USER MOD reduce.3.24.130724 H: found=0, std=0, add=1110, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1105 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 125 ASN : amide:sc= -5.41! K(o=-11!,f=-12) USER MOD Set 1.2: A 130 LYS NZ :NH3+ 155:sc= -5.91! (180deg=-5.45!) USER MOD Set 2.1: A 124 TYR OH : rot 119:sc= 0.0271 USER MOD Set 2.2: A 129 GLN : amide:sc= 0.0302 K(o=0.057,f=-0.47) USER MOD Set 3.1: A 77 SER OG : rot 170:sc= -1.53! USER MOD Set 3.2: A 79 SER OG : rot 44:sc= 0.769 USER MOD Set 3.3: A 110 GLN : amide:sc= -4.74! C(o=-5.5!,f=-8.5!) USER MOD Set 4.1: A 52 ASN : amide:sc= -0.386 K(o=0.08,f=-10!) USER MOD Set 4.2: A 55 SER OG : rot 80:sc= 0.466 USER MOD Set 5.1: A 23 THR OG1 : rot -166:sc= 1.16 USER MOD Set 5.2: A 57 MET CE :methyl -165:sc= -0.297 (180deg=-0.63) USER MOD Set 5.3: A 59 HIS : no HD1:sc= -0.274 K(o=0.59,f=-11!) USER MOD Set 6.1: A 19 SER OG : rot 47:sc= -0.198 USER MOD Set 6.2: A 47 THR OG1 : rot 141:sc= -1.7! USER MOD Set 6.3: A 48 HIS : no HE2:sc= -1.4 K(o=0.17,f=-2) USER MOD Set 6.4: A 50 THR OG1 : rot -71:sc= 2.04 USER MOD Set 6.5: A 61 LYS NZ :NH3+ -162:sc= 2.34 (180deg=0.88) USER MOD Set 6.6: A 75 THR OG1 : rot -169:sc= -0.911 USER MOD Set 7.1: A 13 HIS : no HD1:sc= -4.99! C(o=-3.6!,f=-7.2!) USER MOD Set 7.2: A 103 THR OG1 : rot 115:sc= 1.39 USER MOD Single : A 1 SER N :NH3+ 147:sc= 0.0478 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 53:sc= 0.0572 USER MOD Single : A 6 LYS NZ :NH3+ -167:sc= -3.4! (180deg=-4.15!) USER MOD Single : A 10 SER OG : rot 180:sc= 0.00588 USER MOD Single : A 14 SER OG : rot 16:sc= 1.03 USER MOD Single : A 16 ASN : amide:sc= -1.31! C(o=-1.3!,f=-2.5!) USER MOD Single : A 17 LYS NZ :NH3+ 177:sc= 1.17 (180deg=1.08) USER MOD Single : A 32 SER OG : rot -162:sc= -0.282 USER MOD Single : A 35 GLN : amide:sc= -2.49! K(o=-2.5!,f=-1.2) USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 TYR OH : rot 52:sc= -1.54! USER MOD Single : A 56 LYS NZ :NH3+ -113:sc= 0.94 (180deg=-0.0425) USER MOD Single : A 64 LYS NZ :NH3+ 169:sc= 1.33 (180deg=1.13) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 179:sc= 1.23 (180deg=1.2) USER MOD Single : A 83 SER OG : rot 180:sc= -0.943 USER MOD Single : A 87 GLN : amide:sc= -1.42! K(o=-1.4!,f=-0.043) USER MOD Single : A 88 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 90 SER OG : rot -153:sc= 0.957 USER MOD Single : A 91 TYR OH : rot 180:sc= -2.74! USER MOD Single : A 98 MET CE :methyl -168:sc= -0.883 (180deg=-1.23!) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 MET CE :methyl 158:sc= -0.386 (180deg=-1.88) USER MOD Single : A 104 SER OG : rot 99:sc= 1.11 USER MOD Single : A 105 GLN : amide:sc= -4.29! C(o=-4.3!,f=-5.4!) USER MOD Single : A 106 SER OG : rot -109:sc= 0.254 USER MOD Single : A 118 SER OG : rot -38:sc= 0.194 USER MOD Single : A 123 THR OG1 : rot -120:sc= 0.0698 USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 132 THR OG1 : rot 180:sc= -0.44 USER MOD Single : A 134 LYS NZ :NH3+ 139:sc= 0.891 (180deg=-0.285!) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 142 LYS NZ :NH3+ 165:sc= 1.27 (180deg=1.13) USER MOD Single : A 150 THR OG1 : rot 129:sc= 1.02 USER MOD Single : A 151 SER OG : rot -170:sc= -1.96 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 GLN : amide:sc= -1.14! K(o=-1.1!,f=-0.23) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 25.740 3.616 12.253 1.00 3.53 N ATOM 2 CA SER A 1 24.267 3.495 12.219 1.00 2.82 C ATOM 3 C SER A 1 23.861 2.053 11.944 1.00 1.84 C ATOM 4 O SER A 1 24.588 1.307 11.284 1.00 1.68 O ATOM 5 CB SER A 1 23.692 4.419 11.141 1.00 3.37 C ATOM 6 OG SER A 1 22.274 4.445 11.181 1.00 4.10 O ATOM 0 H1 SER A 1 26.020 4.548 11.888 1.00 3.53 H new ATOM 0 H2 SER A 1 26.074 3.513 13.232 1.00 3.53 H new ATOM 0 H3 SER A 1 26.163 2.872 11.663 1.00 3.53 H new ATOM 0 HA SER A 1 23.868 3.790 13.189 1.00 2.82 H new ATOM 0 HB2 SER A 1 24.080 5.428 11.281 1.00 3.37 H new ATOM 0 HB3 SER A 1 24.023 4.084 10.158 1.00 3.37 H new ATOM 0 HG SER A 1 21.938 5.045 10.482 1.00 4.10 H new ATOM 14 N SER A 2 22.702 1.664 12.456 1.00 1.72 N ATOM 15 CA SER A 2 22.194 0.316 12.281 1.00 1.06 C ATOM 16 C SER A 2 21.466 0.169 10.947 1.00 0.92 C ATOM 17 O SER A 2 20.275 0.461 10.836 1.00 1.65 O ATOM 18 CB SER A 2 21.266 -0.031 13.445 1.00 1.60 C ATOM 19 OG SER A 2 20.426 1.068 13.774 1.00 2.37 O ATOM 0 H SER A 2 22.092 2.273 13.002 1.00 1.72 H new ATOM 0 HA SER A 2 23.035 -0.378 12.271 1.00 1.06 H new ATOM 0 HB2 SER A 2 20.655 -0.894 13.182 1.00 1.60 H new ATOM 0 HB3 SER A 2 21.859 -0.313 14.315 1.00 1.60 H new ATOM 0 HG SER A 2 19.966 1.381 12.967 1.00 2.37 H new ATOM 25 N GLU A 3 22.194 -0.272 9.933 1.00 0.72 N ATOM 26 CA GLU A 3 21.619 -0.510 8.617 1.00 0.65 C ATOM 27 C GLU A 3 21.858 -1.958 8.200 1.00 0.56 C ATOM 28 O GLU A 3 22.875 -2.274 7.585 1.00 0.70 O ATOM 29 CB GLU A 3 22.225 0.445 7.586 1.00 1.06 C ATOM 30 CG GLU A 3 21.993 1.914 7.903 1.00 1.63 C ATOM 31 CD GLU A 3 22.620 2.837 6.879 1.00 1.81 C ATOM 32 OE1 GLU A 3 23.825 3.136 7.002 1.00 2.08 O ATOM 33 OE2 GLU A 3 21.911 3.270 5.947 1.00 2.19 O ATOM 0 H GLU A 3 23.192 -0.474 9.997 1.00 0.72 H new ATOM 0 HA GLU A 3 20.546 -0.327 8.666 1.00 0.65 H new ATOM 0 HB2 GLU A 3 23.297 0.262 7.520 1.00 1.06 H new ATOM 0 HB3 GLU A 3 21.803 0.223 6.606 1.00 1.06 H new ATOM 0 HG2 GLU A 3 20.921 2.106 7.952 1.00 1.63 H new ATOM 0 HG3 GLU A 3 22.403 2.138 8.888 1.00 1.63 H new ATOM 40 N PRO A 4 20.938 -2.864 8.564 1.00 0.41 N ATOM 41 CA PRO A 4 21.074 -4.288 8.284 1.00 0.39 C ATOM 42 C PRO A 4 20.454 -4.709 6.949 1.00 0.39 C ATOM 43 O PRO A 4 20.183 -3.877 6.081 1.00 0.50 O ATOM 44 CB PRO A 4 20.316 -4.914 9.450 1.00 0.39 C ATOM 45 CG PRO A 4 19.229 -3.938 9.772 1.00 0.44 C ATOM 46 CD PRO A 4 19.695 -2.578 9.301 1.00 0.41 C ATOM 0 HA PRO A 4 22.117 -4.593 8.195 1.00 0.39 H new ATOM 0 HB2 PRO A 4 19.906 -5.886 9.178 1.00 0.39 H new ATOM 0 HB3 PRO A 4 20.971 -5.073 10.307 1.00 0.39 H new ATOM 0 HG2 PRO A 4 18.300 -4.219 9.276 1.00 0.44 H new ATOM 0 HG3 PRO A 4 19.028 -3.926 10.843 1.00 0.44 H new ATOM 0 HD2 PRO A 4 18.952 -2.101 8.662 1.00 0.41 H new ATOM 0 HD3 PRO A 4 19.874 -1.905 10.139 1.00 0.41 H new ATOM 54 N ALA A 5 20.245 -6.010 6.798 1.00 0.37 N ATOM 55 CA ALA A 5 19.619 -6.569 5.608 1.00 0.45 C ATOM 56 C ALA A 5 18.116 -6.319 5.628 1.00 0.22 C ATOM 57 O ALA A 5 17.555 -5.990 6.671 1.00 0.43 O ATOM 58 CB ALA A 5 19.909 -8.058 5.512 1.00 0.76 C ATOM 0 H ALA A 5 20.504 -6.707 7.496 1.00 0.37 H new ATOM 0 HA ALA A 5 20.037 -6.075 4.731 1.00 0.45 H new ATOM 0 HB1 ALA A 5 19.435 -8.464 4.618 1.00 0.76 H new ATOM 0 HB2 ALA A 5 20.986 -8.216 5.456 1.00 0.76 H new ATOM 0 HB3 ALA A 5 19.514 -8.563 6.393 1.00 0.76 H new ATOM 64 N LYS A 6 17.490 -6.406 4.453 1.00 0.31 N ATOM 65 CA LYS A 6 16.035 -6.271 4.326 1.00 0.15 C ATOM 66 C LYS A 6 15.311 -7.126 5.373 1.00 0.14 C ATOM 67 O LYS A 6 15.189 -8.341 5.207 1.00 0.20 O ATOM 68 CB LYS A 6 15.556 -6.709 2.928 1.00 0.17 C ATOM 69 CG LYS A 6 16.548 -6.495 1.783 