 0.65 C ATOM 2797 CD LYS B 72 7.594 -6.868 7.747 1.00 0.91 C ATOM 2798 CE LYS B 72 6.446 -7.866 7.915 1.00 1.46 C ATOM 2799 NZ LYS B 72 6.990 -9.252 7.930 1.00 1.81 N ATOM 0 H LYS B 72 9.702 -5.806 4.503 1.00 0.48 H new ATOM 0 HA LYS B 72 7.269 -7.062 3.730 1.00 0.49 H new ATOM 0 HB2 LYS B 72 7.822 -4.840 5.762 1.00 0.49 H new ATOM 0 HB3 LYS B 72 6.353 -5.794 5.705 1.00 0.49 H new ATOM 0 HG2 LYS B 72 7.896 -7.890 5.866 1.00 0.65 H new ATOM 0 HG3 LYS B 72 9.184 -6.779 6.285 1.00 0.65 H new ATOM 0 HD2 LYS B 72 8.403 -7.108 8.437 1.00 0.91 H new ATOM 0 HD3 LYS B 72 7.254 -5.862 7.992 1.00 0.91 H new ATOM 0 HE2 LYS B 72 5.908 -7.665 8.842 1.00 1.46 H new ATOM 0 HE3 LYS B 72 5.730 -7.754 7.100 1.00 1.46 H new ATOM 0 HZ1 LYS B 72 6.337 -9.876 8.445 1.00 1.81 H new ATOM 0 HZ2 LYS B 72 7.097 -9.594 6.954 1.00 1.81 H new ATOM 0 HZ3 LYS B 72 7.917 -9.256 8.402 1.00 1.81 H new ATOM 2813 N PHE B 73 7.349 -3.790 3.222 1.00 0.47 N ATOM 2814 CA PHE B 73 6.657 -2.712 2.457 1.00 0.48 C ATOM 2815 C PHE B 73 6.416 -3.175 1.017 1.00 0.51 C ATOM 2816 O PHE B 73 5.311 -3.124 0.517 1.00 0.52 O ATOM 2817 CB PHE B 73 7.528 -1.455 2.458 1.00 0.48 C ATOM 2818 CG PHE B 73 7.459 -0.784 1.107 1.00 0.52 C ATOM 2819 CD1 PHE B 73 6.478 0.182 0.859 1.00 1.37 C ATOM 2820 CD2 PHE B 73 8.375 -1.127 0.105 1.00 1.25 C ATOM 2821 CE1 PHE B 73 6.411 0.807 -0.393 1.00 1.40 C ATOM 2822 CE2 PHE B 73 8.309 -0.501 -1.146 1.00 1.29 C ATOM 2823 CZ PHE B 73 7.327 0.466 -1.395 1.00 0.67 C ATOM 0 H PHE B 73 8.163 -3.488 3.757 1.00 0.47 H new ATOM 0 HA PHE B 73 5.698 -2.490 2.924 1.00 0.48 H new ATOM 0 HB2 PHE B 73 7.190 -0.768 3.233 1.00 0.48 H new ATOM 0 HB3 PHE B 73 8.560 -1.717 2.692 1.00 0.48 H new ATOM 0 HD1 PHE B 73 5.772 0.446 1.633 1.00 1.37 H new ATOM 0 HD2 PHE B 73 9.132 -1.873 0.297 1.00 1.25 H new ATOM 0 HE1 PHE B 73 5.653 1.552 -0.585 1.00 1.40 H new ATOM 0 HE2 PHE B 73 9.016 -0.764 -1.919 1.00 1.29 H new ATOM 0 HZ PHE B 73 7.276 0.948 -2.360 1.00 0.67 H new ATOM 2833 N ASN B 74 7.440 -3.620 0.349 1.00 0.52 N ATOM 2834 CA ASN B 74 7.262 -4.078 -1.058 1.00 0.55 C ATOM 2835 C ASN B 74 6.223 -5.195 -1.088 1.00 0.57 C ATOM 2836 O ASN B 74 5.439 -5.299 -2.011 1.00 0.60 O ATOM 2837 CB ASN B 74 8.593 -4.591 -1.612 1.00 0.57 C ATOM 2838 CG ASN B 74 8.465 -4.812 -3.120 1.00 0.79 C ATOM 2839 OD1 ASN B 74 7.978 -5.836 -3.556 1.00 1.73 O ATOM 2840 ND2 ASN B 74 8.883 -3.888 -3.941 1.00 0.99 N ATOM 0 H ASN B 74 8.391 -3.687 0.713 1.00 0.52 H new ATOM 0 HA ASN B 74 6.924 -3.245 -1.674 1.00 0.55 H new ATOM 0 HB2 ASN B 74 9.387 -3.873 -1.405 1.00 0.57 H new ATOM 0 HB3 ASN B 74 8.870 -5.523 -1.119 1.00 0.57 H new ATOM 0 HD21 ASN B 74 8.801 -4.026 -4.948 1.00 0.99 H new ATOM 0 HD22 ASN B 74 9.292 -3.028 -3.575 1.00 0.99 H new ATOM 2847 N GLU B 75 6.197 -6.025 -0.084 1.00 0.55 N ATOM 2848 CA GLU B 75 5.192 -7.117 -0.061 1.00 0.59 C ATOM 2849 C GLU B 75 3.815 -6.508 0.183 1.00 0.57 C ATOM 2850 O GLU B 75 2.900 -6.691 -0.593 1.00 0.68 O ATOM 2851 CB GLU B 75 5.524 -8.090 1.069 1.00 0.62 C ATOM 2852 CG GLU B 75 6.404 -9.214 0.530 1.00 1.10 C ATOM 2853 CD GLU B 75 6.759 -10.176 1.665 1.00 1.46 C ATOM 2854 OE1 GLU B 75 6.444 -9.862 2.802 1.00 1.88 O ATOM 2855 OE2 GLU B 75 7.339 -11.210 1.380 1.00 2.12 O ATOM 0 H GLU B 75 6.827 -5.993 0.718 1.00 0.55 H new ATOM 0 HA GLU B 75 5.201 -7.652 -1.011 1.00 0.59 H new ATOM 0 HB2 GLU B 75 6.038 -7.566 1.875 1.00 0.62 H new ATOM 0 HB3 GLU B 75 4.607 -8.502 1.490 1.00 0.62 H new ATOM 0 HG2 GLU B 75 5.883 -9.749 -0.264 1.00 1.10 H new ATOM 0 HG3 GLU B 75 7.313 -8.800 0.093 1.00 1.10 H new ATOM 2862 N MET B 76 3.657 -5.785 1.260 1.00 0.53 N ATOM 2863 CA MET B 76 2.340 -5.168 1.558 1.00 0.51 C ATOM 2864 C MET B 76 2.001 -4.140 0.482 1.00 0.52 C ATOM 2865 O MET B 76 0.872 -4.043 0.044 1.00 0.53 O ATOM 2866 CB MET B 76 2.400 -4.488 2.925 1.00 0.48 C ATOM 2867 CG MET B 76 2.569 -5.557 4.007 1.00 0.48 C ATOM 2868 SD MET B 76 0.989 -5.826 4.847 1.00 0.51 S ATOM 2869 CE MET B 76 1.417 -7.399 5.632 1.00 0.60 C ATOM 0 H MET B 76 4.388 -5.597 1.946 1.00 0.53 H new ATOM 0 HA MET B 76 1.569 -5.938 1.570 1.00 0.51 H new ATOM 0 HB2 MET B 76 3.231 -3.784 2.959 1.00 0.48 H new ATOM 0 HB3 MET B 76 1.489 -3.915 3.101 1.00 0.48 H new ATOM 0 HG2 MET B 76 2.918 -6.488 3.561 1.00 0.48 H new ATOM 0 HG3 MET B 76 3.326 -5.244 4.726 1.00 0.48 H new ATOM 0 HE1 MET B 76 0.569 -7.758 6.215 1.00 0.60 H new ATOM 0 HE2 MET B 76 1.666 -8.132 4.865 1.00 0.60 H new ATOM 0 HE3 MET B 76 2.274 -7.256 6.290 1.00 0.60 H new ATOM 2879 N ARG B 77 2.964 -3.377 0.036 1.00 0.52 N ATOM 2880 CA ARG B 77 2.676 -2.375 -1.024 1.00 0.54 C ATOM 2881 C ARG B 77 2.117 -3.091 -2.253 1.00 0.57 C ATOM 2882 O ARG B 77 1.096 -2.718 -2.796 1.00 0.57 O ATOM 2883 CB ARG B 77 3.963 -1.638 -1.404 1.00 0.54 C ATOM 2884 CG ARG B 77 3.643 -0.524 -2.406 1.00 0.57 C ATOM 2885 CD ARG B 77 4.299 -0.840 -3.752 1.00 0.62 C ATOM 2886 NE ARG B 77 3.911 0.198 -4.748 1.00 0.86 N ATOM 2887 CZ ARG B 77 4.109 -0.010 -6.021 1.00 1.32 C ATOM 2888 NH1 ARG B 77 4.651 -1.127 -6.423 1.00 1.81 N ATOM 2889 NH2 ARG B 77 3.764 0.898 -6.892 1.00 1.80 N ATOM 0 H ARG B 77 3.931 -3.406 0.359 1.00 0.52 H new ATOM 0 HA ARG B 77 1.947 -1.654 -0.654 1.00 0.54 H new ATOM 0 HB2 ARG B 77 4.429 -1.216 -0.513 1.00 0.54 H new ATOM 0 HB3 ARG B 77 4.679 -2.336 -1.838 1.00 0.54 H new ATOM 0 HG2 ARG B 77 2.564 -0.431 -2.529 1.00 0.57 H new ATOM 0 HG3 ARG B 77 4.005 0.433 -2.029 1.00 0.57 H new ATOM 0 HD2 ARG B 77 5.383 -0.868 -3.643 1.00 0.62 H new ATOM 0 HD3 ARG B 77 3.988 -1.826 -4.098 1.00 0.62 H new ATOM 0 HE ARG B 77 3.490 1.073 -4.434 1.00 0.86 H new ATOM 0 HH11 ARG B 77 4.920 -1.837 -5.742 1.00 1.81 H new ATOM 0 HH12 ARG B 77 4.806 -1.290 -7.418 1.00 1.81 H new ATOM 0 HH21 ARG B 77 3.339 1.771 -6.578 1.00 1.80 H new ATOM 0 HH22 ARG B 77 3.919 0.735 -7.887 1.00 1.80 H new ATOM 2903 N LYS B 78 2.776 -4.134 -2.681 1.00 0.58 N ATOM 2904 CA LYS B 78 