USER MOD reduce.3.24.130724 H: found=0, std=0, add=1668, rem=0, adj=39 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 84 LYS NZ :NH3+ 150:sc= -0.391 (180deg=0) USER MOD Set 1.2: B 88 ASN : amide:sc= -0.587 K(o=-0.98,f=-2.2!) USER MOD Set 2.1: A 79 ASN : amide:sc= -0.81 K(o=-0.81,f=-0.29) USER MOD Set 2.2: B 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.1: B 5 SER OG : rot 0:sc= 1.21 USER MOD Set 3.2: B 40 TYR OH : rot -95:sc= 1.87 USER MOD Set 4.1: A 84 LYS NZ :NH3+ 156:sc= -0.264 (180deg=0) USER MOD Set 4.2: A 88 ASN : amide:sc= -4.41! C(o=-4.7!,f=-5.4!) USER MOD Set 5.1: A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.2: B 79 ASN : amide:sc= -0.8 X(o=-0.8,f=-1.1) USER MOD Set 6.1: A 5 SER OG : rot -31:sc= 1.2 USER MOD Set 6.2: A 40 TYR OH : rot -90:sc= 2.02 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ -159:sc= -0.0115 (180deg=-0.217) USER MOD Single : A 11 GLN : amide:sc= -1.56! K(o=-1.6!,f=0) USER MOD Single : A 17 CYS SG : rot -40:sc= -1.3 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot -0:sc= 1.23 USER MOD Single : A 21 SER OG : rot 134:sc= 0.657 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.0763 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) 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 -110:sc= -3.87! USER MOD Single : A 42 LYS NZ :NH3+ 145:sc= 0.164 (180deg=-1.98!) USER MOD Single : A 43 MET CE :methyl -173:sc= -2.26! (180deg=-2.35!) USER MOD Single : A 45 MET CE :methyl 179:sc= -0.137 (180deg=-0.144) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=-0.032) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 GLN : amide:sc= -6.44! K(o=-6.4!,f=-2.4) 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= -1.06 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 169:sc= -0.661 (180deg=-0.921) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -2.27 K(o=-2.3,f=-0.64) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN : amide:sc= -0.0434 K(o=-0.043,f=-2.3!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 95 GLN : amide:sc=-0.00343 K(o=-0.0034,f=-0.83) USER MOD Single : B 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.103) USER MOD Single : B 11 GLN : amide:sc= -1.41! K(o=-1.4!,f=-0.00054) USER MOD Single : B 17 CYS SG : rot -36:sc= -0.964 USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 SER OG : rot 3:sc= 1.1 USER MOD Single : B 21 SER OG : rot 105:sc= 0.467 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 THR OG1 : rot 180:sc= 0.0653 USER MOD Single : B 27 MET CE :methyl 180:sc= 0 (180deg=0) 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 -100:sc= -4.98! USER MOD Single : B 42 LYS NZ :NH3+ 147:sc= 0.195 (180deg=-1.59!) USER MOD Single : B 43 MET CE :methyl -179:sc= -2.46! (180deg=-2.48!) USER MOD Single : B 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 52 GLN : amide:sc= 0 X(o=0,f=-0.0029) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 56 GLN : amide:sc= -0.362 X(o=-0.36,f=-0.82) 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 180:sc= -0.466 USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 62 LYS NZ :NH3+ 170:sc= -0.712 (180deg=-1.04) USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 74 ASN : amide:sc= -2.52 K(o=-2.5,f=-0.63) USER MOD Single : B 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 82 GLN : amide:sc= -0.211 X(o=-0.21,f=-0.051) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 89 SER OG : rot 180:sc= 0 USER MOD Single : B 92 SER OG : rot 180:sc= 0 USER MOD Single : B 95 GLN : amide:sc= -0.0285 K(o=-0.029,f=-1) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -10.433 16.783 2.279 1.00 5.35 N ATOM 2 CA ALA A 1 -9.635 15.540 2.465 1.00 4.76 C ATOM 3 C ALA A 1 -10.415 14.346 1.908 1.00 4.12 C ATOM 4 O ALA A 1 -11.576 14.153 2.211 1.00 3.94 O ATOM 5 CB ALA A 1 -9.360 15.331 3.956 1.00 4.81 C ATOM 0 H1 ALA A 1 -9.904 17.595 2.657 1.00 5.35 H new ATOM 0 H2 ALA A 1 -10.615 16.930 1.266 1.00 5.35 H new ATOM 0 H3 ALA A 1 -11.338 16.694 2.784 1.00 5.35 H new ATOM 0 HA ALA A 1 -8.687 15.629 1.934 1.00 4.76 H new ATOM 0 HB1 ALA A 1 -8.776 14.421 4.094 1.00 4.81 H new ATOM 0 HB2 ALA A 1 -8.803 16.183 4.346 1.00 4.81 H new ATOM 0 HB3 ALA A 1 -10.305 15.240 4.491 1.00 4.81 H new ATOM 13 N LYS A 2 -9.783 13.545 1.093 1.00 4.22 N ATOM 14 CA LYS A 2 -10.483 12.364 0.512 1.00 4.07 C ATOM 15 C LYS A 2 -10.566 11.263 1.572 1.00 3.66 C ATOM 16 O LYS A 2 -9.596 10.959 2.237 1.00 4.35 O ATOM 17 CB LYS A 2 -9.703 11.842 -0.701 1.00 4.82 C ATOM 18 CG LYS A 2 -9.885 12.791 -1.900 1.00 5.66 C ATOM 19 CD LYS A 2 -9.181 14.140 -1.651 1.00 6.60 C ATOM 20 CE LYS A 2 -10.206 15.212 -1.264 1.00 7.50 C ATOM 21 NZ LYS A 2 -10.867 15.736 -2.494 1.00 7.90 N ATOM 0 H LYS A 2 -8.811 13.658 0.804 1.00 4.22 H new ATOM 0 HA LYS A 2 -11.485 12.654 0.196 1.00 4.07 H new ATOM 0 HB2 LYS A 2 -8.645 11.757 -0.453 1.00 4.82 H new ATOM 0 HB3 LYS A 2 -10.050 10.843 -0.963 1.00 4.82 H new ATOM 0 HG2 LYS A 2 -9.481 12.327 -2.800 1.00 5.66 H new ATOM 0 HG3 LYS A 2 -10.947 12.959 -2.077 1.00 5.66 H new ATOM 0 HD2 LYS A 2 -8.442 14.031 -0.858 1.00 6.60 H new ATOM 0 HD3 LYS A 2 -8.643 14.448 -2.548 1.00 6.60 H new ATOM 0 HE2 LYS A 2 -10.951 14.791 -0.589 1.00 7.50 H new ATOM 0 HE3 LYS A 2 -9.714 16.024 -0.729 1.00 7.50 H new ATOM 0 HZ1 LYS A 2 -11.562 16.463 -2.231 1.00 7.90 H new ATOM 0 HZ2 LYS A 2 -10.151 16.153 -3.122 1.00 7.90 H new ATOM 0 HZ3 LYS A 2 -11.349 14.958 -2.987 1.00 7.90 H new ATOM 35 N LYS A 3 -11.715 10.660 1.738 1.00 2.85 N ATOM 36 CA LYS A 3 -11.857 9.576 2.756 1.00 2.88 C ATOM 37 C LYS A 3 -13.309 9.115 2.783 1.00 2.35 C ATOM 38 O LYS A 3 -13.648 8.133 3.413 1.00 2.83 O ATOM 39 CB LYS A 3 -11.476 10.089 4.154 1.00 3.31 C ATOM 40 CG LYS A 3 -10.352 9.225 4.732 1.00 3.76 C ATOM 41 CD LYS A 3 -10.105 9.621 6.190 1.00 4.46 C ATOM 42 CE LYS A 3 -8.993 8.751 6.782 1.00 5.18 C ATOM 43 NZ LYS A 3 -9.213 8.594 8.248 1.00 5.69 N ATOM 0 H LYS A 3 -12.563 10.872 1.212 1.00 2.85 H new ATOM 0 HA LYS A 3 -11.194 8.753 2.489 1.00 2.88 H new ATOM 0 HB2 LYS A 3 -11.155 11.129 4.095 1.00 3.31 H new ATOM 0 HB3 LYS A 3 -12.345 10.060 4.812 1.00 3.31 H new ATOM 0 HG2 LYS A 3 -10.621 8.170 4.671 1.00 3.76 H new ATOM 0 HG3 LYS A 3 -9.441 9.356 4.149 1.00 3.76 H new ATOM 0 HD2 LYS A 3 -9.826 10.673 6.249 1.00 4.46 H new ATOM 0 HD3 LYS A 3 -11.021 9.501 6.769 1.00 4.46 H new ATOM 0 HE2 LYS A 3 -8.984 7.774 6.298 1.00 5.18 H new ATOM 0 HE3 LYS A 3 -8.021 9.208 6.596 1.00 5.18 H new ATOM 0 HZ1 LYS A 3 -8.458 8.003 8.651 1.00 5.69 H new ATOM 0 HZ2 LYS A 3 -9.201 9.529 8.703 1.00 5.69 H new ATOM 0 HZ3 LYS A 3 -10.134 8.140 8.414 1.00 5.69 H new ATOM 57 N LYS A 4 -14.169 9.828 2.111 1.00 1.83 N ATOM 58 CA LYS A 4 -15.605 9.449 2.098 1.00 1.71 C ATOM 59 C LYS A 4 -16.203 9.758 0.727 1.00 1.52 C ATOM 60 O LYS A 4 -15.511 10.139 -0.195 1.00 2.02 O ATOM 61 CB LYS A 4 -16.348 10.253 3.166 1.00 2.12 C ATOM 62 CG LYS A 4 -15.471 10.378 4.413 1.00 2.54 C ATOM 63 CD LYS A 4 -16.273 11.034 5.539 1.00 3.17 C ATOM 64 CE LYS A 4 -15.394 11.154 6.786 1.00 3.65 C ATOM 65 NZ LYS A 4 -15.917 12.242 7.661 1.00 4.24 N ATOM 0 H LYS A 4 -13.936 10.660 1.569 1.00 1.83 H new ATOM 0 HA LYS A 4 -15.702 8.383 2.305 1.00 1.71 H new ATOM 0 HB2 LYS A 4 -16.598 11.243 2.783 1.00 2.12 H new ATOM 0 HB3 LYS A 4 -17.288 9.762 3.417 1.00 2.12 H new ATOM 0 HG2 LYS A 4 -15.123 9.393 4.726 1.00 2.54 H new ATOM 0 HG3 LYS A 4 -14.585 10.973 4.189 1.00 2.54 H new ATOM 0 HD2 LYS A 4 -16.618 12.020 5.228 1.00 3.17 H new ATOM 0 HD3 LYS A 4 -17.160 10.441 5.762 1.00 3.17 H new ATOM 0 HE2 LYS A 4 -15.384 10.209 7.329 1.00 3.65 H new ATOM 0 HE3 LYS A 4 -14.364 11.367 6.499 1.00 3.65 H new ATOM 0 HZ1 LYS A 4 -15.320 12.323 8.508 1.00 4.24 H new ATOM 0 HZ2 LYS A 4 -15.904 13.142 7.141 1.00 4.24 H new ATOM 0 HZ3 LYS A 4 -16.893 12.020 7.945 1.00 4.24 H new ATOM 79 N SER A 5 -17.489 9.592 0.601 1.00 1.49 N ATOM 80 CA SER A 5 -18.158 9.874 -0.699 1.00 1.72 C ATOM 81 C SER A 5 -17.840 8.759 -1.692 1.00 1.51 C ATOM 82 O SER A 5 -18.146 8.855 -2.863 1.00 1.76 O ATOM 83 CB SER A 5 -17.659 11.198 -1.258 1.00 2.08 C ATOM 84 OG SER A 5 -18.719 11.848 -1.947 1.00 2.67 O ATOM 0 H SER A 5 -18.108 9.272 1.345 1.00 1.49 H new ATOM 0 HA SER A 5 -19.235 9.928 -0.541 1.00 1.72 H new ATOM 0 HB2 SER A 5 -17.293 11.832 -0.450 1.00 2.08 H new ATOM 0 HB3 SER A 5 -16.821 11.027 -1.934 1.00 2.08 H new ATOM 0 HG SER A 5 -19.318 11.176 -2.334 1.00 2.67 H new ATOM 90 N LYS A 6 -17.218 7.705 -1.243 1.00 1.38 N ATOM 91 CA LYS A 6 -16.880 6.603 -2.183 1.00 1.30 C ATOM 92 C LYS A 6 -16.187 5.465 -1.431 1.00 1.16 C ATOM 93 O LYS A 6 -16.370 4.308 -1.748 1.00 1.17 O ATOM 94 CB LYS A 6 -15.943 7.144 -3.268 1.00 1.59 C ATOM 95 CG LYS A 6 -15.119 6.000 -3.864 1.00 2.31 C ATOM 96 CD LYS A 6 -14.569 6.423 -5.227 1.00 2.60 C ATOM 97 CE LYS A 6 -13.347 5.570 -5.569 1.00 3.41 C ATOM 98 NZ LYS A 6 -12.176 6.039 -4.774 1.00 3.78 N ATOM 0 H LYS A 6 -16.932 7.560 -0.275 1.00 1.38 H new ATOM 0 HA LYS A 6 -17.794 6.221 -2.637 1.00 1.30 H new ATOM 0 HB2 LYS A 6 -16.523 7.632 -4.051 1.00 1.59 H new ATOM 0 HB3 LYS A 6 -15.280 7.899 -2.845 1.00 1.59 H new ATOM 0 HG2 LYS A 6 -14.299 5.741 -3.194 1.00 2.31 H new ATOM 0 HG3 LYS A 6 -15.738 5.109 -3.970 1.00 2.31 H new ATOM 0 HD2 LYS A 6 -15.335 6.304 -5.993 1.00 2.60 H new ATOM 0 HD3 LYS A 6 -14.296 7.478 -5.210 1.00 2.60 H new ATOM 0 HE2 LYS A 6 -13.550 4.521 -5.353 1.00 3.41 H new ATOM 0 HE3 LYS A 6 -13.128 5.639 -6.635 1.00 3.41 H new ATOM 0 HZ1 LYS A 6 -11.297 5.729 -5.235 1.00 3.78 H new ATOM 0 HZ2 LYS A 6 -12.189 7.077 -4.716 1.00 3.78 H new ATOM 0 HZ3 LYS A 6 -12.224 5.638 -3.816 1.00 3.78 H new ATOM 112 N LEU A 7 -15.374 5.787 -0.459 1.00 1.10 N ATOM 113 CA LEU A 7 -14.643 4.723 0.300 1.00 1.09 C ATOM 114 C LEU A 7 -15.336 4.406 1.632 1.00 1.01 C ATOM 115 O LEU A 7 -15.772 3.295 1.866 1.00 0.97 O ATOM 116 CB LEU A 7 -13.213 5.204 0.578 1.00 1.23 C ATOM 117 CG LEU A 7 -12.204 4.062 0.329 1.00 1.37 C ATOM 118 CD1 LEU A 7 -11.918 3.893 -1.175 1.00 2.05 C ATOM 119 CD2 LEU A 7 -10.889 4.382 1.047 1.00 1.67 C ATOM 0 H LEU A 7 -15.183 6.742 -0.156 1.00 1.10 H new ATOM 0 HA LEU A 7 -14.635 3.815 -0.303 1.00 1.09 H new ATOM 0 HB2 LEU A 7 -12.977 6.053 -0.063 1.00 1.23 H new ATOM 0 HB3 LEU A 7 -13.133 5.551 1.608 1.00 1.23 H new ATOM 0 HG LEU A 7 -12.635 3.137 0.711 1.00 1.37 H new ATOM 0 HD11 LEU A 7 -11.204 3.082 -1.321 1.00 2.05 H new ATOM 0 HD12 LEU A 7 -12.845 3.659 -1.698 1.00 2.05 H new ATOM 0 HD13 LEU A 7 -11.502 4.819 -1.572 1.00 2.05 H new ATOM 0 HD21 LEU A 7 -10.174 3.577 0.873 1.00 1.67 H new ATOM 0 HD22 LEU A 7 -10.483 5.318 0.662 1.00 1.67 H new ATOM 0 HD23 LEU A 7 -11.073 4.479 2.117 1.00 1.67 H new ATOM 131 N GLU A 8 -15.410 5.359 2.520 1.00 1.07 N ATOM 132 CA GLU A 8 -16.033 5.086 3.850 1.00 1.16 C ATOM 133 C GLU A 8 -17.559 5.022 3.742 1.00 1.10 C ATOM 134 O GLU A 8 -18.144 3.976 3.903 1.00 1.03 O ATOM 135 CB GLU A 8 -15.643 6.200 4.825 1.00 1.37 C ATOM 136 CG GLU A 8 -16.557 6.152 6.051 1.00 1.46 C ATOM 137 CD GLU A 8 -15.822 6.736 7.259 1.00 1.74 C ATOM 138 OE1 GLU A 8 -15.332 7.848 7.150 1.00 2.33 O ATOM 139 OE2 GLU A 8 -15.759 6.060 8.273 1.00 2.13 O ATOM 0 H GLU A 8 -15.069 6.311 2.385 1.00 1.07 H new ATOM 0 HA GLU A 8 -15.673 4.122 4.209 1.00 1.16 H new ATOM 0 HB2 GLU A 8 -14.603 6.083 5.129 1.00 1.37 H new ATOM 0 HB3 GLU A 8 -15.725 7.171 4.336 1.00 1.37 H new ATOM 0 HG2 GLU A 8 -17.470 6.716 5.860 1.00 1.46 H new ATOM 0 HG3 GLU A 8 -16.855 5.124 6.256 1.00 1.46 H new ATOM 146 N ILE A 9 -18.186 6.142 3.484 1.00 1.18 N ATOM 147 CA ILE A 9 -19.687 6.179 3.386 1.00 1.23 C ATOM 148 C ILE A 9 -20.176 4.929 2.639 1.00 1.11 C ATOM 149 O ILE A 9 -21.103 4.263 3.060 1.00 1.20 O ATOM 150 CB ILE A 9 -20.113 7.480 2.665 1.00 1.31 C ATOM 151 CG1 ILE A 9 -20.664 8.487 3.689 1.00 1.91 C ATOM 152 CG2 ILE A 9 -21.205 7.210 1.620 1.00 1.86 C ATOM 153 CD1 ILE A 9 -19.576 8.887 4.694 1.00 2.19 C ATOM 0 H ILE A 9 -17.725 7.040 3.335 1.00 1.18 H new ATOM 0 HA ILE A 9 -20.139 6.176 4.378 1.00 1.23 H new ATOM 0 HB ILE A 9 -19.232 7.882 2.165 1.00 1.31 H new ATOM 0 HG12 ILE A 9 -21.033 9.373 3.173 1.00 1.91 H new ATOM 0 HG13 ILE A 9 -21.511 8.050 4.217 1.00 1.91 H new ATOM 0 HG21 ILE A 9 -21.481 8.145 1.132 1.00 1.86 H new ATOM 0 HG22 ILE A 9 -20.830 6.509 0.875 1.00 1.86 H new ATOM 0 HG23 ILE A 9 -22.080 6.784 2.110 1.00 1.86 H new ATOM 0 HD11 ILE A 9 -19.986 9.600 5.410 1.00 2.19 H new ATOM 0 HD12 ILE A 9 -19.227 8.001 5.224 1.00 2.19 H new ATOM 0 HD13 ILE A 9 -18.741 9.345 4.163 1.00 2.19 H new ATOM 165 N ILE A 10 -19.547 4.597 1.551 1.00 0.96 N ATOM 166 CA ILE A 10 -19.966 3.380 0.800 1.00 0.91 C ATOM 167 C ILE A 10 -19.811 2.164 1.716 1.00 0.82 C ATOM 168 O ILE A 10 -20.725 1.385 1.881 1.00 0.85 O ATOM 169 CB ILE A 10 -19.140 3.242 -0.499 1.00 0.92 C ATOM 170 CG1 ILE A 10 -20.058 3.615 -1.676 1.00 1.11 C ATOM 171 CG2 ILE A 10 -18.617 1.803 -0.688 1.00 0.92 C ATOM 172 CD1 ILE A 10 -19.274 3.641 -2.990 1.00 1.39 C ATOM 0 H ILE A 10 -18.764 5.111 1.148 1.00 0.96 H new ATOM 0 HA ILE A 10 -21.011 3.457 0.501 1.00 0.91 H new ATOM 0 HB ILE A 10 -18.273 3.900 -0.447 1.00 0.92 H new ATOM 0 HG12 ILE A 10 -20.874 2.896 -1.748 1.00 1.11 H new ATOM 0 HG13 ILE A 10 -20.508 4.591 -1.497 1.00 1.11 H new ATOM 0 HG21 ILE A 10 -18.041 1.744 -1.611 1.00 0.92 H new ATOM 0 HG22 ILE A 10 -17.980 1.534 0.155 1.00 0.92 H new ATOM 0 HG23 ILE A 10 -19.460 1.114 -0.741 1.00 0.92 H new ATOM 0 HD11 ILE A 10 -19.944 3.907 -3.808 1.00 1.39 H new ATOM 0 HD12 ILE A 10 -18.474 4.378 -2.922 1.00 1.39 H new ATOM 0 HD13 ILE A 10 -18.845 2.656 -3.178 1.00 1.39 H new ATOM 184 N GLN A 11 -18.662 1.990 2.316 1.00 0.77 N ATOM 185 CA GLN A 11 -18.477 0.821 3.221 1.00 0.74 C ATOM 186 C GLN A 11 -19.663 0.752 4.185 1.00 0.80 C ATOM 187 O GLN A 11 -20.169 -0.310 4.491 1.00 0.78 O ATOM 188 CB GLN A 11 -17.180 0.987 4.014 1.00 0.77 C ATOM 189 CG GLN A 11 -16.606 -0.391 4.351 1.00 1.36 C ATOM 190 CD GLN A 11 -15.352 -0.224 5.210 1.00 1.62 C ATOM 191 OE1 GLN A 11 -14.627 -1.172 5.438 1.00 2.31 O ATOM 192 NE2 GLN A 11 -15.063 0.951 5.700 1.00 1.94 N ATOM 0 H GLN A 11 -17.852 2.602 2.219 1.00 0.77 H new ATOM 0 HA GLN A 11 -18.422 -0.097 2.635 1.00 0.74 H new ATOM 0 HB2 GLN A 11 -16.458 1.561 3.434 1.00 0.77 H new ATOM 0 HB3 GLN A 11 -17.371 1.547 4.930 1.00 0.77 H new ATOM 0 HG2 GLN A 11 -17.348 -0.986 4.884 1.00 1.36 H new ATOM 0 HG3 GLN A 11 -16.363 -0.930 3.435 1.00 1.36 H new ATOM 0 HE21 GLN A 11 -15.671 1.747 5.509 1.00 1.94 H new ATOM 0 HE22 GLN A 11 -14.229 1.073 6.274 1.00 1.94 H new ATOM 201 N ALA A 12 -20.127 1.884 4.644 1.00 0.90 N ATOM 202 CA ALA A 12 -21.299 1.897 5.563 1.00 0.98 C ATOM 203 C ALA A 12 -22.530 1.369 4.820 1.00 0.94 C ATOM 204 O ALA A 12 -23.380 0.714 5.391 1.00 0.94 O ATOM 205 CB ALA A 12 -21.563 3.328 6.036 1.00 1.11 C ATOM 0 H ALA A 12 -19.743 2.802 4.420 1.00 0.90 H new ATOM 0 HA ALA A 12 -21.093 1.264 6.426 1.00 0.98 H new ATOM 0 HB1 ALA A 12 -22.421 3.337 6.708 1.00 1.11 H new ATOM 0 HB2 ALA A 12 -20.686 3.705 6.562 1.00 1.11 H new ATOM 0 HB3 ALA A 12 -21.771 3.963 5.175 1.00 1.11 H new ATOM 211 N ILE A 13 -22.626 1.643 3.544 1.00 0.90 N ATOM 212 CA ILE A 13 -23.796 1.146 2.767 1.00 0.86 C ATOM 213 C ILE A 13 -23.680 -0.371 2.609 1.00 0.75 C ATOM 214 O ILE A 13 -24.647 -1.099 2.737 1.00 0.72 O ATOM 215 CB ILE A 13 -23.832 1.803 1.386 1.00 0.87 C ATOM 216 CG1 ILE A 13 -24.371 3.230 1.512 1.00 1.03 C ATOM 217 CG2 ILE A 13 -24.745 0.995 0.468 1.00 0.85 C ATOM 218 CD1 ILE A 13 -24.089 4.005 0.223 1.00 1.06 C ATOM 0 H ILE A 13 -21.947 2.187 3.011 1.00 0.90 H new ATOM 0 HA ILE A 13 -24.714 1.397 3.298 1.00 0.86 H new ATOM 0 HB ILE A 13 -22.825 1.832 0.969 1.00 0.87 H new ATOM 0 HG12 ILE A 13 -25.443 3.208 1.707 1.00 1.03 H new ATOM 0 HG13 ILE A 13 -23.903 3.732 2.359 1.00 1.03 H new ATOM 0 HG21 ILE A 13 -24.774 1.460 -0.518 1.00 0.85 H new ATOM 0 HG22 ILE A 13 -24.363 -0.022 0.379 1.00 0.85 H new ATOM 0 HG23 ILE A 13 -25.751 0.969 0.886 1.00 0.85 H new ATOM 0 HD11 ILE A 13 -24.474 5.020 0.317 1.00 1.06 H new ATOM 0 HD12 ILE A 13 -23.014 4.040 0.047 1.00 1.06 H new ATOM 0 HD13 ILE A 13 -24.578 3.508 -0.615 1.00 1.06 H new ATOM 230 N LEU A 14 -22.499 -0.853 2.339 1.00 0.74 N ATOM 231 CA LEU A 14 -22.301 -2.319 2.176 1.00 0.65 C ATOM 232 C LEU A 14 -22.519 -3.013 3.519 1.00 0.67 C ATOM 233 O LEU A 14 -23.146 -4.048 3.607 1.00 0.64 O ATOM 234 CB LEU A 14 -20.866 -2.569 1.711 1.00 0.65 C ATOM 235 CG LEU A 14 -20.874 -3.302 0.370 1.00 0.67 C ATOM 236 CD1 LEU A 14 -19.437 -3.455 -0.134 1.00 0.61 C ATOM 237 CD2 LEU A 14 -21.502 -4.686 0.550 1.00 1.04 C ATOM 0 H LEU A 14 -21.657 -0.289 2.224 1.00 0.74 H new ATOM 0 HA LEU A 14 -23.008 -2.711 1.445 1.00 0.65 H new ATOM 0 HB2 LEU A 14 -20.336 -1.622 1.614 1.00 0.65 H new ATOM 0 HB3 LEU A 14 -20.331 -3.159 2.455 1.00 0.65 H new ATOM 0 HG LEU A 14 -21.455 -2.731 -0.354 1.00 0.67 H new ATOM 0 HD11 LEU A 14 -19.441 -3.978 -1.090 1.00 0.61 H new ATOM 0 HD12 LEU A 14 -18.989 -2.469 -0.261 1.00 0.61 H new ATOM 0 HD13 LEU A 14 -18.857 -4.027 0.590 1.00 0.61 H new ATOM 0 HD21 LEU A 14 -21.508 -5.210 -0.406 1.00 1.04 H new ATOM 0 HD22 LEU A 14 -20.921 -5.258 1.273 1.00 1.04 H new ATOM 0 HD23 LEU A 14 -22.525 -4.577 0.911 1.00 1.04 H new ATOM 249 N GLU A 15 -21.997 -2.445 4.564 1.00 0.75 N ATOM 250 CA GLU A 15 -22.161 -3.060 5.907 1.00 0.80 C ATOM 251 C GLU A 15 -23.631 -3.019 6.321 1.00 0.83 C ATOM 252 O GLU A 15 -24.144 -3.944 6.916 1.00 0.85 O ATOM 253 CB GLU A 15 -21.322 -2.294 6.928 1.00 0.87 C ATOM 254 CG GLU A 15 -20.271 -3.231 7.518 1.00 0.89 C ATOM 255 CD GLU A 15 -19.481 -2.495 8.602 1.00 1.01 C ATOM 256 OE1 GLU A 15 -19.755 -1.325 8.816 1.00 1.43 O ATOM 257 OE2 GLU A 15 -18.613 -3.111 9.198 1.00 1.53 O ATOM 0 H GLU A 15 -21.461 -1.577 4.547 1.00 0.75 H new ATOM 0 HA GLU A 15 -21.828 -4.097 5.868 1.00 0.80 H new ATOM 0 HB2 GLU A 15 -20.839 -1.440 6.453 1.00 0.87 H new ATOM 0 HB3 GLU A 15 -21.960 -1.900 7.719 1.00 0.87 H new ATOM 0 HG2 GLU A 15 -20.751 -4.114 7.940 1.00 0.89 H new ATOM 0 HG3 GLU A 15 -19.597 -3.578 6.735 1.00 0.89 H new ATOM 264 N ALA A 16 -24.318 -1.959 6.016 1.00 0.85 N ATOM 265 CA ALA A 16 -25.746 -1.882 6.407 1.00 0.88 C ATOM 266 C ALA A 16 -26.516 -2.966 5.668 1.00 0.83 C ATOM 267 O ALA A 16 -27.458 -3.533 6.185 1.00 0.86 O ATOM 268 CB ALA A 16 -26.312 -0.511 6.044 1.00 0.91 C ATOM 0 H ALA A 16 -23.955 -1.148 5.516 1.00 0.85 H new ATOM 0 HA ALA A 16 -25.840 -2.027 7.483 1.00 0.88 H new ATOM 0 HB1 ALA A 16 -27.361 -0.462 6.334 1.00 0.91 H new ATOM 0 HB2 ALA A 16 -25.754 0.264 6.569 1.00 0.91 H new ATOM 0 HB3 ALA A 16 -26.225 -0.355 4.969 1.00 0.91 H new ATOM 274 N CYS A 17 -26.128 -3.266 4.460 1.00 0.76 N ATOM 275 CA CYS A 17 -26.849 -4.312 3.710 1.00 0.72 C ATOM 276 C CYS A 17 -26.384 -5.696 4.169 1.00 0.71 C ATOM 277 O CYS A 17 -26.976 -6.696 3.834 1.00 0.71 O ATOM 278 CB CYS A 17 -26.600 -4.146 2.213 1.00 0.65 C ATOM 279 SG CYS A 17 -24.979 -4.821 1.779 1.00 0.81 S ATOM 0 H CYS A 17 -25.347 -2.831 3.968 1.00 0.76 H new ATOM 0 HA CYS A 17 -27.917 -4.215 3.903 1.00 0.72 H new ATOM 0 HB2 CYS A 17 -27.379 -4.657 1.647 1.00 0.65 H new ATOM 0 HB3 CYS A 17 -26.649 -3.091 1.942 1.00 0.65 H new ATOM 0 HG CYS A 17 -24.120 -4.516 2.705 1.00 0.81 H new ATOM 285 N LYS A 18 -25.328 -5.772 4.931 1.00 0.72 N ATOM 286 CA LYS A 18 -24.842 -7.103 5.398 1.00 0.73 C ATOM 287 C LYS A 18 -25.978 -7.914 6.046 1.00 0.83 C ATOM 288 O LYS A 18 -25.771 -9.033 6.469 1.00 0.87 O ATOM 289 CB LYS A 18 -23.700 -6.909 6.407 1.00 0.78 C ATOM 290 CG LYS A 18 -24.254 -6.837 7.837 1.00 1.34 C ATOM 291 CD LYS A 18 -23.198 -6.232 8.769 1.00 1.96 C ATOM 292 CE LYS A 18 -21.991 -7.168 8.854 1.00 2.36 C ATOM 293 NZ LYS A 18 -21.130 -6.764 10.001 1.00 2.97 N ATOM 0 H LYS A 18 -24.781 -4.973 5.250 1.00 0.72 H new ATOM 0 HA LYS A 18 -24.480 -7.659 4.533 1.00 0.73 H new ATOM 0 HB2 LYS A 18 -22.991 -7.733 6.326 1.00 0.78 H new ATOM 0 HB3 LYS A 18 -23.154 -5.995 6.176 1.00 0.78 H new ATOM 0 HG2 LYS A 18 -25.160 -6.232 7.856 1.00 1.34 H new ATOM 0 HG3 LYS A 18 -24.529 -7.834 8.182 1.00 1.34 H new ATOM 0 HD2 LYS A 18 -22.888 -5.255 8.398 1.00 1.96 H new ATOM 0 HD3 LYS A 18 -23.621 -6.076 9.762 1.00 1.96 H new ATOM 0 HE2 LYS A 18 -22.324 -8.198 8.980 1.00 2.36 H new ATOM 0 HE3 LYS A 18 -21.421 -7.129 7.926 1.00 2.36 H new ATOM 0 HZ1 LYS A 18 -20.309 -7.400 10.060 1.00 2.97 H new ATOM 0 HZ2 LYS A 18 -20.802 -5.787 9.862 1.00 2.97 H new ATOM 0 HZ3 LYS A 18 -21.677 -6.823 10.883 1.00 2.97 H new ATOM 307 N SER A 19 -27.171 -7.378 6.146 1.00 0.88 N ATOM 308 CA SER A 19 -28.266 -8.162 6.785 1.00 0.99 C ATOM 309 C SER A 19 -29.635 -7.618 6.367 1.00 1.05 C ATOM 310 O SER A 19 -30.604 -7.747 7.089 1.00 1.21 O ATOM 311 CB SER A 19 -28.131 -8.072 8.305 1.00 1.07 C ATOM 312 OG SER A 19 -27.077 -8.925 8.734 1.00 1.10 O ATOM 0 H SER A 19 -27.428 -6.447 5.818 1.00 0.88 H new ATOM 0 HA SER A 19 -28.187 -9.200 6.462 1.00 0.99 H new ATOM 0 HB2 SER A 19 -27.927 -7.044 8.603 1.00 1.07 H new ATOM 0 HB3 SER A 19 -29.067 -8.362 8.783 1.00 1.07 H new ATOM 0 HG SER A 19 -26.686 -9.378 7.958 1.00 1.10 H new ATOM 318 N GLY A 20 -29.738 -7.029 5.207 1.00 0.94 N ATOM 319 CA GLY A 20 -31.059 -6.508 4.757 1.00 1.01 C ATOM 320 C GLY A 20 -31.481 -5.317 5.617 1.00 1.07 C ATOM 321 O GLY A 20 -31.958 -5.479 6.723 1.00 1.15 O ATOM 0 H GLY A 20 -28.968 -6.887 4.554 1.00 0.94 H new ATOM 0 HA2 GLY A 20 -31.002 -6.208 3.711 1.00 1.01 H new ATOM 0 HA3 GLY A 20 -31.809 -7.296 4.822 1.00 1.01 H new ATOM 325 N SER A 21 -31.303 -4.120 5.121 1.00 1.06 N ATOM 326 CA SER A 21 -31.687 -2.916 5.912 1.00 1.14 C ATOM 327 C SER A 21 -32.163 -1.804 4.943 1.00 1.14 C ATOM 328 O SER A 21 -31.568 -1.615 3.899 1.00 1.07 O ATOM 329 CB SER A 21 -30.458 -2.435 6.680 1.00 1.14 C ATOM 330 OG SER A 21 -29.667 -3.558 7.045 1.00 1.09 O ATOM 0 H SER A 21 -30.908 -3.925 4.201 1.00 1.06 H new ATOM 0 HA SER A 21 -32.492 -3.156 6.607 1.00 1.14 H new ATOM 0 HB2 SER A 21 -29.875 -1.749 6.065 1.00 1.14 H new ATOM 0 HB3 SER A 21 -30.763 -1.885 7.570 1.00 1.14 H new ATOM 0 HG SER A 21 -28.725 -3.373 6.847 1.00 1.09 H new ATOM 336 N PRO A 22 -33.232 -1.078 5.251 1.00 1.23 N ATOM 337 CA PRO A 22 -33.745 -0.001 4.346 1.00 1.26 C ATOM 338 C PRO A 22 -32.810 1.210 4.283 1.00 1.26 C ATOM 339 O PRO A 22 -31.838 1.291 5.005 1.00 1.25 O ATOM 340 CB PRO A 22 -35.087 0.400 4.962 1.00 1.35 C ATOM 341 CG PRO A 22 -34.987 0.026 6.401 1.00 1.47 C ATOM 342 CD PRO A 22 -34.067 -1.190 6.466 1.00 1.34 C ATOM 0 HA PRO A 22 -33.826 -0.356 3.319 1.00 1.26 H new ATOM 0 HB2 PRO A 22 -35.270 1.468 4.845 1.00 1.35 H new ATOM 0 HB3 PRO A 22 -35.913 -0.120 4.477 1.00 1.35 H new ATOM 0 HG2 PRO A 22 -34.584 0.850 6.990 1.00 1.47 H new ATOM 0 HG3 PRO A 22 -35.970 -0.208 6.811 1.00 1.47 H new ATOM 0 HD2 PRO A 22 -33.458 -1.181 7.370 1.00 1.34 H new ATOM 0 HD3 PRO A 22 -34.636 -2.120 6.474 1.00 1.34 H new ATOM 350 N LYS A 23 -33.100 2.149 3.421 1.00 1.27 N