1.00 0.17 C ATOM 70 CD LYS A 6 17.009 -5.052 1.647 1.00 0.24 C ATOM 71 CE LYS A 6 15.864 -4.117 1.294 1.00 0.23 C ATOM 72 NZ LYS A 6 15.137 -4.578 0.085 1.00 0.66 N ATOM 0 H LYS A 6 17.971 -6.571 3.569 1.00 0.31 H new ATOM 0 HA LYS A 6 15.799 -5.218 4.481 1.00 0.15 H new ATOM 0 HB2 LYS A 6 15.301 -7.768 2.968 1.00 0.17 H new ATOM 0 HB3 LYS A 6 14.639 -6.169 2.694 1.00 0.17 H new ATOM 0 HG2 LYS A 6 17.417 -7.133 1.941 1.00 0.17 H new ATOM 0 HG3 LYS A 6 16.086 -6.811 0.848 1.00 0.17 H new ATOM 0 HD2 LYS A 6 17.466 -4.728 2.582 1.00 0.24 H new ATOM 0 HD3 LYS A 6 17.779 -4.989 0.878 1.00 0.24 H new ATOM 0 HE2 LYS A 6 15.172 -4.054 2.134 1.00 0.23 H new ATOM 0 HE3 LYS A 6 16.252 -3.113 1.125 1.00 0.23 H new ATOM 0 HZ1 LYS A 6 14.514 -3.818 -0.256 1.00 0.66 H new ATOM 0 HZ2 LYS A 6 15.821 -4.825 -0.658 1.00 0.66 H new ATOM 0 HZ3 LYS A 6 14.566 -5.414 0.321 1.00 0.66 H new ATOM 86 N LEU A 7 14.834 -6.498 6.446 1.00 0.14 N ATOM 87 CA LEU A 7 14.111 -7.217 7.491 1.00 0.14 C ATOM 88 C LEU A 7 12.619 -7.185 7.205 1.00 0.13 C ATOM 89 O LEU A 7 12.055 -6.118 6.979 1.00 0.10 O ATOM 90 CB LEU A 7 14.390 -6.592 8.858 1.00 0.15 C ATOM 91 CG LEU A 7 15.863 -6.532 9.262 1.00 0.19 C ATOM 92 CD1 LEU A 7 16.026 -5.717 10.533 1.00 0.20 C ATOM 93 CD2 LEU A 7 16.421 -7.934 9.447 1.00 0.24 C ATOM 0 H LEU A 7 14.935 -5.497 6.614 1.00 0.14 H new ATOM 0 HA LEU A 7 14.452 -8.252 7.502 1.00 0.14 H new ATOM 0 HB2 LEU A 7 13.987 -5.579 8.865 1.00 0.15 H new ATOM 0 HB3 LEU A 7 13.846 -7.157 9.615 1.00 0.15 H new ATOM 0 HG LEU A 7 16.425 -6.044 8.465 1.00 0.19 H new ATOM 0 HD11 LEU A 7 17.080 -5.682 10.810 1.00 0.20 H new ATOM 0 HD12 LEU A 7 15.661 -4.704 10.365 1.00 0.20 H new ATOM 0 HD13 LEU A 7 15.454 -6.180 11.338 1.00 0.20 H new ATOM 0 HD21 LEU A 7 17.471 -7.873 9.734 1.00 0.24 H new ATOM 0 HD22 LEU A 7 15.860 -8.449 10.227 1.00 0.24 H new ATOM 0 HD23 LEU A 7 16.333 -8.487 8.512 1.00 0.24 H new ATOM 105 N ASP A 8 11.997 -8.360 7.221 1.00 0.21 N ATOM 106 CA ASP A 8 10.585 -8.516 6.857 1.00 0.24 C ATOM 107 C ASP A 8 9.689 -7.553 7.634 1.00 0.21 C ATOM 108 O ASP A 8 9.596 -7.625 8.861 1.00 0.29 O ATOM 109 CB ASP A 8 10.137 -9.956 7.106 1.00 0.37 C ATOM 110 CG ASP A 8 8.716 -10.211 6.653 1.00 0.52 C ATOM 111 OD1 ASP A 8 7.835 -10.380 7.524 1.00 0.64 O ATOM 112 OD2 ASP A 8 8.469 -10.214 5.428 1.00 0.65 O ATOM 0 H ASP A 8 12.454 -9.233 7.486 1.00 0.21 H new ATOM 0 HA ASP A 8 10.489 -8.279 5.797 1.00 0.24 H new ATOM 0 HB2 ASP A 8 10.809 -10.637 6.583 1.00 0.37 H new ATOM 0 HB3 ASP A 8 10.221 -10.180 8.169 1.00 0.37 H new ATOM 117 N LEU A 9 9.042 -6.649 6.907 1.00 0.18 N ATOM 118 CA LEU A 9 8.197 -5.627 7.504 1.00 0.16 C ATOM 119 C LEU A 9 6.771 -6.129 7.699 1.00 0.18 C ATOM 120 O LEU A 9 6.421 -7.219 7.240 1.00 0.26 O ATOM 121 CB LEU A 9 8.165 -4.394 6.605 1.00 0.13 C ATOM 122 CG LEU A 9 7.791 -3.090 7.306 1.00 0.14 C ATOM 123 CD1 LEU A 9 8.967 -2.574 8.108 1.00 0.13 C ATOM 124 CD2 LEU A 9 7.322 -2.055 6.306 1.00 0.20 C ATOM 0 H LEU A 9 9.090 -6.606 5.889 1.00 0.18 H new ATOM 0 HA LEU A 9 8.617 -5.376 8.478 1.00 0.16 H new ATOM 0 HB2 LEU A 9 9.146 -4.273 6.146 1.00 0.13 H new ATOM 0 HB3 LEU A 9 7.455 -4.571 5.797 1.00 0.13 H new ATOM 0 HG LEU A 9 6.966 -3.288 7.990 1.00 0.14 H new ATOM 0 HD11 LEU A 9 8.689 -1.644 8.604 1.00 0.13 H new ATOM 0 HD12 LEU A 9 9.249 -3.314 8.857 1.00 0.13 H new ATOM 0 HD13 LEU A 9 9.810 -2.392 7.442 1.00 0.13 H new ATOM 0 HD21 LEU A 9 7.061 -1.135 6.830 1.00 0.20 H new ATOM 0 HD22 LEU A 9 8.119 -1.852 