2.280 -4.897 -3.859 1.00 0.61 C ATOM 2905 C LYS B 78 0.953 -5.555 -3.485 1.00 0.60 C ATOM 2906 O LYS B 78 0.055 -5.674 -4.296 1.00 0.62 O ATOM 2907 CB LYS B 78 3.302 -5.968 -4.247 1.00 0.63 C ATOM 2908 CG LYS B 78 2.614 -7.065 -5.064 1.00 1.17 C ATOM 2909 CD LYS B 78 3.638 -7.747 -5.975 1.00 1.22 C ATOM 2910 CE LYS B 78 3.759 -6.963 -7.284 1.00 1.57 C ATOM 2911 NZ LYS B 78 2.787 -7.500 -8.278 1.00 2.26 N ATOM 0 H LYS B 78 3.637 -4.490 -2.265 1.00 0.58 H new ATOM 0 HA LYS B 78 2.137 -4.227 -4.707 1.00 0.61 H new ATOM 0 HB2 LYS B 78 4.109 -5.521 -4.827 1.00 0.63 H new ATOM 0 HB3 LYS B 78 3.752 -6.396 -3.352 1.00 0.63 H new ATOM 0 HG2 LYS B 78 2.160 -7.798 -4.397 1.00 1.17 H new ATOM 0 HG3 LYS B 78 1.809 -6.637 -5.662 1.00 1.17 H new ATOM 0 HD2 LYS B 78 4.607 -7.797 -5.478 1.00 1.22 H new ATOM 0 HD3 LYS B 78 3.332 -8.773 -6.180 1.00 1.22 H new ATOM 0 HE2 LYS B 78 3.566 -5.905 -7.106 1.00 1.57 H new ATOM 0 HE3 LYS B 78 4.774 -7.040 -7.674 1.00 1.57 H new ATOM 0 HZ1 LYS B 78 2.870 -6.967 -9.167 1.00 2.26 H new ATOM 0 HZ2 LYS B 78 2.991 -8.504 -8.456 1.00 2.26 H new ATOM 0 HZ3 LYS B 78 1.821 -7.404 -7.905 1.00 2.26 H new ATOM 2925 N ASN B 79 0.816 -5.960 -2.252 1.00 0.58 N ATOM 2926 CA ASN B 79 -0.466 -6.584 -1.818 1.00 0.58 C ATOM 2927 C ASN B 79 -1.568 -5.537 -1.938 1.00 0.57 C ATOM 2928 O ASN B 79 -2.622 -5.778 -2.492 1.00 0.57 O ATOM 2929 CB ASN B 79 -0.367 -7.046 -0.365 1.00 0.57 C ATOM 2930 CG ASN B 79 -1.155 -8.344 -0.187 1.00 0.62 C ATOM 2931 OD1 ASN B 79 -2.369 -8.340 -0.214 1.00 1.18 O ATOM 2932 ND2 ASN B 79 -0.510 -9.464 -0.004 1.00 1.16 N ATOM 0 H ASN B 79 1.532 -5.886 -1.530 1.00 0.58 H new ATOM 0 HA ASN B 79 -0.684 -7.449 -2.444 1.00 0.58 H new ATOM 0 HB2 ASN B 79 0.677 -7.202 -0.092 1.00 0.57 H new ATOM 0 HB3 ASN B 79 -0.759 -6.276 0.300 1.00 0.57 H new ATOM 0 HD21 ASN B 79 -1.026 -10.336 0.116 1.00 1.16 H new ATOM 0 HD22 ASN B 79 0.510 -9.467 0.019 1.00 1.16 H new ATOM 2939 N MET B 80 -1.317 -4.367 -1.420 1.00 0.57 N ATOM 2940 CA MET B 80 -2.327 -3.280 -1.490 1.00 0.57 C ATOM 2941 C MET B 80 -2.781 -3.103 -2.942 1.00 0.58 C ATOM 2942 O MET B 80 -3.948 -3.235 -3.253 1.00 0.57 O ATOM 2943 CB MET B 80 -1.690 -1.986 -0.958 1.00 0.60 C ATOM 2944 CG MET B 80 -2.341 -0.754 -1.595 1.00 0.69 C ATOM 2945 SD MET B 80 -1.807 0.733 -0.714 1.00 1.27 S ATOM 2946 CE MET B 80 -2.062 1.906 -2.067 1.00 1.05 C ATOM 0 H MET B 80 -0.448 -4.118 -0.948 1.00 0.57 H new ATOM 0 HA MET B 80 -3.199 -3.526 -0.884 1.00 0.57 H new ATOM 0 HB2 MET B 80 -1.800 -1.941 0.126 1.00 0.60 H new ATOM 0 HB3 MET B 80 -0.621 -1.988 -1.170 1.00 0.60 H new ATOM 0 HG2 MET B 80 -2.064 -0.686 -2.647 1.00 0.69 H new ATOM 0 HG3 MET B 80 -3.427 -0.842 -1.557 1.00 0.69 H new ATOM 0 HE1 MET B 80 -1.789 2.908 -1.736 1.00 1.05 H new ATOM 0 HE2 MET B 80 -1.441 1.622 -2.916 1.00 1.05 H new ATOM 0 HE3 MET B 80 -3.110 1.895 -2.365 1.00 1.05 H new ATOM 2956 N ASP B 81 -1.873 -2.819 -3.839 1.00 0.60 N ATOM 2957 CA