ATOM 351 CA LYS A 23 -32.230 3.356 3.300 1.00 1.28 C ATOM 352 C LYS A 23 -32.116 4.060 4.659 1.00 1.33 C ATOM 353 O LYS A 23 -31.096 4.638 4.979 1.00 1.35 O ATOM 354 CB LYS A 23 -32.840 4.331 2.281 1.00 1.31 C ATOM 355 CG LYS A 23 -31.748 4.874 1.343 1.00 1.27 C ATOM 356 CD LYS A 23 -32.263 6.134 0.646 1.00 1.83 C ATOM 357 CE LYS A 23 -33.558 5.813 -0.103 1.00 1.76 C ATOM 358 NZ LYS A 23 -33.843 6.896 -1.087 1.00 2.13 N ATOM 0 H LYS A 23 -33.904 2.132 2.794 1.00 1.27 H new ATOM 0 HA LYS A 23 -31.240 3.045 2.968 1.00 1.28 H new ATOM 0 HB2 LYS A 23 -33.610 3.825 1.699 1.00 1.31 H new ATOM 0 HB3 LYS A 23 -33.325 5.156 2.802 1.00 1.31 H new ATOM 0 HG2 LYS A 23 -30.845 5.101 1.910 1.00 1.27 H new ATOM 0 HG3 LYS A 23 -31.479 4.119 0.604 1.00 1.27 H new ATOM 0 HD2 LYS A 23 -32.441 6.921 1.379 1.00 1.83 H new ATOM 0 HD3 LYS A 23 -31.512 6.510 -0.049 1.00 1.83 H new ATOM 0 HE2 LYS A 23 -33.467 4.856 -0.616 1.00 1.76 H new ATOM 0 HE3 LYS A 23 -34.385 5.720 0.601 1.00 1.76 H new ATOM 0 HZ1 LYS A 23 -34.723 6.679 -1.597 1.00 2.13 H new ATOM 0 HZ2 LYS A 23 -33.947 7.801 -0.586 1.00 2.13 H new ATOM 0 HZ3 LYS A 23 -33.058 6.964 -1.765 1.00 2.13 H new ATOM 372 N THR A 24 -33.153 4.032 5.457 1.00 1.35 N ATOM 373 CA THR A 24 -33.107 4.713 6.787 1.00 1.41 C ATOM 374 C THR A 24 -32.060 4.080 7.715 1.00 1.43 C ATOM 375 O THR A 24 -31.328 4.774 8.392 1.00 1.48 O ATOM 376 CB THR A 24 -34.485 4.615 7.447 1.00 1.40 C ATOM 377 OG1 THR A 24 -35.070 3.358 7.134 1.00 1.42 O ATOM 378 CG2 THR A 24 -35.382 5.740 6.928 1.00 1.42 C ATOM 0 H THR A 24 -34.034 3.564 5.244 1.00 1.35 H new ATOM 0 HA THR A 24 -32.829 5.754 6.624 1.00 1.41 H new ATOM 0 HB THR A 24 -34.378 4.708 8.528 1.00 1.40 H new ATOM 0 HG1 THR A 24 -35.952 3.293 7.557 1.00 1.42 H new ATOM 0 HG21 THR A 24 -36.363 5.670 7.398 1.00 1.42 H new ATOM 0 HG22 THR A 24 -34.933 6.704 7.168 1.00 1.42 H new ATOM 0 HG23 THR A 24 -35.491 5.650 5.847 1.00 1.42 H new ATOM 386 N ARG A 25 -31.990 2.775 7.774 1.00 1.40 N ATOM 387 CA ARG A 25 -31.002 2.113 8.681 1.00 1.43 C ATOM 388 C ARG A 25 -29.579 2.466 8.251 1.00 1.44 C ATOM 389 O ARG A 25 -28.625 2.231 8.966 1.00 1.47 O ATOM 390 CB ARG A 25 -31.191 0.594 8.586 1.00 1.39 C ATOM 391 CG ARG A 25 -32.032 0.077 9.761 1.00 1.72 C ATOM 392 CD ARG A 25 -31.118 -0.179 10.957 1.00 1.56 C ATOM 393 NE ARG A 25 -31.941 -0.556 12.141 1.00 2.13 N ATOM 394 CZ ARG A 25 -31.435 -0.471 13.340 1.00 2.45 C ATOM 395 NH1 ARG A 25 -30.209 -0.054 13.503 1.00 2.53 N ATOM 396 NH2 ARG A 25 -32.155 -0.802 14.377 1.00 3.15 N ATOM 0 H ARG A 25 -32.575 2.138 7.233 1.00 1.40 H new ATOM 0 HA ARG A 25 -31.161 2.454 9.704 1.00 1.43 H new ATOM 0 HB2 ARG A 25 -31.679 0.341 7.644 1.00 1.39 H new ATOM 0 HB3 ARG A 25 -30.219 0.101 8.584 1.00 1.39 H new ATOM 0 HG2 ARG A 25 -32.799 0.806 10.023 1.00 1.72 H new ATOM 0 HG3 ARG A 25 -32.548 -0.841 9.479 1.00 1.72 H new ATOM 0 HD2 ARG A 25 -30.411 -0.975 10.724 1.00 1.56 H new ATOM 0 HD3 ARG A 25 -30.532 0.713 11.178 1.00 1.56 H new ATOM 0 HE ARG A 25 -32.900 -0.880 12.014 1.00 2.13 H new ATOM 0 HH11 ARG A 25 -29.647 0.205 12.693 1.00 2.53 H new ATOM 0 HH12 ARG A 25 -29.813 0.012 14.441 1.00 2.53 H new ATOM 0 HH21 ARG A 25 -33.113 -1.127 14.250 1.00 3.15 H new ATOM 0 HH22 ARG A 25 -31.759 -0.736 15.315 1.00 3.15 H new ATOM 410 N ILE A 26 -29.432 3.020 7.089 1.00 1.41 N ATOM 411 CA ILE A 26 -28.075 3.378 6.615 1.00 1.41 C ATOM 412 C ILE A 26 -27.669 4.721 7.234 1.00 1.49 C ATOM 413 O ILE A 26 -26.501 5.031 7.358 1.00 1.50 O ATOM 414 CB ILE A 26 -28.084 3.421 5.082 1.00 1.34 C ATOM 415 CG1 ILE A 26 -28.647 2.083 4.578 1.00 1.28 C ATOM 416 CG2 ILE A 26 -26.661 3.628 4.551 1.00 1.34 C ATOM 417 CD1 ILE A 26 -28.052 1.712 3.218 1.00 0.96 C ATOM 0 H ILE A 26 -30.192 3.241 6.446 1.00 1.41 H new ATOM 0 HA ILE A 26 -27.339 2.636 6.924 1.00 1.41 H new ATOM 0 HB ILE A 26 -28.699 4.249 4.730 1.00 1.34 H new ATOM 0 HG12 ILE A 26 -28.428 1.297 5.301 1.00 1.28 H new ATOM 0 HG13 ILE A 26 -29.732 2.149 4.498 1.00 1.28 H new ATOM 0 HG21 ILE A 26 -26.680 3.657 3.462 1.00 1.34 H new ATOM 0 HG22 ILE A 26 -26.264 4.569 4.932 1.00 1.34 H new ATOM 0 HG23 ILE A 26 -26.026 2.806 4.881 1.00 1.34 H new ATOM 0 HD11 ILE A 26 -28.468 0.761 2.886 1.00 0.96 H new ATOM 0 HD12 ILE A 26 -28.294 2.488 2.491 1.00 0.96 H new ATOM 0 HD13 ILE A 26 -26.969 1.623 3.307 1.00 0.96 H new ATOM 429 N MET A 27 -28.624 5.516 7.647 1.00 1.55 N ATOM 430 CA MET A 27 -28.278 6.826 8.272 1.00 1.64 C ATOM 431 C MET A 27 -27.472 6.560 9.541 1.00 1.70 C ATOM 432 O MET A 27 -26.521 7.254 9.843 1.00 1.74 O ATOM 433 CB MET A 27 -29.562 7.597 8.584 1.00 1.72 C ATOM 434 CG MET A 27 -29.232 9.049 8.916 1.00 2.02 C ATOM 435 SD MET A 27 -30.553 9.746 9.941 1.00 2.29 S ATOM 436 CE MET A 27 -31.725 10.119 8.610 1.00 1.90 C ATOM 0 H MET A 27 -29.622 5.315 7.579 1.00 1.55 H new ATOM 0 HA MET A 27 -27.678 7.431 7.592 1.00 1.64 H new ATOM 0 HB2 MET A 27 -30.238 7.555 7.730 1.00 1.72 H new ATOM 0 HB3 MET A 27 -30.080 7.132 9.423 1.00 1.72 H new ATOM 0 HG2 MET A 27 -28.279 9.106 9.443 1.00 2.02 H new ATOM 0 HG3 MET A 27 -29.124 9.628 7.999 1.00 2.02 H new ATOM 0 HE1 MET A 27 -32.626 10.564 9.033 1.00 1.90 H new ATOM 0 HE2 MET A 27 -31.269 10.818 7.909 1.00 1.90 H new ATOM 0 HE3 MET A 27 -31.986 9.199 8.087 1.00 1.90 H new ATOM 446 N TYR A 28 -27.829 5.540 10.271 1.00 1.72 N ATOM 447 CA TYR A 28 -27.068 5.202 11.507 1.00 1.80 C ATOM 448 C TYR A 28 -25.619 4.886 11.125 1.00 1.78 C ATOM 449 O TYR A 28 -24.775 4.658 11.969 1.00 2.09 O ATOM 450 CB TYR A 28 -27.692 3.977 12.170 1.00 1.82 C ATOM 451 CG TYR A 28 -27.272 3.926 13.618 1.00 2.02 C ATOM 452 CD1 TYR A 28 -27.829 4.822 14.539 1.00 2.25 C ATOM 453 CD2 TYR A 28 -26.325 2.986 14.040 1.00 2.64 C ATOM 454 CE1 TYR A 28 -27.437 4.778 15.882 1.00 2.48 C ATOM 455 CE2 TYR A 28 -25.933 2.942 15.383 1.00 3.00 C ATOM 456 CZ TYR A 28 -26.490 3.838 16.304 1.00 2.69 C ATOM 457 OH TYR A 28 -26.103 3.795 17.628 1.00 3.10 O ATOM 0 H TYR A 28 -28.616 4.925 10.065 1.00 1.72 H new ATOM 0 HA TYR A 28 -27.097 6.043 12.200 1.00 1.80 H new ATOM 0 HB2 TYR A 28 -28.779 4.023 12.096 1.00 1.82 H new ATOM 0 HB3 TYR A 28 -27.375 3.070 11.655 1.00 1.82 H new ATOM 0 HD1 TYR A 28 -28.561 5.547 14.213 1.00 2.25 H new ATOM 0 HD2 TYR A 28 -25.897 2.295 13.329 1.00 2.64 H new ATOM 0 HE1 TYR A 28 -27.865 5.469 16.593 1.00 2.48 H new ATOM 0 HE2 TYR A 28 -25.201 2.217 15.709 1.00 3.00 H new ATOM 0 HH TYR A 28 -25.440 3.084 17.752 1.00 3.10 H new ATOM 467 N GLY A 29 -25.329 4.901 9.854 1.00 1.51 N ATOM 468 CA GLY A 29 -23.939 4.635 9.391 1.00 1.48 C ATOM 469 C GLY A 29 -23.241 5.976 9.163 1.00 1.54 C ATOM 470 O GLY A 29 -22.080 6.150 9.476 1.00 1.61 O ATOM 0 H GLY A 29 -26.001 5.088 9.110 1.00 1.51 H new ATOM 0 HA2 GLY A 29 -23.398 4.047 10.133 1.00 1.48 H new ATOM 0 HA3 GLY A 29 -23.951 4.052 8.470 1.00 1.48 H new ATOM 474 N ALA A 30 -23.956 6.926 8.623 1.00 1.57 N ATOM 475 CA ALA A 30 -23.368 8.270 8.367 1.00 1.67 C ATOM 476 C ALA A 30 -24.469 9.199 7.858 1.00 1.71 C ATOM 477 O ALA A 30 -25.516 8.749 7.434 1.00 1.72 O ATOM 478 CB ALA A 30 -22.272 8.162 7.302 1.00 1.66 C ATOM 0 H ALA A 30 -24.933 6.826 8.346 1.00 1.57 H new ATOM 0 HA ALA A 30 -22.938 8.663 9.288 1.00 1.67 H new ATOM 0 HB1 ALA A 30 -21.845 9.148 7.118 1.00 1.66 H new ATOM 0 HB2 ALA A 30 -21.490 7.487 7.651 1.00 1.66 H new ATOM 0 HB3 ALA A 30 -22.700 7.774 6.378 1.00 1.66 H new ATOM 484 N ASN A 31 -24.246 10.486 7.879 1.00 1.82 N ATOM 485 CA ASN A 31 -25.292 11.417 7.371 1.00 1.87 C ATOM 486 C ASN A 31 -25.721 10.924 5.991 1.00 1.82 C ATOM 487 O ASN A 31 -24.917 10.824 5.088 1.00 2.17 O ATOM 488 CB ASN A 31 -24.714 12.832 7.258 1.00 2.00 C ATOM 489 CG ASN A 31 -24.845 13.549 8.604 1.00 2.22 C ATOM 490 OD1 ASN A 31 -23.952 13.491 9.426 1.00 2.79 O ATOM 491 ND2 ASN A 31 -25.927 14.231 8.864 1.00 2.38 N ATOM 0 H ASN A 31 -23.394 10.928 8.222 1.00 1.82 H new ATOM 0 HA ASN A 31 -26.144 11.443 8.050 1.00 1.87 H new ATOM 0 HB2 ASN A 31 -23.667 12.785 6.960 1.00 2.00 H new ATOM 0 HB3 ASN A 31 -25.241 13.390 6.484 1.00 2.00 H new ATOM 0 HD21 ASN A 31 -26.023 14.715 9.757 1.00 2.38 H new ATOM 0 HD22 ASN A 31 -26.677 14.280 8.174 1.00 2.38 H new ATOM 498 N LEU A 32 -26.966 10.579 5.818 1.00 1.81 N ATOM 499 CA LEU A 32 -27.395 10.054 4.495 1.00 1.70 C ATOM 500 C LEU A 32 -27.571 11.190 3.495 1.00 1.72 C ATOM 501 O LEU A 32 -28.424 12.041 3.623 1.00 1.84 O ATOM 502 CB LEU A 32 -28.732 9.313 4.653 1.00 1.75 C ATOM 503 CG LEU A 32 -28.720 7.930 3.968 1.00 1.74 C ATOM 504 CD1 LEU A 32 -28.164 8.006 2.551 1.00 1.67 C ATOM 505 CD2 LEU A 32 -27.879 6.946 4.775 1.00 1.69 C ATOM 0 H LEU A 32 -27.697 10.637 6.527 1.00 1.81 H new ATOM 0 HA LEU A 32 -26.627 9.375 4.124 1.00 1.70 H new ATOM 0 HB2 LEU A 32 -28.953 9.189 5.713 1.00 1.75 H new ATOM 0 HB3 LEU A 32 -29.533 9.919 4.229 1.00 1.75 H new ATOM 0 HG LEU A 32 -29.754 7.588 3.919 1.00 1.74 H new ATOM 0 HD11 LEU A 32 -28.172 7.012 2.103 1.00 1.67 H new ATOM 0 HD12 LEU A 32 -28.780 8.678 1.954 1.00 1.67 H new ATOM 0 HD13 LEU A 32 -27.141 8.382 2.581 1.00 1.67 H new ATOM 0 HD21 LEU A 32 -27.880 5.975 4.280 1.00 1.69 H new ATOM 0 HD22 LEU A 32 -26.856 7.316 4.847 1.00 1.69 H new ATOM 0 HD23 LEU A 32 -28.299 6.843 5.775 1.00 1.69 H new ATOM 517 N SER A 33 -26.785 11.144 2.464 1.00 1.63 N ATOM 518 CA SER A 33 -26.874 12.128 1.355 1.00 1.66 C ATOM 519 C SER A 33 -28.085 11.752 0.491 1.00 1.68 C ATOM 520 O SER A 33 -28.129 12.083 -0.664 1.00 1.69 O ATOM 521 CB SER A 33 -25.593 12.093 0.516 1.00 1.58 C ATOM 522 OG SER A 33 -25.072 13.410 0.400 1.00 1.75 O ATOM 0 H SER A 33 -26.058 10.440 2.339 1.00 1.63 H new ATOM 0 HA SER A 33 -26.990 13.137 1.750 1.00 1.66 H new ATOM 0 HB2 SER A 33 -24.857 11.438 0.982 1.00 1.58 H new ATOM 0 HB3 SER A 33 -25.803 11.684 -0.472 1.00 1.58 H new ATOM 0 HG SER A 33 -24.251 13.391 -0.135 1.00 1.75 H new ATOM 528 N TYR A 34 -28.996 10.971 1.055 1.00 1.70 N ATOM 529 CA TYR A 34 -30.198 10.406 0.333 1.00 1.73 C ATOM 530 C TYR A 34 -30.489 11.083 -1.003 1.00 1.77 C ATOM 531 O TYR A 34 -30.698 10.411 -1.993 1.00 1.71 O ATOM 532 CB TYR A 34 -31.431 10.558 1.226 1.00 1.92 C ATOM 533 CG TYR A 34 -31.848 12.011 1.298 1.00 1.73 C ATOM 534 CD1 TYR A 34 -32.741 12.532 0.353 1.00 1.94 C ATOM 535 CD2 TYR A 34 -31.344 12.836 2.309 1.00 2.49 C ATOM 536 CE1 TYR A 34 -33.126 13.877 0.420 1.00 2.57 C ATOM 537 CE2 TYR A 34 -31.728 14.180 2.377 1.00 3.01 C ATOM 538 CZ TYR A 34 -32.619 14.701 1.432 1.00 2.95 C ATOM 539 OH TYR A 34 -32.997 16.026 1.498 1.00 3.85 O ATOM 0 H TYR A 34 -28.949 10.691 2.035 1.00 1.70 H new ATOM 0 HA TYR A 34 -29.968 9.362 0.122 1.00 1.73 H new ATOM 0 HB2 TYR A 34 -32.250 9.956 0.833 1.00 1.92 H new ATOM 0 HB3 TYR A 34 -31.213 10.185 2.227 1.00 1.92 H new ATOM 0 HD1 TYR A 34 -33.133 11.897 -0.427 1.00 1.94 H new ATOM 0 HD2 TYR A 34 -30.657 12.435 3.039 1.00 2.49 H new ATOM 0 HE1 TYR A 34 -33.814 14.279 -0.309 1.00 2.57 H new ATOM 0 HE2 TYR A 34 -31.337 14.815 3.158 1.00 3.01 H new ATOM 0 HH TYR A 34 -32.555 16.455 2.260 1.00 3.85 H new ATOM 549 N ALA A 35 -30.489 12.374 -1.077 1.00 1.88 N ATOM 550 CA ALA A 35 -30.745 12.996 -2.398 1.00 1.95 C ATOM 551 C ALA A 35 -29.738 12.409 -3.392 1.00 1.82 C ATOM 552 O ALA A 35 -30.085 11.976 -4.472 1.00 1.78 O ATOM 553 CB ALA A 35 -30.556 14.511 -2.302 1.00 2.11 C ATOM 0 H ALA A 35 -30.327 13.016 -0.301 1.00 1.88 H new ATOM 0 HA ALA A 35 -31.765 12.795 -2.724 1.00 1.95 H new ATOM 0 HB1 ALA A 35 -30.745 14.964 -3.275 1.00 2.11 H new ATOM 0 HB2 ALA A 35 -31.253 14.919 -1.570 1.00 2.11 H new ATOM 0 HB3 ALA A 35 -29.535 14.731 -1.992 1.00 2.11 H new ATOM 559 N LEU A 36 -28.489 12.388 -3.012 1.00 1.76 N ATOM 560 CA LEU A 36 -27.424 11.827 -3.895 1.00 1.66 C ATOM 561 C LEU A 36 -27.090 10.370 -3.520 1.00 1.48 C ATOM 562 O LEU A 36 -26.950 9.523 -4.380 1.00 1.40 O ATOM 563 CB LEU A 36 -26.162 12.682 -3.770 1.00 1.73 C ATOM 564 CG LEU A 36 -25.740 13.176 -5.155 1.00 1.83 C ATOM 565 CD1 LEU A 36 -24.503 14.066 -5.026 1.00 2.23 C ATOM 566 CD2 LEU A 36 -25.413 11.976 -6.047 1.00 2.42 C ATOM 0 H LEU A 36 -28.156 12.741 -2.115 1.00 1.76 H new ATOM 0 HA LEU A 36 -27.792 11.839 -4.921 1.00 1.66 H new ATOM 0 HB2 LEU A 36 -26.348 13.530 -3.111 1.00 1.73 H new ATOM 0 HB3 LEU A 36 -25.358 12.099 -3.320 1.00 1.73 H new ATOM 0 HG LEU A 36 -26.554 13.749 -5.599 1.00 1.83 H new ATOM 0 HD11 LEU A 36 -24.203 14.417 -6.013 1.00 2.23 H new ATOM 0 HD12 LEU A 36 -24.735 14.921 -4.391 1.00 2.23 H new ATOM 0 HD13 LEU A 36 -23.688 13.494 -4.581 1.00 2.23 H new ATOM 0 HD21 LEU A 36 -25.112 12.328 -7.034 1.00 2.42 H new ATOM 0 HD22 LEU A 36 -24.599 11.403 -5.602 1.00 2.42 H new ATOM 0 HD23 LEU A 36 -26.294 11.342 -6.141 1.00 2.42 H new ATOM 578 N THR A 37 -26.906 10.090 -2.245 1.00 1.43 N ATOM 579 CA THR A 37 -26.518 8.703 -1.808 1.00 1.30 C ATOM 580 C THR A 37 -27.273 7.635 -2.601 1.00 1.23 C ATOM 581 O THR A 37 -26.712 6.612 -2.947 1.00 1.15 O ATOM 582 CB THR A 37 -26.806 8.507 -0.316 1.00 1.36 C ATOM 583 OG1 THR A 37 -26.187 9.544 0.428 1.00 1.49 O ATOM 584 CG2 THR A 37 -26.249 7.152 0.139 1.00 1.33 C ATOM 0 H THR A 37 -27.008 10.765 -1.487 1.00 1.43 H new ATOM 0 HA THR A 37 -25.450 8.595 -1.996 1.00 1.30 H new ATOM 0 HB THR A 37 -27.883 8.533 -0.149 1.00 1.36 H new ATOM 0 HG1 THR A 37 -25.440 9.175 0.944 1.00 1.49 H new ATOM 0 HG21 THR A 37 -26.454 7.012 1.200 1.00 1.33 H new ATOM 0 HG22 THR A 37 -26.724 6.353 -0.430 1.00 1.33 H new ATOM 0 HG23 THR A 37 -25.172 7.126 -0.029 1.00 1.33 H new ATOM 592 N GLY A 38 -28.529 7.853 -2.891 1.00 1.26 N ATOM 593 CA GLY A 38 -29.290 6.833 -3.676 1.00 1.21 C ATOM 594 C GLY A 38 -28.443 6.454 -4.890 1.00 1.17 C ATOM 595 O GLY A 38 -28.535 5.370 -5.431 1.00 1.12 O ATOM 0 H GLY A 38 -29.057 8.683 -2.622 1.00 1.26 H new ATOM 0 HA2 GLY A 38 -29.496 5.955 -3.064 1.00 1.21 H new ATOM 0 HA3 GLY A 38 -30.253 7.234 -3.992 1.00 1.21 H new ATOM 599 N ARG A 39 -27.600 7.361 -5.294 1.00 1.22 N ATOM 600 CA ARG A 39 -26.695 7.118 -6.451 1.00 1.23 C ATOM 601 C ARG A 39 -25.671 6.044 -6.073 1.00 1.13 C ATOM 602 O ARG A 39 -25.206 5.294 -6.907 1.00 1.10 O ATOM 603 CB ARG A 39 -25.963 8.424 -6.778 1.00 1.33 C ATOM 604 CG ARG A 39 -25.126 8.266 -8.052 1.00 1.36 C ATOM 605 CD ARG A 39 -23.733 8.866 -7.824 1.00 1.39 C ATOM 606 NE ARG A 39 -23.032 9.005 -9.131 1.00 1.58 N ATOM 607 CZ ARG A 39 -21.837 9.529 -9.177 1.00 2.13 C ATOM 608 NH1 ARG A 39 -21.260 9.935 -8.079 1.00 2.75 N ATOM 609 NH2 ARG A 39 -21.221 9.646 -10.321 1.00 2.58 N ATOM 0 H ARG A 39 -27.498 8.279 -4.862 1.00 1.22 H new ATOM 0 HA ARG A 39 -27.269 6.783 -7.315 1.00 1.23 H new ATOM 0 HB2 ARG A 39 -26.685 9.230 -6.908 1.00 1.33 H new ATOM 0 HB3 ARG A 39 -25.319 8.705 -5.945 1.00 1.33 H new ATOM 0 HG2 ARG A 39 -25.041 7.212 -8.316 1.00 1.36 H new ATOM 0 HG3 ARG A 39 -25.617 8.765 -8.887 1.00 1.36 H new ATOM 0 HD2 ARG A 39 -23.819 9.839 -7.340 1.00 1.39 H new ATOM 0 HD3 ARG A 39 -23.155 8.228 -7.155 1.00 1.39 H new ATOM 0 HE ARG A 39 -23.485 8.691 -9.989 1.00 1.58 H new ATOM 0 HH11 ARG A 39 -21.743 9.843 -7.185 1.00 2.75 H new ATOM 0 HH12 ARG A 39 -20.326 10.344 -8.115 1.00 2.75 H new ATOM 0 HH21 ARG A 39 -21.673 9.328 -11.178 1.00 2.58 H new ATOM 0 HH22 ARG A 39 -20.287 10.055 -10.358 1.00 2.58 H new ATOM 623 N TYR A 40 -25.321 5.966 -4.820 1.00 1.10 N ATOM 624 CA TYR A 40 -24.326 4.945 -4.387 1.00 1.01 C ATOM 625 C TYR A 40 -25.021 3.589 -4.319 1.00 0.91 C ATOM 626 O TYR A 40 -24.548 2.606 -4.853 1.00 0.85 O ATOM 627 CB TYR A 40 -23.770 5.315 -3.006 1.00 1.04 C ATOM 628 CG TYR A 40 -22.847 6.540 -3.046 1.00 1.24 C ATOM 629 CD1 TYR A 40 -22.741 7.398 -4.173 1.00 1.74 C ATOM 630 CD2 TYR A 40 -22.084 6.820 -1.908 1.00 1.92 C ATOM 631 CE1 TYR A 40 -21.882 8.503 -4.133 1.00 2.01 C ATOM 632 CE2 TYR A 40 -21.230 7.928 -1.879 1.00 2.17 C ATOM 633 CZ TYR A 40 -21.129 8.767 -2.989 1.00 1.89 C ATOM 634 OH TYR A 40 -20.288 9.860 -2.955 1.00 2.27 O ATOM 0 H TYR A 40 -25.681 6.565 -4.077 1.00 1.10 H new ATOM 0 HA TYR A 40 -23.500 4.904 -5.097 1.00 1.01 H new ATOM 0 HB2 TYR A 40 -24.599 5.512 -2.326 1.00 1.04 H new ATOM 0 HB3 TYR A 40 -23.221 4.465 -2.601 1.00 1.04 H new ATOM 0 HD1 TYR A 40 -23.323 7.198 -5.061 1.00 1.74 H new ATOM 0 HD2 TYR A 40 -22.155 6.176 -1.044 1.00 1.92 H new ATOM 0 HE1 TYR A 40 -21.802 9.154 -4.991 1.00 2.01 H new ATOM 0 HE2 TYR A 40 -20.647 8.135 -0.994 1.00 2.17 H new ATOM 0 HH TYR A 40 -19.400 9.600 -3.278 1.00 2.27 H new ATOM 644 N ILE A 41 -26.150 3.533 -3.667 1.00 0.89 N ATOM 645 CA ILE A 41 -26.885 2.244 -3.568 1.00 0.80 C ATOM 646 C ILE A 41 -27.207 1.742 -4.974 1.00 0.77 C ATOM 647 O ILE A 41 -26.954 0.609 -5.310 1.00 0.70 O ATOM 648 CB ILE A 41 -28.189 2.458 -2.797 1.00 0.82 C ATOM 649 CG1 ILE A 41 -27.903 3.257 -1.524 1.00 0.92 C ATOM 650 CG2 ILE A 41 -28.792 1.102 -2.424 1.00 0.77 C ATOM 651 CD1 ILE A 41 -29.159 3.293 -0.651 1.00 0.95 C ATOM 0 H ILE A 41 -26.593 4.324 -3.200 1.00 0.89 H new ATOM 0 HA ILE A 41 -26.270 1.511 -3.046 1.00 0.80 H new ATOM 0 HB ILE A 41 -28.893 3.008 -3.421 1.00 0.82 H new ATOM 0 HG12 ILE A 41 -27.078 2.803 -0.975 1.00 0.92 H new ATOM 0 HG13 ILE A 41 -27.596 4.271 -1.780 1.00 0.92 H new ATOM 0 HG21 ILE A 41 -29.721 1.256 -1.875 1.00 0.77 H new ATOM 0 HG22 ILE A 41 -28.996 0.533 -3.331 1.00 0.77 H new ATOM 0 HG23 ILE A 41 -28.089 0.550 -1.800 1.00 0.77 H new ATOM 0 HD11 ILE A 41 -28.955 3.862 0.256 1.00 0.95 H new ATOM 0 HD12 ILE A 41 -29.972 3.767 -1.202 1.00 0.95 H new ATOM 0 HD13 ILE A 41 -29.446 2.276 -0.384 1.00 0.95 H new ATOM 663 N LYS A 42 -27.739 2.589 -5.806 1.00 0.85 N ATOM 664 CA LYS A 42 -28.058 2.163 -7.195 1.00 0.86 C ATOM 665 C LYS A 42 -26.778 1.656 -7.865 1.00 0.85 C ATOM 666 O LYS A 42 -26.781 0.674 -8.580 1.00 0.82 O ATOM 667 CB LYS A 42 -28.613 3.355 -7.976 1.00 0.98 C ATOM 668 CG LYS A 42 -29.624 2.865 -9.017 1.00 1.09 C ATOM 669 CD LYS A 42 -28.955 1.852 -9.949 1.00 1.05 C ATOM 670 CE LYS A 42 -29.734 1.778 -11.264 1.00 1.07 C ATOM 671 NZ LYS A 42 -29.249 0.618 -12.064 1.00 1.81 N ATOM 0 H LYS A 42 -27.967 3.558 -5.585 1.00 0.85 H new ATOM 0 HA LYS A 42 -28.803 1.367 -7.179 1.00 0.86 H new ATOM 0 HB2 LYS A 42 -29.091 4.058 -7.294 1.00 0.98 H new ATOM 0 HB3 LYS A 42 -27.801 3.890 -8.468 1.00 0.98 H new ATOM 0 HG2 LYS A 42 -30.479 2.407 -8.520 1.00 1.09 H new ATOM 0 HG3 LYS A 42 -30.004 3.708 -9.594 1.00 1.09 H new ATOM 0 HD2 LYS A 42 -27.923 2.145 -10.141 1.00 1.05 H new ATOM 0 HD3 LYS A 42 -28.925 0.871 -9.476 1.00 1.05 H new ATOM 0 HE2 LYS A 42 -30.800 1.674 -11.062 1.00 1.07 H new ATOM 0 HE3 LYS A 42 -29.605 2.702 -11.828 1.00 1.07 H new ATOM 0 HZ1 LYS A 42 -30.045 0.198 -12.584 1.00 1.81 H new ATOM 0 HZ2 LYS A 42 -28.526 0.940 -12.739 1.00 1.81 H new ATOM 0 HZ3 LYS A 42 -28.837 -0.094 -11.428 1.00 1.81 H new ATOM 685 N MET A 43 -25.684 2.321 -7.625 1.00 0.90 N ATOM 686 CA MET A 43 -24.386 1.894 -8.227 1.00 0.93 C ATOM 687 C MET A 43 -24.050 0.490 -7.735 1.00 0.80 C ATOM 688 O MET A 43 -23.778 -0.408 -8.505 1.00 0.79 O ATOM 689 CB MET A 43 -23.285 2.870 -7.797 1.00 1.02 C ATOM 690 CG MET A 43 -22.018 2.652 -8.629 1.00 1.13 C ATOM 691 SD MET A 43 -20.783 3.886 -8.146 1.00 2.14 S ATOM 692 CE MET A 43 -19.331 3.055 -8.832 1.00 2.36 C ATOM 0 H MET A 43 -25.630 3.150 -7.033 1.00 0.90 H new ATOM 0 HA MET A 43 -24.461 1.892 -9.314 1.00 0.93 H new ATOM 0 HB2 MET A 43 -23.633 3.896 -7.917 1.00 1.02 H new ATOM 0 HB3 MET A 43 -23.061 2.731 -6.739 1.00 1.02 H new ATOM 0 HG2 MET A 43 -21.629 1.646 -8.468 1.00 1.13 H new ATOM 0 HG3 MET A 43 -22.244 2.740 -9.692 1.00 1.13 H new ATOM 0 HE1 MET A 43 -18.430 3.592 -8.535 1.00 2.36 H new ATOM 0 HE2 MET A 43 -19.285 2.033 -8.456 1.00 2.36 H new ATOM 0 HE3 MET A 43 -19.401 3.038 -9.920 1.00 2.36 H new ATOM 702 N LEU A 44 -24.061 0.300 -6.449 1.00 0.73 N ATOM 703 CA LEU A 44 -23.735 -1.034 -5.884 1.00 0.61 C ATOM 704 C LEU A 44 -24.752 -2.073 -6.385 1.00 0.57 C ATOM 705 O LEU A 44 -24.481 -3.258 -6.404 1.00 0.54 O ATOM 706 CB LEU A 44 -23.771 -0.934 -4.356 1.00 0.57 C ATOM 707 CG LEU A 44 -22.678 0.034 -3.872 1.00 0.69 C ATOM 708 CD1 LEU A 44 -22.787 0.213 -2.357 1.00 1.14 C ATOM 709 CD2 LEU A 44 -21.285 -0.515 -4.210 1.00 0.67 C ATOM 0 H LEU A 44 -24.284 1.018 -5.759 1.00 0.73 H new ATOM 0 HA LEU A 44 -22.742 -1.350 -6.204 1.00 0.61 H new ATOM 0 HB2 LEU A 44 -24.750 -0.585 -4.028 1.00 0.57 H new ATOM 0 HB3 LEU A 44 -23.619 -1.919 -3.914 1.00 0.57 H new ATOM 0 HG LEU A 44 -22.816 0.992 -4.374 1.00 0.69 H new ATOM 0 HD11 LEU A 44 -22.012 0.899 -2.015 1.00 1.14 H new ATOM 0 HD12 LEU A 44 -23.767 0.620 -2.108 1.00 1.14 H new ATOM 0 HD13 LEU A 44 -22.659 -0.752 -1.866 1.00 1.14 H new ATOM 0 HD21 LEU A 44 -20.524 0.183 -3.860 1.00 0.67 H new ATOM 0 HD22 LEU A 44 -21.145 -1.479 -3.721 1.00 0.67 H new ATOM 0 HD23 LEU A 44 -21.195 -0.639 -5.289 1.00 0.67 H new ATOM 721 N MET A 45 -25.907 -1.638 -6.821 1.00 0.60 N ATOM 722 CA MET A 45 -26.922 -2.602 -7.354 1.00 0.58 C ATOM 723 C MET A 45 -26.615 -2.849 -8.826 1.00 0.62 C ATOM 724 O MET A 45 -26.582 -3.963 -9.310 1.00 0.59 O ATOM 725 CB MET A 45 -28.324 -1.986 -7.276 1.00 0.64 C ATOM 726 CG MET A 45 -28.649 -1.585 -5.844 1.00 1.07 C ATOM 727 SD MET A 45 -29.837 -2.762 -5.156 1.00 1.19 S ATOM 728 CE MET A 45 -31.068 -1.553 -4.612 1.00 1.04 C ATOM 0 H MET A 45 -26.192 -0.659 -6.832 1.00 0.60 H new ATOM 0 HA MET A 45 -26.885 -3.522 -6.771 1.00 0.58 H new ATOM 0 HB2 MET A 45 -28.381 -1.113 -7.927 1.00 0.64 H new ATOM 0 HB3 MET A 45 -29.063 -2.701 -7.637 1.00 0.64 H new ATOM 0 HG2 MET A 45 -27.741 -1.572 -5.242 1.00 1.07 H new ATOM 0 HG3 MET A 45 -29.062 -0.576 -5.820 1.00 1.07 H new ATOM 0 HE1 MET A 45 -31.915 -2.073 -4.164 1.00 1.04 H new ATOM 0 HE2 MET A 45 -30.621 -0.885 -3.876 1.00 1.04 H new ATOM 0 HE3 MET A 45 -31.411 -0.972 -5.468 1.00 1.04 H new ATOM 738 N ASP A 46 -26.382 -1.781 -9.518 1.00 0.69 N ATOM 739 CA ASP A 46 -26.060 -1.862 -10.967 1.00 0.76 C ATOM 740 C ASP A 46 -24.768 -2.656 -11.161 1.00 0.75 C ATOM 741 O ASP A 46 -24.557 -3.278 -12.183 1.00 0.81 O ATOM 742 CB ASP A 46 -25.884 -0.454 -11.534 1.00 0.85 C ATOM 743 CG ASP A 46 -26.576 -0.362 -12.895 1.00 1.03 C ATOM 744 OD1 ASP A 46 -26.581 -1.356 -13.603 1.00 1.71 O ATOM 745 OD2 ASP A 46 -27.090 0.700 -13.206 1.00 1.26 O ATOM 0 H ASP A 46 -26.400 -0.835 -9.138 1.00 0.69 H new ATOM 0 HA ASP A 46 -26.875 -2.362 -11.490 1.00 0.76 H new ATOM 0 HB2 ASP A 46 -26.307 0.281 -10.849 1.00 0.85 H new ATOM 0 HB3 ASP A 46 -24.824 -0.222 -11.637 1.00 0.85 H new ATOM 750 N LEU A 47 -23.890 -2.617 -10.194 1.00 0.69 N ATOM 751 CA LEU A 47 -22.596 -3.344 -10.327 1.00 0.70 C ATOM 752 C LEU A 47 -22.687 -4.742 -9.709 1.00 0.62 C ATOM 753 O LEU A 47 -21.793 -5.548 -9.872 1.00 0.63 O ATOM 754 CB LEU A 47 -21.503 -2.534 -9.634 1.00 0.72 C ATOM 755 CG LEU A 47 -20.870 -1.573 -10.644 1.00 0.84 C ATOM 756 CD1 LEU A 47 -21.950 -0.719 -11.313 1.00 0.89 C ATOM 757 CD2 LEU A 47 -19.887 -0.657 -9.924 1.00 0.89 C ATOM 0 H LEU A 47 -24.014 -2.112 -9.317 1.00 0.69 H new ATOM 0 HA LEU A 47 -22.359 -3.462 -11.384 1.00 0.70 H new ATOM 0 HB2 LEU A 47 -21.923 -1.976 -8.797 1.00 0.72 H new ATOM 0 HB3 LEU A 47 -20.744 -3.201 -9.224 1.00 0.72 H new ATOM 0 HG LEU A 47 -20.351 -2.155 -11.405 1.00 0.84 H new ATOM 0 HD11 LEU A 47 -21.486 -0.040 -12.029 1.00 0.89 H new ATOM 0 HD12 LEU A 47 -22.656 -1.367 -11.833 1.00 0.89 H new ATOM 0 HD13 LEU A 47 -22.478 -0.141 -10.555 1.00 0.89 H new ATOM 0 HD21 LEU A 47 -19.435 0.028 -10.642 1.00 0.89 H new ATOM 0 HD22 LEU A 47 -20.414 -0.086 -9.160 1.00 0.89 H new ATOM 0 HD23 LEU A 47 -19.107 -1.257 -9.455 1.00 0.89 H new ATOM 769 N GLU A 48 -23.749 -5.025 -8.997 1.00 0.55 N ATOM 770 CA GLU A 48 -23.914 -6.370 -8.353 1.00 0.50 C ATOM 771 C GLU A 48 -23.119 -6.410 -7.039 1.00 0.44 C ATOM 772 O GLU A 48 -22.020 -6.922 -6.967 1.00 0.46 O ATOM 773 CB GLU A 48 -23.448 -7.483 -9.307 1.00 0.56 C ATOM 774 CG GLU A 48 -24.272 -8.747 -9.055 1.00 1.22 C ATOM 775 CD GLU A 48 -25.580 -8.669 -9.843 1.00 1.27 C ATOM 776 OE1 GLU A 48 -25.967 -7.569 -10.203 1.00 1.79 O ATOM 777 OE2 GLU A 48 -26.174 -9.709 -10.074 1.00 1.73 O ATOM 0 H GLU A 48 -24.518 -4.376 -8.831 1.00 0.55 H new ATOM 0 HA GLU A 48 -24.969 -6.536 -8.133 1.00 0.50 H new ATOM 0 HB2 GLU A 48 -23.563 -7.161 -10.342 1.00 0.56 H new ATOM 0 HB3 GLU A 48 -22.389 -7.689 -9.153 1.00 0.56 H new ATOM 0 HG2 GLU A 48 -23.706 -9.629 -9.356 1.00 1.22 H new ATOM 0 HG3 GLU A 48 -24.482 -8.851 -7.990 1.00 1.22 H new ATOM 784 N ILE A 49 -23.684 -5.863 -5.998 1.00 0.40 N ATOM 785 CA ILE A 49 -23.004 -5.843 -4.671 1.00 0.37 C ATOM 786 C ILE A 49 -24.100 -5.810 -3.603 1.00 0.37 C ATOM 787 O ILE A 49 -24.000 -6.452 -2.574 1.00 0.40 O ATOM 788 CB ILE A 49 -22.120 -4.580 -4.565 1.00 0.39 C ATOM 789 CG1 ILE A 49 -20.783 -4.738 -5.330 1.00 0.44 C ATOM 790 CG2 ILE A 49 -21.814 -4.277 -3.095 1.00 0.37 C ATOM 791 CD1 ILE A 49 -20.854 -3.993 -6.668 1.00 0.82 C ATOM 0 H ILE A 49 -24.603 -5.422 -6.011 1.00 0.40 H new ATOM 0 HA ILE A 49 -22.368 -6.718 -4.540 1.00 0.37 H new ATOM 0 HB ILE A 49 -22.678 -3.760 -5.016 1.00 0.39 H new ATOM 0 HG12 ILE A 49 -19.962 -4.346 -4.729 1.00 0.44 H new ATOM 0 HG13 ILE A 49 -20.576 -5.794 -5.503 1.00 0.44 H new ATOM 0 HG21 ILE A 49 -21.190 -3.385 -3.029 1.00 0.37 H new ATOM 0 HG22 ILE A 49 -22.747 -4.108 -2.557 1.00 0.37 H new ATOM 0 HG23 ILE A 49 -21.287 -5.122 -2.651 1.00 0.37 H new ATOM 0 HD11 ILE A 49 -19.910 -4.109 -7.200 1.00 0.82 H new ATOM 0 HD12 ILE A 49 -21.663 -4.405 -7.271 1.00 0.82 H new ATOM 0 HD13 ILE A 49 -21.040 -2.935 -6.486 1.00 0.82 H new ATOM 803 N ILE A 50 -25.163 -5.093 -3.868 1.00 0.43 N ATOM 804 CA ILE A 50 -26.304 -5.038 -2.907 1.00 0.48 C ATOM 805 C ILE A 50 -27.397 -5.960 -3.444 1.00 0.43 C ATOM 806 O ILE A 50 -27.341 -6.384 -4.583 1.00 0.49 O ATOM 807 CB ILE A 50 -26.824 -3.593 -2.805 1.00 0.56 C ATOM 808 CG1 ILE A 50 -25.880 -2.787 -1.898 1.00 0.62 C ATOM 809 CG2 ILE A 50 -28.242 -3.566 -2.205 1.00 0.67 C ATOM 810 CD1 ILE A 50 -26.241 -1.292 -1.921 1.00 0.74 C ATOM 0 H ILE A 50 -25.289 -4.540 -4.716 1.00 0.43 H new ATOM 0 HA ILE A 50 -25.994 -5.358 -1.912 1.00 0.48 H new ATOM 0 HB ILE A 50 -26.858 -3.159 -3.804 1.00 0.56 H new ATOM 0 HG12 ILE A 50 -25.940 -3.164 -0.877 1.00 0.62 H new ATOM 0 HG13 ILE A 50 -24.850 -2.922 -2.227 1.00 0.62 H new ATOM 0 HG21 ILE A 50 -28.591 -2.535 -2.142 1.00 0.67 H new ATOM 0 HG22 ILE A 50 -28.917 -4.139 -2.841 1.00 0.67 H new ATOM 0 HG23 ILE A 50 -28.223 -4.005 -1.207 1.00 0.67 H new ATOM 0 HD11 ILE A 50 -25.559 -0.743 -1.272 1.00 0.74 H new ATOM 0 HD12 ILE A 50 -26.156 -0.913 -2.939 1.00 0.74 H new ATOM 0 HD13 ILE A 50 -27.264 -1.159 -1.568 1.00 0.74 H new ATOM 822 N ARG A 51 -28.385 -6.269 -2.646 1.00 0.58 N ATOM 823 CA ARG A 51 -29.484 -7.157 -3.119 1.00 0.56 C ATOM 824 C ARG A 51 -30.821 -6.625 -2.611 1.00 0.53 C ATOM 825 O ARG A 51 -30.891 -5.919 -1.625 1.00 0.53 O ATOM 826 CB ARG A 51 -29.260 -8.577 -2.604 1.00 0.60 C ATOM 827 CG ARG A 51 -29.567 -9.566 -3.729 1.00 0.83 C ATOM 828 CD ARG A 51 -29.388 -10.997 -3.231 1.00 0.87 C ATOM 829 NE ARG A 51 -30.529 -11.831 -3.707 1.00 1.02 N ATOM 830 CZ ARG A 51 -30.520 -12.325 -4.916 1.00 1.06 C ATOM 831 NH1 ARG A 51 -29.512 -12.095 -5.713 1.00 1.47 N ATOM 832 NH2 ARG A 51 -31.524 -13.050 -5.330 1.00 1.39 N ATOM 0 H ARG A 51 -28.477 -5.943 -1.684 1.00 0.58 H new ATOM 0 HA ARG A 51 -29.493 -7.173 -4.209 1.00 0.56 H new ATOM 0 HB2 ARG A 51 -28.231 -8.698 -2.267 1.00 0.60 H new ATOM 0 HB3 ARG A 51 -29.902 -8.772 -1.745 1.00 0.60 H new ATOM 0 HG2 ARG A 51 -30.588 -9.421 -4.083 1.00 0.83 H new ATOM 0 HG3 ARG A 51 -28.906 -9.382 -4.576 1.00 0.83 H new ATOM 0 HD2 ARG A 51 -28.446 -11.406 -3.596 1.00 0.87 H new ATOM 0 HD3 ARG A 51 -29.341 -11.012 -2.142 1.00 0.87 H new ATOM 0 HE ARG A 51 -31.318 -12.016 -3.087 1.00 1.02 H new ATOM 0 HH11 ARG A 51 -28.727 -11.528 -5.392 1.00 1.47 H new ATOM 0 HH12 ARG A 51 -29.509 -12.483 -6.656 1.00 1.47 H new ATOM 0 HH21 ARG A 51 -32.313 -13.230 -4.710 1.00 1.39 H new ATOM 0 HH22 ARG A 51 -31.519 -13.437 -6.274 1.00 1.39 H new ATOM 846 N GLN A 52 -31.879 -6.939 -3.305 1.00 0.59 N ATOM 847 CA GLN A 52 -33.221 -6.435 -2.906 1.00 0.59 C ATOM 848 C GLN A 52 -33.964 -7.482 -2.078 1.00 0.56 C ATOM 849 O GLN A 52 -34.391 -8.495 -2.596 1.00 0.58 O ATOM 850 CB GLN A 52 -34.032 -6.122 -4.164 1.00 0.68 C ATOM 851 CG GLN A 52 -34.536 -4.679 -4.101 1.00 1.47 C ATOM 852 CD GLN A 52 -35.396 -4.384 -5.331 1.00 1.71 C ATOM 853 OE1 GLN A 52 -36.368 -5.068 -5.585 1.00 2.42 O ATOM 854 NE2 GLN A 52 -35.077 -3.388 -6.111 1.00 1.84 N ATOM 0 H GLN A 52 -31.871 -7.528 -4.138 1.00 0.59 H new ATOM 0 HA GLN A 52 -33.095 -5.535 -2.303 1.00 0.59 H new ATOM 0 HB2 GLN A 52 -33.416 -6.265 -5.052 1.00 0.68 H new ATOM 0 HB3 GLN A 52 -34.874 -6.809 -4.247 1.00 0.68 H new ATOM 0 HG2 GLN A 52 -35.118 -4.525 -3.192 1.00 1.47 H new ATOM 0 HG3 GLN A 52 -33.693 -3.990 -4.060 1.00 1.47 H new ATOM 0 HE21 GLN A 52 -34.261 -2.814 -5.898 1.00 1.84 H new ATOM 0 HE22 GLN A 52 -35.643 -3.183 -6.934 1.00 1.84 H new ATOM 863 N GLU A 53 -34.142 -7.223 -0.802 1.00 0.67 N ATOM 864 CA GLU A 53 -34.887 -8.174 0.076 1.00 0.78 C ATOM 865 C GLU A 53 -36.171 -7.494 0.537 1.00 0.77 C ATOM 866 O GLU A 53 -36.173 -6.703 1.457 1.00 0.87 O ATOM 867 CB GLU A 53 -34.032 -8.522 1.295 1.00 1.04 C ATOM 868 CG GLU A 53 -33.725 -10.020 1.305 1.00 0.85 C ATOM 869 CD GLU A 53 -35.013 -10.810 1.552 1.00 1.59 C ATOM 870 OE1 GLU A 53 -35.700 -11.106 0.588 1.00 2.25 O ATOM 871 OE2 GLU A 53 -35.288 -11.108 2.701 1.00 2.30 O ATOM 0 H GLU A 53 -33.799 -6.386 -0.331 1.00 0.67 H new ATOM 0 HA GLU A 53 -35.118 -9.088 -0.471 1.00 0.78 H new ATOM 0 HB2 GLU A 53 -33.103 -7.952 1.273 1.00 1.04 H new ATOM 0 HB3 GLU A 53 -34.556 -8.243 2.209 1.00 1.04 H new ATOM 0 HG2 GLU A 53 -33.282 -10.316 0.354 1.00 0.85 H new ATOM 0 HG3 GLU A 53 -32.994 -10.246 2.081 1.00 0.85 H new ATOM 878 N GLY A 54 -37.261 -7.781 -0.107 1.00 0.73 N ATOM 879 CA GLY A 54 -38.539 -7.133 0.283 1.00 0.75 C ATOM 880 C GLY A 54 -38.418 -5.620 0.074 1.00 0.83 C ATOM 881 O GLY A 54 -38.930 -4.839 0.850 1.00 1.15 O ATOM 0 H GLY A 54 -37.324 -8.436 -0.887 1.00 0.73 H new ATOM 0 HA2 GLY A 54 -39.360 -7.531 -0.314 1.00 0.75 H new ATOM 0 HA3 GLY A 54 -38.768 -7.351 1.326 1.00 0.75 H new ATOM 885 N LYS A 55 -37.711 -5.211 -0.955 1.00 0.86 N ATOM 886 CA LYS A 55 -37.508 -3.751 -1.221 1.00 1.03 C ATOM 887 C LYS A 55 -36.427 -3.228 -0.275 1.00 1.02 C ATOM 888 O LYS A 55 -36.154 -2.046 -0.203 1.00 1.27 O ATOM 889 CB LYS A 55 -38.814 -2.986 -0.988 1.00 1.21 C ATOM 890 CG LYS A 55 -38.890 -1.793 -1.941 1.00 1.38 C ATOM 891 CD LYS A 55 -39.831 -0.737 -1.358 1.00 1.67 C ATOM 892 CE LYS A 55 -39.983 0.418 -2.348 1.00 1.89 C ATOM 893 NZ LYS A 55 -40.804 1.497 -1.728 1.00 2.27 N ATOM 0 H LYS A 55 -37.262 -5.833 -1.627 1.00 0.86 H new ATOM 0 HA LYS A 55 -37.201 -3.606 -2.257 1.00 1.03 H new ATOM 0 HB2 LYS A 55 -39.667 -3.646 -1.148 1.00 1.21 H new ATOM 0 HB3 LYS A 55 -38.866 -2.642 0.045 1.00 1.21 H new ATOM 0 HG2 LYS A 55 -37.897 -1.369 -2.090 1.00 1.38 H new ATOM 0 HG3 LYS A 55 -39.249 -2.116 -2.918 1.00 1.38 H new ATOM 0 HD2 LYS A 55 -40.805 -1.179 -1.148 1.00 1.67 H new ATOM 0 HD3 LYS A 55 -39.437 -0.368 -0.411 1.00 1.67 H new ATOM 0 HE2 LYS A 55 -39.003 0.806 -2.625 1.00 1.89 H new ATOM 0 HE3 LYS A 55 -40.457 0.066 -3.264 1.00 1.89 H new ATOM 0 HZ1 LYS A 55 -40.908 2.284 -2.400 1.00 2.27 H new ATOM 0 HZ2 LYS A 55 -41.743 1.122 -1.485 1.00 2.27 H new ATOM 0 HZ3 LYS A 55 -40.334 1.839 -0.866 1.00 2.27 H new ATOM 907 N GLN A 56 -35.835 -4.118 0.466 1.00 0.87 N ATOM 908 CA GLN A 56 -34.787 -3.724 1.442 1.00 0.97 C ATOM 909 C GLN A 56 -33.412 -3.962 0.810 1.00 0.89 C ATOM 910 O GLN A 56 -33.309 -4.651 -0.176 1.00 0.86 O ATOM 911 CB GLN A 56 -34.966 -4.594 2.689 1.00 1.04 C ATOM 912 CG GLN A 56 -34.420 -3.894 3.935 1.00 1.44 C ATOM 913 CD GLN A 56 -34.850 -4.670 5.182 1.00 1.38 C ATOM 914 OE1 GLN A 56 -35.829 -4.326 5.815 1.00 1.49 O ATOM 915 NE2 GLN A 56 -34.158 -5.706 5.564 1.00 2.04 N ATOM 0 H GLN A 56 -36.036 -5.117 0.436 1.00 0.87 H new ATOM 0 HA GLN A 56 -34.867 -2.671 1.714 1.00 0.97 H new ATOM 0 HB2 GLN A 56 -36.023 -4.820 2.829 1.00 1.04 H new ATOM 0 HB3 GLN A 56 -34.453 -5.545 2.549 1.00 1.04 H new ATOM 0 HG2 GLN A 56 -33.333 -3.836 3.886 1.00 1.44 H new ATOM 0 HG3 GLN A 56 -34.792 -2.871 3.983 1.00 1.44 H new ATOM 0 HE21 GLN A 56 -33.336 -5.995 5.033 1.00 2.04 H new ATOM 0 HE22 GLN A 56 -34.438 -6.228 6.394 1.00 2.04 H new ATOM 924 N TYR A 57 -32.362 -3.383 1.350 1.00 0.87 N ATOM 925 CA TYR A 57 -31.006 -3.566 0.736 1.00 0.80 C ATOM 926 C TYR A 57 -30.204 -4.615 1.499 1.00 0.79 C ATOM 927 O TYR A 57 -29.870 -4.433 2.650 1.00 0.95 O ATOM 928 CB TYR A 57 -30.243 -2.245 0.791 1.00 0.81 C ATOM 929 CG TYR A 57 -31.095 -1.137 0.217 1.00 0.85 C ATOM 930 CD1 TYR A 57 -31.509 -1.196 -1.120 1.00 1.49 C ATOM 931 CD2 TYR A 57 -31.470 -0.050 1.017 1.00 1.34 C ATOM 932 CE1 TYR A 57 -32.297 -0.171 -1.655 1.00 1.56 C ATOM 933 CE2 TYR A 57 -32.258 0.974 0.480 1.00 1.35 C ATOM 934 CZ TYR A 57 -32.672 0.914 -0.856 1.00 0.98 C ATOM 935 OH TYR A 57 -33.449 1.924 -1.384 1.00 1.06 O ATOM 0 H TYR A 57 -32.386 -2.796 2.184 1.00 0.87 H new ATOM 0 HA TYR A 57 -31.139 -3.893 -0.295 1.00 0.80 H new ATOM 0 HB2 TYR A 57 -29.974 -2.013 1.821 1.00 0.81 H new ATOM 0 HB3 TYR A 57 -29.312 -2.328 0.230 1.00 0.81 H new ATOM 0 HD1 TYR A 57 -31.220 -2.033 -1.738 1.00 1.49 H new ATOM 0 HD2 TYR A 57 -31.151 -0.002 2.048 1.00 1.34 H new ATOM 0 HE1 TYR A 57 -32.616 -0.218 -2.686 1.00 1.56 H new ATOM 0 HE2 TYR A 57 -32.547 1.812 1.097 1.00 1.35 H new ATOM 0 HH TYR A 57 -33.620 2.600 -0.695 1.00 1.06 H new ATOM 945 N MET A 58 -29.909 -5.709 0.844 1.00 0.66 N ATOM 946 CA MET A 58 -29.133 -6.816 1.476 1.00 0.67 C ATOM 947 C MET A 58 -27.839 -7.030 0.684 1.00 0.57 C ATOM 948 O MET A 58 -27.637 -6.426 -0.349 1.00 0.51 O ATOM 949 CB MET A 58 -29.994 -8.085 1.478 1.00 0.73 C ATOM 950 CG MET A 58 -29.196 -9.296 1.959 1.00 0.90 C ATOM 951 SD MET A 58 -30.343 -10.612 2.440 1.00 1.22 S ATOM 952 CE MET A 58 -29.513 -11.967 1.574 1.00 1.60 C ATOM 0 H MET A 58 -30.180 -5.884 -0.124 1.00 0.66 H new ATOM 0 HA MET A 58 -28.873 -6.569 2.505 1.00 0.67 H new ATOM 0 HB2 MET A 58 -30.860 -7.938 2.123 1.00 0.73 H new ATOM 0 HB3 MET A 58 -30.373 -8.272 0.473 1.00 0.73 H new ATOM 0 HG2 MET A 58 -28.532 -9.647 1.169 1.00 0.90 H new ATOM 0 HG3 MET A 58 -28.566 -9.019 2.804 1.00 0.90 H new ATOM 0 HE1 MET A 58 -30.062 -12.894 1.738 1.00 1.60 H new ATOM 0 HE2 MET A 58 -29.478 -11.749 0.506 1.00 1.60 H new ATOM 0 HE3 MET A 58 -28.498 -12.075 1.955 1.00 1.60 H new ATOM 962 N LEU A 59 -26.958 -7.861 1.175 1.00 0.59 N ATOM 963 CA LEU A 59 -25.661 -8.092 0.464 1.00 0.52 C ATOM 964 C LEU A 59 -25.755 -9.347 -0.414 1.00 0.46 C ATOM 965 O LEU A 59 -26.267 -10.367 -0.001 1.00 0.53 O ATOM 966 CB LEU A 59 -24.511 -8.237 1.490 1.00 0.63 C ATOM 967 CG LEU A 59 -24.522 -9.603 2.216 1.00 0.71 C ATOM 968 CD1 LEU A 59 -23.360 -9.648 3.209 1.00 1.03 C ATOM 969 CD2 LEU A 59 -25.831 -9.790 2.986 1.00 1.16 C ATOM 0 H LEU A 59 -27.078 -8.391 2.038 1.00 0.59 H new ATOM 0 HA LEU A 59 -25.452 -7.235 -0.176 1.00 0.52 H new ATOM 0 HB2 LEU A 59 -23.557 -8.110 0.979 1.00 0.63 H new ATOM 0 HB3 LEU A 59 -24.586 -7.438 2.228 1.00 0.63 H new ATOM 0 HG LEU A 59 -24.426 -10.396 1.475 1.00 0.71 H new ATOM 0 HD11 LEU A 59 -23.360 -10.608 3.726 1.00 1.03 H new ATOM 0 HD12 LEU A 59 -22.419 -9.524 2.673 1.00 1.03 H new ATOM 0 HD13 LEU A 59 -23.472 -8.844 3.937 1.00 1.03 H new ATOM 0 HD21 LEU A 59 -25.821 -10.756 3.491 1.00 1.16 H new ATOM 0 HD22 LEU A 59 -25.935 -8.996 3.725 1.00 1.16 H new ATOM 0 HD23 LEU A 59 -26.670 -9.752 2.292 1.00 1.16 H new ATOM 981 N THR A 60 -25.239 -9.280 -1.618 1.00 0.39 N ATOM 982 CA THR A 60 -25.270 -10.473 -2.520 1.00 0.41 C ATOM 983 C THR A 60 -23.919 -11.181 -2.421 1.00 0.46 C ATOM 984 O THR A 60 -22.987 -10.648 -1.853 1.00 0.43 O ATOM 985 CB THR A 60 -25.514 -10.047 -3.973 1.00 0.40 C ATOM 986 OG1 THR A 60 -24.974 -11.027 -4.848 1.00 1.12 O ATOM 987 CG2 THR A 60 -24.844 -8.704 -4.241 1.00 1.04 C ATOM 0 H THR A 60 -24.798 -8.450 -2.014 1.00 0.39 H new ATOM 0 HA THR A 60 -26.079 -11.137 -2.216 1.00 0.41 H new ATOM 0 HB THR A 60 -26.586 -9.952 -4.143 1.00 0.40 H new ATOM 0 HG1 THR A 60 -25.130 -10.758 -5.777 1.00 1.12 H new ATOM 0 HG21 THR A 60 -25.022 -8.409 -5.275 1.00 1.04 H new ATOM 0 HG22 THR A 60 -25.259 -7.950 -3.572 1.00 1.04 H new ATOM 0 HG23 THR A 60 -23.771 -8.792 -4.068 1.00 1.04 H new ATOM 995 N LYS A 61 -23.807 -12.372 -2.958 1.00 0.54 N ATOM 996 CA LYS A 61 -22.505 -13.109 -2.890 1.00 0.61 C ATOM 997 C LYS A 61 -21.355 -12.144 -3.222 1.00 0.57 C ATOM 998 O LYS A 61 -20.316 -12.144 -2.593 1.00 0.56 O ATOM 999 CB LYS A 61 -22.505 -14.278 -3.889 1.00 0.70 C ATOM 1000 CG LYS A 61 -23.233 -13.893 -5.185 1.00 1.39 C ATOM 1001 CD LYS A 61 -24.638 -14.499 -5.183 1.00 0.99 C ATOM 1002 CE LYS A 61 -25.472 -13.856 -6.294 1.00 1.84 C ATOM 1003 NZ LYS A 61 -26.597 -14.763 -6.658 1.00 2.26 N ATOM 0 H LYS A 61 -24.559 -12.865 -3.440 1.00 0.54 H new ATOM 0 HA LYS A 61 -22.371 -13.506 -1.884 1.00 0.61 H new ATOM 0 HB2 LYS A 61 -21.479 -14.567 -4.116 1.00 0.70 H new ATOM 0 HB3 LYS A 61 -22.989 -15.145 -3.440 1.00 0.70 H new ATOM 0 HG2 LYS A 61 -23.294 -12.808 -5.271 1.00 1.39 H new ATOM 0 HG3 LYS A 61 -22.673 -14.251 -6.049 1.00 1.39 H new ATOM 0 HD2 LYS A 61 -24.581 -15.577 -5.334 1.00 0.99 H new ATOM 0 HD3 LYS A 61 -25.114 -14.337 -4.216 1.00 0.99 H new ATOM 0 HE2 LYS A 61 -25.860 -12.893 -5.961 1.00 1.84 H new ATOM 0 HE3 LYS A 61 -24.848 -13.664 -7.167 1.00 1.84 H new ATOM 0 HZ1 LYS A 61 -27.164 -14.327 -7.413 1.00 2.26 H new ATOM 0 HZ2 LYS A 61 -26.216 -15.671 -6.992 1.00 2.26 H new ATOM 0 HZ3 LYS A 61 -27.197 -14.924 -5.824 1.00 2.26 H new ATOM 1017 N LYS A 62 -21.548 -11.331 -4.218 1.00 0.57 N ATOM 1018 CA LYS A 62 -20.494 -10.356 -4.622 1.00 0.56 C ATOM 1019 C LYS A 62 -20.216 -9.361 -3.485 1.00 0.50 C ATOM 1020 O LYS A 62 -19.087 -8.980 -3.246 1.00 0.58 O ATOM 1021 CB LYS A 62 -20.959 -9.589 -5.863 1.00 0.59 C ATOM 1022 CG LYS A 62 -20.524 -10.337 -7.127 1.00 0.78 C ATOM 1023 CD LYS A 62 -21.142 -11.738 -7.132 1.00 1.25 C ATOM 1024 CE LYS A 62 -20.862 -12.418 -8.474 1.00 1.29 C ATOM 1025 NZ LYS A 62 -19.693 -11.766 -9.130 1.00 2.14 N ATOM 0 H LYS A 62 -22.400 -11.298 -4.778 1.00 0.57 H new ATOM 0 HA LYS A 62 -19.578 -10.903 -4.844 1.00 0.56 H new ATOM 0 HB2 LYS A 62 -22.043 -9.479 -5.849 1.00 0.59 H new ATOM 0 HB3 LYS A 62 -20.537 -8.584 -5.860 1.00 0.59 H new ATOM 0 HG2 LYS A 62 -20.838 -9.787 -8.014 1.00 0.78 H new ATOM 0 HG3 LYS A 62 -19.437 -10.408 -7.164 1.00 0.78 H new ATOM 0 HD2 LYS A 62 -20.727 -12.332 -6.318 1.00 1.25 H new ATOM 0 HD3 LYS A 62 -22.217 -11.673 -6.963 1.00 1.25 H new ATOM 0 HE2 LYS A 62 -20.661 -13.478 -8.321 1.00 1.29 H new ATOM 0 HE3 LYS A 62 -21.739 -12.349 -9.118 1.00 1.29 H new ATOM 0 HZ1 LYS A 62 -19.387 -12.338 -9.943 1.00 2.14 H new ATOM 0 HZ2 LYS A 62 -19.963 -10.817 -9.457 1.00 2.14 H new ATOM 0 HZ3 LYS A 62 -18.911 -11.688 -8.448 1.00 2.14 H new ATOM 1039 N GLY A 63 -21.238 -8.912 -2.804 1.00 0.43 N ATOM 1040 CA GLY A 63 -21.030 -7.914 -1.712 1.00 0.38 C ATOM 1041 C GLY A 63 -20.237 -8.511 -0.544 1.00 0.40 C ATOM 1042 O GLY A 63 -19.338 -7.885 -0.019 1.00 0.39 O ATOM 0 H GLY A 63 -22.207 -9.193 -2.956 1.00 0.43 H new ATOM 0 HA2 GLY A 63 -20.500 -7.047 -2.107 1.00 0.38 H new ATOM 0 HA3 GLY A 63 -21.996 -7.560 -1.353 1.00 0.38 H new ATOM 1046 N GLU A 64 -20.548 -9.706 -0.129 1.00 0.46 N ATOM 1047 CA GLU A 64 -19.786 -10.308 1.010 1.00 0.51 C ATOM 1048 C GLU A 64 -18.327 -10.515 0.599 1.00 0.51 C ATOM 1049 O GLU A 64 -17.409 -10.126 1.298 1.00 0.50 O ATOM 1050 CB GLU A 64 -20.398 -11.648 1.420 1.00 0.60 C ATOM 1051 CG GLU A 64 -21.616 -11.932 0.555 1.00 0.65 C ATOM 1052 CD GLU A 64 -22.256 -13.254 0.983 1.00 0.80 C ATOM 1053 OE1 GLU A 64 -21.552 -14.075 1.548 1.00 1.25 O ATOM 1054 OE2 GLU A 64 -23.439 -13.423 0.738 1.00 1.40 O ATOM 0 H GLU A 64 -21.287 -10.290 -0.521 1.00 0.46 H new ATOM 0 HA GLU A 64 -19.836 -9.628 1.860 1.00 0.51 H new ATOM 0 HB2 GLU A 64 -19.664 -12.446 1.307 1.00 0.60 H new ATOM 0 HB3 GLU A 64 -20.683 -11.624 2.472 1.00 0.60 H new ATOM 0 HG2 GLU A 64 -22.338 -11.120 0.649 1.00 0.65 H new ATOM 0 HG3 GLU A 64 -21.325 -11.981 -0.494 1.00 0.65 H new ATOM 1061 N GLU A 65 -18.108 -11.128 -0.532 1.00 0.55 N ATOM 1062 CA GLU A 65 -16.711 -11.366 -0.991 1.00 0.58 C ATOM 1063 C GLU A 65 -15.983 -10.026 -1.091 1.00 0.52 C ATOM 1064 O GLU A 65 -14.788 -9.939 -0.893 1.00 0.53 O ATOM 1065 CB GLU A 65 -16.731 -12.040 -2.365 1.00 0.64 C ATOM 1066 CG GLU A 65 -17.193 -13.491 -2.216 1.00 0.72 C ATOM 1067 CD GLU A 65 -17.208 -14.166 -3.589 1.00 1.15 C ATOM 1068 OE1 GLU A 65 -16.387 -13.802 -4.415 1.00 1.82 O ATOM 1069 OE2 GLU A 65 -18.041 -15.034 -3.791 1.00 1.69 O ATOM 0 H GLU A 65 -18.836 -11.474 -1.157 1.00 0.55 H new ATOM 0 HA GLU A 65 -16.196 -12.013 -0.280 1.00 0.58 H new ATOM 0 HB2 GLU A 65 -17.400 -11.501 -3.036 1.00 0.64 H new ATOM 0 HB3 GLU A 65 -15.737 -12.008 -2.812 1.00 0.64 H new ATOM 0 HG2 GLU A 65 -16.526 -14.029 -1.542 1.00 0.72 H new ATOM 0 HG3 GLU A 65 -18.188 -13.523 -1.772 1.00 0.72 H new ATOM 1076 N LEU A 66 -16.699 -8.979 -1.393 1.00 0.50 N ATOM 1077 CA LEU A 66 -16.055 -7.643 -1.503 1.00 0.48 C ATOM 1078 C LEU A 66 -15.732 -7.122 -0.101 1.00 0.44 C ATOM 1079 O LEU A 66 -14.679 -6.564 0.134 1.00 0.45 O ATOM 1080 CB LEU A 66 -17.017 -6.681 -2.218 1.00 0.46 C ATOM 1081 CG LEU A 66 -16.492 -5.244 -2.169 1.00 0.62 C ATOM 1082 CD1 LEU A 66 -15.064 -5.197 -2.710 1.00 0.77 C ATOM 1083 CD2 LEU A 66 -17.389 -4.358 -3.033 1.00 1.54 C ATOM 0 H LEU A 66 -17.704 -8.992 -1.568 1.00 0.50 H new ATOM 0 HA LEU A 66 -15.130 -7.717 -2.075 1.00 0.48 H new ATOM 0 HB2 LEU A 66 -17.143 -6.991 -3.255 1.00 0.46 H new ATOM 0 HB3 LEU A 66 -18.000 -6.729 -1.750 1.00 0.46 H new ATOM 0 HG LEU A 66 -16.497 -4.888 -1.139 1.00 0.62 H new ATOM 0 HD11 LEU A 66 -14.695 -4.172 -2.673 1.00 0.77 H new ATOM 0 HD12 LEU A 66 -14.423 -5.836 -2.102 1.00 0.77 H new ATOM 0 HD13 LEU A 66 -15.054 -5.549 -3.741 1.00 0.77 H new ATOM 0 HD21 LEU A 66 -17.023 -3.332 -3.004 1.00 1.54 H new ATOM 0 HD22 LEU A 66 -17.376 -4.720 -4.061 1.00 1.54 H new ATOM 0 HD23 LEU A 66 -18.409 -4.390 -2.650 1.00 1.54 H new ATOM 1095 N LEU A 67 -16.624 -7.303 0.835 1.00 0.43 N ATOM 1096 CA LEU A 67 -16.361 -6.825 2.220 1.00 0.43 C ATOM 1097 C LEU A 67 -15.038 -7.403 2.714 1.00 0.46 C ATOM 1098 O LEU A 67 -14.232 -6.715 3.309 1.00 0.48 O ATOM 1099 CB LEU A 67 -17.499 -7.283 3.138 1.00 0.46 C ATOM 1100 CG LEU A 67 -17.648 -6.307 4.315 1.00 0.61 C ATOM 1101 CD1 LEU A 67 -18.560 -5.137 3.924 1.00 0.89 C ATOM 1102 CD2 LEU A 67 -18.264 -7.039 5.511 1.00 1.39 C ATOM 0 H LEU A 67 -17.525 -7.762 0.699 1.00 0.43 H new ATOM 0 HA LEU A 67 -16.304 -5.737 2.228 1.00 0.43 H new ATOM 0 HB2 LEU A 67 -18.432 -7.334 2.577 1.00 0.46 H new ATOM 0 HB3 LEU A 67 -17.295 -8.287 3.511 1.00 0.46 H new ATOM 0 HG LEU A 67 -16.662 -5.923 4.578 1.00 0.61 H new ATOM 0 HD11 LEU A 67 -18.657 -4.453 4.767 1.00 0.89 H new ATOM 0 HD12 LEU A 67 -18.128 -4.607 3.075 1.00 0.89 H new ATOM 0 HD13 LEU A 67 -19.544 -5.518 3.651 1.00 0.89 H new ATOM 0 HD21 LEU A 67 -18.370 -6.347 6.346 1.00 1.39 H new ATOM 0 HD22 LEU A 67 -19.245 -7.427 5.235 1.00 1.39 H new ATOM 0 HD23 LEU A 67 -17.617 -7.865 5.805 1.00 1.39 H new ATOM 1114 N GLU A 68 -14.804 -8.663 2.471 1.00 0.50 N ATOM 1115 CA GLU A 68 -13.527 -9.278 2.926 1.00 0.55 C ATOM 1116 C GLU A 68 -12.372 -8.678 2.127 1.00 0.52 C ATOM 1117 O GLU A 68 -11.343 -8.328 2.669 1.00 0.52 O ATOM 1118 CB GLU A 68 -13.577 -10.790 2.698 1.00 0.62 C ATOM 1119 CG GLU A 68 -13.970 -11.490 4.001 1.00 1.34 C ATOM 1120 CD GLU A 68 -14.317 -12.951 3.710 1.00 1.80 C ATOM 1121 OE1 GLU A 68 -14.367 -13.307 2.544 1.00 2.26 O ATOM 1122 OE2 GLU A 68 -14.528 -13.690 4.658 1.00 2.26 O ATOM 0 H GLU A 68 -15.440 -9.291 1.979 1.00 0.50 H new ATOM 0 HA GLU A 68 -13.381 -9.080 3.988 1.00 0.55 H new ATOM 0 HB2 GLU A 68 -14.297 -11.027 1.914 1.00 0.62 H new ATOM 0 HB3 GLU A 68 -12.606 -11.150 2.358 1.00 0.62 H new ATOM 0 HG2 GLU A 68 -13.150 -11.435 4.717 1.00 1.34 H new ATOM 0 HG3 GLU A 68 -14.823 -10.986 4.454 1.00 1.34 H new ATOM 1129 N ASP A 69 -12.535 -8.554 0.838 1.00 0.51 N ATOM 1130 CA ASP A 69 -11.448 -7.973 0.003 1.00 0.51 C ATOM 1131 C ASP A 69 -11.072 -6.592 0.542 1.00 0.46 C ATOM 1132 O ASP A 69 -9.916 -6.306 0.784 1.00 0.48 O ATOM 1133 CB ASP A 69 -11.925 -7.839 -1.444 1.00 0.53 C ATOM 1134 CG ASP A 69 -12.496 -9.176 -1.920 1.00 0.62 C ATOM 1135 OD1 ASP A 69 -12.213 -10.179 -1.285 1.00 1.34 O ATOM 1136 OD2 ASP A 69 -13.206 -9.175 -2.912 1.00 1.13 O ATOM 0 H ASP A 69 -13.374 -8.830 0.328 1.00 0.51 H new ATOM 0 HA ASP A 69 -10.578 -8.629 0.039 1.00 0.51 H new ATOM 0 HB2 ASP A 69 -12.685 -7.061 -1.517 1.00 0.53 H new ATOM 0 HB3 ASP A 69 -11.096 -7.537 -2.085 1.00 0.53 H new ATOM 1141 N ILE A 70 -12.035 -5.731 0.734 1.00 0.43 N ATOM 1142 CA ILE A 70 -11.723 -4.370 1.257 1.00 0.43 C ATOM 1143 C ILE A 70 -11.026 -4.490 2.613 1.00 0.42 C ATOM 1144 O ILE A 70 -10.112 -3.751 2.920 1.00 0.43 O ATOM 1145 CB ILE A 70 -13.024 -3.576 1.417 1.00 0.48 C ATOM 1146 CG1 ILE A 70 -13.403 -2.953 0.066 1.00 0.89 C ATOM 1147 CG2 ILE A 70 -12.825 -2.468 2.458 1.00 0.78 C ATOM 1148 CD1 ILE A 70 -14.818 -2.363 0.127 1.00 1.29 C ATOM 0 H ILE A 70 -13.022 -5.911 0.552 1.00 0.43 H new ATOM 0 HA ILE A 70 -11.065 -3.853 0.558 1.00 0.43 H new ATOM 0 HB ILE A 70 -13.821 -4.241 1.750 1.00 0.48 H new ATOM 0 HG12 ILE A 70 -12.688 -2.173 -0.195 1.00 0.89 H new ATOM 0 HG13 ILE A 70 -13.351 -3.709 -0.718 1.00 0.89 H new ATOM 0 HG21 ILE A 70 -13.751 -1.904 2.571 1.00 0.78 H new ATOM 0 HG22 ILE A 70 -12.552 -2.913 3.415 1.00 0.78 H new ATOM 0 HG23 ILE A 70 -12.030 -1.798 2.129 1.00 0.78 H new ATOM 0 HD11 ILE A 70 -15.072 -1.925 -0.838 1.00 1.29 H new ATOM 0 HD12 ILE A 70 -15.531 -3.152 0.366 1.00 1.29 H new ATOM 0 HD13 ILE A 70 -14.858 -1.592 0.897 1.00 1.29 H new ATOM 1160 N ARG A 71 -11.445 -5.416 3.428 1.00 0.43 N ATOM 1161 CA ARG A 71 -10.802 -5.580 4.759 1.00 0.47 C ATOM 1162 C ARG A 71 -9.301 -5.817 4.580 1.00 0.48 C ATOM 1163 O ARG A 71 -8.481 -5.041 5.026 1.00 0.51 O ATOM 1164 CB ARG A 71 -11.426 -6.776 5.480 1.00 0.51 C ATOM 1165 CG ARG A 71 -11.789 -6.377 6.912 1.00 0.81 C ATOM 1166 CD ARG A 71 -12.388 -7.581 7.641 1.00 1.02 C ATOM 1167 NE ARG A 71 -11.420 -8.076 8.660 1.00 1.58 N ATOM 1168 CZ ARG A 71 -11.312 -7.467 9.809 1.00 2.24 C ATOM 1169 NH1 ARG A 71 -12.053 -6.424 10.067 1.00 2.68 N ATOM 1170 NH2 ARG A 71 -10.464 -7.901 10.700 1.00 3.04 N ATOM 0 H ARG A 71 -12.205 -6.066 3.229 1.00 0.43 H new ATOM 0 HA ARG A 71 -10.956 -4.677 5.350 1.00 0.47 H new ATOM 0 HB2 ARG A 71 -12.316 -7.111 4.948 1.00 0.51 H new ATOM 0 HB3 ARG A 71 -10.727 -7.613 5.490 1.00 0.51 H new ATOM 0 HG2 ARG A 71 -10.902 -6.024 7.438 1.00 0.81 H new ATOM 0 HG3 ARG A 71 -12.502 -5.553 6.901 1.00 0.81 H new ATOM 0 HD2 ARG A 71 -13.326 -7.300 8.121 1.00 1.02 H new ATOM 0 HD3 ARG A 71 -12.619 -8.373 6.929 1.00 1.02 H new ATOM 0 HE ARG A 71 -10.841 -8.892 8.459 1.00 1.58 H new ATOM 0 HH11 ARG A 71 -12.717 -6.085 9.370 1.00 2.68 H new ATOM 0 HH12 ARG A 71 -11.969 -5.948 10.965 1.00 2.68 H new ATOM 0 HH21 ARG A 71 -9.885 -8.716 10.499 1.00 3.04 H new ATOM 0 HH22 ARG A 71 -10.380 -7.425 11.598 1.00 3.04 H new ATOM 1184 N LYS A 72 -8.942 -6.894 3.935 1.00 0.49 N ATOM 1185 CA LYS A 72 -7.498 -7.209 3.727 1.00 0.52 C ATOM 1186 C LYS A 72 -6.748 -5.975 3.213 1.00 0.49 C ATOM 1187 O LYS A 72 -5.806 -5.514 3.826 1.00 0.50 O ATOM 1188 CB LYS A 72 -7.376 -8.339 2.704 1.00 0.57 C ATOM 1189 CG LYS A 72 -8.268 -9.509 3.123 1.00 0.69 C ATOM 1190 CD LYS A 72 -7.638 -10.824 2.658 1.00 0.93 C ATOM 1191 CE LYS A 72 -8.551 -11.992 3.034 1.00 1.44 C ATOM 1192 NZ LYS A 72 -8.818 -12.822 1.825 1.00 1.87 N ATOM 0 H LYS A 72 -9.591 -7.574 3.540 1.00 0.49 H new ATOM 0 HA LYS A 72 -7.060 -7.514 4.678 1.00 0.52 H new ATOM 0 HB2 LYS A 72 -7.667 -7.982 1.716 1.00 0.57 H new ATOM 0 HB3 LYS A 72 -6.339 -8.667 2.631 1.00 0.57 H new ATOM 0 HG2 LYS A 72 -8.392 -9.516 4.206 1.00 0.69 H new ATOM 0 HG3 LYS A 72 -9.262 -9.396 2.689 1.00 0.69 H new ATOM 0 HD2 LYS A 72 -7.483 -10.803 1.579 1.00 0.93 H new ATOM 0 HD3 LYS A 72 -6.658 -10.952 3.118 1.00 0.93 H new ATOM 0 HE2 LYS A 72 -8.083 -12.599 3.809 1.00 1.44 H new ATOM 0 HE3 LYS A 72 -9.488 -11.617 3.445 1.00 1.44 H new ATOM 0 HZ1 LYS A 72 -9.439 -13.617 2.080 1.00 1.87 H new ATOM 0 HZ2 LYS A 72 -9.282 -12.239 1.099 1.00 1.87 H new ATOM 0 HZ3 LYS A 72 -7.920 -13.190 1.451 1.00 1.87 H new ATOM 1206 N PHE A 73 -7.153 -5.451 2.086 1.00 0.48 N ATOM 1207 CA PHE A 73 -6.466 -4.253 1.510 1.00 0.47 C ATOM 1208 C PHE A 73 -6.184 -3.227 2.611 1.00 0.46 C ATOM 1209 O PHE A 73 -5.054 -2.860 2.861 1.00 0.46 O ATOM 1210 CB PHE A 73 -7.376 -3.628 0.448 1.00 0.45 C ATOM 1211 CG PHE A 73 -7.481 -2.135 0.671 1.00 0.46 C ATOM 1212 CD1 PHE A 73 -6.365 -1.320 0.464 1.00 1.35 C ATOM 1213 CD2 PHE A 73 -8.695 -1.567 1.082 1.00 1.20 C ATOM 1214 CE1 PHE A 73 -6.456 0.062 0.668 1.00 1.34 C ATOM 1215 CE2 PHE A 73 -8.787 -0.185 1.286 1.00 1.27 C ATOM 1216 CZ PHE A 73 -7.668 0.630 1.079 1.00 0.58 C ATOM 0 H PHE A 73 -7.936 -5.803 1.535 1.00 0.48 H new ATOM 0 HA PHE A 73 -5.519 -4.555 1.062 1.00 0.47 H new ATOM 0 HB2 PHE A 73 -6.979 -3.828 -0.547 1.00 0.45 H new ATOM 0 HB3 PHE A 73 -8.366 -4.081 0.493 1.00 0.45 H new ATOM 0 HD1 PHE A 73 -5.430 -1.757 0.146 1.00 1.35 H new ATOM 0 HD2 PHE A 73 -9.559 -2.195 1.241 1.00 1.20 H new ATOM 0 HE1 PHE A 73 -5.592 0.690 0.508 1.00 1.34 H new ATOM 0 HE2 PHE A 73 -9.722 0.253 1.603 1.00 1.27 H new ATOM 0 HZ PHE A 73 -7.739 1.696 1.236 1.00 0.58 H new ATOM 1226 N ASN A 74 -7.208 -2.762 3.262 1.00 0.47 N ATOM 1227 CA ASN A 74 -7.007 -1.756 4.342 1.00 0.48 C ATOM 1228 C ASN A 74 -6.097 -2.349 5.416 1.00 0.50 C ATOM 1229 O ASN A 74 -5.304 -1.657 6.022 1.00 0.52 O ATOM 1230 CB ASN A 74 -8.358 -1.386 4.957 1.00 0.48 C ATOM 1231 CG ASN A 74 -8.143 -0.403 6.109 1.00 0.67 C ATOM 1232 OD1 ASN A 74 -9.011 -0.223 6.940 1.00 1.58 O ATOM 1233 ND2 ASN A 74 -7.014 0.247 6.195 1.00 1.06 N ATOM 0 H ASN A 74 -8.177 -3.033 3.095 1.00 0.47 H new ATOM 0 HA ASN A 74 -6.546 -0.859 3.927 1.00 0.48 H new ATOM 0 HB2 ASN A 74 -9.004 -0.940 4.201 1.00 0.48 H new ATOM 0 HB3 ASN A 74 -8.862 -2.282 5.319 1.00 0.48 H new ATOM 0 HD21 ASN A 74 -6.861 0.905 6.959 1.00 1.06 H new ATOM 0 HD22 ASN A 74 -6.285 0.097 5.498 1.00 1.06 H new ATOM 1240 N GLU A 75 -6.208 -3.623 5.662 1.00 0.51 N ATOM 1241 CA GLU A 75 -5.361 -4.258 6.695 1.00 0.55 C ATOM 1242 C GLU A 75 -3.929 -4.389 6.179 1.00 0.55 C ATOM 1243 O GLU A 75 -2.991 -4.428 6.951 1.00 0.65 O ATOM 1244 CB GLU A 75 -5.919 -5.642 7.010 1.00 0.59 C ATOM 1245 CG GLU A 75 -6.506 -5.648 8.421 1.00 0.87 C ATOM 1246 CD GLU A 75 -7.215 -6.980 8.675 1.00 1.22 C ATOM 1247 OE1 GLU A 75 -7.962 -7.405 7.810 1.00 1.77 O ATOM 1248 OE2 GLU A 75 -6.998 -7.552 9.730 1.00 1.79 O ATOM 0 H GLU A 75 -6.855 -4.252 5.186 1.00 0.51 H new ATOM 0 HA GLU A 75 -5.360 -3.645 7.596 1.00 0.55 H new ATOM 0 HB2 GLU A 75 -6.687 -5.909 6.284 1.00 0.59 H new ATOM 0 HB3 GLU A 75 -5.130 -6.390 6.930 1.00 0.59 H new ATOM 0 HG2 GLU A 75 -5.715 -5.499 9.156 1.00 0.87 H new ATOM 0 HG3 GLU A 75 -7.208 -4.822 8.537 1.00 0.87 H new ATOM 1255 N MET A 76 -3.742 -4.446 4.882 1.00 0.52 N ATOM 1256 CA MET A 76 -2.367 -4.561 4.327 1.00 0.51 C ATOM 1257 C MET A 76 -1.879 -3.167 3.941 1.00 0.51 C ATOM 1258 O MET A 76 -0.725 -2.832 4.120 1.00 0.52 O ATOM 1259 CB MET A 76 -2.395 -5.455 3.087 1.00 0.50 C ATOM 1260 CG MET A 76 -2.667 -6.901 3.509 1.00 0.52 C ATOM 1261 SD MET A 76 -1.184 -7.901 3.233 1.00 0.55 S ATOM 1262 CE MET A 76 -1.887 -9.491 3.735 1.00 0.65 C ATOM 0 H MET A 76 -4.488 -4.417 4.187 1.00 0.52 H new ATOM 0 HA MET A 76 -1.698 -4.997 5.069 1.00 0.51 H new ATOM 0 HB2 MET A 76 -3.167 -5.115 2.397 1.00 0.50 H new ATOM 0 HB3 MET A 76 -1.444 -5.392 2.558 1.00 0.50 H new ATOM 0 HG2 MET A 76 -2.952 -6.936 4.561 1.00 0.52 H new ATOM 0 HG3 MET A 76 -3.503 -7.306 2.939 1.00 0.52 H new ATOM 0 HE1 MET A 76 -1.130 -10.269 3.642 1.00 0.65 H new ATOM 0 HE2 MET A 76 -2.220 -9.431 4.771 1.00 0.65 H new ATOM 0 HE3 MET A 76 -2.735 -9.732 3.095 1.00 0.65 H new ATOM 1272 N ARG A 77 -2.755 -2.342 3.425 1.00 0.50 N ATOM 1273 CA ARG A 77 -2.344 -0.963 3.045 1.00 0.50 C ATOM 1274 C ARG A 77 -1.804 -0.241 4.278 1.00 0.51 C ATOM 1275 O ARG A 77 -0.766 0.390 4.240 1.00 0.52 O ATOM 1276 CB ARG A 77 -3.552 -0.200 2.498 1.00 0.49 C ATOM 1277 CG ARG A 77 -3.118 1.201 2.061 1.00 0.52 C ATOM 1278 CD ARG A 77 -3.830 2.248 2.921 1.00 0.54 C ATOM 1279 NE ARG A 77 -3.464 3.612 2.446 1.00 0.85 N ATOM 1280 CZ ARG A 77 -3.781 4.658 3.159 1.00 1.35 C ATOM 1281 NH1 ARG A 77 -4.420 4.510 4.287 1.00 1.85 N ATOM 1282 NH2 ARG A 77 -3.460 5.853 2.743 1.00 1.84 N ATOM 0 H ARG A 77 -3.735 -2.566 3.252 1.00 0.50 H new ATOM 0 HA ARG A 77 -1.570 -1.012 2.279 1.00 0.50 H new ATOM 0 HB2 ARG A 77 -3.983 -0.738 1.654 1.00 0.49 H new ATOM 0 HB3 ARG A 77 -4.327 -0.130 3.261 1.00 0.49 H new ATOM 0 HG2 ARG A 77 -2.038 1.306 2.161 1.00 0.52 H new ATOM 0 HG3 ARG A 77 -3.357 1.356 1.009 1.00 0.52 H new ATOM 0 HD2 ARG A 77 -4.910 2.109 2.863 1.00 0.54 H new ATOM 0 HD3 ARG A 77 -3.548 2.128 3.967 1.00 0.54 H new ATOM 0 HE ARG A 77 -2.966 3.728 1.564 1.00 0.85 H new ATOM 0 HH11 ARG A 77 -4.672 3.576 4.612 1.00 1.85 H new ATOM 0 HH12 ARG A 77 -4.668 5.328 4.844 1.00 1.85 H new ATOM 0 HH21 ARG A 77 -2.961 5.969 1.861 1.00 1.84 H new ATOM 0 HH22 ARG A 77 -3.708 6.671 3.300 1.00 1.84 H new ATOM 1296 N LYS A 78 -2.494 -0.349 5.381 1.00 0.51 N ATOM 1297 CA LYS A 78 -2.014 0.310 6.624 1.00 0.52 C ATOM 1298 C LYS A 78 -0.665 -0.303 6.986 1.00 0.53 C ATOM 1299 O LYS A 78 0.243 0.373 7.427 1.00 0.55 O ATOM 1300 CB LYS A 78 -3.021 0.074 7.756 1.00 0.52 C ATOM 1301 CG LYS A 78 -2.311 0.178 9.111 1.00 0.90 C ATOM 1302 CD LYS A 78 -3.331 0.481 10.219 1.00 1.04 C ATOM 1303 CE LYS A 78 -3.898 1.902 10.067 1.00 1.45 C ATOM 1304 NZ LYS A 78 -3.789 2.619 11.369 1.00 2.15 N ATOM 0 H LYS A 78 -3.369 -0.865 5.473 1.00 0.51 H new ATOM 0 HA LYS A 78 -1.912 1.385 6.474 1.00 0.52 H new ATOM 0 HB2 LYS A 78 -3.825 0.808 7.699 1.00 0.52 H new ATOM 0 HB3 LYS A 78 -3.479 -0.909 7.649 1.00 0.52 H new ATOM 0 HG2 LYS A 78 -1.790 -0.754 9.330 1.00 0.90 H new ATOM 0 HG3 LYS A 78 -1.556 0.964 9.076 1.00 0.90 H new ATOM 0 HD2 LYS A 78 -4.143 -0.245 10.180 1.00 1.04 H new ATOM 0 HD3 LYS A 78 -2.856 0.377 11.195 1.00 1.04 H new ATOM 0 HE2 LYS A 78 -3.352 2.443 9.294 1.00 1.45 H new ATOM 0 HE3 LYS A 78 -4.940 1.858 9.749 1.00 1.45 H new ATOM 0 HZ1 LYS A 78 -4.172 3.581 11.269 1.00 2.15 H new ATOM 0 HZ2 LYS A 78 -4.329 2.105 12.094 1.00 2.15 H new ATOM 0 HZ3 LYS A 78 -2.790 2.672 11.654 1.00 2.15 H new ATOM 1318 N ASN A 79 -0.523 -1.580 6.770 1.00 0.52 N ATOM 1319 CA ASN A 79 0.777 -2.241 7.066 1.00 0.53 C ATOM 1320 C ASN A 79 1.836 -1.632 6.151 1.00 0.54 C ATOM 1321 O ASN A 79 2.908 -1.255 6.580 1.00 0.54 O ATOM 1322 CB ASN A 79 0.670 -3.743 6.797 1.00 0.54 C ATOM 1323 CG ASN A 79 1.338 -4.517 7.934 1.00 0.60 C ATOM 1324 OD1 ASN A 79 0.867 -5.564 8.331 1.00 1.17 O ATOM 1325 ND2 ASN A 79 2.425 -4.044 8.479 1.00 1.14 N ATOM 0 H ASN A 79 -1.250 -2.194 6.402 1.00 0.52 H new ATOM 0 HA ASN A 79 1.045 -2.092 8.112 1.00 0.53 H new ATOM 0 HB2 ASN A 79 -0.377 -4.034 6.712 1.00 0.54 H new ATOM 0 HB3 ASN A 79 1.147 -3.988 5.848 1.00 0.54 H new ATOM 0 HD21 ASN A 79 2.878 -4.553 9.238 1.00 1.14 H new ATOM 0 HD22 ASN A 79 2.821 -3.165 8.146 1.00 1.14 H new ATOM 1332 N MET A 80 1.533 -1.527 4.885 1.00 0.56 N ATOM 1333 CA MET A 80 2.505 -0.939 3.927 1.00 0.58 C ATOM 1334 C MET A 80 2.935 0.443 4.429 1.00 0.57 C ATOM 1335 O MET A 80 4.105 0.688 4.649 1.00 0.56 O ATOM 1336 CB MET A 80 1.848 -0.829 2.543 1.00 0.60 C ATOM 1337 CG MET A 80 2.595 0.186 1.669 1.00 0.64 C ATOM 1338 SD MET A 80 1.884 1.834 1.908 1.00 1.38 S ATOM 1339 CE MET A 80 3.012 2.729 0.812 1.00 1.16 C ATOM 0 H MET A 80 0.649 -1.826 4.474 1.00 0.56 H new ATOM 0 HA MET A 80 3.387 -1.575 3.849 1.00 0.58 H new ATOM 0 HB2 MET A 80 1.847 -1.804 2.057 1.00 0.60 H new ATOM 0 HB3 MET A 80 0.807 -0.526 2.652 1.00 0.60 H new ATOM 0 HG2 MET A 80 3.654 0.195 1.928 1.00 0.64 H new ATOM 0 HG3 MET A 80 2.526 -0.102 0.620 1.00 0.64 H new ATOM 0 HE1 MET A 80 2.751 3.787 0.807 1.00 1.16 H new ATOM 0 HE2 MET A 80 4.036 2.609 1.167 1.00 1.16 H new ATOM 0 HE3 MET A 80 2.930 2.330 -0.199 1.00 1.16 H new ATOM 1349 N ASP A 81 2.015 1.353 4.618 1.00 0.58 N ATOM 1350 CA ASP A 81 2.395 2.708 5.109 1.00 0.58 C ATOM 1351 C ASP A 81 3.148 2.593 6.431 1.00 0.56 C ATOM 1352 O ASP A 81 4.136 3.264 6.655 1.00 0.56 O ATOM 1353 CB ASP A 81 1.126 3.534 5.324 1.00 0.59 C ATOM 1354 CG ASP A 81 1.334 4.948 4.778 1.00 0.61 C ATOM 1355 OD1 ASP A 81 2.373 5.523 5.059 1.00 1.12 O ATOM 1356 OD2 ASP A 81 0.451 5.431 4.089 1.00 1.22 O ATOM 0 H ASP A 81 1.018 1.215 4.453 1.00 0.58 H new ATOM 0 HA ASP A 81 3.037 3.191 4.373 1.00 0.58 H new ATOM 0 HB2 ASP A 81 0.282 3.060 4.822 1.00 0.59 H new ATOM 0 HB3 ASP A 81 0.883 3.576 6.386 1.00 0.59 H new ATOM 1361 N GLN A 82 2.701 1.735 7.302 1.00 0.56 N ATOM 1362 CA GLN A 82 3.392 1.552 8.599 1.00 0.54 C ATOM 1363 C GLN A 82 4.806 1.049 8.310 1.00 0.53 C ATOM 1364 O GLN A 82 5.793 1.576 8.790 1.00 0.55 O ATOM 1365 CB GLN A 82 2.602 0.512 9.385 1.00 0.55 C ATOM 1366 CG GLN A 82 3.122 0.418 10.809 1.00 1.12 C ATOM 1367 CD GLN A 82 2.365 1.408 11.694 1.00 0.77 C ATOM 1368 OE1 GLN A 82 2.310 2.586 11.398 1.00 1.13 O ATOM 1369 NE2 GLN A 82 1.770 0.977 12.773 1.00 1.43 N ATOM 0 H GLN A 82 1.878 1.148 7.166 1.00 0.56 H new ATOM 0 HA GLN A 82 3.454 2.477 9.172 1.00 0.54 H new ATOM 0 HB2 GLN A 82 1.545 0.779 9.394 1.00 0.55 H new ATOM 0 HB3 GLN A 82 2.681 -0.459 8.897 1.00 0.55 H new ATOM 0 HG2 GLN A 82 2.995 -0.596 11.188 1.00 1.12 H new ATOM 0 HG3 GLN A 82 4.190 0.635 10.833 1.00 1.12 H new ATOM 0 HE21 GLN A 82 1.816 -0.011 13.021 1.00 1.43 H new ATOM 0 HE22 GLN A 82 1.259 1.629 13.368 1.00 1.43 H new ATOM 1378 N LEU A 83 4.892 0.041 7.495 1.00 0.51 N ATOM 1379 CA LEU A 83 6.221 -0.507 7.123 1.00 0.51 C ATOM 1380 C LEU A 83 6.983 0.583 6.365 1.00 0.52 C ATOM 1381 O LEU A 83 8.141 0.841 6.625 1.00 0.53 O ATOM 1382 CB LEU A 83 6.039 -1.741 6.235 1.00 0.49 C ATOM 1383 CG LEU A 83 5.436 -2.892 7.062 1.00 0.47 C ATOM 1384 CD1 LEU A 83 4.940 -3.988 6.120 1.00 0.52 C ATOM 1385 CD2 LEU A 83 6.476 -3.491 8.028 1.00 0.48 C ATOM 0 H LEU A 83 4.095 -0.430 7.068 1.00 0.51 H new ATOM 0 HA LEU A 83 6.777 -0.804 8.012 1.00 0.51 H new ATOM 0 HB2 LEU A 83 5.386 -1.503 5.395 1.00 0.49 H new ATOM 0 HB3 LEU A 83 6.999 -2.045 5.817 1.00 0.49 H new ATOM 0 HG LEU A 83 4.609 -2.492 7.649 1.00 0.47 H new ATOM 0 HD11 LEU A 83 4.513 -4.804 6.704 1.00 0.52 H new ATOM 0 HD12 LEU A 83 4.178 -3.580 5.456 1.00 0.52 H new ATOM 0 HD13 LEU A 83 5.774 -4.364 5.528 1.00 0.52 H new ATOM 0 HD21 LEU A 83 6.020 -4.301 8.597 1.00 0.48 H new ATOM 0 HD22 LEU A 83 7.321 -3.879 7.458 1.00 0.48 H new ATOM 0 HD23 LEU A 83 6.824 -2.718 8.713 1.00 0.48 H new ATOM 1397 N LYS A 84 6.328 1.243 5.446 1.00 0.53 N ATOM 1398 CA LYS A 84 6.999 2.337 4.688 1.00 0.56 C ATOM 1399 C LYS A 84 7.649 3.306 5.679 1.00 0.56 C ATOM 1400 O LYS A 84 8.806 3.664 5.555 1.00 0.57 O ATOM 1401 CB LYS A 84 5.958 3.087 3.852 1.00 0.57 C ATOM 1402 CG LYS A 84 6.667 4.025 2.870 1.00 0.58 C ATOM 1403 CD LYS A 84 5.882 5.336 2.752 1.00 0.75 C ATOM 1404 CE LYS A 84 6.586 6.274 1.767 1.00 0.77 C ATOM 1405 NZ LYS A 84 7.482 7.199 2.517 1.00 1.42 N ATOM 0 H LYS A 84 5.356 1.070 5.188 1.00 0.53 H new ATOM 0 HA LYS A 84 7.760 1.918 4.030 1.00 0.56 H new ATOM 0 HB2 LYS A 84 5.334 2.378 3.308 1.00 0.57 H new ATOM 0 HB3 LYS A 84 5.297 3.658 4.503 1.00 0.57 H new ATOM 0 HG2 LYS A 84 7.682 4.227 3.213 1.00 0.58 H new ATOM 0 HG3 LYS A 84 6.749 3.550 1.893 1.00 0.58 H new ATOM 0 HD2 LYS A 84 4.866 5.133 2.413 1.00 0.75 H new ATOM 0 HD3 LYS A 84 5.803 5.813 3.729 1.00 0.75 H new ATOM 0 HE2 LYS A 84 7.164 5.695 1.047 1.00 0.77 H new ATOM 0 HE3 LYS A 84 5.849 6.844 1.201 1.00 0.77 H new ATOM 0 HZ1 LYS A 84 8.236 7.539 1.887 1.00 1.42 H new ATOM 0 HZ2 LYS A 84 6.931 8.009 2.866 1.00 1.42 H new ATOM 0 HZ3 LYS A 84 7.905 6.695 3.323 1.00 1.42 H new ATOM 1419 N GLU A 85 6.906 3.728 6.666 1.00 0.55 N ATOM 1420 CA GLU A 85 7.463 4.669 7.677 1.00 0.55 C ATOM 1421 C GLU A 85 8.707 4.050 8.311 1.00 0.57 C ATOM 1422 O GLU A 85 9.669 4.728 8.612 1.00 0.57 O ATOM 1423 CB GLU A 85 6.416 4.925 8.764 1.00 0.55 C ATOM 1424 CG GLU A 85 7.113 5.376 10.051 1.00 0.56 C ATOM 1425 CD GLU A 85 6.111 6.111 10.943 1.00 0.56 C ATOM 1426 OE1 GLU A 85 5.431 5.447 11.708 1.00 1.18 O ATOM 1427 OE2 GLU A 85 6.039 7.324 10.844 1.00 1.12 O ATOM 0 H GLU A 85 5.933 3.460 6.815 1.00 0.55 H new ATOM 0 HA GLU A 85 7.726 5.610 7.194 1.00 0.55 H new ATOM 0 HB2 GLU A 85 5.712 5.688 8.433 1.00 0.55 H new ATOM 0 HB3 GLU A 85 5.840 4.019 8.949 1.00 0.55 H new ATOM 0 HG2 GLU A 85 7.521 4.513 10.578 1.00 0.56 H new ATOM 0 HG3 GLU A 85 7.952 6.030 9.813 1.00 0.56 H new ATOM 1434 N LYS A 86 8.698 2.763 8.506 1.00 0.58 N ATOM 1435 CA LYS A 86 9.884 2.096 9.109 1.00 0.61 C ATOM 1436 C LYS A 86 11.081 2.272 8.175 1.00 0.62 C ATOM 1437 O LYS A 86 12.209 2.412 8.608 1.00 0.63 O ATOM 1438 CB LYS A 86 9.595 0.605 9.293 1.00 0.62 C ATOM 1439 CG LYS A 86 9.673 0.248 10.779 1.00 0.65 C ATOM 1440 CD LYS A 86 9.240 -1.206 10.978 1.00 0.83 C ATOM 1441 CE LYS A 86 9.235 -1.536 12.472 1.00 1.01 C ATOM 1442 NZ LYS A 86 7.878 -2.003 12.873 1.00 1.24 N ATOM 0 H LYS A 86 7.921 2.144 8.274 1.00 0.58 H new ATOM 0 HA LYS A 86 10.103 2.541 10.079 1.00 0.61 H new ATOM 0 HB2 LYS A 86 8.606 0.365 8.902 1.00 0.62 H new ATOM 0 HB3 LYS A 86 10.314 0.012 8.728 1.00 0.62 H new ATOM 0 HG2 LYS A 86 10.690 0.389 11.145 1.00 0.65 H new ATOM 0 HG3 LYS A 86 9.031 0.912 11.358 1.00 0.65 H new ATOM 0 HD2 LYS A 86 8.247 -1.362 10.557 1.00 0.83 H new ATOM 0 HD3 LYS A 86 9.919 -1.875 10.449 1.00 0.83 H new ATOM 0 HE2 LYS A 86 9.975 -2.307 12.688 1.00 1.01 H new ATOM 0 HE3 LYS A 86 9.514 -0.656 13.051 1.00 1.01 H new ATOM 0 HZ1 LYS A 86 7.874 -2.227 13.888 1.00 1.24 H new ATOM 0 HZ2 LYS A 86 7.182 -1.254 12.681 1.00 1.24 H new ATOM 0 HZ3 LYS A 86 7.629 -2.854 12.329 1.00 1.24 H new ATOM 1456 N ILE A 87 10.839 2.266 6.893 1.00 0.64 N ATOM 1457 CA ILE A 87 11.952 2.431 5.918 1.00 0.67 C ATOM 1458 C ILE A 87 12.548 3.830 6.050 1.00 0.65 C ATOM 1459 O ILE A 87 13.741 3.984 6.216 1.00 0.63 O ATOM 1460 CB ILE A 87 11.414 2.222 4.498 1.00 0.71 C ATOM 1461 CG1 ILE A 87 10.757 0.841 4.409 1.00 0.79 C ATOM 1462 CG2 ILE A 87 12.559 2.302 3.481 1.00 0.80 C ATOM 1463 CD1 ILE A 87 10.150 0.636 3.018 1.00 0.84 C ATOM 0 H ILE A 87 9.914 2.153 6.478 1.00 0.64 H new ATOM 0 HA ILE A 87 12.730 1.695 6.121 1.00 0.67 H new ATOM 0 HB ILE A 87 10.684 3.000 4.274 1.00 0.71 H new ATOM 0 HG12 ILE A 87 11.495 0.065 4.610 1.00 0.79 H new ATOM 0 HG13 ILE A 87 9.982 0.749 5.170 1.00 0.79 H new ATOM 0 HG21 ILE A 87 12.164 2.152 2.476 1.00 0.80 H new ATOM 0 HG22 ILE A 87 13.032 3.282 3.542 1.00 0.80 H new ATOM 0 HG23 ILE A 87 13.295 1.529 3.701 1.00 0.80 H new ATOM 0 HD11 ILE A 87 9.686 -0.349 2.965 1.00 0.84 H new ATOM 0 HD12 ILE A 87 9.398 1.403 2.833 1.00 0.84 H new ATOM 0 HD13 ILE A 87 10.934 0.708 2.265 1.00 0.84 H new ATOM 1475 N ASN A 88 11.744 4.857 5.995 1.00 0.66 N ATOM 1476 CA ASN A 88 12.304 6.227 6.136 1.00 0.65 C ATOM 1477 C ASN A 88 12.980 6.366 7.499 1.00 0.62 C ATOM 1478 O ASN A 88 13.921 7.114 7.658 1.00 0.62 O ATOM 1479 CB ASN A 88 11.181 7.259 6.022 1.00 0.69 C ATOM 1480 CG ASN A 88 10.785 7.426 4.554 1.00 1.66 C ATOM 1481 OD1 ASN A 88 11.422 6.879 3.675 1.00 2.38 O ATOM 1482 ND2 ASN A 88 9.754 8.165 4.248 1.00 2.46 N ATOM 0 H ASN A 88 10.734 4.806 5.860 1.00 0.66 H new ATOM 0 HA ASN A 88 13.035 6.397 5.346 1.00 0.65 H new ATOM 0 HB2 ASN A 88 10.319 6.940 6.608 1.00 0.69 H new ATOM 0 HB3 ASN A 88 11.508 8.214 6.432 1.00 0.69 H new ATOM 0 HD21 ASN A 88 9.483 8.283 3.272 1.00 2.46 H new ATOM 0 HD22 ASN A 88 9.219 8.624 4.985 1.00 2.46 H new ATOM 1489 N SER A 89 12.496 5.669 8.495 1.00 0.61 N ATOM 1490 CA SER A 89 13.105 5.788 9.849 1.00 0.61 C ATOM 1491 C SER A 89 14.557 5.302 9.834 1.00 0.63 C ATOM 1492 O SER A 89 15.473 6.068 10.059 1.00 0.71 O ATOM 1493 CB SER A 89 12.299 4.948 10.840 1.00 0.62 C ATOM 1494 OG SER A 89 12.678 5.295 12.166 1.00 1.29 O ATOM 0 H SER A 89 11.708 5.025 8.427 1.00 0.61 H new ATOM 0 HA SER A 89 13.092 6.836 10.149 1.00 0.61 H new ATOM 0 HB2 SER A 89 11.232 5.120 10.697 1.00 0.62 H new ATOM 0 HB3 SER A 89 12.477 3.887 10.664 1.00 0.62 H new ATOM 0 HG SER A 89 12.162 4.760 12.804 1.00 1.29 H new ATOM 1500 N VAL A 90 14.784 4.039 9.582 1.00 0.58 N ATOM 1501 CA VAL A 90 16.184 3.522 9.571 1.00 0.60 C ATOM 1502 C VAL A 90 16.954 4.129 8.401 1.00 0.59 C ATOM 1503 O VAL A 90 18.118 4.458 8.515 1.00 0.63 O ATOM 1504 CB VAL A 90 16.159 2.001 9.422 1.00 0.61 C ATOM 1505 CG1 VAL A 90 17.577 1.434 9.562 1.00 0.52 C ATOM 1506 CG2 VAL A 90 15.259 1.399 10.503 1.00 0.81 C ATOM 0 H VAL A 90 14.063 3.345 9.384 1.00 0.58 H new ATOM 0 HA VAL A 90 16.675 3.796 10.505 1.00 0.60 H new ATOM 0 HB VAL A 90 15.771 1.746 8.436 1.00 0.61 H new ATOM 0 HG11 VAL A 90 17.548 0.350 9.454 1.00 0.52 H new ATOM 0 HG12 VAL A 90 18.217 1.858 8.788 1.00 0.52 H new ATOM 0 HG13 VAL A 90 17.976 1.690 10.543 1.00 0.52 H new ATOM 0 HG21 VAL A 90 15.240 0.314 10.398 1.00 0.81 H new ATOM 0 HG22 VAL A 90 15.647 1.662 11.487 1.00 0.81 H new ATOM 0 HG23 VAL A 90 14.248 1.792 10.395 1.00 0.81 H new ATOM 1516 N LEU A 91 16.308 4.304 7.284 1.00 0.57 N ATOM 1517 CA LEU A 91 16.996 4.917 6.119 1.00 0.61 C ATOM 1518 C LEU A 91 17.074 6.422 6.352 1.00 0.67 C ATOM 1519 O LEU A 91 17.832 7.122 5.719 1.00 0.70 O ATOM 1520 CB LEU A 91 16.190 4.644 4.844 1.00 0.62 C ATOM 1521 CG LEU A 91 17.052 4.933 3.609 1.00 0.72 C ATOM 1522 CD1 LEU A 91 17.814 3.669 3.209 1.00 0.91 C ATOM 1523 CD2 LEU A 91 16.157 5.377 2.445 1.00 0.97 C ATOM 0 H LEU A 91 15.333 4.049 7.128 1.00 0.57 H new ATOM 0 HA LEU A 91 17.995 4.495 6.007 1.00 0.61 H new ATOM 0 HB2 LEU A 91 15.856 3.607 4.830 1.00 0.62 H new ATOM 0 HB3 LEU A 91 15.296 5.267 4.828 1.00 0.62 H new ATOM 0 HG LEU A 91 17.760 5.727 3.844 1.00 0.72 H new ATOM 0 HD11 LEU A 91 18.426 3.876 2.331 1.00 0.91 H new ATOM 0 HD12 LEU A 91 18.455 3.355 4.033 1.00 0.91 H new ATOM 0 HD13 LEU A 91 17.105 2.874 2.978 1.00 0.91 H new ATOM 0 HD21 LEU A 91 16.773 5.581 1.570 1.00 0.97 H new ATOM 0 HD22 LEU A 91 15.445 4.585 2.211 1.00 0.97 H new ATOM 0 HD23 LEU A 91 15.616 6.280 2.726 1.00 0.97 H new ATOM 1535 N SER A 92 16.305 6.919 7.281 1.00 0.71 N ATOM 1536 CA SER A 92 16.322 8.390 7.599 1.00 0.81 C ATOM 1537 C SER A 92 15.947 9.257 6.373 1.00 0.88 C ATOM 1538 O SER A 92 15.537 10.387 6.532 1.00 1.04 O ATOM 1539 CB SER A 92 17.712 8.797 8.082 1.00 0.85 C ATOM 1540 OG SER A 92 17.639 9.185 9.448 1.00 0.94 O ATOM 0 H SER A 92 15.656 6.369 7.844 1.00 0.71 H new ATOM 0 HA SER A 92 15.578 8.561 8.377 1.00 0.81 H new ATOM 0 HB2 SER A 92 18.408 7.967 7.964 1.00 0.85 H new ATOM 0 HB3 SER A 92 18.093 9.620 7.478 1.00 0.85 H new ATOM 0 HG SER A 92 18.530 9.445 9.762 1.00 0.94 H new ATOM 1546 N ILE A 93 16.152 8.768 5.168 1.00 0.85 N ATOM 1547 CA ILE A 93 15.881 9.555 3.919 1.00 0.92 C ATOM 1548 C ILE A 93 17.090 10.463 3.681 1.00 1.05 C ATOM 1549 O ILE A 93 17.901 10.195 2.825 1.00 1.13 O ATOM 1550 CB ILE A 93 14.584 10.400 3.977 1.00 1.02 C ATOM 1551 CG1 ILE A 93 13.418 9.611 4.609 1.00 1.07 C ATOM 1552 CG2 ILE A 93 14.193 10.761 2.540 1.00 1.16 C ATOM 1553 CD1 ILE A 93 12.087 10.240 4.181 1.00 1.65 C ATOM 0 H ILE A 93 16.507 7.827 4.996 1.00 0.85 H new ATOM 0 HA ILE A 93 15.728 8.851 3.101 1.00 0.92 H new ATOM 0 HB ILE A 93 14.771 11.284 4.586 1.00 1.02 H new ATOM 0 HG12 ILE A 93 13.458 8.568 4.295 1.00 1.07 H new ATOM 0 HG13 ILE A 93 13.505 9.620 5.696 1.00 1.07 H new ATOM 0 HG21 ILE A 93 13.281 11.358 2.550 1.00 1.16 H new ATOM 0 HG22 ILE A 93 14.996 11.334 2.077 1.00 1.16 H new ATOM 0 HG23 ILE A 93 14.023 9.848 1.969 1.00 1.16 H new ATOM 0 HD11 ILE A 93 11.262 9.684 4.626 1.00 1.65 H new ATOM 0 HD12 ILE A 93 12.050 11.276 4.517 1.00 1.65 H new ATOM 0 HD13 ILE A 93 12.002 10.208 3.095 1.00 1.65 H new ATOM 1565 N ARG A 94 17.237 11.516 4.437 1.00 1.20 N ATOM 1566 CA ARG A 94 18.427 12.400 4.242 1.00 1.42 C ATOM 1567 C ARG A 94 18.822 13.044 5.574 1.00 1.49 C ATOM 1568 O ARG A 94 19.560 14.008 5.615 1.00 1.74 O ATOM 1569 CB ARG A 94 18.161 13.490 3.181 1.00 1.79 C ATOM 1570 CG ARG A 94 16.659 13.759 2.998 1.00 2.10 C ATOM 1571 CD ARG A 94 16.062 14.370 4.268 1.00 2.55 C ATOM 1572 NE ARG A 94 15.295 15.594 3.903 1.00 3.16 N ATOM 1573 CZ ARG A 94 15.930 16.699 3.619 1.00 3.74 C ATOM 1574 NH1 ARG A 94 17.234 16.735 3.669 1.00 3.85 N ATOM 1575 NH2 ARG A 94 15.260 17.768 3.285 1.00 4.56 N ATOM 0 H ARG A 94 16.594 11.803 5.175 