5.591 1.00 0.20 H new ATOM 0 HD23 LEU A 9 6.447 -2.431 5.776 1.00 0.20 H new ATOM 136 N SER A 10 5.951 -5.336 8.374 1.00 0.18 N ATOM 137 CA SER A 10 4.541 -5.647 8.539 1.00 0.21 C ATOM 138 C SER A 10 3.830 -5.662 7.181 1.00 0.19 C ATOM 139 O SER A 10 3.070 -6.586 6.882 1.00 0.24 O ATOM 140 CB SER A 10 3.903 -4.620 9.471 1.00 0.25 C ATOM 141 OG SER A 10 4.725 -4.401 10.605 1.00 1.21 O ATOM 0 H SER A 10 6.243 -4.466 8.819 1.00 0.18 H new ATOM 0 HA SER A 10 4.441 -6.639 8.979 1.00 0.21 H new ATOM 0 HB2 SER A 10 3.751 -3.681 8.938 1.00 0.25 H new ATOM 0 HB3 SER A 10 2.920 -4.969 9.789 1.00 0.25 H new ATOM 0 HG SER A 10 4.303 -3.739 11.192 1.00 1.21 H new ATOM 147 N CYS A 11 4.085 -4.649 6.354 1.00 0.15 N ATOM 148 CA CYS A 11 3.537 -4.619 5.010 1.00 0.15 C ATOM 149 C CYS A 11 4.666 -4.694 3.996 1.00 0.14 C ATOM 150 O CYS A 11 5.510 -3.807 3.918 1.00 0.12 O ATOM 151 CB CYS A 11 2.698 -3.356 4.775 1.00 0.17 C ATOM 152 SG CYS A 11 3.610 -1.777 4.897 1.00 0.19 S ATOM 0 H CYS A 11 4.665 -3.845 6.594 1.00 0.15 H new ATOM 0 HA CYS A 11 2.880 -5.481 4.890 1.00 0.15 H new ATOM 0 HB2 CYS A 11 2.246 -3.419 3.785 1.00 0.17 H new ATOM 0 HB3 CYS A 11 1.882 -3.342 5.498 1.00 0.17 H new ATOM 157 N VAL A 12 4.715 -5.792 3.271 1.00 0.15 N ATOM 158 CA VAL A 12 5.619 -5.930 2.146 1.00 0.13 C ATOM 159 C VAL A 12 5.133 -7.025 1.216 1.00 0.16 C ATOM 160 O VAL A 12 4.826 -8.132 1.663 1.00 0.21 O ATOM 161 CB VAL A 12 7.092 -6.184 2.570 1.00 0.11 C ATOM 162 CG1 VAL A 12 7.162 -6.906 3.904 1.00 0.12 C ATOM 163 CG2 VAL A 12 7.841 -6.971 1.506 1.00 0.12 C ATOM 0 H VAL A 12 4.132 -6.611 3.443 1.00 0.15 H new ATOM 0 HA VAL A 12 5.614 -4.975 1.620 1.00 0.13 H new ATOM 0 HB VAL A 12 7.572 -5.212 2.680 1.00 0.11 H new ATOM 0 HG11 VAL A 12 8.205 -7.070 4.175 1.00 0.12 H new ATOM 0 HG12 VAL A 12 6.679 -6.301 4.671 1.00 0.12 H new ATOM 0 HG13 VAL A 12 6.652 -7.866 3.825 1.00 0.12 H new ATOM 0 HG21 VAL A 12 8.869 -7.134 1.830 1.00 0.12 H new ATOM 0 HG22 VAL A 12 7.352 -7.933 1.353 1.00 0.12 H new ATOM 0 HG23 VAL A 12 7.840 -6.411 0.571 1.00 0.12 H new ATOM 173 N HIS A 13 5.004 -6.687 -0.059 1.00 0.17 N ATOM 174 CA HIS A 13 4.588 -7.641 -1.079 1.00 0.24 C ATOM 175 C HIS A 13 5.284 -8.983 -0.905 1.00 0.37 C ATOM 176 O HIS A 13 4.626 -9.989 -0.652 1.00 0.98 O ATOM 177 CB HIS A 13 4.904 -7.082 -2.460 1.00 0.32 C ATOM 178 CG HIS A 13 3.749 -6.387 -3.091 1.00 0.47 C ATOM 179 ND1 HIS A 13 2.822 -7.030 -3.876 1.00 0.68 N ATOM 180 CD2 HIS A 13 3.378 -5.092 -3.056 1.00 0.83 C ATOM 181 CE1 HIS A 13 1.936 -6.154 -4.300 1.00 1.01 C ATOM 182 NE2 HIS A 13 2.250 -4.969 -3.811 1.00 1.09 N ATOM 0 H HIS A 13 5.184 -5.748 -0.415 1.00 0.17 H new ATOM 0 HA HIS A 13 3.515 -7.799 -0.975 1.00 0.24 H new ATOM 0 HB2 HIS A 13 5.739 -6.386 -2.380 1.00 0.32 H new ATOM 0 HB3 HIS A 13 5.228 -7.896 -3.109 1.00 0.32 H new ATOM 0 HD2 HIS A 13 3.882 -4.297 -2.527 1.00 0.83 H new ATOM 0 HE1 HIS A 13 1.093 -6.369 -4.941 1.00 1.01 H new ATOM 0 HE2 HIS A 13 1.734 -4.104 -3.972 1.00 1.09 H new ATOM 190 N SER A 14 6.614 -8.972 -1.000 1.00 0.37 N ATOM 191 CA SER A 14 7.420 -10.195 -1.024 1.00 0.35 C ATOM 192 C SER A 14 6.902 -11.164 -2.093 1.00 0.52 C ATOM 193 O SER A 14 6.961 -12.386 -1.944 1.00 1.14 O ATOM 194 CB SER A 14 7.510 -10.862 0.367 1.00 0.30 C ATOM 195 OG SER A 14 6.235 -11.145 0.922 1.00 1.16 O ATOM 0 H SER A 14 7.164 -8.115 -1.063 1.00 0.37 H new ATOM 0 HA SER A 14 8.438 -9.914 -1.293 1.00 0.35 H new ATOM 0 HB2 SER A 14 8.080 -11.788 0.285 1.00 0.30 H new ATOM 