ASP B 81 -2.256 -2.650 -5.271 1.00 0.62 C ATOM 2958 C ASP B 81 -2.920 -3.924 -5.787 1.00 0.63 C ATOM 2959 O ASP B 81 -3.896 -3.881 -6.509 1.00 0.64 O ATOM 2960 CB ASP B 81 -1.001 -2.372 -6.095 1.00 0.65 C ATOM 2961 CG ASP B 81 -1.232 -1.156 -6.994 1.00 0.67 C ATOM 2962 OD1 ASP B 81 -1.709 -0.153 -6.489 1.00 1.19 O ATOM 2963 OD2 ASP B 81 -0.930 -1.250 -8.172 1.00 1.23 O ATOM 0 H ASP B 81 -0.880 -2.697 -3.640 1.00 0.60 H new ATOM 0 HA ASP B 81 -2.955 -1.818 -5.360 1.00 0.62 H new ATOM 0 HB2 ASP B 81 -0.153 -2.192 -5.434 1.00 0.65 H new ATOM 0 HB3 ASP B 81 -0.753 -3.243 -6.702 1.00 0.65 H new ATOM 2968 N GLN B 82 -2.414 -5.060 -5.402 1.00 0.64 N ATOM 2969 CA GLN B 82 -3.022 -6.337 -5.839 1.00 0.66 C ATOM 2970 C GLN B 82 -4.440 -6.381 -5.273 1.00 0.63 C ATOM 2971 O GLN B 82 -5.408 -6.622 -5.968 1.00 0.65 O ATOM 2972 CB GLN B 82 -2.172 -7.460 -5.260 1.00 0.68 C ATOM 2973 CG GLN B 82 -2.669 -8.817 -5.735 1.00 1.09 C ATOM 2974 CD GLN B 82 -1.787 -9.312 -6.882 1.00 0.83 C ATOM 2975 OE1 GLN B 82 -2.014 -8.978 -8.028 1.00 1.28 O ATOM 2976 NE2 GLN B 82 -0.781 -10.102 -6.619 1.00 1.41 N ATOM 0 H GLN B 82 -1.598 -5.155 -4.798 1.00 0.64 H new ATOM 0 HA GLN B 82 -3.064 -6.437 -6.924 1.00 0.66 H new ATOM 0 HB2 GLN B 82 -1.132 -7.325 -5.557 1.00 0.68 H new ATOM 0 HB3 GLN B 82 -2.200 -7.419 -4.171 1.00 0.68 H new ATOM 0 HG2 GLN B 82 -2.649 -9.532 -4.912 1.00 1.09 H new ATOM 0 HG3 GLN B 82 -3.705 -8.741 -6.066 1.00 1.09 H new ATOM 0 HE21 GLN B 82 -0.591 -10.382 -5.657 1.00 1.41 H new ATOM 0 HE22 GLN B 82 -0.186 -10.439 -7.376 1.00 1.41 H new ATOM 2985 N LEU B 83 -4.548 -6.120 -4.004 1.00 0.59 N ATOM 2986 CA LEU B 83 -5.885 -6.107 -3.360 1.00 0.56 C ATOM 2987 C LEU B 83 -6.704 -5.002 -4.026 1.00 0.55 C ATOM 2988 O LEU B 83 -7.851 -5.188 -4.378 1.00 0.56 O ATOM 2989 CB LEU B 83 -5.738 -5.835 -1.862 1.00 0.53 C ATOM 2990 CG LEU B 83 -5.110 -7.060 -1.187 1.00 0.53 C ATOM 2991 CD1 LEU B 83 -4.771 -6.731 0.264 1.00 0.55 C ATOM 2992 CD2 LEU B 83 -6.083 -8.248 -1.224 1.00 0.56 C ATOM 0 H LEU B 83 -3.765 -5.914 -3.383 1.00 0.59 H new ATOM 0 HA LEU B 83 -6.382 -7.070 -3.478 1.00 0.56 H new ATOM 0 HB2 LEU B 83 -5.115 -4.956 -1.699 1.00 0.53 H new ATOM 0 HB3 LEU B 83 -6.712 -5.621 -1.422 1.00 0.53 H new ATOM 0 HG LEU B 83 -4.201 -7.327 -1.726 1.00 0.53 H new ATOM 0 HD11 LEU B 83 -4.325 -7.604 0.740 1.00 0.55 H new ATOM 0 HD12 LEU B 83 -4.065 -5.901 0.294 1.00 0.55 H new ATOM 0 HD13 LEU B 83 -5.681 -6.453 0.796 1.00 0.55 H new ATOM 0 HD21 LEU B 83 -5.623 -9.110 -0.741 1.00 0.56 H new ATOM 0 HD22 LEU B 83 -7.000 -7.984 -0.698 1.00 0.56 H new ATOM 0 HD23 LEU B 83 -6.317 -8.494 -2.260 1.00 0.56 H new ATOM 3004 N LYS B 84 -6.104 -3.859 -4.231 1.00 0.55 N ATOM 3005 CA LYS B 84 -6.825 -2.746 -4.908 1.00 0.55 C ATOM 3006 C LYS B 84 -7.450 -3.280 -6.201 1.00 0.58 C ATOM 3007 O LYS B 84 -8.583 -2.985 -6.536 1.00 0.58 O ATOM 3008 CB LYS B 84 -5.834 -1.632 -5.251 1.00 0.56 C ATOM 3009 CG LYS B 84 -6.598 -0.393 -5.726 1.00 0.57 C ATOM 3010 CD LYS B 84 -5.606 0.712 -6.101 1.00 0.80 C ATOM 3011 CE LYS B 84 -6.171 1.532 -7.263 1.00 0.80 C ATOM 3012 NZ LYS B 84 -6.335 0.655 -8.457 1.00 1.40 N ATOM 0 H LYS B 84 -5.144 -3.650 -3.958 1.00 0.55 H new ATOM 0 HA LYS B 84 -7.600 -2.352 -4.251 1.00 0.55 H new ATOM 0 HB2 LYS B 84 -5.230 -1.387 -4.377 1.00 0.56 H new ATOM 0 HB3 LYS B 84 -5.148 -1.969 -6.028 1.00 0.56 H new ATOM 0 HG2 LYS B 84 -7.219 -0.644 -6.585 1.00 0.57 H new ATOM 0 HG3 LYS B 84 -7.267 -0.043 -4.940 1.00 0.57 H new ATOM 0 HD2 LYS B 84 -5.422 1.357 -5.242 1.00 0.80 H new ATOM 0 HD3 LYS B 84 -4.648 0.275 -6.382 1.00 0.80 H new ATOM 0 HE2 LYS B 84 -7.131 1.966 -6.983 1.00 0.80 H new ATOM 0 HE3 LYS B 84 -5.502 2.361 -7.496 1.00 0.80 H new ATOM 0 HZ1 LYS B 84 -6.134 1.201 -9.319 1.00 1.40 H new ATOM 0 HZ2 LYS B 84 -5.675 -0.146 -8.393 1.00 1.40 H new ATOM 0 HZ3 LYS B 84 -7.311 0.297 -8.494 1.00 1.40 H new ATOM 3026 N GLU B 85 -6.709 -4.068 -6.931 1.00 0.60 N ATOM 3027 CA GLU B 85 -7.244 -4.627 -8.200 1.00 0.63 C ATOM 3028 C GLU B 85 -8.411 -5.565 -7.892 1.00 0.63 C ATOM 3029 O GLU B 85 -9.369 -5.644 -8.633 1.00 0.64 O ATOM 3030 CB GLU B 85 -6.143 -5.411 -8.922 1.00 0.66 C ATOM 3031 CG GLU B 85 -6.777 -6.491 -9.803 1.00 0.69 C ATOM 3032 CD GLU B 85 -5.769 -6.943 -10.861 1.00 0.73 C ATOM 3033 OE1 GLU B 85 -4.827 -7.630 -10.498 1.00 1.21 O ATOM 3034 OE2 GLU B 85 -5.955 -6.597 -12.015 1.00 1.28 O ATOM 0 H GLU B 85 -5.755 -4.348 -6.701 1.00 0.60 H new ATOM 0 HA GLU B 85 -7.587 -3.811 -8.836 1.00 0.63 H new ATOM 0 HB2 GLU B 85 -5.542 -4.736 -9.532 1.00 0.66 H new ATOM 0 HB3 GLU B 85 -5.471 -5.868 -8.195 1.00 0.66 H new ATOM 0 HG2 GLU B 85 -7.084 -7.340 -9.192 1.00 0.69 H new ATOM 0 HG3 GLU B 85 -7.675 -6.103 -10.283 1.00 0.69 H new ATOM 3041 N LYS B 86 -8.345 -6.268 -6.798 1.00 0.63 N ATOM 3042 CA LYS B 86 -9.460 -7.186 -6.443 1.00 0.63 C ATOM 3043 C LYS B 86 -10.717 -6.355 -6.197 1.00 0.61 C ATOM 3044 O LYS B 86 -11.818 -6.758 -6.516 1.00 0.62 O ATOM 3045 CB LYS B 86 -9.104 -7.971 -5.179 1.00 0.64 C ATOM 3046 CG LYS B 86 -9.341 -9.463 -5.422 1.00 0.70 C ATOM 3047 CD LYS B 86 -8.954 -10.251 -4.170 1.00 0.89 C ATOM 3048 CE LYS B 86 -8.726 -11.718 -4.540 1.00 1.09 C ATOM 3049 NZ LYS B 86 -7.334 -11.894 -5.044 1.00 0.99 N ATOM 0 H LYS B 86 -7.569 -6.247 -6.136 1.00 0.63 H new ATOM 0 HA LYS B 86 -9.633 -7.891 -7.256 1.00 0.63 H new ATOM 0 HB2 LYS B 86 -8.062 -7.796 -4.911 1.00 0.64 H new ATOM 0 HB3 LYS B 86 -9.711 -7.627 -4.341 1.00 0.64 H new ATOM 0 HG2 LYS B 86 -10.388 -9.641 -5.667 1.00 0.70 H new ATOM 0 HG3 LYS B 86 -8.752 -9.802 -6.274 1.00 0.70 H new ATOM 0 HD2 LYS B 86 -8.050 -9.832 -3.729 1.00 0.89 H new ATOM 0 HD3 LYS B 86 -9.741 -10.172 -3.420 1.00 0.89 H new ATOM 0 HE2 LYS B 86 -8.892 -12.353 -3.670 1.00 1.09 H new ATOM 0 HE3 LYS B 86 -9.442 -12.027 -5.302 1.00 1.09 H new ATOM 0 HZ1 LYS B 86 -7.179 -12.891 -5.295 1.00 0.99 H new ATOM 0 HZ2 LYS B 86 -7.191 -11.299 -5.885 1.00 0.99 H new ATOM 0 HZ3 LYS B 86 -6.659 -11.615 -4.304 1.00 0.99 H new ATOM 3063 N ILE B 87 -10.556 -5.186 -5.637 1.00 0.59 N ATOM 3064 CA ILE B 87 -11.733 -4.318 -5.377 1.00 0.57 C ATOM 3065 C ILE B 87 -12.363 -3.928 -6.710 1.00 0.57 C ATOM 3066 O ILE B 87 -13.553 -4.072 -6.905 1.00 0.55 O ATOM 3067 CB ILE B 87 -11.288 -3.056 -4.632 1.00 0.59 C ATOM 3068 CG1 ILE B 87 -11.120 -3.373 -3.142 1.00 0.65 C ATOM 3069 CG2 ILE B 87 -12.339 -1.957 -4.801 1.00 0.68 C ATOM 3070 CD1 ILE B 87 -10.058 -2.450 -2.535 1.00 0.70 C ATOM 0 H ILE B 87 -9.658 -4.797 -5.349 1.00 0.59 H new ATOM 0 HA ILE B 87 -12.459 -4.855 -4.767 1.00 0.57 H new ATOM 0 HB ILE B 87 -10.338 -2.714 -5.043 1.00 0.59 H new ATOM 0 HG12 ILE B 87 -12.069 -3.242 -2.623 1.00 0.65 H new ATOM 0 HG13 ILE B 87 -10.827 -4.415 -3.013 1.00 0.65 H new ATOM 0 HG21 ILE B 87 -12.018 -1.061 -4.269 1.00 0.68 H new ATOM 0 HG22 ILE B 87 -12.458 -1.727 -5.860 1.00 0.68 H new ATOM 0 HG23 ILE B 87 -13.291 -2.298 -4.395 1.00 0.68 H new ATOM 0 HD11 ILE B 87 -9.941 -2.678 -1.476 1.00 0.70 H new ATOM 0 HD12 ILE B 87 -9.108 -2.603 -3.046 1.00 0.70 H new ATOM 0 HD13 ILE B 87 -10.369 -1.412 -2.651 1.00 0.70 H new ATOM 3082 N ASN B 88 -11.579 -3.461 -7.643 1.00 0.60 N ATOM 3083 CA ASN B 88 -12.158 -3.101 -8.964 1.00 0.63 C ATOM 3084 C ASN B 88 -12.761 -4.346 -9.607 1.00 0.63 C ATOM 3085 O ASN B 88 -13.690 -4.266 -10.381 1.00 0.64 O ATOM 3086 CB ASN B 88 -11.068 -2.541 -9.882 1.00 0.70 C ATOM 3087 CG ASN B 88 -10.412 -3.684 -10.662 1.00 1.78 C ATOM 3088 OD1 ASN B 88 -9.293 -4.059 -10.384 1.00 2.47 O ATOM 3089 ND2 ASN B 88 -11.063 -4.255 -11.640 1.00 2.62 N ATOM 0 H ASN B 88 -10.574 -3.315 -7.548 1.00 0.60 H new ATOM 0 HA ASN B 88 -12.929 -2.344 -8.819 1.00 0.63 H new ATOM 0 HB2 ASN B 88 -11.498 -1.816 -10.573 1.00 0.70 H new ATOM 0 HB3 ASN B 88 -10.318 -2.013 -9.292 1.00 0.70 H new ATOM 0 HD21 ASN B 88 -10.630 -5.013 -12.167 1.00 2.62 H new ATOM 0 HD22 ASN B 88 -12.005 -3.942 -11.877 1.00 2.62 H new ATOM 3096 N SER B 89 -12.224 -5.500 -9.310 1.00 0.64 N ATOM 3097 CA SER B 89 -12.751 -6.748 -9.925 1.00 0.68 C ATOM 3098 C SER B 89 -14.195 -7.000 -9.486 1.00 0.67 C ATOM 3099 O SER B 89 -15.105 -6.974 -10.290 1.00 0.74 O ATOM 3100 CB SER B 89 -11.878 -7.929 -9.500 1.00 0.70 C ATOM 3101 OG SER B 89 -12.053 -8.998 -10.420 1.00 1.23 O ATOM 0 H SER B 89 -11.443 -5.630 -8.667 1.00 0.64 H new ATOM 0 HA SER B 89 -12.731 -6.639 -11.009 1.00 0.68 H new ATOM 0 HB2 SER B 89 -10.831 -7.629 -9.469 1.00 0.70 H new ATOM 0 HB3 SER B 89 -12.147 -8.252 -8.494 1.00 0.70 H new ATOM 0 HG SER B 89 -11.493 -9.756 -10.151 1.00 1.23 H new ATOM 3107 N VAL B 90 -14.423 -7.249 -8.225 1.00 0.63 N ATOM 3108 CA VAL B 90 -15.812 -7.505 -7.752 1.00 0.64 C ATOM 3109 C VAL B 90 -16.619 -6.209 -7.779 1.00 0.57 C ATOM 3110 O VAL B 90 -17.770 -6.188 -8.166 1.00 0.59 O ATOM 3111 CB VAL B 90 -15.762 -8.037 -6.323 1.00 0.66 C ATOM 3112 CG1 VAL B 90 -17.073 -8.751 -5.993 