1.00 1.20 H new ATOM 0 HA ARG A 94 19.248 11.781 3.880 1.00 1.42 H new ATOM 0 HB2 ARG A 94 18.662 14.412 3.475 1.00 1.79 H new ATOM 0 HB3 ARG A 94 18.593 13.183 2.229 1.00 1.79 H new ATOM 0 HG2 ARG A 94 16.505 14.434 2.156 1.00 2.10 H new ATOM 0 HG3 ARG A 94 16.144 12.829 2.759 1.00 2.10 H new ATOM 0 HD2 ARG A 94 15.409 13.650 4.761 1.00 2.55 H new ATOM 0 HD3 ARG A 94 16.854 14.619 4.974 1.00 2.55 H new ATOM 0 HE ARG A 94 14.276 15.569 3.875 1.00 3.16 H new ATOM 0 HH11 ARG A 94 17.758 15.899 3.930 1.00 3.85 H new ATOM 0 HH12 ARG A 94 17.729 17.599 3.447 1.00 3.85 H new ATOM 0 HH21 ARG A 94 14.241 17.740 3.246 1.00 4.56 H new ATOM 0 HH22 ARG A 94 15.755 18.632 3.063 1.00 4.56 H new ATOM 1589 N GLN A 95 18.354 12.505 6.668 1.00 1.46 N ATOM 1590 CA GLN A 95 18.726 13.077 7.994 1.00 1.61 C ATOM 1591 C GLN A 95 18.263 14.533 8.081 1.00 2.21 C ATOM 1592 O GLN A 95 17.656 15.000 7.134 1.00 2.75 O ATOM 1593 CB GLN A 95 20.247 13.017 8.155 1.00 1.83 C ATOM 1594 CG GLN A 95 20.610 12.974 9.640 1.00 2.35 C ATOM 1595 CD GLN A 95 22.056 13.442 9.820 1.00 2.88 C ATOM 1596 OE1 GLN A 95 22.846 13.376 8.900 1.00 3.43 O ATOM 1597 NE2 GLN A 95 22.438 13.914 10.975 1.00 3.20 N ATOM 1598 OXT GLN A 95 18.527 15.157 9.096 1.00 2.78 O ATOM 0 H GLN A 95 17.733 11.697 6.701 1.00 1.46 H new ATOM 0 HA GLN A 95 18.245 12.502 8.785 1.00 1.61 H new ATOM 0 HB2 GLN A 95 20.641 12.135 7.649 1.00 1.83 H new ATOM 0 HB3 GLN A 95 20.706 13.886 7.684 1.00 1.83 H new ATOM 0 HG2 GLN A 95 19.935 13.613 10.210 1.00 2.35 H new ATOM 0 HG3 GLN A 95 20.492 11.961 10.026 1.00 2.35 H new ATOM 0 HE21 GLN A 95 21.775 13.970 11.748 1.00 3.20 H new ATOM 0 HE22 GLN A 95 23.400 14.227 11.105 1.00 3.20 H new TER 1607 GLN A 95 ATOM 1608 N ALA B 1 10.313 5.758 -16.174 1.00 5.31 N ATOM 1609 CA ALA B 1 9.545 4.995 -15.148 1.00 4.73 C ATOM 1610 C ALA B 1 10.336 4.959 -13.838 1.00 4.10 C ATOM 1611 O ALA B 1 11.501 4.613 -13.815 1.00 3.94 O ATOM 1612 CB ALA B 1 9.312 3.567 -15.644 1.00 4.76 C ATOM 0 H1 ALA B 1 9.775 5.782 -17.064 1.00 5.31 H new ATOM 0 H2 ALA B 1 10.470 6.730 -15.838 1.00 5.31 H new ATOM 0 H3 ALA B 1 11.230 5.295 -16.336 1.00 5.31 H new ATOM 0 HA ALA B 1 8.585 5.482 -14.977 1.00 4.73 H new ATOM 0 HB1 ALA B 1 8.751 3.009 -14.895 1.00 4.76 H new ATOM 0 HB2 ALA B 1 8.747 3.593 -16.576 1.00 4.76 H new ATOM 0 HB3 ALA B 1 10.272 3.080 -15.815 1.00 4.76 H new ATOM 1620 N LYS B 2 9.712 5.315 -12.747 1.00 4.19 N ATOM 1621 CA LYS B 2 10.426 5.302 -11.437 1.00 4.06 C ATOM 1622 C LYS B 2 10.513 3.860 -10.931 1.00 3.61 C ATOM 1623 O LYS B 2 9.531 3.146 -10.904 1.00 4.29 O ATOM 1624 CB LYS B 2 9.657 6.149 -10.415 1.00 4.79 C ATOM 1625 CG LYS B 2 9.830 7.647 -10.722 1.00 5.69 C ATOM 1626 CD LYS B 2 9.110 8.034 -12.028 1.00 6.62 C ATOM 1627 CE LYS B 2 10.126 8.185 -13.166 1.00 7.56 C ATOM 1628 NZ LYS B 2 10.799 9.511 -13.061 1.00 7.96 N ATOM 0 H LYS B 2 8.738 5.615 -12.706 1.00 4.19 H new ATOM 0 HA LYS B 2 11.426 5.715 -11.566 1.00 4.06 H new ATOM 0 HB2 LYS B 2 8.599 5.886 -10.438 1.00 4.79 H new ATOM 0 HB3 LYS B 2 10.018 5.933 -9.409 1.00 4.79 H new ATOM 0 HG2 LYS B 2 9.434 8.238 -9.896 1.00 5.69 H new ATOM 0 HG3 LYS B 2 10.891 7.884 -10.804 1.00 5.69 H new ATOM 0 HD2 LYS B 2 8.374 7.272 -12.286 1.00 6.62 H new ATOM 0 HD3 LYS B 2 8.566 8.968 -11.889 1.00 6.62 H new ATOM 0 HE2 LYS B 2 10.865 7.385 -13.116 1.00 7.56 H new ATOM 0 HE3 LYS B 2 9.624 8.095 -14.130 1.00 7.56 H new ATOM 0 HZ1 LYS B 2 11.488 9.613 -13.833 1.00 7.96 H new ATOM 0 HZ2 LYS B 2 10.088 10.267 -13.129 1.00 7.96 H new ATOM 0 HZ3 LYS B 2 11.291 9.579 -12.147 1.00 7.96 H new ATOM 1642 N LYS B 3 11.678 3.419 -10.529 1.00 2.84 N ATOM 1643 CA LYS B 3 11.810 2.018 -10.029 1.00 2.84 C ATOM 1644 C LYS B 3 13.259 1.765 -9.622 1.00 2.25 C ATOM 1645 O LYS B 3 13.593 0.714 -9.111 1.00 2.75 O ATOM 1646 CB LYS B 3 11.430 1.021 -11.134 1.00 3.27 C ATOM 1647 CG LYS B 3 10.359 0.057 -10.618 1.00 3.74 C ATOM 1648 CD LYS B 3 10.164 -1.072 -11.632 1.00 4.47 C ATOM 1649 CE LYS B 3 9.050 -2.003 -11.153 1.00 5.15 C ATOM 1650 NZ LYS B 3 9.274 -3.369 -11.702 1.00 5.62 N ATOM 0 H LYS B 3 12.539 3.966 -10.525 1.00 2.84 H new ATOM 0 HA LYS B 3 11.145 1.884 -9.176 1.00 2.84 H new ATOM 0 HB2 LYS B 3 11.059 1.557 -12.008 1.00 3.27 H new ATOM 0 HB3 LYS B 3 12.311 0.464 -11.452 1.00 3.27 H new ATOM 0 HG2 LYS B 3 10.657 -0.353 -9.653 1.00 3.74 H new ATOM 0 HG3 LYS B 3 9.420 0.588 -10.463 1.00 3.74 H new ATOM 0 HD2 LYS B 3 9.912 -0.658 -12.608 1.00 4.47 H new ATOM 0 HD3 LYS B 3 11.092 -1.631 -11.753 1.00 4.47 H new ATOM 0 HE2 LYS B 3 9.032 -2.036 -10.064 1.00 5.15 H new ATOM 0 HE3 LYS B 3 8.081 -1.624 -11.476 1.00 5.15 H new ATOM 0 HZ1 LYS B 3 8.516 -4.003 -11.376 1.00 5.62 H new ATOM 0 HZ2 LYS B 3 9.270 -3.330 -12.741 1.00 5.62 H new ATOM 0 HZ3 LYS B 3 10.192 -3.729 -11.372 1.00 5.62 H new ATOM 1664 N LYS B 4 14.122 2.715 -9.859 1.00 1.66 N ATOM 1665 CA LYS B 4 15.555 2.527 -9.503 1.00 1.45 C ATOM 1666 C LYS B 4 16.151 3.854 -9.033 1.00 1.21 C ATOM 1667 O LYS B 4 15.473 4.689 -8.467 1.00 1.74 O ATOM 1668 CB LYS B 4 16.312 2.036 -10.739 1.00 1.77 C ATOM 1669 CG LYS B 4 15.462 0.996 -11.477 1.00 2.27 C ATOM 1670 CD LYS B 4 16.272 0.386 -12.623 1.00 2.87 C ATOM 1671 CE LYS B 4 15.438 -0.696 -13.314 1.00 3.35 C ATOM 1672 NZ LYS B 4 15.969 -0.935 -14.686 1.00 3.94 N ATOM 0 H LYS B 4 13.895 3.614 -10.284 1.00 1.66 H new ATOM 0 HA LYS B 4 15.640 1.795 -8.700 1.00 1.45 H new ATOM 0 HB2 LYS B 4 16.535 2.874 -11.399 1.00 1.77 H new ATOM 0 HB3 LYS B 4 17.266 1.599 -10.445 1.00 1.77 H new ATOM 0 HG2 LYS B 4 15.146 0.214 -10.786 1.00 2.27 H new ATOM 0 HG3 LYS B 4 14.557 1.462 -11.867 1.00 2.27 H new ATOM 0 HD2 LYS B 4 16.550 1.160 -13.339 1.00 2.87 H new ATOM 0 HD3 LYS B 4 17.199 -0.042 -12.241 1.00 2.87 H new ATOM 0 HE2 LYS B 4 15.469 -1.619 -12.735 1.00 3.35 H new ATOM 0 HE3 LYS B 4 14.394 -0.387 -13.366 1.00 3.35 H new ATOM 0 HZ1 LYS B 4 15.402 -1.670 -15.155 1.00 3.94 H new ATOM 0 HZ2 LYS B 4 15.917 -0.054 -15.237 1.00 3.94 H new ATOM 0 HZ3 LYS B 4 16.959 -1.248 -14.625 1.00 3.94 H new ATOM 1686 N SER B 5 17.415 4.051 -9.274 1.00 1.06 N ATOM 1687 CA SER B 5 18.072 5.320 -8.856 1.00 1.29 C ATOM 1688 C SER B 5 17.703 5.667 -7.412 1.00 1.14 C ATOM 1689 O SER B 5 17.959 6.762 -6.954 1.00 1.52 O ATOM 1690 CB SER B 5 17.609 6.442 -9.771 1.00 1.71 C ATOM 1691 OG SER B 5 18.595 7.465 -9.799 1.00 2.58 O ATOM 0 H SER B 5 18.026 3.384 -9.745 1.00 1.06 H new ATOM 0 HA SER B 5 19.153 5.197 -8.923 1.00 1.29 H new ATOM 0 HB2 SER B 5 17.438 6.059 -10.777 1.00 1.71 H new ATOM 0 HB3 SER B 5 16.660 6.846 -9.418 1.00 1.71 H new ATOM 0 HG SER B 5 19.348 7.210 -9.226 1.00 2.58 H new ATOM 1697 N LYS B 6 17.112 4.757 -6.685 1.00 1.03 N ATOM 1698 CA LYS B 6 16.750 5.076 -5.274 1.00 1.04 C ATOM 1699 C LYS B 6 16.123 3.860 -4.587 1.00 0.96 C ATOM 1700 O LYS B 6 16.346 3.628 -3.416 1.00 1.02 O ATOM 1701 CB LYS B 6 15.745 6.233 -5.255 1.00 1.37 C ATOM 1702 CG LYS B 6 14.984 6.230 -3.926 1.00 2.21 C ATOM 1703 CD LYS B 6 14.398 7.620 -3.670 1.00 2.52 C ATOM 1704 CE LYS B 6 13.225 7.508 -2.694 1.00 3.33 C ATOM 1705 NZ LYS B 6 12.021 7.013 -3.419 1.00 3.75 N ATOM 0 H LYS B 6 16.867 3.819 -7.001 1.00 1.03 H new ATOM 0 HA LYS B 6 17.658 5.355 -4.739 1.00 1.04 H new ATOM 0 HB2 LYS B 6 16.265 7.182 -5.386 1.00 1.37 H new ATOM 0 HB3 LYS B 6 15.046 6.135 -6.086 1.00 1.37 H new ATOM 0 HG2 LYS B 6 14.187 5.487 -3.953 1.00 2.21 H new ATOM 0 HG3 LYS B 6 15.653 5.950 -3.112 1.00 2.21 H new ATOM 0 HD2 LYS B 6 15.164 8.279 -3.261 1.00 2.52 H new ATOM 0 HD3 LYS B 6 14.063 8.064 -4.608 1.00 2.52 H new ATOM 0 HE2 LYS B 6 13.478 6.828 -1.881 1.00 3.33 H new ATOM 0 HE3 LYS B 6 13.018 8.479 -2.244 1.00 3.33 H new ATOM 0 HZ1 LYS B 6 11.173 7.190 -2.844 1.00 3.75 H new ATOM 0 HZ2 LYS B 6 11.934 7.511 -4.328 1.00 3.75 H new ATOM 0 HZ3 LYS B 6 12.115 5.992 -3.592 1.00 3.75 H new ATOM 1719 N LEU B 7 15.316 3.108 -5.290 1.00 0.91 N ATOM 1720 CA LEU B 7 14.645 1.926 -4.659 1.00 0.98 C ATOM 1721 C LEU B 7 15.372 0.612 -4.980 1.00 0.86 C ATOM 1722 O LEU B 7 15.807 -0.100 -4.096 1.00 0.86 O ATOM 1723 CB LEU B 7 13.208 1.827 -5.182 1.00 1.15 C ATOM 1724 CG LEU B 7 12.229 1.678 -4.003 1.00 1.40 C ATOM 1725 CD1 LEU B 7 12.211 2.954 -3.148 1.00 2.06 C ATOM 1726 CD2 LEU B 7 10.814 1.416 -4.534 1.00 1.70 C ATOM 0 H LEU B 7 15.091 3.259 -6.273 1.00 0.91 H new ATOM 0 HA LEU B 7 14.663 2.072 -3.579 1.00 0.98 H new ATOM 0 HB2 LEU B 7 12.961 2.717 -5.761 1.00 1.15 H new ATOM 0 HB3 LEU B 7 13.114 0.974 -5.854 1.00 1.15 H new ATOM 0 HG LEU B 7 12.559 0.841 -3.388 1.00 1.40 H new ATOM 0 HD11 LEU B 7 11.513 2.828 -2.320 1.00 2.06 H new ATOM 0 HD12 LEU B 7 13.210 3.142 -2.755 1.00 2.06 H new ATOM 0 HD13 LEU B 7 11.897 3.799 -3.761 1.00 2.06 H new ATOM 0 HD21 LEU B 7 10.125 1.311 -3.696 1.00 1.70 H new ATOM 0 HD22 LEU B 7 10.500 2.251 -5.160 1.00 1.70 H new ATOM 0 HD23 LEU B 7 10.811 0.499 -5.124 1.00 1.70 H new ATOM 1738 N GLU B 8 15.470 0.266 -6.234 1.00 0.85 N ATOM 1739 CA GLU B 8 16.122 -1.029 -6.598 1.00 0.91 C ATOM 1740 C GLU B 8 17.643 -0.932 -6.498 1.00 0.79 C ATOM 1741 O GLU B 8 18.244 -1.549 -5.649 1.00 0.74 O ATOM 1742 CB GLU B 8 15.734 -1.402 -8.030 1.00 1.08 C ATOM 1743 CG GLU B 8 16.653 -2.515 -8.536 1.00 1.20 C ATOM 1744 CD GLU B 8 15.935 -3.309 -9.628 1.00 1.47 C ATOM 1745 OE1 GLU B 8 15.439 -2.689 -10.554 1.00 2.06 O ATOM 1746 OE2 GLU B 8 15.892 -4.523 -9.519 1.00 1.97 O ATOM 0 H GLU B 8 15.130 0.819 -7.021 1.00 0.85 H new ATOM 0 HA GLU B 8 15.781 -1.793 -5.899 1.00 0.91 H new ATOM 0 HB2 GLU B 8 14.695 -1.731 -8.062 1.00 1.08 H new ATOM 0 HB3 GLU B 8 15.812 -0.529 -8.678 1.00 1.08 H new ATOM 0 HG2 GLU B 8 17.576 -2.089 -8.928 1.00 1.20 H new ATOM 0 HG3 GLU B 8 16.930 -3.175 -7.714 1.00 1.20 H new ATOM 1753 N ILE B 9 18.249 -0.169 -7.371 1.00 0.80 N ATOM 1754 CA ILE B 9 19.745 -0.030 -7.364 1.00 0.81 C ATOM 1755 C ILE B 9 20.230 0.065 -5.907 1.00 0.71 C ATOM 1756 O ILE B 9 21.132 -0.636 -5.490 1.00 0.82 O ATOM 1757 CB ILE B 9 20.131 1.221 -8.183 1.00 0.85 C ATOM 1758 CG1 ILE B 9 20.742 0.779 -9.517 1.00 1.52 C ATOM 1759 CG2 ILE B 9 21.147 2.097 -7.441 1.00 1.50 C ATOM 1760 CD1 ILE B 9 19.753 -0.114 -10.269 1.00 1.88 C ATOM 0 H ILE B 9 17.772 0.369 -8.095 1.00 0.80 H new ATOM 0 HA ILE B 9 20.223 -0.896 -7.822 1.00 0.81 H new ATOM 0 HB ILE B 9 19.227 1.808 -8.343 1.00 0.85 H new ATOM 0 HG12 ILE B 9 20.990 1.652 -10.121 1.00 1.52 H new ATOM 0 HG13 ILE B 9 21.672 0.239 -9.340 1.00 1.52 H new ATOM 0 HG21 ILE B 9 21.392 2.966 -8.051 1.00 1.50 H new ATOM 0 HG22 ILE B 9 20.720 2.427 -6.494 1.00 1.50 H new ATOM 0 HG23 ILE B 9 22.053 1.521 -7.250 1.00 1.50 H new ATOM 0 HD11 ILE B 9 20.192 -0.426 -11.217 1.00 1.88 H new ATOM 0 HD12 ILE B 9 19.527 -0.994 -9.667 1.00 1.88 H new ATOM 0 HD13 ILE B 9 18.834 0.441 -10.460 1.00 1.88 H new ATOM 1772 N ILE B 10 19.620 0.914 -5.137 1.00 0.59 N ATOM 1773 CA ILE B 10 20.024 1.046 -3.707 1.00 0.59 C ATOM 1774 C ILE B 10 19.889 -0.320 -3.031 1.00 0.51 C ATOM 1775 O ILE B 10 20.800 -0.793 -2.381 1.00 0.54 O ATOM 1776 CB ILE B 10 19.157 2.118 -3.007 1.00 0.67 C ATOM 1777 CG1 ILE B 10 20.026 3.372 -2.813 1.00 0.85 C ATOM 1778 CG2 ILE B 10 18.642 1.626 -1.635 1.00 0.74 C ATOM 1779 CD1 ILE B 10 19.194 4.529 -2.254 1.00 1.31 C ATOM 0 H ILE B 10 18.858 1.525 -5.432 1.00 0.59 H new ATOM 0 HA ILE B 10 21.062 1.371 -3.635 1.00 0.59 H new ATOM 0 HB ILE B 10 18.285 2.334 -3.624 1.00 0.67 H new ATOM 0 HG12 ILE B 10 20.849 3.148 -2.134 1.00 0.85 H new ATOM 0 HG13 ILE B 10 20.469 3.664 -3.765 1.00 0.85 H new ATOM 0 HG21 ILE B 10 18.037 2.406 -1.173 1.00 0.74 H new ATOM 0 HG22 ILE B 10 18.036 0.731 -1.774 1.00 0.74 H new ATOM 0 HG23 ILE B 10 19.490 1.394 -0.990 1.00 0.74 H new ATOM 0 HD11 ILE B 10 19.830 5.405 -2.125 1.00 1.31 H new ATOM 0 HD12 ILE B 10 18.387 4.765 -2.948 1.00 1.31 H new ATOM 0 HD13 ILE B 10 18.772 4.242 -1.291 1.00 1.31 H new ATOM 1791 N GLN B 11 18.760 -0.958 -3.179 1.00 0.50 N ATOM 1792 CA GLN B 11 18.578 -2.292 -2.543 1.00 0.50 C ATOM 1793 C GLN B 11 19.775 -3.180 -2.889 1.00 0.52 C ATOM 1794 O GLN B 11 20.270 -3.919 -2.061 1.00 0.52 O ATOM 1795 CB GLN B 11 17.293 -2.940 -3.064 1.00 0.55 C ATOM 1796 CG GLN B 11 16.746 -3.909 -2.014 1.00 1.24 C ATOM 1797 CD GLN B 11 15.503 -4.612 -2.564 1.00 1.53 C ATOM 1798 OE1 GLN B 11 14.791 -5.272 -1.833 1.00 2.22 O ATOM 1799 NE2 GLN B 11 15.209 -4.497 -3.830 1.00 1.91 N ATOM 0 H GLN B 11 17.960 -0.615 -3.710 1.00 0.50 H new ATOM 0 HA GLN B 11 18.507 -2.175 -1.462 1.00 0.50 H new ATOM 0 HB2 GLN B 11 16.551 -2.173 -3.287 1.00 0.55 H new ATOM 0 HB3 GLN B 11 17.493 -3.471 -3.995 1.00 0.55 H new ATOM 0 HG2 GLN B 11 17.506 -4.645 -1.752 1.00 1.24 H new ATOM 0 HG3 GLN B 11 16.497 -3.369 -1.101 1.00 1.24 H new ATOM 0 HE21 GLN B 11 15.806 -3.943 -4.444 1.00 1.91 H new ATOM 0 HE22 GLN B 11 14.382 -4.961 -4.206 1.00 1.91 H new ATOM 1808 N ALA B 12 20.257 -3.102 -4.102 1.00 0.57 N ATOM 1809 CA ALA B 12 21.435 -3.928 -4.492 1.00 0.62 C ATOM 1810 C ALA B 12 22.656 -3.492 -3.677 1.00 0.57 C ATOM 1811 O ALA B 12 23.503 -4.291 -3.331 1.00 0.57 O ATOM 1812 CB ALA B 12 21.719 -3.741 -5.984 1.00 0.71 C ATOM 0 H ALA B 12 19.885 -2.502 -4.838 1.00 0.57 H new ATOM 0 HA ALA B 12 21.224 -4.979 -4.294 1.00 0.62 H new ATOM 0 HB1 ALA B 12 22.580 -4.345 -6.269 1.00 0.71 H new ATOM 0 HB2 ALA B 12 20.849 -4.054 -6.562 1.00 0.71 H new ATOM 0 HB3 ALA B 12 21.930 -2.691 -6.185 1.00 0.71 H new ATOM 1818 N ILE B 13 22.741 -2.229 -3.353 1.00 0.55 N ATOM 1819 CA ILE B 13 23.896 -1.749 -2.542 1.00 0.51 C ATOM 1820 C ILE B 13 23.760 -2.323 -1.131 1.00 0.44 C ATOM 1821 O ILE B 13 24.731 -2.662 -0.483 1.00 0.45 O ATOM 1822 CB ILE B 13 23.891 -0.217 -2.496 1.00 0.52 C ATOM 1823 CG1 ILE B 13 24.009 0.318 -3.927 1.00 0.65 C ATOM 1824 CG2 ILE B 13 25.078 0.293 -1.668 1.00 0.52 C ATOM 1825 CD1 ILE B 13 23.909 1.846 -3.930 1.00 0.84 C ATOM 0 H ILE B 13 22.064 -1.512 -3.614 1.00 0.55 H new ATOM 0 HA ILE B 13 24.836 -2.077 -2.985 1.00 0.51 H new ATOM 0 HB ILE B 13 22.965 0.128 -2.036 1.00 0.52 H new ATOM 0 HG12 ILE B 13 24.959 0.008 -4.362 1.00 0.65 H new ATOM 0 HG13 ILE B 13 23.220 -0.107 -4.548 1.00 0.65 H new ATOM 0 HG21 ILE B 13 25.063 1.383 -1.643 1.00 0.52 H new ATOM 0 HG22 ILE B 13 25.006 -0.094 -0.652 1.00 0.52 H new ATOM 0 HG23 ILE B 13 26.010 -0.047 -2.120 1.00 0.52 H new ATOM 0 HD11 ILE B 13 23.994 2.214 -4.952 1.00 0.84 H new ATOM 0 HD12 ILE B 13 22.948 2.149 -3.514 1.00 0.84 H new ATOM 0 HD13 ILE B 13 24.714 2.264 -3.325 1.00 0.84 H new ATOM 1837 N LEU B 14 22.551 -2.441 -0.662 1.00 0.45 N ATOM 1838 CA LEU B 14 22.323 -2.998 0.698 1.00 0.41 C ATOM 1839 C LEU B 14 22.595 -4.504 0.676 1.00 0.42 C ATOM 1840 O LEU B 14 23.222 -5.050 1.561 1.00 0.41 O ATOM 1841 CB LEU B 14 20.869 -2.748 1.103 1.00 0.45 C ATOM 1842 CG LEU B 14 20.819 -1.803 2.307 1.00 0.57 C ATOM 1843 CD1 LEU B 14 19.362 -1.460 2.632 1.00 0.54 C ATOM 1844 CD2 LEU B 14 21.462 -2.483 3.519 1.00 1.01 C ATOM 0 H LEU B 14 21.705 -2.174 -1.166 1.00 0.45 H new ATOM 0 HA LEU B 14 22.990 -2.517 1.413 1.00 0.41 H new ATOM 0 HB2 LEU B 14 20.319 -2.316 0.267 1.00 0.45 H new ATOM 0 HB3 LEU B 14 20.384 -3.692 1.350 1.00 0.45 H new ATOM 0 HG LEU B 14 21.363 -0.889 2.070 1.00 0.57 H new ATOM 0 HD11 LEU B 14 19.329 -0.787 3.489 1.00 0.54 H new ATOM 0 HD12 LEU B 14 18.902 -0.974 1.772 1.00 0.54 H new ATOM 0 HD13 LEU B 14 18.817 -2.374 2.867 1.00 0.54 H new ATOM 0 HD21 LEU B 14 21.426 -1.810 4.375 1.00 1.01 H new ATOM 0 HD22 LEU B 14 20.918 -3.398 3.754 1.00 1.01 H new ATOM 0 HD23 LEU B 14 22.500 -2.726 3.292 1.00 1.01 H new ATOM 1856 N GLU B 15 22.129 -5.175 -0.340 1.00 0.47 N ATOM 1857 CA GLU B 15 22.360 -6.643 -0.439 1.00 0.52 C ATOM 1858 C GLU B 15 23.848 -6.912 -0.650 1.00 0.53 C ATOM 1859 O GLU B 15 24.401 -7.854 -0.122 1.00 0.60 O ATOM 1860 CB GLU B 15 21.574 -7.217 -1.623 1.00 0.59 C ATOM 1861 CG GLU B 15 20.085 -7.316 -1.278 1.00 0.80 C ATOM 1862 CD GLU B 15 19.371 -8.143 -2.349 1.00 0.73 C ATOM 1863 OE1 GLU B 15 19.618 -7.900 -3.519 1.00 1.29 O ATOM 1864 OE2 GLU B 15 18.591 -9.006 -1.981 1.00 1.28 O ATOM 0 H GLU B 15 21.596 -4.768 -1.109 1.00 0.47 H new ATOM 0 HA GLU B 15 22.025 -7.118 0.483 1.00 0.52 H new ATOM 0 HB2 GLU B 15 21.709 -6.583 -2.499 1.00 0.59 H new ATOM 0 HB3 GLU B 15 21.960 -8.203 -1.880 1.00 0.59 H new ATOM 0 HG2 GLU B 15 19.957 -7.779 -0.299 1.00 0.80 H new ATOM 0 HG3 GLU B 15 19.647 -6.320 -1.219 1.00 0.80 H new ATOM 1871 N ALA B 16 24.509 -6.094 -1.415 1.00 0.49 N ATOM 1872 CA ALA B 16 25.954 -6.322 -1.646 1.00 0.52 C ATOM 1873 C ALA B 16 26.686 -6.176 -0.322 1.00 0.50 C ATOM 1874 O ALA B 16 27.608 -6.908 -0.023 1.00 0.54 O ATOM 1875 CB ALA B 16 26.485 -5.286 -2.635 1.00 0.53 C ATOM 0 H ALA B 16 24.112 -5.282 -1.887 1.00 0.49 H new ATOM 0 HA ALA B 16 26.112 -7.320 -2.054 1.00 0.52 H new ATOM 0 HB1 ALA B 16 27.548 -5.456 -2.804 1.00 0.53 H new ATOM 0 HB2 ALA B 16 25.949 -5.377 -3.580 1.00 0.53 H new ATOM 0 HB3 ALA B 16 26.337 -4.286 -2.228 1.00 0.53 H new ATOM 1881 N CYS B 17 26.296 -5.218 0.469 1.00 0.46 N ATOM 1882 CA CYS B 17 26.985 -5.013 1.756 1.00 0.46 C ATOM 1883 C CYS B 17 26.569 -6.089 2.762 1.00 0.47 C ATOM 1884 O CYS B 17 27.181 -6.250 3.794 1.00 0.49 O ATOM 1885 CB CYS B 17 26.644 -3.630 2.301 1.00 0.42 C ATOM 1886 SG CYS B 17 24.997 -3.657 3.051 1.00 0.42 S ATOM 0 H CYS B 17 25.530 -4.573 0.274 1.00 0.46 H new ATOM 0 HA CYS B 17 28.061 -5.085 1.598 1.00 0.46 H new ATOM 0 HB2 CYS B 17 27.386 -3.327 3.040 1.00 0.42 H new ATOM 0 HB3 CYS B 17 26.676 -2.894 1.498 1.00 0.42 H new ATOM 0 HG CYS B 17 24.220 -4.440 2.363 1.00 0.42 H new ATOM 1892 N LYS B 18 25.536 -6.830 2.478 1.00 0.49 N ATOM 1893 CA LYS B 18 25.095 -7.893 3.430 1.00 0.51 C ATOM 1894 C LYS B 18 26.268 -8.809 3.822 1.00 0.55 C ATOM 1895 O LYS B 18 26.103 -9.716 4.613 1.00 0.58 O ATOM 1896 CB LYS B 18 23.968 -8.723 2.796 1.00 0.56 C ATOM 1897 CG LYS B 18 24.542 -9.948 2.069 1.00 1.18 C ATOM 1898 CD LYS B 18 23.487 -10.524 1.117 1.00 1.89 C ATOM 1899 CE LYS B 18 22.301 -11.059 1.924 1.00 2.29 C ATOM 1900 NZ LYS B 18 21.450 -11.915 1.049 1.00 2.90 N ATOM 0 H LYS B 18 24.976 -6.748 1.629 1.00 0.49 H new ATOM 0 HA LYS B 18 24.726 -7.411 4.335 1.00 0.51 H new ATOM 0 HB2 LYS B 18 23.269 -9.046 3.567 1.00 0.56 H new ATOM 0 HB3 LYS B 18 23.406 -8.107 2.094 1.00 0.56 H new ATOM 0 HG2 LYS B 18 25.435 -9.666 1.511 1.00 1.18 H new ATOM 0 HG3 LYS B 18 24.844 -10.704 2.793 1.00 1.18 H new ATOM 0 HD2 LYS B 18 23.150 -9.754 0.424 1.00 1.89 H new ATOM 0 HD3 LYS B 18 23.922 -11.324 0.518 1.00 1.89 H new ATOM 0 HE2 LYS B 18 22.658 -11.635 2.778 1.00 2.29 H new ATOM 0 HE3 LYS B 18 21.715 -10.231 2.322 1.00 2.29 H new ATOM 0 HZ1 LYS B 18 20.644 -12.279 1.597 1.00 2.90 H new ATOM 0 HZ2 LYS B 18 21.098 -11.352 0.248 1.00 2.90 H new ATOM 0 HZ3 LYS B 18 22.013 -12.713 0.690 1.00 2.90 H new ATOM 1914 N SER B 19 27.448 -8.601 3.288 1.00 0.57 N ATOM 1915 CA SER B 19 28.585 -9.490 3.663 1.00 0.63 C ATOM 1916 C SER B 19 29.921 -8.818 3.327 1.00 0.66 C ATOM 1917 O SER B 19 30.863 -9.469 2.921 1.00 0.84 O ATOM 1918 CB SER B 19 28.473 -10.806 2.893 1.00 0.70 C ATOM 1919 OG SER B 19 27.435 -11.595 3.458 1.00 0.93 O ATOM 0 H SER B 19 27.668 -7.864 2.618 1.00 0.57 H new ATOM 0 HA SER B 19 28.545 -9.681 4.735 1.00 0.63 H new ATOM 0 HB2 SER B 19 28.264 -10.609 1.842 1.00 0.70 H new ATOM 0 HB3 SER B 19 29.419 -11.346 2.934 1.00 0.70 H new ATOM 0 HG SER B 19 27.002 -11.096 4.182 1.00 0.93 H new ATOM 1925 N GLY B 20 30.021 -7.528 3.505 1.00 0.65 N ATOM 1926 CA GLY B 20 31.308 -6.833 3.207 1.00 0.66 C ATOM 1927 C GLY B 20 31.699 -7.062 1.747 1.00 0.70 C ATOM 1928 O GLY B 20 32.061 -8.154 1.355 1.00 0.77 O ATOM 0 H GLY B 20 29.270 -6.926 3.843 1.00 0.65 H new ATOM 0 HA2 GLY B 20 31.208 -5.765 3.402 1.00 0.66 H new ATOM 0 HA3 GLY B 20 32.093 -7.205 3.865 1.00 0.66 H new ATOM 1932 N SER B 21 31.616 -6.045 0.934 1.00 0.67 N ATOM 1933 CA SER B 21 31.967 -6.214 -0.503 1.00 0.74 C ATOM 1934 C SER B 21 32.441 -4.855 -1.071 1.00 0.72 C ATOM 1935 O SER B 21 31.839 -3.839 -0.783 1.00 0.63 O ATOM 1936 CB SER B 21 30.717 -6.669 -1.254 1.00 0.74 C ATOM 1937 OG SER B 21 29.908 -7.450 -0.384 1.00 0.72 O ATOM 0 H SER B 21 31.321 -5.106 1.203 1.00 0.67 H new ATOM 0 HA SER B 21 32.762 -6.951 -0.616 1.00 0.74 H new ATOM 0 HB2 SER B 21 30.158 -5.804 -1.612 1.00 0.74 H new ATOM 0 HB3 SER B 21 30.997 -7.252 -2.131 1.00 0.74 H new ATOM 0 HG SER B 21 29.135 -6.922 -0.094 1.00 0.72 H new ATOM 1943 N PRO B 22 33.502 -4.806 -1.865 1.00 0.82 N ATOM 1944 CA PRO B 22 33.999 -3.515 -2.434 1.00 0.83 C ATOM 1945 C PRO B 22 33.027 -2.907 -3.449 1.00 0.81 C ATOM 1946 O PRO B 22 32.054 -3.521 -3.837 1.00 0.80 O ATOM 1947 CB PRO B 22 35.317 -3.886 -3.119 1.00 0.93 C ATOM 1948 CG PRO B 22 35.218 -5.344 -3.405 1.00 1.08 C ATOM 1949 CD PRO B 22 34.341 -5.940 -2.307 1.00 0.95 C ATOM 0 HA PRO B 22 34.112 -2.760 -1.656 1.00 0.83 H new ATOM 0 HB2 PRO B 22 35.457 -3.314 -4.036 1.00 0.93 H new ATOM 0 HB3 PRO B 22 36.169 -3.669 -2.475 1.00 0.93 H new ATOM 0 HG2 PRO B 22 34.781 -5.518 -4.388 1.00 1.08 H new ATOM 0 HG3 PRO B 22 36.205 -5.807 -3.408 1.00 1.08 H new ATOM 0 HD2 PRO B 22 33.734 -6.763 -2.684 1.00 0.95 H new ATOM 0 HD3 PRO B 22 34.941 -6.336 -1.488 1.00 0.95 H new ATOM 1957 N LYS B 23 33.285 -1.700 -3.877 1.00 0.80 N ATOM 1958 CA LYS B 23 32.381 -1.038 -4.861 1.00 0.80 C ATOM 1959 C LYS B 23 32.273 -1.891 -6.133 1.00 0.79 C ATOM 1960 O LYS B 23 31.258 -1.890 -6.799 1.00 0.79 O ATOM 1961 CB LYS B 23 32.946 0.343 -5.220 1.00 0.82 C ATOM 1962 CG LYS B 23 31.809 1.374 -5.327 1.00 0.78 C ATOM 1963 CD LYS B 23 32.285 2.566 -6.160 1.00 1.42 C ATOM 1964 CE LYS B 23 33.569 3.134 -5.553 1.00 1.27 C ATOM 1965 NZ LYS B 23 33.783 4.523 -6.051 1.00 1.83 N ATOM 0 H LYS B 23 34.087 -1.142 -3.586 1.00 0.80 H new ATOM 0 HA LYS B 23 31.390 -0.929 -4.420 1.00 0.80 H new ATOM 0 HB2 LYS B 23 33.662 0.659 -4.461 1.00 0.82 H new ATOM 0 HB3 LYS B 23 33.486 0.288 -6.165 1.00 0.82 H new ATOM 0 HG2 LYS B 23 30.933 0.919 -5.789 1.00 0.78 H new ATOM 0 HG3 LYS B 23 31.509 1.707 -4.333 1.00 0.78 H new ATOM 0 HD2 LYS B 23 32.464 2.255 -7.189 1.00 1.42 H new ATOM 0 HD3 LYS B 23 31.513 3.335 -6.188 1.00 1.42 H new ATOM 0 HE2 LYS B 23 33.501 3.133 -4.465 1.00 1.27 H new ATOM 0 HE3 LYS B 23 34.419 2.506 -5.820 1.00 1.27 H new ATOM 0 HZ1 LYS B 23 34.656 4.909 -5.638 1.00 1.83 H new ATOM 0 HZ2 LYS B 23 33.866 4.511 -7.088 1.00 1.83 H new ATOM 0 HZ3 LYS B 23 32.977 5.119 -5.775 1.00 1.83 H new ATOM 1979 N THR B 24 33.307 -2.617 -6.483 1.00 0.79 N ATOM 1980 CA THR B 24 33.257 -3.463 -7.715 1.00 0.79 C ATOM 1981 C THR B 24 32.254 -4.615 -7.570 1.00 0.82 C ATOM 1982 O THR B 24 31.513 -4.917 -8.485 1.00 0.84 O ATOM 1983 CB THR B 24 34.648 -4.044 -7.980 1.00 0.78 C ATOM 1984 OG1 THR B 24 35.273 -4.353 -6.742 1.00 0.85 O ATOM 1985 CG2 THR B 24 35.494 -3.023 -8.741 1.00 0.82 C ATOM 0 H THR B 24 34.186 -2.660 -5.967 1.00 0.79 H new ATOM 0 HA THR B 24 32.936 -2.834 -8.545 1.00 0.79 H new ATOM 0 HB THR B 24 34.556 -4.951 -8.577 1.00 