0 HB3 SER A 14 8.059 -10.208 1.044 1.00 0.30 H new ATOM 0 HG SER A 14 5.554 -11.099 0.218 1.00 1.16 H new ATOM 201 N ASP A 15 6.379 -10.586 -3.173 1.00 0.25 N ATOM 202 CA ASP A 15 5.936 -11.344 -4.333 1.00 0.31 C ATOM 203 C ASP A 15 6.761 -10.916 -5.533 1.00 0.28 C ATOM 204 O ASP A 15 6.454 -11.261 -6.673 1.00 0.55 O ATOM 205 CB ASP A 15 4.460 -11.075 -4.650 1.00 0.48 C ATOM 206 CG ASP A 15 3.588 -10.882 -3.429 1.00 1.66 C ATOM 207 OD1 ASP A 15 3.180 -9.734 -3.148 1.00 2.50 O ATOM 208 OD2 ASP A 15 3.324 -11.884 -2.726 1.00 2.26 O ATOM 0 H ASP A 15 6.252 -9.578 -3.265 1.00 0.25 H new ATOM 0 HA ASP A 15 6.060 -12.405 -4.116 1.00 0.31 H new ATOM 0 HB2 ASP A 15 4.391 -10.185 -5.276 1.00 0.48 H new ATOM 0 HB3 ASP A 15 4.068 -11.907 -5.234 1.00 0.48 H new ATOM 213 N ASN A 16 7.807 -10.145 -5.242 1.00 0.23 N ATOM 214 CA ASN A 16 8.610 -9.473 -6.260 1.00 0.21 C ATOM 215 C ASN A 16 7.746 -8.461 -7.005 1.00 0.19 C ATOM 216 O ASN A 16 7.335 -8.678 -8.145 1.00 0.22 O ATOM 217 CB ASN A 16 9.264 -10.469 -7.235 1.00 0.23 C ATOM 218 CG ASN A 16 10.135 -11.486 -6.528 1.00 1.06 C ATOM 219 OD1 ASN A 16 10.762 -11.185 -5.514 1.00 2.09 O ATOM 220 ND2 ASN A 16 10.183 -12.696 -7.055 1.00 0.95 N ATOM 0 H ASN A 16 8.122 -9.968 -4.288 1.00 0.23 H new ATOM 0 HA ASN A 16 9.425 -8.950 -5.759 1.00 0.21 H new ATOM 0 HB2 ASN A 16 8.486 -10.988 -7.795 1.00 0.23 H new ATOM 0 HB3 ASN A 16 9.866 -9.921 -7.960 1.00 0.23 H new ATOM 0 HD21 ASN A 16 10.755 -13.420 -6.619 1.00 0.95 H new ATOM 0 HD22 ASN A 16 9.648 -12.907 -7.898 1.00 0.95 H new ATOM 227 N LYS A 17 7.482 -7.341 -6.344 1.00 0.19 N ATOM 228 CA LYS A 17 6.615 -6.315 -6.897 1.00 0.19 C ATOM 229 C LYS A 17 7.153 -4.920 -6.661 1.00 0.21 C ATOM 230 O LYS A 17 7.770 -4.635 -5.636 1.00 0.28 O ATOM 231 CB LYS A 17 5.207 -6.405 -6.301 1.00 0.23 C ATOM 232 CG LYS A 17 4.278 -7.353 -7.031 1.00 0.25 C ATOM 233 CD LYS A 17 3.970 -6.805 -8.408 1.00 0.25 C ATOM 234 CE LYS A 17 2.817 -7.516 -9.077 1.00 0.43 C ATOM 235 NZ LYS A 17 3.079 -8.968 -9.282 1.00 0.93 N ATOM 0 H LYS A 17 7.858 -7.122 -5.422 1.00 0.19 H new ATOM 0 HA LYS A 17 6.577 -6.497 -7.971 1.00 0.19 H new ATOM 0 HB2 LYS A 17 5.285 -6.722 -5.261 1.00 0.23 H new ATOM 0 HB3 LYS A 17 4.762 -5.410 -6.299 1.00 0.23 H new ATOM 0 HG2 LYS A 17 4.739 -8.337 -7.115 1.00 0.25 H new ATOM 0 HG3 LYS A 17 3.355 -7.481 -6.465 1.00 0.25 H new ATOM 0 HD2 LYS A 17 3.739 -5.743 -8.328 1.00 0.25 H new ATOM 0 HD3 LYS A 17 4.857 -6.891 -9.035 1.00 0.25 H new ATOM 0 HE2 LYS A 17 1.919 -7.395 -8.470 1.00 0.43 H new ATOM 0 HE3 LYS A 17 2.616 -7.047 -10.040 1.00 0.43 H new ATOM 0 HZ1 LYS A 17 2.238 -9.417 -9.697 1.00 0.93 H new ATOM 0 HZ2 LYS A 17 3.888 -9.087 -9.924 1.00 0.93 H new ATOM 0 HZ3 LYS A 17 3.294 -9.414 -8.368 1.00 0.93 H new ATOM 249 N GLY A 18 6.879 -4.053 -7.615 1.00 0.19 N ATOM 250 CA GLY A 18 7.280 -2.670 -7.506 1.00 0.20 C ATOM 251 C GLY A 18 6.141 -1.754 -7.865 1.00 0.15 C ATOM 252 O GLY A 18 5.042 -2.233 -8.136 1.00 0.15 O ATOM 0 H GLY A 18 6.380 -4.285 -8.474 1.00 0.19 H new ATOM 0 HA2 GLY A 18 7.613 -2.462 -6.489 1.00 0.20 H new ATOM 0 HA3 GLY A 18 8.128 -2.479 -8.164 1.00 0.20 H new ATOM 256 N SER A 19 6.373 -0.451 -7.888 1.00 0.19 N ATOM 257 CA SER A 19 5.297 0.478 -8.143 1.00 0.18 C ATOM 258 C SER A 19 5.779 1.685 -8.922 1.00 0.22 C ATOM 259 O SER A 19 6.793 2.279 -8.586 1.00 0.36 O ATOM 260 CB SER A 19 4.701 0.901 -6.810 1.00 0.21 C ATOM 261 OG SER A 19 5.729 1.188 -5.878 1.00 1.22 O ATOM 0 H SER A 19 7.286 -0.022 -7.735 