1.00 0.66 C ATOM 3113 CG2 VAL B 90 -14.596 -9.019 -6.188 1.00 0.89 C ATOM 0 H VAL B 90 -13.705 -7.286 -7.501 1.00 0.63 H new ATOM 0 HA VAL B 90 -16.287 -8.236 -8.406 1.00 0.64 H new ATOM 0 HB VAL B 90 -15.622 -7.206 -5.631 1.00 0.66 H new ATOM 0 HG11 VAL B 90 -17.034 -9.130 -4.972 1.00 0.66 H new ATOM 0 HG12 VAL B 90 -17.903 -8.051 -6.089 1.00 0.66 H new ATOM 0 HG13 VAL B 90 -17.218 -9.582 -6.683 1.00 0.66 H new ATOM 0 HG21 VAL B 90 -14.558 -9.401 -5.168 1.00 0.89 H new ATOM 0 HG22 VAL B 90 -14.737 -9.849 -6.881 1.00 0.89 H new ATOM 0 HG23 VAL B 90 -13.661 -8.508 -6.419 1.00 0.89 H new ATOM 3123 N LEU B 91 -16.018 -5.121 -7.380 1.00 0.51 N ATOM 3124 CA LEU B 91 -16.748 -3.829 -7.395 1.00 0.49 C ATOM 3125 C LEU B 91 -16.875 -3.363 -8.836 1.00 0.57 C ATOM 3126 O LEU B 91 -17.633 -2.482 -9.127 1.00 0.61 O ATOM 3127 CB LEU B 91 -15.969 -2.768 -6.606 1.00 0.47 C ATOM 3128 CG LEU B 91 -16.899 -1.606 -6.234 1.00 0.59 C ATOM 3129 CD1 LEU B 91 -17.951 -2.070 -5.222 1.00 0.91 C ATOM 3130 CD2 LEU B 91 -16.073 -0.473 -5.620 1.00 0.84 C ATOM 0 H LEU B 91 -15.055 -5.074 -7.046 1.00 0.51 H new ATOM 0 HA LEU B 91 -17.729 -3.966 -6.941 1.00 0.49 H new ATOM 0 HB2 LEU B 91 -15.547 -3.210 -5.704 1.00 0.47 H new ATOM 0 HB3 LEU B 91 -15.133 -2.400 -7.202 1.00 0.47 H new ATOM 0 HG LEU B 91 -17.403 -1.254 -7.134 1.00 0.59 H new ATOM 0 HD11 LEU B 91 -18.604 -1.235 -4.967 1.00 0.91 H new ATOM 0 HD12 LEU B 91 -18.544 -2.875 -5.657 1.00 0.91 H new ATOM 0 HD13 LEU B 91 -17.455 -2.431 -4.321 1.00 0.91 H new ATOM 0 HD21 LEU B 91 -16.731 0.354 -5.355 1.00 0.84 H new ATOM 0 HD22 LEU B 91 -15.567 -0.835 -4.725 1.00 0.84 H new ATOM 0 HD23 LEU B 91 -15.332 -0.130 -6.342 1.00 0.84 H new ATOM 3142 N SER B 92 -16.174 -3.991 -9.738 1.00 0.63 N ATOM 3143 CA SER B 92 -16.272 -3.614 -11.192 1.00 0.76 C ATOM 3144 C SER B 92 -15.989 -2.111 -11.432 1.00 0.83 C ATOM 3145 O SER B 92 -15.481 -1.755 -12.470 1.00 1.11 O ATOM 3146 CB SER B 92 -17.674 -3.947 -11.699 1.00 0.72 C ATOM 3147 OG SER B 92 -17.591 -5.012 -12.639 1.00 0.89 O ATOM 0 H SER B 92 -15.530 -4.756 -9.537 1.00 0.63 H new ATOM 0 HA SER B 92 -15.515 -4.182 -11.733 1.00 0.76 H new ATOM 0 HB2 SER B 92 -18.317 -4.231 -10.866 1.00 0.72 H new ATOM 0 HB3 SER B 92 -18.123 -3.070 -12.164 1.00 0.72 H new ATOM 0 HG SER B 92 -18.468 -5.441 -12.725 1.00 0.89 H new ATOM 3153 N ILE B 93 -16.367 -1.240 -10.512 1.00 0.74 N ATOM 3154 CA ILE B 93 -16.198 0.249 -10.668 1.00 0.82 C ATOM 3155 C ILE B 93 -17.430 0.777 -11.398 1.00 1.03 C ATOM 3156 O ILE B 93 -18.261 1.454 -10.825 1.00 1.11 O ATOM 3157 CB ILE B 93 -14.936 0.654 -11.464 1.00 0.92 C ATOM 3158 CG1 ILE B 93 -13.671 0.017 -10.872 1.00 0.87 C ATOM 3159 CG2 ILE B 93 -14.778 2.176 -11.400 1.00 1.13 C ATOM 3160 CD1 ILE B 93 -12.524 0.166 -11.874 1.00 1.43 C ATOM 0 H ILE B 93 -16.800 -1.513 -9.630 1.00 0.74 H new ATOM 0 HA ILE B 93 -16.083 0.675 -9.671 1.00 0.82 H new ATOM 0 HB ILE B 93 -15.057 0.309 -12.491 1.00 