0.78 H new ATOM 0 HG1 THR B 24 36.163 -4.727 -6.909 1.00 0.85 H new ATOM 0 HG21 THR B 24 36.484 -3.438 -8.929 1.00 0.82 H new ATOM 0 HG22 THR B 24 35.013 -2.788 -9.690 1.00 0.82 H new ATOM 0 HG23 THR B 24 35.589 -2.114 -8.147 1.00 0.82 H new ATOM 1993 N ARG B 25 32.230 -5.276 -6.441 1.00 0.84 N ATOM 1994 CA ARG B 25 31.286 -6.420 -6.254 1.00 0.89 C ATOM 1995 C ARG B 25 29.849 -5.922 -6.367 1.00 0.90 C ATOM 1996 O ARG B 25 28.922 -6.686 -6.555 1.00 0.96 O ATOM 1997 CB ARG B 25 31.503 -7.010 -4.854 1.00 0.90 C ATOM 1998 CG ARG B 25 32.325 -8.303 -4.928 1.00 1.33 C ATOM 1999 CD ARG B 25 31.395 -9.474 -5.242 1.00 1.07 C ATOM 2000 NE ARG B 25 32.206 -10.699 -5.495 1.00 1.67 N ATOM 2001 CZ ARG B 25 31.685 -11.704 -6.143 1.00 2.00 C ATOM 2002 NH1 ARG B 25 30.454 -11.638 -6.571 1.00 2.14 N ATOM 2003 NH2 ARG B 25 32.395 -12.777 -6.365 1.00 2.74 N ATOM 0 H ARG B 25 32.825 -5.072 -5.638 1.00 0.84 H new ATOM 0 HA ARG B 25 31.467 -7.177 -7.017 1.00 0.89 H new ATOM 0 HB2 ARG B 25 32.016 -6.283 -4.224 1.00 0.90 H new ATOM 0 HB3 ARG B 25 30.539 -7.213 -4.387 1.00 0.90 H new ATOM 0 HG2 ARG B 25 33.092 -8.216 -5.697 1.00 1.33 H new ATOM 0 HG3 ARG B 25 32.839 -8.475 -3.983 1.00 1.33 H new ATOM 0 HD2 ARG B 25 30.712 -9.643 -4.410 1.00 1.07 H new ATOM 0 HD3 ARG B 25 30.784 -9.243 -6.114 1.00 1.07 H new ATOM 0 HE ARG B 25 33.168 -10.751 -5.161 1.00 1.67 H new ATOM 0 HH11 ARG B 25 29.898 -10.800 -6.399 1.00 2.14 H new ATOM 0 HH12 ARG B 25 30.047 -12.424 -7.078 1.00 2.14 H new ATOM 0 HH21 ARG B 25 33.358 -12.830 -6.032 1.00 2.74 H new ATOM 0 HH22 ARG B 25 31.987 -13.563 -6.872 1.00 2.74 H new ATOM 2017 N ILE B 26 29.664 -4.647 -6.251 1.00 0.86 N ATOM 2018 CA ILE B 26 28.296 -4.096 -6.347 1.00 0.89 C ATOM 2019 C ILE B 26 27.918 -3.960 -7.822 1.00 0.93 C ATOM 2020 O ILE B 26 26.755 -3.966 -8.174 1.00 0.96 O ATOM 2021 CB ILE B 26 28.238 -2.759 -5.612 1.00 0.86 C ATOM 2022 CG1 ILE B 26 28.852 -2.974 -4.216 1.00 0.92 C ATOM 2023 CG2 ILE B 26 26.777 -2.303 -5.502 1.00 0.90 C ATOM 2024 CD1 ILE B 26 28.124 -2.151 -3.148 1.00 0.62 C ATOM 0 H ILE B 26 30.402 -3.961 -6.094 1.00 0.86 H new ATOM 0 HA ILE B 26 27.574 -4.763 -5.875 1.00 0.89 H new ATOM 0 HB ILE B 26 28.792 -1.987 -6.146 1.00 0.86 H new ATOM 0 HG12 ILE B 26 28.805 -4.032 -3.956 1.00 0.92 H new ATOM 0 HG13 ILE B 26 29.906 -2.697 -4.235 1.00 0.92 H new ATOM 0 HG21 ILE B 26 26.732 -1.348 -4.978 1.00 0.90 H new ATOM 0 HG22 ILE B 26 26.355 -2.188 -6.501 1.00 0.90 H new ATOM 0 HG23 ILE B 26 26.204 -3.048 -4.950 1.00 0.90 H new ATOM 0 HD11 ILE B 26 28.584 -2.328 -2.176 1.00 0.62 H new ATOM 0 HD12 ILE B 26 28.193 -1.092 -3.395 1.00 0.62 H new ATOM 0 HD13 ILE B 26 27.076 -2.447 -3.112 1.00 0.62 H new ATOM 2036 N MET B 27 28.888 -3.860 -8.698 1.00 0.94 N ATOM 2037 CA MET B 27 28.562 -3.752 -10.149 1.00 0.99 C ATOM 2038 C MET B 27 27.692 -4.951 -10.527 1.00 1.06 C ATOM 2039 O MET B 27 26.735 -4.835 -11.267 1.00 1.10 O ATOM 2040 CB MET B 27 29.849 -3.770 -10.980 1.00 0.98 C ATOM 2041 CG MET B 27 30.659 -2.490 -10.736 1.00 1.55 C ATOM 2042 SD MET B 27 32.376 -2.770 -11.239 1.00 1.89 S ATOM 2043 CE MET B 27 32.163 -2.441 -13.008 1.00 1.25 C ATOM 0 H MET B 27 29.882 -3.849 -8.471 1.00 0.94 H new ATOM 0 HA MET B 27 28.036 -2.818 -10.346 1.00 0.99 H new ATOM 0 HB2 MET B 27 30.447 -4.643 -10.717 1.00 0.98 H new ATOM 0 HB3 MET B 27 29.605 -3.858 -12.039 1.00 0.98 H new ATOM 0 HG2 MET B 27 30.232 -1.661 -11.301 1.00 1.55 H new ATOM 0 HG3 MET B 27 30.616 -2.213 -9.683 1.00 1.55 H new ATOM 0 HE1 MET B 27 33.119 -2.560 -13.518 1.00 1.25 H new ATOM 0 HE2 MET B 27 31.440 -3.143 -13.424 1.00 1.25 H new ATOM 0 HE3 MET B 27 31.802 -1.422 -13.148 1.00 1.25 H new ATOM 2053 N TYR B 28 28.015 -6.101 -10.000 1.00 1.07 N ATOM 2054 CA TYR B 28 27.212 -7.324 -10.290 1.00 1.14 C ATOM 2055 C TYR B 28 25.762 -7.091 -9.853 1.00 1.09 C ATOM 2056 O TYR B 28 24.901 -7.926 -10.050 1.00 1.20 O ATOM 2057 CB TYR B 28 27.792 -8.502 -9.506 1.00 1.17 C ATOM 2058 CG TYR B 28 27.391 -9.802 -10.164 1.00 1.43 C ATOM 2059 CD1 TYR B 28 27.960 -10.170 -11.389 1.00 1.71 C ATOM 2060 CD2 TYR B 28 26.455 -10.642 -9.547 1.00 2.20 C ATOM 2061 CE1 TYR B 28 27.595 -11.378 -11.997 1.00 1.98 C ATOM 2062 CE2 TYR B 28 26.089 -11.849 -10.156 1.00 2.58 C ATOM 2063 CZ TYR B 28 26.659 -12.217 -11.380 1.00 2.21 C ATOM 2064 OH TYR B 28 26.300 -13.408 -11.979 1.00 2.65 O ATOM 0 H TYR B 28 28.808 -6.247 -9.375 1.00 1.07 H new ATOM 0 HA TYR B 28 27.243 -7.541 -11.358 1.00 1.14 H new ATOM 0 HB2 TYR B 28 28.878 -8.424 -9.466 1.00 1.17 H new ATOM 0 HB3 TYR B 28 27.432 -8.478 -8.477 1.00 1.17 H new ATOM 0 HD1 TYR B 28 28.681 -9.522 -11.866 1.00 1.71 H new ATOM 0 HD2 TYR B 28 26.016 -10.359 -8.602 1.00 2.20 H new ATOM 0 HE1 TYR B 28 28.035 -11.662 -12.941 1.00 1.98 H new ATOM 0 HE2 TYR B 28 25.367 -12.496 -9.681 1.00 2.58 H new ATOM 0 HH TYR B 28 25.642 -13.870 -11.419 1.00 2.65 H new ATOM 2074 N GLY B 29 25.487 -5.949 -9.281 1.00 1.05 N ATOM 2075 CA GLY B 29 24.098 -5.633 -8.847 1.00 1.02 C ATOM 2076 C GLY B 29 23.416 -4.788 -9.927 1.00 1.05 C ATOM 2077 O GLY B 29 22.242 -4.945 -10.201 1.00 1.10 O ATOM 0 H GLY B 29 26.172 -5.217 -9.095 1.00 1.05 H new ATOM 0 HA2 GLY B 29 23.538 -6.553 -8.680 1.00 1.02 H new ATOM 0 HA3 GLY B 29 24.113 -5.093 -7.901 1.00 1.02 H new ATOM 2081 N ALA B 30 24.143 -3.888 -10.540 1.00 1.06 N ATOM 2082 CA ALA B 30 23.532 -3.031 -11.598 1.00 1.10 C ATOM 2083 C ALA B 30 24.629 -2.399 -12.466 1.00 1.16 C ATOM 2084 O ALA B 30 25.797 -2.701 -12.325 1.00 1.24 O ATOM 2085 CB ALA B 30 22.703 -1.929 -10.937 1.00 1.13 C ATOM 0 H ALA B 30 25.130 -3.711 -10.354 1.00 1.06 H new ATOM 0 HA ALA B 30 22.892 -3.645 -12.231 1.00 1.10 H new ATOM 0 HB1 ALA B 30 22.255 -1.300 -11.706 1.00 1.13 H new ATOM 0 HB2 ALA B 30 21.916 -2.379 -10.332 1.00 1.13 H new ATOM 0 HB3 ALA B 30 23.347 -1.321 -10.301 1.00 1.13 H new ATOM 2091 N ASN B 31 24.256 -1.522 -13.368 1.00 1.19 N ATOM 2092 CA ASN B 31 25.269 -0.868 -14.254 1.00 1.26 C ATOM 2093 C ASN B 31 26.095 0.138 -13.448 1.00 1.28 C ATOM 2094 O ASN B 31 26.831 0.931 -13.998 1.00 1.73 O ATOM 2095 CB ASN B 31 24.555 -0.143 -15.395 1.00 1.34 C ATOM 2096 CG ASN B 31 24.705 -0.954 -16.683 1.00 1.68 C ATOM 2097 OD1 ASN B 31 23.774 -1.603 -17.117 1.00 2.40 O ATOM 2098 ND2 ASN B 31 25.846 -0.945 -17.315 1.00 1.85 N ATOM 0 H ASN B 31 23.292 -1.231 -13.528 1.00 1.19 H new ATOM 0 HA ASN B 31 25.933 -1.630 -14.663 1.00 1.26 H new ATOM 0 HB2 ASN B 31 23.500 -0.013 -15.154 1.00 1.34 H new ATOM 0 HB3 ASN B 31 24.977 0.853 -15.528 1.00 1.34 H new ATOM 0 HD21 ASN B 31 25.957 -1.483 -18.174 1.00 1.85 H new ATOM 0 HD22 ASN B 31 26.627 -0.400 -16.950 1.00 1.85 H new ATOM 2105 N LEU B 32 26.005 0.060 -12.150 1.00 1.11 N ATOM 2106 CA LEU B 32 26.799 0.944 -11.242 1.00 1.05 C ATOM 2107 C LEU B 32 27.069 2.331 -11.808 1.00 1.03 C ATOM 2108 O LEU B 32 27.967 2.552 -12.596 1.00 1.08 O ATOM 2109 CB LEU B 32 28.132 0.259 -10.913 1.00 1.08 C ATOM 2110 CG LEU B 32 28.364 0.151 -9.389 1.00 1.11 C ATOM 2111 CD1 LEU B 32 28.443 1.538 -8.734 1.00 1.07 C ATOM 2112 CD2 LEU B 32 27.241 -0.657 -8.732 1.00 1.16 C ATOM 0 H LEU B 32 25.397 -0.599 -11.664 1.00 1.11 H new ATOM 0 HA LEU B 32 26.196 1.092 -10.346 1.00 1.05 H new ATOM 0 HB2 LEU B 32 28.146 -0.738 -11.354 1.00 1.08 H new ATOM 0 HB3 LEU B 32 28.950 0.820 -11.366 1.00 1.08 H new ATOM 0 HG LEU B 32 29.316 -0.359 -9.239 1.00 1.11 H new ATOM 0 HD11 LEU B 32 28.607 1.425 -7.662 1.00 1.07 H new ATOM 0 HD12 LEU B 32 29.269 2.100 -9.170 1.00 1.07 H new ATOM 0 HD13 LEU B 32 27.509 2.074 -8.904 1.00 1.07 H new ATOM 0 HD21 LEU B 32 27.420 -0.723 -7.659 1.00 1.16 H new ATOM 0 HD22 LEU B 32 26.285 -0.164 -8.911 1.00 1.16 H new ATOM 0 HD23 LEU B 32 27.217 -1.660 -9.158 1.00 1.16 H new ATOM 2124 N SER B 33 26.333 3.276 -11.327 1.00 0.99 N ATOM 2125 CA SER B 33 26.541 4.693 -11.700 1.00 1.01 C ATOM 2126 C SER B 33 27.835 5.183 -11.016 1.00 0.96 C ATOM 2127 O SER B 33 27.976 6.354 -10.780 1.00 0.96 O ATOM 2128 CB SER B 33 25.345 5.530 -11.240 1.00 0.99 C ATOM 2129 OG SER B 33 24.856 6.291 -12.337 1.00 1.33 O ATOM 0 H SER B 33 25.569 3.122 -10.668 1.00 0.99 H new ATOM 0 HA SER B 33 26.632 4.794 -12.781 1.00 1.01 H new ATOM 0 HB2 SER B 33 24.559 4.881 -10.853 1.00 0.99 H new ATOM 0 HB3 SER B 33 25.641 6.192 -10.426 1.00 0.99 H new ATOM 0 HG SER B 33 24.089 6.827 -12.047 1.00 1.33 H new ATOM 2135 N TYR B 34 28.717 4.255 -10.628 1.00 0.95 N ATOM 2136 CA TYR B 34 29.988 4.549 -9.856 1.00 0.94 C ATOM 2137 C TYR B 34 30.329 6.040 -9.768 1.00 0.96 C ATOM 2138 O TYR B 34 30.554 6.555 -8.690 1.00 0.89 O ATOM 2139 CB TYR B 34 31.157 3.840 -10.543 1.00 1.10 C ATOM 2140 CG TYR B 34 31.523 4.552 -11.825 1.00 1.01 C ATOM 2141 CD1 TYR B 34 30.866 4.231 -13.018 1.00 1.81 C ATOM 2142 CD2 TYR B 34 32.528 5.529 -11.820 1.00 1.77 C ATOM 2143 CE1 TYR B 34 31.210 4.888 -14.206 1.00 2.56 C ATOM 2144 CE2 TYR B 34 32.871 6.186 -13.008 1.00 2.53 C ATOM 2145 CZ TYR B 34 32.213 5.865 -14.201 1.00 2.75 C ATOM 2146 OH TYR B 34 32.552 6.512 -15.372 1.00 3.76 O ATOM 0 H TYR B 34 28.592 3.263 -10.829 1.00 0.95 H new ATOM 0 HA TYR B 34 29.821 4.193 -8.840 1.00 0.94 H new ATOM 0 HB2 TYR B 34 32.018 3.814 -9.875 1.00 1.10 H new ATOM 0 HB3 TYR B 34 30.888 2.806 -10.758 1.00 1.10 H new ATOM 0 HD1 TYR B 34 30.093 3.476 -13.023 1.00 1.81 H new ATOM 0 HD2 TYR B 34 33.038 5.775 -10.900 1.00 1.77 H new ATOM 0 HE1 TYR B 34 30.702 4.641 -15.126 1.00 2.56 H new ATOM 0 HE2 TYR B 34 33.644 6.941 -13.004 1.00 2.53 H new ATOM 0 HH TYR B 34 33.265 7.160 -15.193 1.00 3.76 H new ATOM 2156 N ALA B 35 30.355 6.753 -10.851 1.00 1.07 N ATOM 2157 CA ALA B 35 30.662 8.202 -10.740 1.00 1.15 C ATOM 2158 C ALA B 35 29.666 8.832 -9.758 1.00 1.05 C ATOM 2159 O ALA B 35 30.034 9.543 -8.845 1.00 1.03 O ATOM 2160 CB ALA B 35 30.522 8.866 -12.112 1.00 1.30 C ATOM 0 H ALA B 35 30.181 6.406 -11.794 1.00 1.07 H new ATOM 0 HA ALA B 35 31.682 8.343 -10.384 1.00 1.15 H new ATOM 0 HB1 ALA B 35 30.748 9.929 -12.027 1.00 1.30 H new ATOM 0 HB2 ALA B 35 31.216 8.403 -12.813 1.00 1.30 H new ATOM 0 HB3 ALA B 35 29.502 8.740 -12.475 1.00 1.30 H new ATOM 2166 N LEU B 36 28.403 8.561 -9.949 1.00 1.02 N ATOM 2167 CA LEU B 36 27.352 9.119 -9.045 1.00 0.96 C ATOM 2168 C LEU B 36 26.987 8.115 -7.940 1.00 0.83 C ATOM 2169 O LEU B 36 26.823 8.481 -6.793 1.00 0.79 O ATOM 2170 CB LEU B 36 26.100 9.440 -9.865 1.00 1.03 C ATOM 2171 CG LEU B 36 25.678 10.889 -9.614 1.00 1.16 C ATOM 2172 CD1 LEU B 36 24.437 11.212 -10.449 1.00 1.74 C ATOM 2173 CD2 LEU B 36 25.354 11.078 -8.130 1.00 1.99 C ATOM 0 H LEU B 36 28.049 7.970 -10.701 1.00 1.02 H new ATOM 0 HA LEU B 36 27.742 10.023 -8.578 1.00 0.96 H new ATOM 0 HB2 LEU B 36 26.299 9.287 -10.926 1.00 1.03 H new ATOM 0 HB3 LEU B 36 25.291 8.763 -9.592 1.00 1.03 H new ATOM 0 HG LEU B 36 26.492 11.557 -9.897 1.00 1.16 H new ATOM 0 HD11 LEU B 36 24.137 12.244 -10.270 1.00 1.74 H new ATOM 0 HD12 LEU B 36 24.665 11.079 -11.506 1.00 1.74 H new ATOM 0 HD13 LEU B 36 23.624 10.543 -10.166 1.00 1.74 H new ATOM 0 HD21 LEU B 36 25.053 12.110 -7.952 1.00 1.99 H new ATOM 0 HD22 LEU B 36 24.541 10.409 -7.847 1.00 1.99 H new ATOM 0 HD23 LEU B 36 26.237 10.849 -7.533 1.00 1.99 H new ATOM 2185 N THR B 37 26.817 6.860 -8.291 1.00 0.80 N ATOM 2186 CA THR B 37 26.414 5.827 -7.279 1.00 0.71 C ATOM 2187 C THR B 37 27.181 6.023 -5.971 1.00 0.66 C ATOM 2188 O THR B 37 26.642 5.830 -4.900 1.00 0.61 O ATOM 2189 CB THR B 37 26.686 4.424 -7.828 1.00 0.80 C ATOM 2190 OG1 THR B 37 25.975 4.246 -9.043 1.00 0.93 O ATOM 2191 CG2 THR B 37 26.235 3.367 -6.815 1.00 0.81 C ATOM 0 H THR B 37 26.941 6.505 -9.239 1.00 0.80 H new ATOM 0 HA THR B 37 25.348 5.940 -7.080 1.00 0.71 H new ATOM 0 HB THR B 37 27.755 4.313 -8.008 1.00 0.80 H new ATOM 0 HG1 THR B 37 25.157 3.735 -8.871 1.00 0.93 H new ATOM 0 HG21 THR B 37 26.433 2.372 -7.215 1.00 0.81 H new ATOM 0 HG22 THR B 37 26.784 3.499 -5.883 1.00 0.81 H new ATOM 0 HG23 THR B 37 25.167 3.476 -6.626 1.00 0.81 H new ATOM 2199 N GLY B 38 28.425 6.412 -6.039 1.00 0.69 N ATOM 2200 CA GLY B 38 29.192 6.632 -4.776 1.00 0.68 C ATOM 2201 C GLY B 38 28.344 7.521 -3.864 1.00 0.65 C ATOM 2202 O GLY B 38 28.431 7.472 -2.654 1.00 0.64 O ATOM 0 H GLY B 38 28.940 6.586 -6.902 1.00 0.69 H new ATOM 0 HA2 GLY B 38 29.408 5.681 -4.289 1.00 0.68 H new ATOM 0 HA3 GLY B 38 30.150 7.106 -4.988 1.00 0.68 H new ATOM 2206 N ARG B 39 27.508 8.319 -4.467 1.00 0.67 N ATOM 2207 CA ARG B 39 26.605 9.221 -3.697 1.00 0.69 C ATOM 2208 C ARG B 39 25.582 8.372 -2.941 1.00 0.64 C ATOM 2209 O ARG B 39 25.076 8.760 -1.907 1.00 0.64 O ATOM 2210 CB ARG B 39 25.874 10.137 -4.686 1.00 0.76 C ATOM 2211 CG ARG B 39 25.027 11.170 -3.935 1.00 0.80 C ATOM 2212 CD ARG B 39 23.622 11.221 -4.548 1.00 0.82 C ATOM 2213 NE ARG B 39 22.898 12.418 -4.033 1.00 1.17 N ATOM 2214 CZ ARG B 39 21.705 12.702 -4.478 1.00 1.79 C ATOM 2215 NH1 ARG B 39 21.143 11.936 -5.374 1.00 2.44 N ATOM 2216 NH2 ARG B 39 21.073 13.751 -4.028 1.00 2.34 N ATOM 0 H ARG B 39 27.410 8.386 -5.480 1.00 0.67 H new ATOM 0 HA ARG B 39 27.178 9.819 -2.988 1.00 0.69 H new ATOM 0 HB2 ARG B 39 26.598 10.645 -5.323 1.00 0.76 H new ATOM 0 HB3 ARG B 39 25.237 9.541 -5.340 1.00 0.76 H new ATOM 0 HG2 ARG B 39 24.965 10.907 -2.879 1.00 0.80 H new ATOM 0 HG3 ARG B 39 25.496 12.152 -3.992 1.00 0.80 H new ATOM 0 HD2 ARG B 39 23.689 11.263 -5.635 1.00 0.82 H new ATOM 0 HD3 ARG B 39 23.071 10.314 -4.298 1.00 0.82 H new ATOM 0 HE ARG B 39 23.336 13.016 -3.332 1.00 1.17 H new ATOM 0 HH11 ARG B 39 21.637 11.116 -5.726 1.00 2.44 H new ATOM 0 HH12 ARG B 39 20.210 12.158 -5.722 1.00 2.44 H new ATOM 0 HH21 ARG B 39 21.512 14.349 -3.328 1.00 2.34 H new ATOM 0 HH22 ARG B 39 20.140 13.973 -4.376 1.00 2.34 H new ATOM 2230 N TYR B 40 25.278 7.214 -3.454 1.00 0.60 N ATOM 2231 CA TYR B 40 24.291 6.331 -2.774 1.00 0.56 C ATOM 2232 C TYR B 40 24.983 5.640 -1.604 1.00 0.48 C ATOM 2233 O TYR B 40 24.457 5.565 -0.512 1.00 0.47 O ATOM 2234 CB TYR B 40 23.764 5.288 -3.764 1.00 0.58 C ATOM 2235 CG TYR B 40 22.804 5.890 -4.796 1.00 0.81 C ATOM 2236 CD1 TYR B 40 22.681 7.287 -5.020 1.00 1.51 C ATOM 2237 CD2 TYR B 40 22.023 5.010 -5.552 1.00 1.61 C ATOM 2238 CE1 TYR B 40 21.786 7.763 -5.986 1.00 1.79 C ATOM 2239 CE2 TYR B 40 21.132 5.497 -6.516 1.00 1.88 C ATOM 2240 CZ TYR B 40 21.014 6.871 -6.731 1.00 1.59 C ATOM 2241 OH TYR B 40 20.137 7.347 -7.683 1.00 2.01 O ATOM 0 H TYR B 40 25.671 6.840 -4.317 1.00 0.60 H new ATOM 0 HA TYR B 40 23.450 6.920 -2.408 1.00 0.56 H new ATOM 0 HB2 TYR B 40 24.605 4.825 -4.281 1.00 0.58 H new ATOM 0 HB3 TYR B 40 23.253 4.497 -3.215 1.00 0.58 H new ATOM 0 HD1 TYR B 40 23.277 7.981 -4.446 1.00 1.51 H new ATOM 0 HD2 TYR B 40 22.108 3.945 -5.391 1.00 1.61 H new ATOM 0 HE1 TYR B 40 21.693 8.826 -6.155 1.00 1.79 H new ATOM 0 HE2 TYR B 40 20.535 4.808 -7.095 1.00 1.88 H new ATOM 0 HH TYR B 40 19.244 7.435 -7.290 1.00 2.01 H new ATOM 2251 N ILE B 41 26.172 5.146 -1.822 1.00 0.44 N ATOM 2252 CA ILE B 41 26.914 4.472 -0.722 1.00 0.40 C ATOM 2253 C ILE B 41 27.145 5.476 0.408 1.00 0.41 C ATOM 2254 O ILE B 41 26.805 5.234 1.549 1.00 0.41 O ATOM 2255 CB ILE B 41 28.259 3.972 -1.257 1.00 0.41 C ATOM 2256 CG1 ILE B 41 28.028 3.209 -2.563 1.00 0.53 C ATOM 2257 CG2 ILE B 41 28.911 3.042 -0.233 1.00 0.47 C ATOM 2258 CD1 ILE B 41 29.287 2.420 -2.929 1.00 0.54 C ATOM 0 H ILE B 41 26.661 5.181 -2.717 1.00 0.44 H new ATOM 0 HA ILE B 41 26.340 3.626 -0.344 1.00 0.40 H new ATOM 0 HB ILE B 41 28.916 4.823 -1.437 1.00 0.41 H new ATOM 0 HG12 ILE B 41 27.181 2.531 -2.455 1.00 0.53 H new ATOM 0 HG13 ILE B 41 27.778 3.906 -3.363 1.00 0.53 H new ATOM 0 HG21 ILE B 41 29.867 2.689 -0.619 1.00 0.47 H new ATOM 0 HG22 ILE B 41 29.073 3.584 0.699 1.00 0.47 H new ATOM 0 HG23 ILE B 41 28.258 2.189 -0.048 1.00 0.47 H new ATOM 0 HD11 ILE B 41 29.119 1.878 -3.860 1.00 0.54 H new ATOM 0 HD12 ILE B 41 30.123 3.108 -3.056 1.00 0.54 H new ATOM 0 HD13 ILE B 41 29.517 1.712 -2.133 1.00 0.54 H new ATOM 2270 N LYS B 42 27.711 6.611 0.095 1.00 0.46 N ATOM 2271 CA LYS B 42 27.952 7.639 1.143 1.00 0.50 C ATOM 2272 C LYS B 42 26.626 7.956 1.837 1.00 0.51 C ATOM 2273 O LYS B 42 26.542 8.025 3.047 1.00 0.53 O ATOM 2274 CB LYS B 42 28.507 8.904 0.485 1.00 0.59 C ATOM 2275 CG LYS B 42 29.536 9.560 1.408 1.00 0.89 C ATOM 2276 CD LYS B 42 28.874 9.928 2.736 1.00 0.61 C ATOM 2277 CE LYS B 42 29.632 11.092 3.377 1.00 0.65 C ATOM 2278 NZ LYS B 42 29.177 11.267 4.785 1.00 1.61 N ATOM 0 H LYS B 42 28.017 6.869 -0.843 1.00 0.46 H new ATOM 0 HA LYS B 42 28.669 7.270 1.876 1.00 0.50 H new ATOM 0 HB2 LYS B 42 28.969 8.655 -0.471 1.00 0.59 H new ATOM 0 HB3 LYS B 42 27.696 9.602 0.275 1.00 0.59 H new ATOM 0 HG2 LYS B 42 30.369 8.879 1.582 1.00 0.89 H new ATOM 0 HG3 LYS B 42 29.947 10.452 0.935 1.00 0.89 H new ATOM 0 HD2 LYS B 42 27.833 10.205 2.571 1.00 0.61 H new ATOM 0 HD3 LYS B 42 28.873 9.068 3.405 1.00 0.61 H new ATOM 0 HE2 LYS B 42 30.705 10.899 3.352 1.00 0.65 H new ATOM 0 HE3 LYS B 42 29.459 12.008 2.811 1.00 0.65 H new ATOM 0 HZ1 LYS B 42 29.972 11.600 5.368 1.00 1.61 H new ATOM 0 HZ2 LYS B 42 28.408 11.966 4.817 1.00 1.61 H new ATOM 0 HZ3 LYS B 42 28.834 10.358 5.154 1.00 1.61 H new ATOM 2292 N MET B 43 25.588 8.140 1.069 1.00 0.55 N ATOM 2293 CA MET B 43 24.252 8.445 1.656 1.00 0.60 C ATOM 2294 C MET B 43 23.875 7.347 2.654 1.00 0.50 C ATOM 2295 O MET B 43 23.535 7.612 3.785 1.00 0.52 O ATOM 2296 CB MET B 43 23.227 8.508 0.515 1.00 0.68 C ATOM 2297 CG MET B 43 21.797 8.321 1.037 1.00 0.78 C ATOM 2298 SD MET B 43 20.640 8.758 -0.286 1.00 1.39 S ATOM 2299 CE MET B 43 19.335 9.429 0.764 1.00 2.16 C ATOM 0 H MET B 43 25.608 8.092 0.050 1.00 0.55 H new ATOM 0 HA MET B 43 24.271 9.400 2.182 1.00 0.60 H new ATOM 0 HB2 MET B 43 23.307 9.468 0.004 1.00 0.68 H new ATOM 0 HB3 MET B 43 23.451 7.736 -0.221 1.00 0.68 H new ATOM 0 HG2 MET B 43 21.641 7.289 1.351 1.00 0.78 H new ATOM 0 HG3 MET B 43 21.628 8.950 1.911 1.00 0.78 H new ATOM 0 HE1 MET B 43 18.498 9.749 0.144 1.00 2.16 H new ATOM 0 HE2 MET B 43 18.998 8.662 1.461 1.00 2.16 H new ATOM 0 HE3 MET B 43 19.720 10.282 1.322 1.00 2.16 H new ATOM 2309 N LEU B 44 23.934 6.115 2.243 1.00 0.43 N ATOM 2310 CA LEU B 44 23.577 5.006 3.168 1.00 0.35 C ATOM 2311 C LEU B 44 24.571 4.976 4.339 1.00 0.32 C ATOM 2312 O LEU B 44 24.231 4.617 5.449 1.00 0.35 O ATOM 2313 CB LEU B 44 23.636 3.684 2.398 1.00 0.33 C ATOM 2314 CG LEU B 44 22.564 3.666 1.301 1.00 0.49 C ATOM 2315 CD1 LEU B 44 22.717 2.396 0.460 1.00 0.90 C ATOM 2316 CD2 LEU B 44 21.161 3.699 1.924 1.00 0.68 C ATOM 0 H LEU B 44 24.214 5.826 1.306 1.00 0.43 H new ATOM 0 HA LEU B 44 22.572 5.155 3.562 1.00 0.35 H new ATOM 0 HB2 LEU B 44 24.624 3.556 1.955 1.00 0.33 H new ATOM 0 HB3 LEU B 44 23.483 2.849 3.081 1.00 0.33 H new ATOM 0 HG LEU B 44 22.691 4.546 0.670 1.00 0.49 H new ATOM 0 HD11 LEU B 44 21.956 2.382 -0.320 1.00 0.90 H new ATOM 0 HD12 LEU B 44 23.706 2.380 0.002 1.00 0.90 H new ATOM 0 HD13 LEU B 44 22.598 1.520 1.098 1.00 0.90 H new ATOM 0 HD21 LEU B 44 20.411 3.686 1.133 1.00 0.68 H new ATOM 0 HD22 LEU B 44 21.027 2.828 2.565 1.00 0.68 H new ATOM 0 HD23 LEU B 44 21.047 4.607 2.517 1.00 0.68 H new ATOM 2328 N MET B 45 25.794 5.361 4.100 1.00 0.40 N ATOM 2329 CA MET B 45 26.808 5.367 5.196 1.00 0.42 C ATOM 2330 C MET B 45 26.513 6.530 6.142 1.00 0.44 C ATOM 2331 O MET B 45 26.447 6.385 7.347 1.00 0.43 O ATOM 2332 CB MET B 45 28.198 5.593 4.585 1.00 0.52 C ATOM 2333 CG MET B 45 29.136 4.423 4.888 1.00 1.13 C ATOM 2334 SD MET B 45 30.832 4.910 4.488 1.00 0.80 S ATOM 2335 CE MET B 45 31.231 3.512 3.412 1.00 0.83 C ATOM 0 H MET B 45 26.137 5.673 3.191 1.00 0.40 H new ATOM 0 HA MET B 45 26.773 4.419 5.733 1.00 0.42 H new ATOM 0 HB2 MET B 45 28.107 5.719 3.506 1.00 0.52 H new ATOM 0 HB3 MET B 45 28.625 6.515 4.979 1.00 0.52 H new ATOM 0 HG2 MET B 45 29.062 4.144 5.939 1.00 1.13 H new ATOM 0 HG3 MET B 45 28.848 3.548 4.305 1.00 1.13 H new ATOM 0 HE1 MET B 45 32.253 3.614 3.047 1.00 0.83 H new ATOM 0 HE2 MET B 45 31.137 2.582 3.973 1.00 0.83 H new ATOM 0 HE3 MET B 45 30.543 3.496 2.566 1.00 0.83 H new ATOM 2345 N ASP B 46 26.343 7.684 5.575 1.00 0.48 N ATOM 2346 CA ASP B 46 26.053 8.902 6.381 1.00 0.53 C ATOM 2347 C ASP B 46 24.741 8.727 7.147 1.00 0.51 C ATOM 2348 O ASP B 46 24.524 9.345 8.170 1.00 0.55 O ATOM 2349 CB ASP B 46 25.932 10.107 5.451 1.00 0.59 C ATOM 2350 CG ASP B 46 26.533 11.340 6.130 1.00 0.71 C ATOM 2351 OD1 ASP B 46 26.499 11.397 7.348 1.00 1.30 O ATOM 2352 OD2 ASP B 46 27.015 12.206 5.419 1.00 1.26 O ATOM 0 H ASP B 46 26.393 7.842 4.568 1.00 0.48 H new ATOM 0 HA ASP B 46 26.865 9.059 7.091 1.00 0.53 H new ATOM 0 HB2 ASP B 46 26.449 9.908 4.512 1.00 0.59 H new ATOM 0 HB3 ASP B 46 24.885 10.287 5.207 1.00 0.59 H new ATOM 2357 N LEU B 47 23.856 7.910 6.646 1.00 0.48 N ATOM 2358 CA LEU B 47 22.547 7.720 7.330 1.00 0.50 C ATOM 2359 C LEU B 47 22.621 6.536 8.297 1.00 0.46 C ATOM 2360 O LEU B 47 21.688 6.269 9.026 1.00 0.50 O ATOM 2361 CB LEU B 47 21.465 7.488 6.274 1.00 0.51 C ATOM 2362 CG LEU B 47 20.812 8.827 5.896 1.00 0.59 C ATOM 2363 CD1 LEU B 47 21.876 9.869 5.530 1.00 0.59 C ATOM 2364 CD2 LEU B 47 19.892 8.619 4.692 1.00 0.62 C ATOM 0 H LEU B 47 23.983 7.366 5.793 1.00 0.48 H new ATOM 0 HA LEU B 47 22.301 8.611 7.908 1.00 0.50 H new ATOM 0 HB2 LEU B 47 21.901 7.023 5.390 1.00 0.51 H new ATOM 0 HB3 LEU B 47 20.711 6.800 6.657 1.00 0.51 H new ATOM 0 HG LEU B 47 20.243 9.187 6.753 1.00 0.59 H new ATOM 0 HD11 LEU B 47 21.390 10.808 5.266 1.00 0.59 H new ATOM 0 HD12 LEU B 47 22.537 10.029 6.382 1.00 0.59 H new ATOM 0 HD13 LEU B 47 22.459 9.511 4.681 1.00 0.59 H new ATOM 0 HD21 LEU B 47 19.427 9.567 4.421 1.00 0.62 H new ATOM 0 HD22 LEU B 47 20.474 8.247 3.849 1.00 0.62 H new ATOM 0 HD23 LEU B 47 19.118 7.895 4.946 1.00 0.62 H new ATOM 2376 N GLU B 48 23.724 5.832 8.307 1.00 0.42 N ATOM 2377 CA GLU B 48 23.880 4.666 9.231 1.00 0.42 C ATOM 2378 C GLU B 48 23.147 3.446 8.657 1.00 0.39 C ATOM 2379 O GLU B 48 22.133 3.005 9.160 1.00 0.47 O ATOM 2380 CB GLU B 48 23.344 5.021 10.628 1.00 0.47 C ATOM 2381 CG GLU B 48 24.146 4.262 11.686 1.00 1.16 C ATOM 2382 CD GLU B 48 25.488 4.962 11.912 1.00 1.19 C ATOM 2383 OE1 GLU B 48 25.859 5.771 11.078 1.00 1.69 O ATOM 2384 OE2 GLU B 48 26.121 4.676 12.914 1.00 1.72 O ATOM 0 H GLU B 48 24.530 6.016 7.710 1.00 0.42 H new ATOM 0 HA GLU B 48 24.938 4.421 9.326 1.00 0.42 H new ATOM 0 HB2 GLU B 48 23.422 6.095 10.798 1.00 0.47 H new ATOM 0 HB3 GLU B 48 22.288 4.762 10.701 1.00 0.47 H new ATOM 0 HG2 GLU B 48 23.585 4.218 12.620 1.00 1.16 H new ATOM 0 HG3 GLU B 48 24.310 3.234 11.364 1.00 1.16 H new ATOM 2391 N ILE B 49 23.670 2.894 7.599 1.00 0.32 N ATOM 2392 CA ILE B 49 23.037 1.700 6.972 1.00 0.30 C ATOM 2393 C ILE B 49 24.155 0.819 6.428 1.00 0.30 C ATOM 2394 O ILE B 49 24.091 -0.397 6.502 1.00 0.31 O ATOM 2395 CB ILE B 49 22.117 2.145 5.816 1.00 0.29 C ATOM 2396 CG1 ILE B 49 20.773 2.707 6.334 1.00 0.35 C ATOM 2397 CG2 ILE B 49 21.840 0.960 4.891 1.00 