1.00 0.19 H new ATOM 0 HA SER A 19 4.537 -0.010 -8.753 1.00 0.18 H new ATOM 0 HB2 SER A 19 4.071 1.780 -6.949 1.00 0.21 H new ATOM 0 HB3 SER A 19 4.061 0.108 -6.423 1.00 0.21 H new ATOM 0 HG SER A 19 6.404 1.758 -6.301 1.00 1.22 H new ATOM 267 N ARG A 20 5.049 2.039 -9.962 1.00 0.18 N ATOM 268 CA ARG A 20 5.425 3.160 -10.799 1.00 0.20 C ATOM 269 C ARG A 20 5.051 4.463 -10.116 1.00 0.17 C ATOM 270 O ARG A 20 3.889 4.683 -9.777 1.00 0.16 O ATOM 271 CB ARG A 20 4.747 3.058 -12.156 1.00 0.24 C ATOM 272 CG ARG A 20 4.790 1.656 -12.724 1.00 0.31 C ATOM 273 CD ARG A 20 4.583 1.667 -14.221 1.00 0.40 C ATOM 274 NE ARG A 20 4.667 0.330 -14.803 1.00 0.58 N ATOM 275 CZ ARG A 20 3.622 -0.480 -14.968 1.00 0.97 C ATOM 276 NH1 ARG A 20 2.427 -0.149 -14.490 1.00 2.03 N ATOM 277 NH2 ARG A 20 3.779 -1.645 -15.579 1.00 0.92 N ATOM 0 H ARG A 20 4.192 1.566 -10.247 1.00 0.18 H new ATOM 0 HA ARG A 20 6.504 3.140 -10.952 1.00 0.20 H new ATOM 0 HB2 ARG A 20 3.709 3.377 -12.064 1.00 0.24 H new ATOM 0 HB3 ARG A 20 5.231 3.743 -12.852 1.00 0.24 H new ATOM 0 HG2 ARG A 20 5.750 1.195 -12.490 1.00 0.31 H new ATOM 0 HG3 ARG A 20 4.020 1.046 -12.252 1.00 0.31 H new ATOM 0 HD2 ARG A 20 3.608 2.099 -14.447 1.00 0.40 H new ATOM 0 HD3 ARG A 20 5.331 2.310 -14.684 1.00 0.40 H new ATOM 0 HE ARG A 20 5.583 -0.005 -15.102 1.00 0.58 H new ATOM 0 HH11 ARG A 20 2.303 0.732 -13.991 1.00 2.03 H new ATOM 0 HH12 ARG A 20 1.633 -0.776 -14.622 1.00 2.03 H new ATOM 0 HH21 ARG A 20 4.699 -1.921 -15.922 1.00 0.92 H new ATOM 0 HH22 ARG A 20 2.980 -2.266 -15.706 1.00 0.92 H new ATOM 291 N ALA A 21 6.047 5.308 -9.928 1.00 0.17 N ATOM 292 CA ALA A 21 5.902 6.574 -9.225 1.00 0.15 C ATOM 293 C ALA A 21 7.289 7.185 -9.088 1.00 0.17 C ATOM 294 O ALA A 21 8.280 6.456 -9.141 1.00 0.20 O ATOM 295 CB ALA A 21 5.253 6.361 -7.857 1.00 0.17 C ATOM 0 H ALA A 21 6.994 5.134 -10.263 1.00 0.17 H new ATOM 0 HA ALA A 21 5.251 7.248 -9.782 1.00 0.15 H new ATOM 0 HB1 ALA A 21 5.154 7.320 -7.348 1.00 0.17 H new ATOM 0 HB2 ALA A 21 4.267 5.916 -7.988 1.00 0.17 H new ATOM 0 HB3 ALA A 21 5.875 5.695 -7.259 1.00 0.17 H new ATOM 301 N PRO A 22 7.404 8.511 -8.931 1.00 0.17 N ATOM 302 CA PRO A 22 8.703 9.175 -8.906 1.00 0.18 C ATOM 303 C PRO A 22 9.479 8.840 -7.647 1.00 0.16 C ATOM 304 O PRO A 22 8.939 8.921 -6.540 1.00 0.16 O ATOM 305 CB PRO A 22 8.358 10.671 -8.933 1.00 0.21 C ATOM 306 CG PRO A 22 6.908 10.735 -9.278 1.00 0.22 C ATOM 307 CD PRO A 22 6.313 9.472 -8.733 1.00 0.21 C ATOM 0 HA PRO A 22 9.334 8.863 -9.738 1.00 0.18 H new ATOM 0 HB2 PRO A 22 8.553 11.137 -7.967 1.00 0.21 H new ATOM 0 HB3 PRO A 22 8.961 11.200 -9.670 1.00 0.21 H new ATOM 0 HG2 PRO A 22 6.437 11.613 -8.836 1.00 0.22 H new ATOM 0 HG3 PRO A 22 6.763 10.804 -10.356 1.00 0.22 H new ATOM 0 HD2 PRO A 22 6.041 9.570 -7.682 1.00 0.21 H new ATOM 0 HD3 PRO A 22 5.410 9.181 -9.270 1.00 0.21 H new ATOM 315 N THR A 23 10.730 8.438 -7.812 1.00 0.16 N ATOM 316 CA THR A 23 11.577 8.196 -6.668 1.00 0.15 C ATOM 317 C THR A 23 11.978 9.525 -6.057 1.00 0.14 C ATOM 318 O THR A 23 12.819 10.252 -6.595 1.00 0.18 O ATOM 319 CB THR A 23 12.832 7.387 -7.035 1.00 0.17 C ATOM 320 OG1 THR A 23 12.443 6.131 -7.608 1.00 0.18 O ATOM 321 CG2 THR A 23 13.695 7.139 -5.803 1.00 0.17 C ATOM 0 H THR A 23 11.171 8.276 -8.717 1.00 0.16 H new ATOM 0 HA THR A 23 11.012 7.603 -5.949 1.00 0.15 H new ATOM 0 HB THR A 23 13.414 7.959 -7.758 1.00 0.17 H new ATOM 0 HG1 THR A 23 13.218 5.531 -7.639 1.00 0.18 H new ATOM 0 HG21 THR A 23 14.577 6.565 -6.086 1.00 0.17 H new ATOM 0 HG22 THR A 23 14.004 8.094 -5.377 1.00 0.17 H new ATOM 0 HG23 THR A 23 13.121 6.581 -5.063 1.00 0.17 H new ATOM 329 N ILE A 24 11.350 9.831 -4.944 1.00 0.12 N ATOM 330 CA ILE A 24 11.547 11.090 -4.265 1.00 0.12 C ATOM 331 C ILE A 24 12.975 11.208 -3.749 1.00 0.14 C ATOM 332 O ILE A 24 13.428 10.386 -2.951 1.00 0.15 O ATOM 333 CB ILE A 24 10.567 11.225 -3.094 1.00 0.11 C ATOM 334 CG1 ILE A 24 9.155 10.891 -3.550 1.00 0.11 C ATOM 335 CG2 ILE A 24 10.620 12.627 -2.525 1.00 0.13 C ATOM 336 CD1 ILE A 24 8.159 10.852 -2.417 1.00 0.13 C ATOM 0 H ILE A 24 10.685 9.210 -4.483 1.00 0.12 H new ATOM 0 HA ILE A 24 11.364 11.890 -4.982 1.00 0.12 H new ATOM 0 HB ILE A 24 10.856 10.522 -2.312 1.00 0.11 H new ATOM 0 HG12 ILE A 24 8.833 11.630 -4.284 1.00 0.11 H new ATOM 0 HG13 ILE A 24 9.162 9.924 -4.053 1.00 0.11 H new ATOM 0 HG21 ILE A 24 9.919 12.709 -1.694 1.00 0.13 H new ATOM 0 HG22 ILE A 24 11.629 12.838 -2.171 1.00 0.13 H new ATOM 0 HG23 ILE A 24 10.350 13.345 -3.300 1.00 0.13 H new ATOM 0 HD11 ILE A 24 7.171 10.609 -2.809 1.00 0.13 H new ATOM 0 HD12 ILE A 24 8.460 10.094 -1.694 1.00 0.13 H new ATOM 0 HD13 ILE A 24 8.125 11.826 -1.928 1.00 0.13 H new ATOM 348 N GLY A 25 13.678 12.230 -4.211 1.00 0.14 N ATOM 349 CA GLY A 25 15.058 12.422 -3.816 1.00 0.16 C ATOM 350 C GLY A 25 15.968 11.345 -4.376 1.00 0.16 C ATOM 351 O GLY A 25 15.998 11.120 -5.589 1.00 0.24 O ATOM 0 H GLY A 25 13.316 12.933 -4.855 1.00 0.14 H new ATOM 0 HA2 GLY A 25 15.400 13.399 -4.158 1.00 0.16 H new ATOM 0 HA3 GLY A 25 15.126 12.424 -2.728 1.00 0.16 H new ATOM 355 N GLU A 26 16.705 10.683 -3.499 1.00 0.17 N ATOM 356 CA GLU A 26 17.589 9.597 -3.900 1.00 0.16 C ATOM 357 C GLU A 26 17.290 8.353 -3.065 1.00 0.16 C ATOM 358 O GLU A 26 16.850 8.468 -1.916 1.00 0.21 O ATOM 359 CB GLU A 26 19.054 10.019 -3.731 1.00 0.26 C ATOM 360 CG GLU A 26 19.430 10.368 -2.300 1.00 1.20 C ATOM 361 CD GLU A 26 20.855 10.857 -2.175 1.00 1.83 C ATOM 362 OE1 GLU A 26 21.091 12.066 -2.373 1.00 2.41 O ATOM 363 OE2 GLU A 26 21.747 10.036 -1.871 1.00 2.09 O ATOM 0 H GLU A 26 16.709 10.879 -2.498 1.00 0.17 H new ATOM 0 HA GLU A 26 17.417 9.364 -4.951 1.00 0.16 H new ATOM 0 HB2 GLU A 26 19.698 9.211 -4.079 1.00 0.26 H new ATOM 0 HB3 GLU A 26 19.250 10.881 -4.369 1.00 0.26 H new ATOM 0 HG2 GLU A 26 18.752 11.136 -1.927 1.00 1.20 H new ATOM 0 HG3 GLU A 26 19.295 9.490 -1.668 1.00 1.20 H new ATOM 370 N PRO A 27 17.501 7.148 -3.624 1.00 0.13 N ATOM 371 CA PRO A 27 17.249 5.904 -2.911 1.00 0.13 C ATOM 372 C PRO A 27 18.300 5.613 -1.850 1.00 0.14 C ATOM 373 O PRO A 27 19.379 6.207 -1.844 1.00 0.20 O ATOM 374 CB PRO A 27 17.280 4.822 -3.997 1.00 0.14 C ATOM 375 CG PRO A 27 17.438 5.537 -5.298 1.00 0.14 C ATOM 376 CD PRO A 27 17.993 6.897 -4.984 1.00 0.14 C ATOM 0 HA PRO A 27 16.301 5.949 -2.374 1.00 0.13 H new ATOM 0 HB2 PRO A 27 18.105 4.129 -3.832 1.00 0.14 H new ATOM 0 HB3 PRO A 27 16.362 4.234 -3.986 1.00 0.14 H new ATOM 0 HG2 PRO A 27 18.109 4.990 -5.960 1.00 0.14 H new ATOM 0 HG3 PRO A 27 16.480 5.620 -5.812 1.00 0.14 H new ATOM 0 HD2 PRO A 27 19.082 6.909 -5.028 1.00 0.14 H new ATOM 0 HD3 PRO A 27 17.638 7.650 -5.687 1.00 0.14 H new ATOM 384 N VAL A 28 17.966 4.706 -0.948 1.00 0.13 N ATOM 385 CA VAL A 28 18.864 4.324 0.134 1.00 0.13 C ATOM 386 C VAL A 28 19.275 2.870 -0.019 1.00 0.13 C ATOM 387 O VAL A 28 18.457 1.980 0.175 1.00 0.10 O ATOM 388 CB VAL A 28 18.194 4.470 1.509 1.00 0.13 C ATOM 389 CG1 VAL A 28 19.225 4.824 2.566 1.00 0.16 