0.92 H new ATOM 0 HG12 ILE B 93 -13.412 0.499 -9.929 1.00 0.87 H new ATOM 0 HG13 ILE B 93 -13.846 -1.036 -10.654 1.00 0.87 H new ATOM 0 HG21 ILE B 93 -13.890 2.473 -11.958 1.00 1.13 H new ATOM 0 HG22 ILE B 93 -15.657 2.652 -11.835 1.00 1.13 H new ATOM 0 HG23 ILE B 93 -14.674 2.488 -10.361 1.00 1.13 H new ATOM 0 HD11 ILE B 93 -11.620 -0.284 -11.462 1.00 1.43 H new ATOM 0 HD12 ILE B 93 -12.787 -0.336 -12.805 1.00 1.43 H new ATOM 0 HD13 ILE B 93 -12.346 1.224 -12.069 1.00 1.43 H new ATOM 3172 N ARG B 94 -17.565 0.458 -12.651 1.00 1.25 N ATOM 3173 CA ARG B 94 -18.752 0.923 -13.412 1.00 1.52 C ATOM 3174 C ARG B 94 -18.986 0.007 -14.612 1.00 1.60 C ATOM 3175 O ARG B 94 -19.689 0.351 -15.540 1.00 1.76 O ATOM 3176 CB ARG B 94 -18.528 2.352 -13.892 1.00 1.97 C ATOM 3177 CG ARG B 94 -19.878 3.009 -14.168 1.00 2.23 C ATOM 3178 CD ARG B 94 -20.409 3.658 -12.890 1.00 2.52 C ATOM 3179 NE ARG B 94 -21.730 4.293 -13.166 1.00 3.12 N ATOM 3180 CZ ARG B 94 -21.801 5.354 -13.926 1.00 3.73 C ATOM 3181 NH1 ARG B 94 -20.715 5.864 -14.439 1.00 3.88 N ATOM 3182 NH2 ARG B 94 -22.957 5.907 -14.171 1.00 4.55 N ATOM 0 H ARG B 94 -16.902 -0.107 -13.183 1.00 1.25 H new ATOM 0 HA ARG B 94 -19.627 0.896 -12.763 1.00 1.52 H new ATOM 0 HB2 ARG B 94 -17.982 2.919 -13.139 1.00 1.97 H new ATOM 0 HB3 ARG B 94 -17.919 2.353 -14.796 1.00 1.97 H new ATOM 0 HG2 ARG B 94 -19.774 3.759 -14.952 1.00 2.23 H new ATOM 0 HG3 ARG B 94 -20.587 2.265 -14.531 1.00 2.23 H new ATOM 0 HD2 ARG B 94 -20.511 2.909 -12.104 1.00 2.52 H new ATOM 0 HD3 ARG B 94 -19.703 4.405 -12.529 1.00 2.52 H new ATOM 0 HE ARG B 94 -22.579 3.899 -12.761 1.00 3.12 H new ATOM 0 HH11 ARG B 94 -19.810 5.435 -14.247 1.00 3.88 H new ATOM 0 HH12 ARG B 94 -20.771 6.692 -15.032 1.00 3.88 H new ATOM 0 HH21 ARG B 94 -23.807 5.511 -13.769 1.00 4.55 H new ATOM 0 HH22 ARG B 94 -23.011 6.735 -14.764 1.00 4.55 H new ATOM 3196 N GLN B 95 -18.402 -1.156 -14.601 1.00 1.55 N ATOM 3197 CA GLN B 95 -18.597 -2.088 -15.749 1.00 1.73 C ATOM 3198 C GLN B 95 -18.358 -1.333 -17.058 1.00 2.40 C ATOM 3199 O GLN B 95 -17.204 -1.138 -17.405 1.00 2.92 O ATOM 3200 CB GLN B 95 -20.032 -2.624 -15.730 1.00 1.94 C ATOM 3201 CG GLN B 95 -20.131 -3.812 -14.771 1.00 2.44 C ATOM 3202 CD GLN B 95 -20.012 -5.117 -15.561 1.00 2.98 C ATOM 3203 OE1 GLN B 95 -18.927 -5.625 -15.758 1.00 3.53 O ATOM 3204 NE2 GLN B 95 -21.092 -5.683 -16.026 1.00 3.31 N ATOM 3205 OXT GLN B 95 -19.333 -0.961 -17.690 1.00 3.00 O ATOM 0 H GLN B 95 -17.801 -1.502 -13.853 1.00 1.55 H new ATOM 0 HA GLN B 95 -17.895 -2.918 -15.670 1.00 1.73 H new ATOM 0 HB2 GLN B 95 -20.719 -1.837 -15.420 1.00 1.94 H new ATOM 0 HB3 GLN B 95 -20.329 -2.930 -16.733 1.00 1.94 H new ATOM 0 HG2 GLN B 95 -19.341 -3.755 -14.022 1.00 2.44 H new ATOM 0 HG3 GLN B 95 -21.080 -3.783 -14.236 1.00 2.44 H new ATOM 0 HE21 GLN B 95 -22.003 -5.256 -15.860 1.00 3.31 H new ATOM 0 HE22 GLN B 95 -21.025 -6.552 -16.555 1.00 3.31 H new TER 3214 GLN B 95