0.29 C ATOM 2398 CD1 ILE B 49 20.835 4.235 6.378 1.00 0.51 C ATOM 0 H ILE B 49 24.518 3.222 7.137 1.00 0.32 H new ATOM 0 HA ILE B 49 22.438 1.155 7.702 1.00 0.30 H new ATOM 0 HB ILE B 49 22.631 2.938 5.273 1.00 0.29 H new ATOM 0 HG12 ILE B 49 19.959 2.385 5.685 1.00 0.35 H new ATOM 0 HG13 ILE B 49 20.562 2.313 7.328 1.00 0.35 H new ATOM 0 HG21 ILE B 49 21.190 1.279 4.076 1.00 0.29 H new ATOM 0 HG22 ILE B 49 22.780 0.590 4.482 1.00 0.29 H new ATOM 0 HG23 ILE B 49 21.352 0.165 5.455 1.00 0.29 H new ATOM 0 HD11 ILE B 49 19.886 4.627 6.744 1.00 0.51 H new ATOM 0 HD12 ILE B 49 21.638 4.547 7.045 1.00 0.51 H new ATOM 0 HD13 ILE B 49 21.025 4.620 5.376 1.00 0.51 H new ATOM 2410 N ILE B 50 25.197 1.427 5.917 1.00 0.30 N ATOM 2411 CA ILE B 50 26.343 0.636 5.397 1.00 0.31 C ATOM 2412 C ILE B 50 27.401 0.599 6.487 1.00 0.36 C ATOM 2413 O ILE B 50 27.315 1.318 7.463 1.00 0.57 O ATOM 2414 CB ILE B 50 26.887 1.289 4.112 1.00 0.31 C ATOM 2415 CG1 ILE B 50 25.992 0.845 2.942 1.00 0.35 C ATOM 2416 CG2 ILE B 50 28.338 0.844 3.835 1.00 0.36 C ATOM 2417 CD1 ILE B 50 26.373 1.585 1.655 1.00 0.70 C ATOM 0 H ILE B 50 25.299 2.439 5.840 1.00 0.30 H new ATOM 0 HA ILE B 50 26.040 -0.380 5.143 1.00 0.31 H new ATOM 0 HB ILE B 50 26.881 2.373 4.227 1.00 0.31 H new ATOM 0 HG12 ILE B 50 26.089 -0.230 2.791 1.00 0.35 H new ATOM 0 HG13 ILE B 50 24.947 1.040 3.183 1.00 0.35 H new ATOM 0 HG21 ILE B 50 28.697 1.320 2.922 1.00 0.36 H new ATOM 0 HG22 ILE B 50 28.974 1.136 4.671 1.00 0.36 H new ATOM 0 HG23 ILE B 50 28.370 -0.239 3.716 1.00 0.36 H new ATOM 0 HD11 ILE B 50 25.727 1.255 0.841 1.00 0.70 H new ATOM 0 HD12 ILE B 50 26.252 2.658 1.803 1.00 0.70 H new ATOM 0 HD13 ILE B 50 27.412 1.369 1.405 1.00 0.70 H new ATOM 2429 N ARG B 51 28.375 -0.249 6.344 1.00 0.42 N ATOM 2430 CA ARG B 51 29.430 -0.364 7.382 1.00 0.44 C ATOM 2431 C ARG B 51 30.778 -0.541 6.678 1.00 0.44 C ATOM 2432 O ARG B 51 30.869 -1.116 5.612 1.00 0.54 O ATOM 2433 CB ARG B 51 29.065 -1.565 8.278 1.00 0.52 C ATOM 2434 CG ARG B 51 30.125 -1.847 9.352 1.00 0.75 C ATOM 2435 CD ARG B 51 29.874 -0.944 10.559 1.00 0.89 C ATOM 2436 NE ARG B 51 30.986 -1.104 11.538 1.00 0.89 N ATOM 2437 CZ ARG B 51 30.841 -0.681 12.764 1.00 0.95 C ATOM 2438 NH1 ARG B 51 29.724 -0.117 13.132 1.00 1.50 N ATOM 2439 NH2 ARG B 51 31.813 -0.826 13.623 1.00 1.24 N ATOM 0 H ARG B 51 28.487 -0.873 5.545 1.00 0.42 H new ATOM 0 HA ARG B 51 29.503 0.524 8.010 1.00 0.44 H new ATOM 0 HB2 ARG B 51 28.106 -1.375 8.761 1.00 0.52 H new ATOM 0 HB3 ARG B 51 28.939 -2.452 7.657 1.00 0.52 H new ATOM 0 HG2 ARG B 51 30.085 -2.894 9.652 1.00 0.75 H new ATOM 0 HG3 ARG B 51 31.122 -1.668 8.951 1.00 0.75 H new ATOM 0 HD2 ARG B 51 29.803 0.096 10.240 1.00 0.89 H new ATOM 0 HD3 ARG B 51 28.923 -1.200 11.027 1.00 0.89 H new ATOM 0 HE ARG B 51 31.860 -1.544 11.250 1.00 0.89 H new ATOM 0 HH11 ARG B 51 28.963 -0.006 12.461 1.00 1.50 H new ATOM 0 HH12 ARG B 51 29.611 0.213 14.090 1.00 1.50 H new ATOM 0 HH21 ARG B 51 32.685 -1.270 13.336 1.00 1.24 H new ATOM 0 HH22 ARG B 51 31.700 -0.496 14.581 1.00 1.24 H new ATOM 2453 N GLN B 52 31.819 -0.012 7.263 1.00 0.44 N ATOM 2454 CA GLN B 52 33.166 -0.099 6.631 1.00 0.48 C ATOM 2455 C GLN B 52 33.942 -1.286 7.195 1.00 0.53 C ATOM 2456 O GLN B 52 34.385 -1.266 8.327 1.00 0.65 O ATOM 2457 CB GLN B 52 33.942 1.190 6.916 1.00 0.61 C ATOM 2458 CG GLN B 52 34.493 1.758 5.606 1.00 1.46 C ATOM 2459 CD GLN B 52 35.378 2.969 5.907 1.00 1.70 C ATOM 2460 OE1 GLN B 52 36.364 2.856 6.608 1.00 2.42 O ATOM 2461 NE2 GLN B 52 35.066 4.131 5.402 1.00 1.80 N ATOM 0 H GLN B 52 31.793 0.479 8.157 1.00 0.44 H new ATOM 0 HA GLN B 52 33.044 -0.233 5.556 1.00 0.48 H new ATOM 0 HB2 GLN B 52 33.290 1.920 7.395 1.00 0.61 H new ATOM 0 HB3 GLN B 52 34.759 0.989 7.609 1.00 0.61 H new ATOM 0 HG2 GLN B 52 35.068 0.996 5.080 1.00 1.46 H new ATOM 0 HG3 GLN B 52 33.673 2.048 4.949 1.00 1.46 H new ATOM 0 HE21 GLN B 52 34.238 4.226 4.814 1.00 1.80 H new ATOM 0 HE22 GLN B 52 35.650 4.945 5.596 1.00 1.80 H new ATOM 2470 N GLU B 53 34.114 -2.308 6.395 1.00 0.57 N ATOM 2471 CA GLU B 53 34.872 -3.515 6.835 1.00 0.74 C ATOM 2472 C GLU B 53 36.126 -3.640 5.976 1.00 0.75 C ATOM 2473 O GLU B 53 36.078 -4.083 4.850 1.00 0.76 O ATOM 2474 CB GLU B 53 33.985 -4.751 6.651 1.00 0.90 C ATOM 2475 CG GLU B 53 34.739 -6.030 7.042 1.00 1.02 C ATOM 2476 CD GLU B 53 35.206 -5.947 8.497 1.00 1.37 C ATOM 2477 OE1 GLU B 53 36.232 -5.332 8.736 1.00 1.95 O ATOM 2478 OE2 GLU B 53 34.531 -6.503 9.347 1.00 2.11 O ATOM 0 H GLU B 53 33.755 -2.356 5.441 1.00 0.57 H new ATOM 0 HA GLU B 53 35.156 -3.430 7.884 1.00 0.74 H new ATOM 0 HB2 GLU B 53 33.087 -4.653 7.261 1.00 0.90 H new ATOM 0 HB3 GLU B 53 33.660 -4.819 5.613 1.00 0.90 H new ATOM 0 HG2 GLU B 53 34.092 -6.897 6.910 1.00 1.02 H new ATOM 0 HG3 GLU B 53 35.597 -6.170 6.385 1.00 1.02 H new ATOM 2485 N GLY B 54 37.246 -3.248 6.507 1.00 0.80 N ATOM 2486 CA GLY B 54 38.514 -3.337 5.734 1.00 0.85 C ATOM 2487 C GLY B 54 38.426 -2.457 4.481 1.00 0.74 C ATOM 2488 O GLY B 54 38.973 -2.788 3.448 1.00 0.88 O ATOM 0 H GLY B 54 37.340 -2.867 7.449 1.00 0.80 H new ATOM 0 HA2 GLY B 54 39.351 -3.018 6.355 1.00 0.85 H new ATOM 0 HA3 GLY B 54 38.704 -4.372 5.449 1.00 0.85 H new ATOM 2492 N LYS B 55 37.714 -1.358 4.564 1.00 0.78 N ATOM 2493 CA LYS B 55 37.541 -0.443 3.388 1.00 0.78 C ATOM 2494 C LYS B 55 36.408 -0.966 2.499 1.00 0.69 C ATOM 2495 O LYS B 55 36.037 -0.350 1.520 1.00 0.70 O ATOM 2496 CB LYS B 55 38.838 -0.332 2.577 1.00 0.91 C ATOM 2497 CG LYS B 55 38.968 1.091 2.028 1.00 1.13 C ATOM 2498 CD LYS B 55 39.932 1.102 0.839 1.00 1.34 C ATOM 2499 CE LYS B 55 40.055 2.529 0.298 1.00 1.60 C ATOM 2500 NZ LYS B 55 40.858 2.519 -0.957 1.00 2.11 N ATOM 0 H LYS B 55 37.237 -1.051 5.412 1.00 0.78 H new ATOM 0 HA LYS B 55 37.290 0.552 3.756 1.00 0.78 H new ATOM 0 HB2 LYS B 55 39.696 -0.572 3.205 1.00 0.91 H new ATOM 0 HB3 LYS B 55 38.832 -1.051 1.758 1.00 0.91 H new ATOM 0 HG2 LYS B 55 37.991 1.462 1.719 1.00 1.13 H new ATOM 0 HG3 LYS B 55 39.331 1.760 2.808 1.00 1.13 H new ATOM 0 HD2 LYS B 55 40.910 0.732 1.146 1.00 1.34 H new ATOM 0 HD3 LYS B 55 39.570 0.435 0.057 1.00 1.34 H new ATOM 0 HE2 LYS B 55 39.065 2.942 0.105 1.00 1.60 H new ATOM 0 HE3 LYS B 55 40.529 3.171 1.040 1.00 1.60 H new ATOM 0 HZ1 LYS B 55 40.941 3.489 -1.324 1.00 2.11 H new ATOM 0 HZ2 LYS B 55 41.807 2.141 -0.759 1.00 2.11 H new ATOM 0 HZ3 LYS B 55 40.388 1.920 -1.665 1.00 2.11 H new ATOM 2514 N GLN B 56 35.849 -2.092 2.848 1.00 0.70 N ATOM 2515 CA GLN B 56 34.729 -2.652 2.039 1.00 0.70 C ATOM 2516 C GLN B 56 33.419 -2.187 2.659 1.00 0.60 C ATOM 2517 O GLN B 56 33.399 -1.688 3.763 1.00 0.60 O ATOM 2518 CB GLN B 56 34.757 -4.182 2.053 1.00 0.85 C ATOM 2519 CG GLN B 56 36.174 -4.677 1.787 1.00 1.17 C ATOM 2520 CD GLN B 56 36.109 -5.967 0.966 1.00 1.15 C ATOM 2521 OE1 GLN B 56 36.852 -6.140 0.021 1.00 1.54 O ATOM 2522 NE2 GLN B 56 35.240 -6.886 1.292 1.00 1.66 N ATOM 0 H GLN B 56 36.119 -2.649 3.659 1.00 0.70 H new ATOM 0 HA GLN B 56 34.827 -2.310 1.009 1.00 0.70 H new ATOM 0 HB2 GLN B 56 34.408 -4.552 3.017 1.00 0.85 H new ATOM 0 HB3 GLN B 56 34.077 -4.574 1.296 1.00 0.85 H new ATOM 0 HG2 GLN B 56 36.743 -3.918 1.250 1.00 1.17 H new ATOM 0 HG3 GLN B 56 36.692 -4.857 2.729 1.00 1.17 H new ATOM 0 HE21 GLN B 56 34.617 -6.740 2.086 1.00 1.66 H new ATOM 0 HE22 GLN B 56 35.185 -7.750 0.753 1.00 1.66 H new ATOM 2531 N TYR B 57 32.332 -2.337 1.956 1.00 0.56 N ATOM 2532 CA TYR B 57 31.022 -1.888 2.498 1.00 0.48 C ATOM 2533 C TYR B 57 30.274 -3.083 3.066 1.00 0.47 C ATOM 2534 O TYR B 57 29.983 -4.027 2.366 1.00 0.53 O ATOM 2535 CB TYR B 57 30.197 -1.281 1.372 1.00 0.46 C ATOM 2536 CG TYR B 57 31.055 -0.320 0.582 1.00 0.49 C ATOM 2537 CD1 TYR B 57 31.536 0.844 1.192 1.00 1.18 C ATOM 2538 CD2 TYR B 57 31.371 -0.592 -0.754 1.00 1.27 C ATOM 2539 CE1 TYR B 57 32.333 1.738 0.466 1.00 1.18 C ATOM 2540 CE2 TYR B 57 32.169 0.302 -1.480 1.00 1.30 C ATOM 2541 CZ TYR B 57 32.649 1.466 -0.870 1.00 0.57 C ATOM 2542 OH TYR B 57 33.435 2.346 -1.585 1.00 0.63 O ATOM 0 H TYR B 57 32.295 -2.753 1.025 1.00 0.56 H new ATOM 0 HA TYR B 57 31.186 -1.148 3.282 1.00 0.48 H new ATOM 0 HB2 TYR B 57 29.818 -2.068 0.720 1.00 0.46 H new ATOM 0 HB3 TYR B 57 29.331 -0.761 1.781 1.00 0.46 H new ATOM 0 HD1 TYR B 57 31.292 1.053 2.223 1.00 1.18 H new ATOM 0 HD2 TYR B 57 31.000 -1.490 -1.225 1.00 1.27 H new ATOM 0 HE1 TYR B 57 32.703 2.637 0.937 1.00 1.18 H new ATOM 0 HE2 TYR B 57 32.414 0.092 -2.511 1.00 1.30 H new ATOM 0 HH TYR B 57 33.560 2.007 -2.496 1.00 0.63 H new ATOM 2552 N MET B 58 29.985 -3.035 4.338 1.00 0.44 N ATOM 2553 CA MET B 58 29.262 -4.145 5.018 1.00 0.45 C ATOM 2554 C MET B 58 27.942 -3.594 5.558 1.00 0.42 C ATOM 2555 O MET B 58 27.693 -2.408 5.486 1.00 0.40 O ATOM 2556 CB MET B 58 30.147 -4.707 6.141 1.00 0.50 C ATOM 2557 CG MET B 58 29.381 -5.722 6.987 1.00 1.04 C ATOM 2558 SD MET B 58 30.562 -6.717 7.930 1.00 1.10 S ATOM 2559 CE MET B 58 29.697 -6.656 9.517 1.00 1.52 C ATOM 0 H MET B 58 30.226 -2.254 4.948 1.00 0.44 H new ATOM 0 HA MET B 58 29.044 -4.960 4.327 1.00 0.45 H new ATOM 0 HB2 MET B 58 31.030 -5.180 5.711 1.00 0.50 H new ATOM 0 HB3 MET B 58 30.498 -3.892 6.774 1.00 0.50 H new ATOM 0 HG2 MET B 58 28.697 -5.209 7.663 1.00 1.04 H new ATOM 0 HG3 MET B 58 28.775 -6.364 6.347 1.00 1.04 H new ATOM 0 HE1 MET B 58 30.262 -7.218 10.261 1.00 1.52 H new ATOM 0 HE2 MET B 58 29.602 -5.619 9.840 1.00 1.52 H new ATOM 0 HE3 MET B 58 28.705 -7.094 9.408 1.00 1.52 H new ATOM 2569 N LEU B 59 27.092 -4.442 6.068 1.00 0.44 N ATOM 2570 CA LEU B 59 25.769 -3.962 6.581 1.00 0.43 C ATOM 2571 C LEU B 59 25.840 -3.744 8.095 1.00 0.41 C ATOM 2572 O LEU B 59 26.349 -4.568 8.828 1.00 0.47 O ATOM 2573 CB LEU B 59 24.656 -4.978 6.236 1.00 0.51 C ATOM 2574 CG LEU B 59 24.709 -6.247 7.116 1.00 0.77 C ATOM 2575 CD1 LEU B 59 23.581 -7.191 6.696 1.00 1.05 C ATOM 2576 CD2 LEU B 59 26.047 -6.966 6.934 1.00 1.25 C ATOM 0 H LEU B 59 27.252 -5.446 6.153 1.00 0.44 H new ATOM 0 HA LEU B 59 25.531 -3.013 6.100 1.00 0.43 H new ATOM 0 HB2 LEU B 59 23.684 -4.499 6.355 1.00 0.51 H new ATOM 0 HB3 LEU B 59 24.744 -5.264 5.188 1.00 0.51 H new ATOM 0 HG LEU B 59 24.597 -5.958 8.161 1.00 0.77 H new ATOM 0 HD11 LEU B 59 23.611 -8.090 7.312 1.00 1.05 H new ATOM 0 HD12 LEU B 59 22.621 -6.692 6.828 1.00 1.05 H new ATOM 0 HD13 LEU B 59 23.707 -7.465 5.648 1.00 1.05 H new ATOM 0 HD21 LEU B 59 26.069 -7.858 7.560 1.00 1.25 H new ATOM 0 HD22 LEU B 59 26.167 -7.253 5.889 1.00 1.25 H new ATOM 0 HD23 LEU B 59 26.860 -6.300 7.222 1.00 1.25 H new ATOM 2588 N THR B 60 25.326 -2.636 8.566 1.00 0.38 N ATOM 2589 CA THR B 60 25.356 -2.363 10.034 1.00 0.41 C ATOM 2590 C THR B 60 24.031 -2.820 10.641 1.00 0.44 C ATOM 2591 O THR B 60 23.092 -3.104 9.924 1.00 0.43 O ATOM 2592 CB THR B 60 25.535 -0.862 10.293 1.00 0.40 C ATOM 2593 OG1 THR B 60 24.780 -0.489 11.437 1.00 1.04 O ATOM 2594 CG2 THR B 60 25.052 -0.062 9.086 1.00 1.01 C ATOM 0 H THR B 60 24.888 -1.910 7.998 1.00 0.38 H new ATOM 0 HA THR B 60 26.190 -2.901 10.485 1.00 0.41 H new ATOM 0 HB THR B 60 26.591 -0.652 10.462 1.00 0.40 H new ATOM 0 HG1 THR B 60 24.894 0.470 11.606 1.00 1.04 H new ATOM 0 HG21 THR B 60 25.183 1.003 9.279 1.00 1.01 H new ATOM 0 HG22 THR B 60 25.631 -0.345 8.207 1.00 1.01 H new ATOM 0 HG23 THR B 60 23.997 -0.272 8.909 1.00 1.01 H new ATOM 2602 N LYS B 61 23.950 -2.900 11.948 1.00 0.51 N ATOM 2603 CA LYS B 61 22.675 -3.338 12.598 1.00 0.54 C ATOM 2604 C LYS B 61 21.497 -2.621 11.924 1.00 0.51 C ATOM 2605 O LYS B 61 20.459 -3.197 11.664 1.00 0.50 O ATOM 2606 CB LYS B 61 22.697 -2.997 14.097 1.00 0.61 C ATOM 2607 CG LYS B 61 23.393 -1.651 14.341 1.00 1.28 C ATOM 2608 CD LYS B 61 24.817 -1.897 14.844 1.00 1.04 C ATOM 2609 CE LYS B 61 25.609 -0.589 14.795 1.00 1.73 C ATOM 2610 NZ LYS B 61 26.753 -0.665 15.748 1.00 2.19 N ATOM 0 H LYS B 61 24.711 -2.681 12.591 1.00 0.51 H new ATOM 0 HA LYS B 61 22.566 -4.417 12.486 1.00 0.54 H new ATOM 0 HB2 LYS B 61 21.677 -2.959 14.481 1.00 0.61 H new ATOM 0 HB3 LYS B 61 23.215 -3.784 14.646 1.00 0.61 H new ATOM 0 HG2 LYS B 61 23.417 -1.069 13.419 1.00 1.28 H new ATOM 0 HG3 LYS B 61 22.833 -1.067 15.072 1.00 1.28 H new ATOM 0 HD2 LYS B 61 24.792 -2.282 15.864 1.00 1.04 H new ATOM 0 HD3 LYS B 61 25.305 -2.653 14.230 1.00 1.04 H new ATOM 0 HE2 LYS B 61 25.975 -0.411 13.784 1.00 1.73 H new ATOM 0 HE3 LYS B 61 24.962 0.250 15.052 1.00 1.73 H new ATOM 0 HZ1 LYS B 61 27.292 0.224 15.715 1.00 2.19 H new ATOM 0 HZ2 LYS B 61 26.393 -0.816 16.712 1.00 2.19 H new ATOM 0 HZ3 LYS B 61 27.374 -1.456 15.483 1.00 2.19 H new ATOM 2624 N LYS B 62 21.667 -1.363 11.643 1.00 0.51 N ATOM 2625 CA LYS B 62 20.588 -0.577 10.979 1.00 0.49 C ATOM 2626 C LYS B 62 20.312 -1.131 9.574 1.00 0.45 C ATOM 2627 O LYS B 62 19.180 -1.210 9.140 1.00 0.53 O ATOM 2628 CB LYS B 62 21.020 0.888 10.869 1.00 0.54 C ATOM 2629 CG LYS B 62 20.589 1.652 12.125 1.00 0.75 C ATOM 2630 CD LYS B 62 21.249 1.026 13.355 1.00 1.16 C ATOM 2631 CE LYS B 62 20.960 1.885 14.589 1.00 1.17 C ATOM 2632 NZ LYS B 62 19.783 2.760 14.323 1.00 2.08 N ATOM 0 H LYS B 62 22.517 -0.837 11.846 1.00 0.51 H new ATOM 0 HA LYS B 62 19.679 -0.653 11.575 1.00 0.49 H new ATOM 0 HB2 LYS B 62 22.102 0.950 10.748 1.00 0.54 H new ATOM 0 HB3 LYS B 62 20.574 1.343 9.985 1.00 0.54 H new ATOM 0 HG2 LYS B 62 20.873 2.701 12.041 1.00 0.75 H new ATOM 0 HG3 LYS B 62 19.504 1.623 12.227 1.00 0.75 H new ATOM 0 HD2 LYS B 62 20.871 0.015 13.507 1.00 1.16 H new ATOM 0 HD3 LYS B 62 22.325 0.945 13.201 1.00 1.16 H new ATOM 0 HE2 LYS B 62 20.765 1.247 15.451 1.00 1.17 H new ATOM 0 HE3 LYS B 62 21.831 2.493 14.833 1.00 1.17 H new ATOM 0 HZ1 LYS B 62 19.483 3.216 15.208 1.00 2.08 H new ATOM 0 HZ2 LYS B 62 20.042 3.489 13.628 1.00 2.08 H new ATOM 0 HZ3 LYS B 62 19.002 2.186 13.947 1.00 2.08 H new ATOM 2646 N GLY B 63 21.342 -1.483 8.848 1.00 0.41 N ATOM 2647 CA GLY B 63 21.141 -1.993 7.459 1.00 0.39 C ATOM 2648 C GLY B 63 20.378 -3.321 7.450 1.00 0.38 C ATOM 2649 O GLY B 63 19.478 -3.516 6.658 1.00 0.39 O ATOM 0 H GLY B 63 22.313 -1.439 9.157 1.00 0.41 H new ATOM 0 HA2 GLY B 63 20.592 -1.254 6.875 1.00 0.39 H new ATOM 0 HA3 GLY B 63 22.109 -2.126 6.976 1.00 0.39 H new ATOM 2653 N GLU B 64 20.715 -4.235 8.314 1.00 0.40 N ATOM 2654 CA GLU B 64 19.979 -5.538 8.325 1.00 0.43 C ATOM 2655 C GLU B 64 18.518 -5.294 8.708 1.00 0.43 C ATOM 2656 O GLU B 64 17.603 -5.748 8.048 1.00 0.42 O ATOM 2657 CB GLU B 64 20.613 -6.507 9.323 1.00 0.52 C ATOM 2658 CG GLU B 64 21.812 -5.841 9.979 1.00 0.63 C ATOM 2659 CD GLU B 64 22.470 -6.813 10.960 1.00 0.88 C ATOM 2660 OE1 GLU B 64 21.781 -7.701 11.434 1.00 1.51 O ATOM 2661 OE2 GLU B 64 23.651 -6.653 11.221 1.00 1.45 O ATOM 0 H GLU B 64 21.458 -4.143 9.007 1.00 0.40 H new ATOM 0 HA GLU B 64 20.033 -5.978 7.329 1.00 0.43 H new ATOM 0 HB2 GLU B 64 19.884 -6.796 10.080 1.00 0.52 H new ATOM 0 HB3 GLU B 64 20.923 -7.420 8.814 1.00 0.52 H new ATOM 0 HG2 GLU B 64 22.531 -5.534 9.219 1.00 0.63 H new ATOM 0 HG3 GLU B 64 21.497 -4.938 10.503 1.00 0.63 H new ATOM 2668 N GLU B 65 18.296 -4.577 9.776 1.00 0.46 N ATOM 2669 CA GLU B 65 16.899 -4.301 10.212 1.00 0.49 C ATOM 2670 C GLU B 65 16.150 -3.596 9.081 1.00 0.45 C ATOM 2671 O GLU B 65 14.962 -3.777 8.901 1.00 0.48 O ATOM 2672 CB GLU B 65 16.918 -3.405 11.452 1.00 0.54 C ATOM 2673 CG GLU B 65 17.350 -4.225 12.669 1.00 0.62 C ATOM 2674 CD GLU B 65 17.384 -3.326 13.906 1.00 1.07 C ATOM 2675 OE1 GLU B 65 16.561 -2.429 13.984 1.00 1.68 O ATOM 2676 OE2 GLU B 65 18.232 -3.549 14.754 1.00 1.66 O ATOM 0 H GLU B 65 19.023 -4.171 10.365 1.00 0.46 H new ATOM 0 HA GLU B 65 16.398 -5.238 10.454 1.00 0.49 H new ATOM 0 HB2 GLU B 65 17.603 -2.571 11.300 1.00 0.54 H new ATOM 0 HB3 GLU B 65 15.929 -2.978 11.620 1.00 0.54 H new ATOM 0 HG2 GLU B 65 16.658 -5.052 12.827 1.00 0.62 H new ATOM 0 HG3 GLU B 65 18.334 -4.661 12.496 1.00 0.62 H new ATOM 2683 N LEU B 66 16.838 -2.799 8.311 1.00 0.44 N ATOM 2684 CA LEU B 66 16.169 -2.089 7.186 1.00 0.45 C ATOM 2685 C LEU B 66 15.879 -3.092 6.065 1.00 0.43 C ATOM 2686 O LEU B 66 14.833 -3.057 5.447 1.00 0.45 O ATOM 2687 CB LEU B 66 17.090 -0.967 6.679 1.00 0.46 C ATOM 2688 CG LEU B 66 16.546 -0.353 5.382 1.00 0.64 C ATOM 2689 CD1 LEU B 66 15.104 0.113 5.589 1.00 0.72 C ATOM 2690 CD2 LEU B 66 17.412 0.847 5.004 1.00 1.57 C ATOM 0 H LEU B 66 17.835 -2.609 8.413 1.00 0.44 H new ATOM 0 HA LEU B 66 15.229 -1.649 7.521 1.00 0.45 H new ATOM 0 HB2 LEU B 66 17.181 -0.194 7.442 1.00 0.46 H new ATOM 0 HB3 LEU B 66 18.091 -1.363 6.506 1.00 0.46 H new ATOM 0 HG LEU B 66 16.569 -1.100 4.589 1.00 0.64 H new ATOM 0 HD11 LEU B 66 14.726 0.547 4.664 1.00 0.72 H new ATOM 0 HD12 LEU B 66 14.484 -0.738 5.871 1.00 0.72 H new ATOM 0 HD13 LEU B 66 15.074 0.862 6.380 1.00 0.72 H new ATOM 0 HD21 LEU B 66 17.035 1.292 4.083 1.00 1.57 H new ATOM 0 HD22 LEU B 66 17.379 1.586 5.804 1.00 1.57 H new ATOM 0 HD23 LEU B 66 18.441 0.520 4.854 1.00 1.57 H new ATOM 2702 N LEU B 67 16.787 -3.994 5.801 1.00 0.42 N ATOM 2703 CA LEU B 67 16.550 -5.000 4.727 1.00 0.43 C ATOM 2704 C LEU B 67 15.233 -5.728 4.991 1.00 0.45 C ATOM 2705 O LEU B 67 14.431 -5.927 4.100 1.00 0.48 O ATOM 2706 CB LEU B 67 17.696 -6.020 4.722 1.00 0.45 C ATOM 2707 CG LEU B 67 17.753 -6.742 3.361 1.00 0.51 C ATOM 2708 CD1 LEU B 67 18.189 -5.777 2.245 1.00 0.90 C ATOM 2709 CD2 LEU B 67 18.752 -7.902 3.433 1.00 1.26 C ATOM 0 H LEU B 67 17.682 -4.077 6.283 1.00 0.42 H new ATOM 0 HA LEU B 67 16.502 -4.495 3.762 1.00 0.43 H new ATOM 0 HB2 LEU B 67 18.643 -5.516 4.916 1.00 0.45 H new ATOM 0 HB3 LEU B 67 17.551 -6.746 5.522 1.00 0.45 H new ATOM 0 HG LEU B 67 16.755 -7.118 3.134 1.00 0.51 H new ATOM 0 HD11 LEU B 67 18.221 -6.310 1.295 1.00 0.90 H new ATOM 0 HD12 LEU B 67 17.476 -4.955 2.176 1.00 0.90 H new ATOM 0 HD13 LEU B 67 19.179 -5.381 2.473 1.00 0.90 H new ATOM 0 HD21 LEU B 67 18.790 -8.410 2.469 1.00 1.26 H new ATOM 0 HD22 LEU B 67 19.741 -7.516 3.678 1.00 1.26 H new ATOM 0 HD23 LEU B 67 18.437 -8.607 4.203 1.00 1.26 H new ATOM 2721 N GLU B 68 15.004 -6.131 6.213 1.00 0.44 N ATOM 2722 CA GLU B 68 13.740 -6.849 6.536 1.00 0.48 C ATOM 2723 C GLU B 68 12.562 -5.888 6.392 1.00 0.46 C ATOM 2724 O GLU B 68 11.534 -6.228 5.840 1.00 0.47 O ATOM 2725 CB GLU B 68 13.802 -7.369 7.974 1.00 0.52 C ATOM 2726 CG GLU B 68 14.230 -8.837 7.971 1.00 1.26 C ATOM 2727 CD GLU B 68 14.605 -9.263 9.392 1.00 1.77 C ATOM 2728 OE1 GLU B 68 14.666 -8.399 10.251 1.00 2.23 O ATOM 2729 OE2 GLU B 68 14.825 -10.445 9.596 1.00 2.25 O ATOM 0 H GLU B 68 15.638 -5.993 7.000 1.00 0.44 H new ATOM 0 HA GLU B 68 13.612 -7.688 5.852 1.00 0.48 H new ATOM 0 HB2 GLU B 68 14.507 -6.775 8.556 1.00 0.52 H new ATOM 0 HB3 GLU B 68 12.828 -7.265 8.451 1.00 0.52 H new ATOM 0 HG2 GLU B 68 13.420 -9.462 7.595 1.00 1.26 H new ATOM 0 HG3 GLU B 68 15.079 -8.978 7.302 1.00 1.26 H new ATOM 2736 N ASP B 69 12.702 -4.688 6.882 1.00 0.44 N ATOM 2737 CA ASP B 69 11.589 -3.707 6.768 1.00 0.45 C ATOM 2738 C ASP B 69 11.206 -3.543 5.297 1.00 0.45 C ATOM 2739 O ASP B 69 10.050 -3.635 4.934 1.00 0.46 O ATOM 2740 CB ASP B 69 12.031 -2.357 7.333 1.00 0.46 C ATOM 2741 CG ASP B 69 12.645 -2.556 8.719 1.00 0.51 C ATOM 2742 OD1 ASP B 69 12.395 -3.593 9.313 1.00 1.25 O ATOM 2743 OD2 ASP B 69 13.356 -1.670 9.164 1.00 1.12 O ATOM 0 H ASP B 69 13.538 -4.345 7.356 1.00 0.44 H new ATOM 0 HA ASP B 69 10.729 -4.069 7.332 1.00 0.45 H new ATOM 0 HB2 ASP B 69 12.757 -1.893 6.666 1.00 0.46 H new ATOM 0 HB3 ASP B 69 11.178 -1.681 7.396 1.00 0.46 H new ATOM 2748 N ILE B 70 12.165 -3.302 4.443 1.00 0.45 N ATOM 2749 CA ILE B 70 11.849 -3.136 2.996 1.00 0.49 C ATOM 2750 C ILE B 70 11.167 -4.401 2.474 1.00 0.48 C ATOM 2751 O ILE B 70 10.256 -4.343 1.672 1.00 0.50 O ATOM 2752 CB ILE B 70 13.146 -2.899 2.217 1.00 0.56 C ATOM 2753 CG1 ILE B 70 13.571 -1.434 2.369 1.00 0.90 C ATOM 2754 CG2 ILE B 70 12.921 -3.213 0.735 1.00 0.85 C ATOM 2755 CD1 ILE B 70 14.998 -1.245 1.845 1.00 1.29 C ATOM 0 H ILE B 70 13.152 -3.213 4.685 1.00 0.45 H new ATOM 0 HA ILE B 70 11.183 -2.284 2.865 1.00 0.49 H new ATOM 0 HB ILE B 70 13.928 -3.549 2.610 1.00 0.56 H new ATOM 0 HG12 ILE B 70 12.885 -0.789 1.820 1.00 0.90 H new ATOM 0 HG13 ILE B 70 13.517 -1.138 3.417 1.00 0.90 H new ATOM 0 HG21 ILE B 70 13.845 -3.044 0.183 1.00 0.85 H new ATOM 0 HG22 ILE B 70 12.619 -4.254 0.626 1.00 0.85 H new ATOM 0 HG23 ILE B 70 12.139 -2.565 0.340 1.00 0.85 H new ATOM 0 HD11 ILE B 70 15.291 -0.201 1.957 1.00 1.29 H new ATOM 0 HD12 ILE B 70 15.681 -1.877 2.413 1.00 1.29 H new ATOM 0 HD13 ILE B 70 15.039 -1.522 0.792 1.00 1.29 H new ATOM 2767 N ARG B 71 11.602 -5.544 2.924 1.00 0.47 N ATOM 2768 CA ARG B 71 10.983 -6.816 2.460 1.00 0.50 C ATOM 2769 C ARG B 71 9.486 -6.814 2.777 1.00 0.50 C ATOM 2770 O ARG B 71 8.657 -6.997 1.910 1.00 0.54 O ATOM 2771 CB ARG B 71 11.652 -7.994 3.171 1.00 0.52 C ATOM 2772 CG ARG B 71 12.021 -9.069 2.147 1.00 0.82 C ATOM 2773 CD ARG B 71 12.641 -10.268 2.867 1.00 1.02 C ATOM 2774 NE ARG B 71 11.687 -11.412 2.840 1.00 1.57 N ATOM 2775 CZ ARG B 71 11.580 -12.148 1.768 1.00 2.17 C ATOM 2776 NH1 ARG B 71 12.309 -11.882 0.719 1.00 2.58 N ATOM 2777 NH2 ARG B 71 10.744 -13.149 1.745 1.00 2.98 N ATOM 0 H ARG B 71 12.362 -5.652 3.595 1.00 0.47 H new ATOM 0 HA ARG B 71 11.120 -6.910 1.383 1.00 0.50 H new ATOM 0 HB2 ARG B 71 12.545 -7.655 3.696 1.00 0.52 H new ATOM 0 HB3 ARG B 71 10.979 -8.408 3.922 1.00 0.52 H new ATOM 0 HG2 ARG B 71 11.134 -9.381 1.596 1.00 0.82 H new ATOM 0 HG3 ARG B 71 12.724 -8.666 1.418 1.00 0.82 H new ATOM 0 HD2 ARG B 71 13.577 -10.550 2.386 1.00 1.02 H new ATOM 0 HD3 ARG B 71 12.879 -10.004 3.897 1.00 1.02 H new ATOM 0 HE ARG B 71 11.117 -11.620 3.660 1.00 1.57 H new ATOM 0 HH11 ARG B 71 12.962 -11.099 0.737 1.00 2.58 H new ATOM 0 HH12 ARG B 71 12.226 -12.457 -0.119 1.00 2.58 H new ATOM 0 HH21 ARG B 71 10.174 -13.356 2.565 1.00 2.98 H new ATOM 0 HH22 ARG B 71 10.660 -13.724 0.907 1.00 2.98 H new ATOM 2791 N LYS B 72 9.139 -6.620 4.021 1.00 0.48 N ATOM 2792 CA LYS B 72 7.699 -6.621 4.414 1.00 0.49 C ATOM 2793 C LYS B 72 6.914 -5.623 3.558 1.00 0.48 C ATOM 2794 O LYS B 72 5.962 -5.981 2.892 1.00 0.51 O ATOM 2795 CB LYS B 72 7.580 -6.233 5.888 1.00 0.49 C ATOM 2796 CG LYS B 72 8.490 -7.131 6.728 1.00 0.65 C ATOM 2797 CD LYS B 72 7.851 -7.369 8.098 1.00 0.91 C ATOM 2798 CE LYS B 72 8.781 -8.234 8.952 1.00 1.46 C ATOM 2799 NZ LYS B 72 9.034 -7.556 10.255 1.00 1.81 N ATOM 0 H LYS B 72 9.794 -6.460 4.786 1.00 0.48 H new ATOM 0 HA LYS B 72 7.287 -7.618 4.258 1.00 0.49 H new ATOM 0 HB2 LYS B 72 7.858 -5.188 6.023 1.00 0.49 H new ATOM 0 HB3 LYS B 72 6.546 -6.334 6.219 1.00 0.49 H new ATOM 0 HG2 LYS B 72 8.650 -8.082 6.220 1.00 0.65 H new ATOM 0 HG3 LYS B 72 9.468 -6.665 6.847 1.00 0.65 H new ATOM 0 HD2 LYS B 72 7.665 -6.417 8.595 1.00 0.91 H new ATOM 0 HD3 LYS B 72 6.886 -7.861 7.980 1.00 0.91 H new ATOM 0 HE2 LYS B 72 8.332 -9.213 9.121 1.00 1.46 H new ATOM 0 HE3 LYS B 72 9.722 -8.401 8.428 1.00 1.46 H new ATOM 0 HZ1 LYS B 72 9.666 -8.144 10.835 1.00 1.81 H new ATOM 0 HZ2 LYS B 72 9.480 -6.632 10.085 1.00 1.81 H new ATOM 0 HZ3 LYS B 72 8.133 -7.418 10.755 1.00 1.81 H new ATOM 2813 N PHE B 73 7.299 -4.375 3.580 1.00 0.47 N ATOM 2814 CA PHE B 73 6.576 -3.343 2.777 1.00 0.48 C ATOM 2815 C PHE B 73 6.304 -3.880 1.368 1.00 0.51 C ATOM 2816 O PHE B 73 5.175 -3.978 0.934 1.00 0.52 O ATOM 2817 CB PHE B 73 7.444 -2.082 2.695 1.00 0.48 C ATOM 2818 CG PHE B 73 7.550 -1.618 1.261 1.00 0.52 C ATOM 2819 CD1 PHE B 73 6.433 -1.072 0.623 1.00 1.37 C ATOM 2820 CD2 PHE B 73 8.764 -1.732 0.571 1.00 1.25 C ATOM 2821 CE1 PHE B 73 6.526 -0.639 -0.705 1.00 1.40 C ATOM 2822 CE2 PHE B 73 8.857 -1.300 -0.757 1.00 1.29 C ATOM 2823 CZ PHE B 73 7.738 -0.753 -1.396 1.00 0.67 C ATOM 0 H PHE B 73 8.088 -4.023 4.123 1.00 0.47 H new ATOM 0 HA PHE B 73 5.624 -3.105 3.252 1.00 0.48 H new ATOM 0 HB2 PHE B 73 7.012 -1.293 3.310 1.00 0.48 H new ATOM 0 HB3 PHE B 73 8.437 -2.288 3.093 1.00 0.48 H new ATOM 0 HD1 PHE B 73 5.497 -0.984 1.155 1.00 1.37 H new ATOM 0 HD2 PHE B 73 9.628 -2.153 1.064 1.00 1.25 H new ATOM 0 HE1 PHE B 73 5.662 -0.217 -1.197 1.00 1.40 H new ATOM 0 HE2 PHE B 73 9.793 -1.389 -1.289 1.00 1.29 H new ATOM 0 HZ PHE B 73 7.810 -0.419 -2.421 1.00 0.67 H new ATOM 2833 N ASN B 74 7.336 -4.214 0.653 1.00 0.52 N ATOM 2834 CA ASN B 74 7.147 -4.731 -0.732 1.00 0.55 C ATOM 2835 C ASN B 74 6.246 -5.967 -0.697 1.00 0.57 C ATOM 2836 O ASN B 74 5.446 -6.187 -1.585 1.00 0.60 O ATOM 2837 CB ASN B 74 8.505 -5.101 -1.331 1.00 0.57 C ATOM 2838 CG ASN B 74 8.306 -5.660 -2.741 1.00 0.79 C ATOM 2839 OD1 ASN B 74 9.188 -6.292 -3.287 1.00 1.73 O ATOM 2840 ND2 ASN B 74 7.174 -5.453 -3.357 1.00 0.99 N ATOM 0 H ASN B 74 8.305 -4.153 0.965 1.00 0.52 H new ATOM 0 HA ASN B 74 6.681 -3.961 -1.346 1.00 0.55 H new ATOM 0 HB2 ASN B 74 9.151 -4.224 -1.364 1.00 0.57 H new ATOM 0 HB3 ASN B 74 9.003 -5.840 -0.702 1.00 0.57 H new ATOM 0 HD21 ASN B 74 7.030 -5.822 -4.297 1.00 0.99 H new ATOM 0 HD22 ASN B 74 6.433 -4.922 -2.898 1.00 0.99 H new ATOM 2847 N GLU B 75 6.368 -6.779 0.315 1.00 0.55 N ATOM 2848 CA GLU B 75 5.525 -7.996 0.400 1.00 0.59 C ATOM 2849 C GLU B 75 4.096 -7.612 0.782 1.00 0.57 C ATOM 2850 O GLU B 75 3.161 -8.335 0.502 1.00 0.68 O ATOM 2851 CB GLU B 75 6.104 -8.924 1.464 1.00 0.62 C ATOM 2852 CG GLU B 75 6.909 -10.034 0.790 1.00 1.10 C ATOM 2853 CD GLU B 75 7.584 -10.897 1.857 1.00 1.46 C ATOM 2854 OE1 GLU B 75 8.313 -10.344 2.665 1.00 2.12 O ATOM 2855 OE2 GLU B 75 7.361 -12.096 1.849 1.00 1.88 O ATOM 0 H GLU B 75 7.019 -6.649 1.089 1.00 0.55 H new ATOM 0 HA GLU B 75 5.511 -8.500 -0.567 1.00 0.59 H new ATOM 0 HB2 GLU B 75 6.742 -8.360 2.145 1.00 0.62 H new ATOM 0 HB3 GLU B 75 5.301 -9.355 2.062 1.00 0.62 H new ATOM 0 HG2 GLU B 75 6.254 -10.648 0.172 1.00 1.10 H new ATOM 0 HG3 GLU B 75 7.660 -9.602 0.128 1.00 1.10 H new ATOM 2862 N MET B 76 3.912 -6.475 1.405 1.00 0.53 N ATOM 2863 CA MET B 76 2.541 -6.042 1.789 1.00 0.51 C ATOM 2864 C MET B 76 2.022 -5.079 0.724 1.00 0.52 C ATOM 2865 O MET B 76 0.859 -5.092 0.372 1.00 0.53 O ATOM 2866 CB MET B 76 2.595 -5.330 3.142 1.00 0.48 C ATOM 2867 CG MET B 76 2.896 -6.350 4.242 1.00 0.48 C ATOM 2868 SD MET B 76 1.420 -6.590 5.263 1.00 0.51 S ATOM 2869 CE MET B 76 2.127 -7.807 6.402 1.00 0.60 C ATOM 0 H MET B 76 4.657 -5.828 1.663 1.00 0.53 H new ATOM 0 HA MET B 76 1.880 -6.905 1.865 1.00 0.51 H new ATOM 0 HB2 MET B 76 3.363 -4.557 3.128 1.00 0.48 H new ATOM 0 HB3 MET B 76 1.646 -4.833 3.342 1.00 0.48 H new ATOM 0 HG2 MET B 76 3.203 -7.298 3.800 1.00 0.48 H new ATOM 0 HG3 MET B 76 3.725 -6.002 4.858 1.00 0.48 H new ATOM 0 HE1 MET B 76 1.374 -8.101 7.133 1.00 0.60 H new ATOM 0 HE2 MET B 76 2.451 -8.684 5.842 1.00 0.60 H new ATOM 0 HE3 MET B 76 2.982 -7.369 6.918 1.00 0.60 H new ATOM 2879 N ARG B 77 2.883 -4.245 0.199 1.00 0.52 N ATOM 2880 CA ARG B 77 2.452 -3.285 -0.852 1.00 0.54 C ATOM 2881 C ARG B 77 1.900 -4.051 -2.055 1.00 0.57 C ATOM 2882 O ARG B 77 0.871 -3.711 -2.603 1.00 0.57 O ATOM 2883 CB ARG B 77 3.650 -2.442 -1.293 1.00 0.54 C ATOM 2884 CG ARG B 77 3.195 -1.400 -2.317 1.00 0.57 C ATOM 2885 CD ARG B 77 3.910 -1.647 -3.646 1.00 0.62 C ATOM 2886 NE ARG B 77 3.521 -0.592 -4.622 1.00 0.86 N ATOM 2887 CZ ARG B 77 3.823 -0.729 -5.884 1.00 1.32 C ATOM 2888 NH1 ARG B 77 4.466 -1.789 -6.290 1.00 1.81 N ATOM 2889 NH2 ARG B 77 3.481 0.195 -6.739 1.00 1.80 N ATOM 0 H ARG B 77 3.868 -4.190 0.456 1.00 0.52 H new ATOM 0 HA ARG B 77 1.675 -2.635 -0.450 1.00 0.54 H new ATOM 0 HB2 ARG B 77 4.097 -1.948 -0.430 1.00 0.54 H new ATOM 0 HB3 ARG B 77 4.418 -3.082 -1.727 1.00 0.54 H new ATOM 0 HG2 ARG B 77 2.115 -1.458 -2.456 1.00 0.57 H new ATOM 0 HG3 ARG B 77 3.416 -0.396 -1.954 1.00 0.57 H new ATOM 0 HD2 ARG B 77 4.990 -1.640 -3.497 1.00 0.62 H new ATOM 0 HD3 ARG B 77 3.649 -2.631 -4.035 1.00 0.62 H new ATOM 0 HE ARG B 77 3.019 0.237 -4.304 1.00 0.86 H new ATOM 0 HH11 ARG B 77 4.733 -2.511 -5.621 1.00 1.81 H new ATOM 0 HH12 ARG B 77 4.702 -1.896 -7.277 1.00 1.81 H new ATOM 0 HH21 ARG B 77 2.978 1.023 -6.421 1.00 1.80 H new ATOM 0 HH22 ARG B 77 3.717 0.089 -7.726 1.00 1.80 H new ATOM 2903 N LYS B 78 2.568 -5.100 -2.452 1.00 0.58 N ATOM 2904 CA LYS B 78 2.070 -5.899 -3.597 1.00 0.61 C ATOM 2905 C LYS B 78 0.748 -6.524 -3.180 1.00 0.60 C ATOM 2906 O LYS B 78 -0.172 -6.644 -3.960 1.00 0.62 O ATOM 2907 CB LYS B 78 3.069 -7.001 -3.953 1.00 0.63 C ATOM 2908 CG LYS B 78 2.330 -8.117 -4.703 1.00 1.17 C ATOM 2909 CD LYS B 78 3.311 -8.957 -5.531 1.00 1.22 C ATOM 2910 CE LYS B 78 3.911 -8.128 -6.677 1.00 1.57 C ATOM 2911 NZ LYS B 78 3.824 -8.905 -7.945 1.00 2.26 N ATOM 0 H LYS B 78 3.435 -5.434 -2.031 1.00 0.58 H new ATOM 0 HA LYS B 78 1.941 -5.262 -4.472 1.00 0.61 H new ATOM 0 HB2 LYS B 78 3.871 -6.598 -4.572 1.00 0.63 H new ATOM 0 HB3 LYS B 78 3.532 -7.397 -3.049 1.00 0.63 H new ATOM 0 HG2 LYS B 78 1.808 -8.756 -3.991 1.00 1.17 H new ATOM 0 HG3 LYS B 78 1.573 -7.683 -5.357 1.00 1.17 H new ATOM 0 HD2 LYS B 78 4.110 -9.329 -4.889 1.00 1.22 H new ATOM 0 HD3 LYS B 78 2.797 -9.828 -5.937 1.00 1.22 H new ATOM 0 HE2 LYS B 78 3.375 -7.184 -6.778 1.00 1.57 H new ATOM 0 HE3 LYS B 78 4.950 -7.882 -6.458 1.00 1.57 H new ATOM 0 HZ1 LYS B 78 4.229 -8.346 -8.723 1.00 2.26 H new ATOM 0 HZ2 LYS B 78 4.354 -9.794 -7.844 1.00 2.26 H new ATOM 0 HZ3 LYS B 78 2.828 -9.118 -8.154 1.00 2.26 H new ATOM 2925 N ASN B 79 0.639 -6.893 -1.937 1.00 0.58 N ATOM 2926 CA ASN B 79 -0.638 -7.478 -1.458 1.00 0.58 C ATOM 2927 C ASN B 79 -1.711 -6.405 -1.577 1.00 0.57 C ATOM 2928 O ASN B 79 -2.757 -6.612 -2.156 1.00 0.57 O ATOM 2929 CB ASN B 79 -0.501 -7.915 0.001 1.00 0.57 C ATOM 2930 CG ASN B 79 -1.148 -9.289 0.185 1.00 0.62 C ATOM 2931 OD1 ASN B 79 -0.672 -10.100 0.955 1.00 1.18 O ATOM 2932 ND2 ASN B 79 -2.221 -9.588 -0.495 1.00 1.16 N ATOM 0 H ASN B 79 1.376 -6.815 -1.236 1.00 0.58 H new ATOM 0 HA ASN B 79 -0.902 -8.353 -2.053 1.00 0.58 H new ATOM 0 HB2 ASN B 79 0.551 -7.956 0.282 1.00 0.57 H new ATOM 0 HB3 ASN B 79 -0.978 -7.186 0.656 1.00 0.57 H new ATOM 0 HD21 ASN B 79 -2.660 -10.502 -0.380 1.00 1.16 H new ATOM 0 HD22 ASN B 79 -2.621 -8.908 -1.141 1.00 1.16 H new ATOM 2939 N MET B 80 -1.445 -5.244 -1.046 1.00 0.57 N ATOM 2940 CA MET B 80 -2.437 -4.147 -1.139 1.00 0.57 C ATOM 2941 C MET B 80 -2.849 -3.988 -2.604 1.00 0.58 C ATOM 2942 O MET B 80 -4.014 -4.070 -2.934 1.00 0.57 O ATOM 2943 CB MET B 80 -1.813 -2.849 -0.603 1.00 0.60 C ATOM 2944 CG MET B 80 -2.557 -1.625 -1.151 1.00 0.69 C ATOM 2945 SD MET B 80 -1.821 -1.119 -2.725 1.00 1.27 S ATOM 2946 CE MET B 80 -2.914 0.287 -3.045 1.00 1.05 C ATOM 0 H MET B 80 -0.583 -5.011 -0.553 1.00 0.57 H new ATOM 0 HA MET B 80 -3.320 -4.375 -0.541 1.00 0.57 H new ATOM 0 HB2 MET B 80 -1.849 -2.845 0.486 1.00 0.60 H new ATOM 0 HB3 MET B 80 -0.762 -2.800 -0.888 1.00 0.60 H new ATOM 0 HG2 MET B 80 -3.612 -1.861 -1.291 1.00 0.69 H new ATOM 0 HG3 MET B 80 -2.506 -0.805 -0.434 1.00 0.69 H new ATOM 0 HE1 MET B 80 -2.634 0.758 -3.987 1.00 1.05 H new ATOM 0 HE2 MET B 80 -3.945 -0.060 -3.105 1.00 1.05 H new ATOM 0 HE3 MET B 80 -2.822 1.011 -2.236 1.00 1.05 H new ATOM 2956 N ASP B 81 -1.916 -3.764 -3.494 1.00 0.60 N ATOM 2957 CA ASP B 81 -2.278 -3.608 -4.931 1.00 0.62 C ATOM 2958 C ASP B 81 -3.023 -4.845 -5.433 1.00 0.63 C ATOM 2959 O ASP B 81 -4.012 -4.738 -6.130 1.00 0.64 O ATOM 2960 CB ASP B 81 -0.999 -3.419 -5.748 1.00 0.65 C ATOM 2961 CG ASP B 81 -1.243 -2.388 -6.852 1.00 0.67 C ATOM 2962 OD1 ASP B 81 -2.282 -2.463 -7.487 1.00 1.19 O ATOM 2963 OD2 ASP B 81 -0.387 -1.540 -7.043 1.00 1.23 O ATOM 0 H ASP B 81 -0.921 -3.683 -3.286 1.00 0.60 H new ATOM 0 HA ASP B 81 -2.928 -2.740 -5.043 1.00 0.62 H new ATOM 0 HB2 ASP B 81 -0.187 -3.088 -5.100 1.00 0.65 H new ATOM 0 HB3 ASP B 81 -0.691 -4.369 -6.185 1.00 0.65 H new ATOM 2968 N GLN B 82 -2.581 -6.021 -5.070 1.00 0.64 N ATOM 2969 CA GLN B 82 -3.299 -7.247 -5.517 1.00 0.66 C ATOM 2970 C GLN B 82 -4.712 -7.185 -4.945 1.00 0.63 C ATOM 2971 O GLN B 82 -5.699 -7.390 -5.626 1.00 0.65 O ATOM 2972 CB GLN B 82 -2.581 -8.486 -4.971 1.00 0.68 C ATOM 2973 CG GLN B 82 -1.172 -8.579 -5.561 1.00 1.09 C ATOM 2974 CD GLN B 82 -1.148 -9.638 -6.666 1.00 0.83 C ATOM 2975 OE1 GLN B 82 -0.740 -9.362 -7.776 1.00 1.28 O ATOM 2976 NE2 GLN B 82 -1.573 -10.845 -6.411 1.00 1.41 N ATOM 0 H GLN B 82 -1.760 -6.183 -4.487 1.00 0.64 H new ATOM 0 HA GLN B 82 -3.325 -7.305 -6.605 1.00 0.66 H new ATOM 0 HB2 GLN B 82 -2.526 -8.434 -3.884 1.00 0.68 H new ATOM 0 HB3 GLN B 82 -3.148 -9.383 -5.219 1.00 0.68 H new ATOM 0 HG2 GLN B 82 -0.871 -7.612 -5.963 1.00 1.09 H new ATOM 0 HG3 GLN B 82 -0.456 -8.837 -4.781 1.00 1.09 H new ATOM 0 HE21 GLN B 82 -1.916 -11.079 -5.479 1.00 1.41 H new ATOM 0 HE22 GLN B 82 -1.562 -11.555 -7.143 1.00 1.41 H new ATOM 2985 N LEU B 83 -4.793 -6.877 -3.686 1.00 0.59 N ATOM 2986 CA LEU B 83 -6.116 -6.767 -3.024 1.00 0.56 C ATOM 2987 C LEU B 83 -6.873 -5.605 -3.669 1.00 0.55 C ATOM 2988 O LEU B 83 -8.031 -5.722 -4.019 1.00 0.56 O ATOM 2989 CB LEU B 83 -5.916 -6.510 -1.529 1.00 0.53 C ATOM 2990 CG LEU B 83 -5.294 -7.757 -0.879 1.00 0.53 C ATOM 2991 CD1 LEU B 83 -4.792 -7.401 0.519 1.00 0.55 C ATOM 2992 CD2 LEU B 83 -6.320 -8.900 -0.773 1.00 0.56 C ATOM 0 H LEU B 83 -3.992 -6.695 -3.082 1.00 0.59 H new ATOM 0 HA LEU B 83 -6.686 -7.689 -3.142 1.00 0.56 H new ATOM 0 HB2 LEU B 83 -5.268 -5.646 -1.380 1.00 0.53 H new ATOM 0 HB3 LEU B 83 -6.871 -6.277 -1.057 1.00 0.53 H new ATOM 0 HG LEU B 83 -4.467 -8.093 -1.504 1.00 0.53 H new ATOM 0 HD11 LEU B 83 -4.350 -8.283 0.983 1.00 0.55 H new ATOM 0 HD12 LEU B 83 -4.041 -6.615 0.447 1.00 0.55 H new ATOM 0 HD13 LEU B 83 -5.626 -7.051 1.127 1.00 0.55 H new ATOM 0 HD21 LEU B 83 -5.851 -9.768 -0.310 1.00 0.56 H new ATOM 0 HD22 LEU B 83 -7.164 -8.576 -0.165 1.00 0.56 H new ATOM 0 HD23 LEU B 83 -6.672 -9.167 -1.770 1.00 0.56 H new ATOM 3004 N LYS B 84 -6.217 -4.490 -3.850 1.00 0.55 N ATOM 3005 CA LYS B 84 -6.886 -3.326 -4.497 1.00 0.55 C ATOM 3006 C LYS B 84 -7.508 -3.782 -5.820 1.00 0.58 C ATOM 3007 O LYS B 84 -8.650 -3.498 -6.119 1.00 0.58 O ATOM 3008 CB LYS B 84 -5.853 -2.230 -4.768 1.00 0.56 C ATOM 3009 CG LYS B 84 -6.575 -0.928 -5.126 1.00 0.57 C ATOM 3010 CD LYS B 84 -5.804 -0.195 -6.228 1.00 0.80 C ATOM 3011 CE LYS B 84 -6.529 1.106 -6.587 1.00 0.80 C ATOM 3012 NZ LYS B 84 -7.457 0.860 -7.727 1.00 1.40 N ATOM 0 H LYS B 84 -5.246 -4.336 -3.577 1.00 0.55 H new ATOM 0 HA LYS B 84 -7.663 -2.934 -3.840 1.00 0.55 H new ATOM 0 HB2 LYS B 84 -5.226 -2.081 -3.889 1.00 0.56 H new ATOM 0 HB3 LYS B 84 -5.194 -2.529 -5.583 1.00 0.56 H new ATOM 0 HG2 LYS B 84 -7.590 -1.144 -5.461 1.00 0.57 H new ATOM 0 HG3 LYS B 84 -6.659 -0.293 -4.244 1.00 0.57 H new ATOM 0 HD2 LYS B 84 -4.790 0.023 -5.893 1.00 0.80 H new ATOM 0 HD3 LYS B 84 -5.718 -0.830 -7.110 1.00 0.80 H new ATOM 0 HE2 LYS B 84 -7.085 1.475 -5.725 1.00 0.80 H new ATOM 0 HE3 LYS B 84 -5.805 1.876 -6.853 1.00 0.80 H new ATOM 0 HZ1 LYS B 84 -8.270 1.505 -7.658 1.00 1.40 H new ATOM 0 HZ2 LYS B 84 -6.957 1.027 -8.624 1.00 1.40 H new ATOM 0 HZ3 LYS B 84 -7.792 -0.124 -7.696 1.00 1.40 H new ATOM 3026 N GLU B 85 -6.757 -4.493 -6.613 1.00 0.60 N ATOM 3027 CA GLU B 85 -7.297 -4.977 -7.915 1.00 0.63 C ATOM 3028 C GLU B 85 -8.549 -5.815 -7.654 1.00 0.63 C ATOM 3029 O GLU B 85 -9.501 -5.787 -8.409 1.00 0.64 O ATOM 3030 CB GLU B 85 -6.248 -5.840 -8.618 1.00 0.66 C ATOM 3031 CG GLU B 85 -6.943 -6.766 -9.618 1.00 0.69 C ATOM 3032 CD GLU B 85 -5.934 -7.229 -10.671 1.00 0.73 C ATOM 3033 OE1 GLU B 85 -5.253 -8.209 -10.420 1.00 1.21 O ATOM 3034 OE2 GLU B 85 -5.861 -6.596 -11.712 1.00 1.28 O ATOM 0 H GLU B 85 -5.792 -4.760 -6.417 1.00 0.60 H new ATOM 0 HA GLU B 85 -7.545 -4.125 -8.548 1.00 0.63 H new ATOM 0 HB2 GLU B 85 -5.525 -5.207 -9.133 1.00 0.66 H new ATOM 0 HB3 GLU B 85 -5.693 -6.427 -7.886 1.00 0.66 H new ATOM 0 HG2 GLU B 85 -7.365 -7.627 -9.100 1.00 0.69 H new ATOM 0 HG3 GLU B 85 -7.772 -6.245 -10.097 1.00 0.69 H new ATOM 3041 N LYS B 86 -8.554 -6.551 -6.581 1.00 0.63 N ATOM 3042 CA LYS B 86 -9.744 -7.386 -6.250 1.00 0.63 C ATOM 3043 C LYS B 86 -10.936 -6.469 -5.964 1.00 0.61 C ATOM 3044 O LYS B 86 -12.063 -6.772 -6.303 1.00 0.62 O ATOM 3045 CB LYS B 86 -9.445 -8.238 -5.016 1.00 0.64 C ATOM 3046 CG LYS B 86 -9.503 -9.721 -5.389 1.00 0.70 C ATOM 3047 CD LYS B 86 -9.043 -10.566 -4.200 1.00 0.89 C ATOM 3048 CE LYS B 86 -9.017 -12.042 -4.599 1.00 1.09 C ATOM 3049 NZ LYS B 86 -7.651 -12.594 -4.375 1.00 0.99 N ATOM 0 H LYS B 86 -7.784 -6.612 -5.915 1.00 0.63 H new ATOM 0 HA LYS B 86 -9.978 -8.041 -7.090 1.00 0.63 H new ATOM 0 HB2 LYS B 86 -8.460 -7.990 -4.621 1.00 0.64 H new ATOM 0 HB3 LYS B 86 -10.168 -8.022 -4.229 1.00 0.64 H new ATOM 0 HG2 LYS B 86 -10.519 -9.996 -5.672 1.00 0.70 H new ATOM 0 HG3 LYS B 86 -8.868 -9.914 -6.253 1.00 0.70 H new ATOM 0 HD2 LYS B 86 -8.051 -10.249 -3.877 1.00 0.89 H new ATOM 0 HD3 LYS B 86 -9.715 -10.419 -3.355 1.00 0.89 H new ATOM 0 HE2 LYS B 86 -9.747 -12.601 -4.013 1.00 1.09 H new ATOM 0 HE3 LYS B 86 -9.298 -12.151 -5.647 1.00 1.09 H new ATOM 0 HZ1 LYS B 86 -7.633 -13.598 -4.646 1.00 0.99 H new ATOM 0 HZ2 LYS B 86 -6.965 -12.067 -4.952 1.00 0.99 H new ATOM 0 HZ3 LYS B 86 -7.400 -12.503 -3.370 1.00 0.99 H new ATOM 3063 N ILE B 87 -10.691 -5.350 -5.337 1.00 0.59 N ATOM 3064 CA ILE B 87 -11.801 -4.408 -5.020 1.00 0.57 C ATOM 3065 C ILE B 87 -12.427 -3.897 -6.314 1.00 0.57 C ATOM 3066 O ILE B 87 -13.623 -3.985 -6.508 1.00 0.55 O ATOM 3067 CB ILE B 87 -11.250 -3.227 -4.207 1.00 0.59 C ATOM 3068 CG1 ILE B 87 -10.787 -3.744 -2.836 1.00 0.65 C ATOM 3069 CG2 ILE B 87 -12.338 -2.159 -4.024 1.00 0.68 C ATOM 3070 CD1 ILE B 87 -10.074 -2.634 -2.054 1.00 0.70 C ATOM 0 H ILE B 87 -9.767 -5.047 -5.030 1.00 0.59 H new ATOM 0 HA ILE B 87 -12.562 -4.926 -4.436 1.00 0.57 H new ATOM 0 HB ILE B 87 -10.410 -2.777 -4.736 1.00 0.59 H new ATOM 0 HG12 ILE B 87 -11.645 -4.103 -2.268 1.00 0.65 H new ATOM 0 HG13 ILE B 87 -10.115 -4.592 -2.969 1.00 0.65 H new ATOM 0 HG21 ILE B 87 -11.937 -1.326 -3.446 1.00 0.68 H new ATOM 0 HG22 ILE B 87 -12.663 -1.800 -5.000 1.00 0.68 H new ATOM 0 HG23 ILE B 87 -13.187 -2.592 -3.495 1.00 0.68 H new ATOM 0 HD11 ILE B 87 -9.754 -3.019 -1.086 1.00 0.70 H new ATOM 0 HD12 ILE B 87 -9.204 -2.295 -2.616 1.00 0.70 H new ATOM 0 HD13 ILE B 87 -10.757 -1.798 -1.904 1.00 0.70 H new ATOM 3082 N ASN B 88 -11.639 -3.372 -7.210 1.00 0.60 N ATOM 3083 CA ASN B 88 -12.209 -2.873 -8.488 1.00 0.63 C ATOM 3084 C ASN B 88 -12.860 -4.024 -9.252 1.00 0.63 C ATOM 3085 O ASN B 88 -13.794 -3.828 -9.997 1.00 0.64 O ATOM 3086 CB ASN B 88 -11.100 -2.265 -9.345 1.00 0.70 C ATOM 3087 CG ASN B 88 -10.731 -0.884 -8.801 1.00 1.78 C ATOM 3088 OD1 ASN B 88 -11.366 -0.387 -7.892 1.00 2.47 O ATOM 3089 ND2 ASN B 88 -9.724 -0.238 -9.322 1.00 2.62 N ATOM 0 H ASN B 88 -10.629 -3.268 -7.112 1.00 0.60 H new ATOM 0 HA ASN B 88 -12.959 -2.114 -8.267 1.00 0.63 H new ATOM 0 HB2 ASN B 88 -10.225 -2.915 -9.340 1.00 0.70 H new ATOM 0 HB3 ASN B 88 -11.430 -2.183 -10.381 1.00 0.70 H new ATOM 0 HD21 ASN B 88 -9.470 0.684 -8.966 1.00 2.62 H new ATOM 0 HD22 ASN B 88 -9.191 -0.655 -10.085 1.00 2.62 H new ATOM 3096 N SER B 89 -12.362 -5.222 -9.097 1.00 0.64 N ATOM 3097 CA SER B 89 -12.944 -6.374 -9.843 1.00 0.68 C ATOM 3098 C SER B 89 -14.397 -6.621 -9.425 1.00 0.67 C ATOM 3099 O SER B 89 -15.302 -6.531 -10.231 1.00 0.74 O ATOM 3100 CB SER B 89 -12.118 -7.628 -9.556 1.00 0.70 C ATOM 3101 OG SER B 89 -12.496 -8.656 -10.462 1.00 1.23 O ATOM 0 H SER B 89 -11.578 -5.452 -8.486 1.00 0.64 H new ATOM 0 HA SER B 89 -12.924 -6.143 -10.908 1.00 0.68 H new ATOM 0 HB2 SER B 89 -11.055 -7.409 -9.659 1.00 0.70 H new ATOM 0 HB3 SER B 89 -12.278 -7.956 -8.529 1.00 0.70 H new ATOM 0 HG SER B 89 -11.967 -9.461 -10.282 1.00 1.23 H new ATOM 3107 N VAL B 90 -14.633 -6.942 -8.182 1.00 0.63 N ATOM 3108 CA VAL B 90 -16.033 -7.203 -7.737 1.00 0.64 C ATOM 3109 C VAL B 90 -16.819 -5.897 -7.720 1.00 0.57 C ATOM 3110 O VAL B 90 -17.976 -5.853 -8.087 1.00 0.59 O ATOM 3111 CB VAL B 90 -16.031 -7.815 -6.338 1.00 0.66 C ATOM 3112 CG1 VAL B 90 -17.375 -8.505 -6.084 1.00 0.66 C ATOM 3113 CG2 VAL B 90 -14.906 -8.847 -6.231 1.00 0.89 C ATOM 0 H VAL B 90 -13.921 -7.035 -7.458 1.00 0.63 H new ATOM 0 HA VAL B 90 -16.501 -7.900 -8.432 1.00 0.64 H new ATOM 0 HB VAL B 90 -15.875 -7.029 -5.599 1.00 0.66 H new ATOM 0 HG11 VAL B 90 -17.376 -8.943 -5.086 1.00 0.66 H new ATOM 0 HG12 VAL B 90 -18.180 -7.774 -6.161 1.00 0.66 H new ATOM 0 HG13 VAL B 90 -17.527 -9.290 -6.825 1.00 0.66 H new ATOM 0 HG21 VAL B 90 -14.906 -9.283 -5.232 1.00 0.89 H new ATOM 0 HG22 VAL B 90 -15.062 -9.633 -6.970 1.00 0.89 H new ATOM 0 HG23 VAL B 90 -13.948 -8.361 -6.415 1.00 0.89 H new ATOM 3123 N LEU B 91 -16.193 -4.825 -7.323 1.00 0.51 N ATOM 3124 CA LEU B 91 -16.899 -3.519 -7.318 1.00 0.49 C ATOM 3125 C LEU B 91 -16.992 -3.045 -8.762 1.00 0.57 C ATOM 3126 O LEU B 91 -17.653 -2.076 -9.063 1.00 0.61 O ATOM 3127 CB LEU B 91 -16.099 -2.506 -6.493 1.00 0.47 C ATOM 3128 CG LEU B 91 -16.987 -1.310 -6.133 1.00 0.59 C ATOM 3129 CD1 LEU B 91 -17.645 -1.550 -4.774 1.00 0.91 C ATOM 3130 CD2 LEU B 91 -16.136 -0.038 -6.063 1.00 0.84 C ATOM 0 H LEU B 91 -15.225 -4.799 -7.003 1.00 0.51 H new ATOM 0 HA LEU B 91 -17.892 -3.617 -6.880 1.00 0.49 H new ATOM 0 HB2 LEU B 91 -15.724 -2.978 -5.585 1.00 0.47 H new ATOM 0 HB3 LEU B 91 -15.230 -2.168 -7.058 1.00 0.47 H new ATOM 0 HG LEU B 91 -17.756 -1.193 -6.897 1.00 0.59 H new ATOM 0 HD11 LEU B 91 -18.276 -0.698 -4.520 1.00 0.91 H new ATOM 0 HD12 LEU B 91 -18.254 -2.453 -4.819 1.00 0.91 H new ATOM 0 HD13 LEU B 91 -16.874 -1.670 -4.013 1.00 0.91 H new ATOM 0 HD21 LEU B 91 -16.770 0.811 -5.807 1.00 0.84 H new ATOM 0 HD22 LEU B 91 -15.365 -0.157 -5.302 1.00 0.84 H new ATOM 0 HD23 LEU B 91 -15.666 0.139 -7.031 1.00 0.84 H new ATOM 3142 N SER B 92 -16.338 -3.760 -9.650 1.00 0.63 N ATOM 3143 CA SER B 92 -16.362 -3.409 -11.109 1.00 0.76 C ATOM 3144 C SER B 92 -16.338 -1.888 -11.298 1.00 0.83 C ATOM 3145 O SER B 92 -16.833 -1.381 -12.276 1.00 1.11 O ATOM 3146 CB SER B 92 -17.637 -3.980 -11.733 1.00 0.72 C ATOM 3147 OG SER B 92 -17.302 -4.684 -12.922 1.00 0.89 O ATOM 0 H SER B 92 -15.781 -4.583 -9.422 1.00 0.63 H new ATOM 0 HA SER B 92 -15.482 -3.832 -11.593 1.00 0.76 H new ATOM 0 HB2 SER B 92 -18.133 -4.648 -11.029 1.00 0.72 H new ATOM 0 HB3 SER B 92 -18.338 -3.176 -11.958 1.00 0.72 H new ATOM 0 HG SER B 92 -18.116 -5.053 -13.324 1.00 0.89 H new ATOM 3153 N ILE B 93 -15.737 -1.176 -10.372 1.00 0.74 N ATOM 3154 CA ILE B 93 -15.641 0.326 -10.469 1.00 0.82 C ATOM 3155 C ILE B 93 -16.972 0.937 -10.953 1.00 1.03 C ATOM 3156 O ILE B 93 -17.787 1.356 -10.159 1.00 1.11 O ATOM 3157 CB ILE B 93 -14.498 0.719 -11.412 1.00 0.92 C ATOM 3158 CG1 ILE B 93 -13.273 -0.150 -11.110 1.00 0.87 C ATOM 3159 CG2 ILE B 93 -14.140 2.192 -11.192 1.00 1.13 C ATOM 3160 CD1 ILE B 93 -12.082 0.332 -11.943 1.00 1.43 C ATOM 0 H ILE B 93 -15.302 -1.574 -9.540 1.00 0.74 H new ATOM 0 HA ILE B 93 -15.433 0.721 -9.475 1.00 0.82 H new ATOM 0 HB ILE B 93 -14.809 0.570 -12.446 1.00 0.92 H new ATOM 0 HG12 ILE B 93 -13.031 -0.099 -10.048 1.00 0.87 H new ATOM 0 HG13 ILE B 93 -13.490 -1.194 -11.338 1.00 0.87 H new ATOM 0 HG21 ILE B 93 -13.327 2.473 -11.862 1.00 1.13 H new ATOM 0 HG22 ILE B 93 -15.012 2.813 -11.399 1.00 1.13 H new ATOM 0 HG23 ILE B 93 -13.826 2.340 -10.159 1.00 1.13 H new ATOM 0 HD11 ILE B 93 -11.212 -0.288 -11.726 1.00 1.43 H new ATOM 0 HD12 ILE B 93 -12.325 0.258 -13.003 1.00 1.43 H new ATOM 0 HD13 ILE B 93 -11.860 1.370 -11.694 1.00 1.43 H new ATOM 3172 N ARG B 94 -17.206 0.975 -12.240 1.00 1.25 N ATOM 3173 CA ARG B 94 -18.483 1.534 -12.770 1.00 1.52 C ATOM 3174 C ARG B 94 -18.905 0.704 -13.993 1.00 1.60 C ATOM 3175 O ARG B 94 -19.630 1.158 -14.857 1.00 1.76 O ATOM 3176 CB ARG B 94 -18.314 3.021 -13.161 1.00 1.97 C ATOM 3177 CG ARG B 94 -16.840 3.379 -13.420 1.00 2.23 C ATOM 3178 CD ARG B 94 -16.301 2.597 -14.622 1.00 2.52 C ATOM 3179 NE ARG B 94 -15.527 3.517 -15.504 1.00 3.12 N ATOM 3180 CZ ARG B 94 -16.151 4.262 -16.380 1.00 3.73 C ATOM 3181 NH1 ARG B 94 -17.453 4.213 -16.474 1.00 3.88 N ATOM 3182 NH2 ARG B 94 -15.472 5.058 -17.160 1.00 4.55 N ATOM 0 H ARG B 94 -16.559 0.638 -12.953 1.00 1.25 H new ATOM 0 HA ARG B 94 -19.252 1.482 -11.999 1.00 1.52 H new ATOM 0 HB2 ARG B 94 -18.902 3.231 -14.055 1.00 1.97 H new ATOM 0 HB3 ARG B 94 -18.707 3.653 -12.365 1.00 1.97 H new ATOM 0 HG2 ARG B 94 -16.746 4.449 -13.603 1.00 2.23 H new ATOM 0 HG3 ARG B 94 -16.244 3.154 -12.535 1.00 2.23 H new ATOM 0 HD2 ARG B 94 -15.665 1.780 -14.283 1.00 2.52 H new ATOM 0 HD3 ARG B 94 -17.125 2.150 -15.178 1.00 2.52 H new ATOM 0 HE ARG B 94 -14.511 3.566 -15.424 1.00 3.12 H new ATOM 0 HH11 ARG B 94 -17.985 3.593 -15.864 1.00 3.88 H new ATOM 0 HH12 ARG B 94 -17.937 4.795 -17.158 1.00 3.88 H new ATOM 0 HH21 ARG B 94 -14.455 5.099 -17.086 1.00 4.55 H new ATOM 0 HH22 ARG B 94 -15.958 5.639 -17.843 1.00 4.55 H new ATOM 3196 N GLN B 95 -18.461 -0.523 -14.060 1.00 1.55 N ATOM 3197 CA GLN B 95 -18.835 -1.396 -15.211 1.00 1.73 C ATOM 3198 C GLN B 95 -18.428 -0.723 -16.524 1.00 2.40 C ATOM 3199 O GLN B 95 -17.820 0.331 -16.465 1.00 2.92 O ATOM 3200 CB GLN B 95 -20.347 -1.624 -15.205 1.00 1.94 C ATOM 3201 CG GLN B 95 -20.671 -2.941 -15.913 1.00 2.44 C ATOM 3202 CD GLN B 95 -22.093 -2.882 -16.473 1.00 2.98 C ATOM 3203 OE1 GLN B 95 -22.901 -2.090 -16.029 1.00 3.53 O ATOM 3204 NE2 GLN B 95 -22.436 -3.693 -17.436 1.00 3.31 N ATOM 3205 OXT GLN B 95 -18.731 -1.276 -17.569 1.00 3.00 O ATOM 0 H GLN B 95 -17.854 -0.959 -13.366 1.00 1.55 H new ATOM 0 HA GLN B 95 -18.319 -2.352 -15.121 1.00 1.73 H new ATOM 0 HB2 GLN B 95 -20.717 -1.650 -14.180 1.00 1.94 H new ATOM 0 HB3 GLN B 95 -20.851 -0.797 -15.705 1.00 1.94 H new ATOM 0 HG2 GLN B 95 -19.958 -3.118 -16.719 1.00 2.44 H new ATOM 0 HG3 GLN B 95 -20.577 -3.774 -15.216 1.00 2.44 H new ATOM 0 HE21 GLN B 95 -21.758 -4.358 -17.809 1.00 3.31 H new ATOM 0 HE22 GLN B 95 -23.382 -3.662 -17.816 1.00 3.31 H new TER 3214 GLN B 95