C ATOM 390 CG2 VAL A 28 17.077 5.497 1.473 1.00 0.14 C ATOM 0 H VAL A 28 17.072 4.215 -0.942 1.00 0.13 H new ATOM 0 HA VAL A 28 19.727 4.987 0.077 1.00 0.13 H new ATOM 0 HB VAL A 28 17.748 3.511 1.771 1.00 0.13 H new ATOM 0 HG11 VAL A 28 18.734 4.924 3.534 1.00 0.16 H new ATOM 0 HG12 VAL A 28 19.976 4.036 2.620 1.00 0.16 H new ATOM 0 HG13 VAL A 28 19.706 5.767 2.304 1.00 0.16 H new ATOM 0 HG21 VAL A 28 16.624 5.576 2.461 1.00 0.14 H new ATOM 0 HG22 VAL A 28 17.483 6.466 1.181 1.00 0.14 H new ATOM 0 HG23 VAL A 28 16.321 5.188 0.751 1.00 0.14 H new ATOM 400 N PRO A 29 20.524 2.597 -0.374 1.00 0.17 N ATOM 401 CA PRO A 29 20.997 1.232 -0.544 1.00 0.17 C ATOM 402 C PRO A 29 21.464 0.605 0.758 1.00 0.17 C ATOM 403 O PRO A 29 21.799 1.309 1.714 1.00 0.20 O ATOM 404 CB PRO A 29 22.156 1.411 -1.492 1.00 0.20 C ATOM 405 CG PRO A 29 22.750 2.714 -1.083 1.00 0.23 C ATOM 406 CD PRO A 29 21.587 3.580 -0.651 1.00 0.21 C ATOM 0 HA PRO A 29 20.216 0.562 -0.903 1.00 0.17 H new ATOM 0 HB2 PRO A 29 22.876 0.597 -1.402 1.00 0.20 H new ATOM 0 HB3 PRO A 29 21.825 1.430 -2.530 1.00 0.20 H new ATOM 0 HG2 PRO A 29 23.462 2.581 -0.268 1.00 0.23 H new ATOM 0 HG3 PRO A 29 23.293 3.173 -1.909 1.00 0.23 H new ATOM 0 HD2 PRO A 29 21.830 4.171 0.232 1.00 0.21 H new ATOM 0 HD3 PRO A 29 21.294 4.281 -1.433 1.00 0.21 H new ATOM 414 N ASP A 30 21.481 -0.720 0.775 1.00 0.17 N ATOM 415 CA ASP A 30 21.916 -1.486 1.933 1.00 0.20 C ATOM 416 C ASP A 30 21.096 -1.106 3.165 1.00 0.18 C ATOM 417 O ASP A 30 21.637 -0.776 4.223 1.00 0.28 O ATOM 418 CB ASP A 30 23.415 -1.266 2.167 1.00 0.27 C ATOM 419 CG ASP A 30 24.020 -2.287 3.115 1.00 0.37 C ATOM 420 OD1 ASP A 30 24.101 -3.477 2.751 1.00 0.47 O ATOM 421 OD2 ASP A 30 24.422 -1.904 4.236 1.00 0.48 O ATOM 0 H ASP A 30 21.193 -1.295 -0.016 1.00 0.17 H new ATOM 0 HA ASP A 30 21.752 -2.547 1.745 1.00 0.20 H new ATOM 0 HB2 ASP A 30 23.937 -1.310 1.211 1.00 0.27 H new ATOM 0 HB3 ASP A 30 23.572 -0.265 2.570 1.00 0.27 H new ATOM 426 N VAL A 31 19.774 -1.147 3.014 1.00 0.12 N ATOM 427 CA VAL A 31 18.870 -0.779 4.095 1.00 0.12 C ATOM 428 C VAL A 31 17.791 -1.824 4.259 1.00 0.12 C ATOM 429 O VAL A 31 17.472 -2.568 3.334 1.00 0.13 O ATOM 430 CB VAL A 31 18.206 0.605 3.889 1.00 0.12 C ATOM 431 CG1 VAL A 31 19.265 1.664 3.677 1.00 0.14 C ATOM 432 CG2 VAL A 31 17.191 0.600 2.744 1.00 0.10 C ATOM 0 H VAL A 31 19.308 -1.432 2.153 1.00 0.12 H new ATOM 0 HA VAL A 31 19.483 -0.720 4.995 1.00 0.12 H new ATOM 0 HB VAL A 31 17.648 0.841 4.795 1.00 0.12 H new ATOM 0 HG11 VAL A 31 18.787 2.633 3.533 1.00 0.14 H new ATOM 0 HG12 VAL A 31 19.917 1.707 4.550 1.00 0.14 H new ATOM 0 HG13 VAL A 31 19.856 1.416 2.795 1.00 0.14 H new ATOM 0 HG21 VAL A 31 16.754 1.593 2.641 1.00 0.10 H new ATOM 0 HG22 VAL A 31 17.691 0.325 1.815 1.00 0.10 H new ATOM 0 HG23 VAL A 31 16.403 -0.122 2.959 1.00 0.10 H new ATOM 442 N SER A 32 17.237 -1.867 5.446 1.00 0.16 N ATOM 443 CA SER A 32 16.207 -2.818 5.777 1.00 0.16 C ATOM 444 C SER A 32 14.856 -2.322 5.279 1.00 0.16 C ATOM 445 O SER A 32 14.727 -1.156 4.899 1.00 0.18 O ATOM 446 CB SER A 32 16.184 -3.024 7.290 1.00 0.18 C ATOM 447 OG SER A 32 15.064 -3.785 7.700 1.00 0.19 O ATOM 0 H SER A 32 17.489 -1.241 6.211 1.00 0.16 H new ATOM 0 HA SER A 32 16.417 -3.771 5.291 1.00 0.16 H new ATOM 0 HB2 SER A 32 17.099 -3.527 7.602 1.00 0.18 H new ATOM 0 HB3 SER A 32 16.167 -2.055 7.789 1.00 0.18 H new ATOM 0 HG SER A 32 14.918 -3.661 8.661 1.00 0.19 H new ATOM 453 N LEU A 33 13.852 -3.187 5.280 1.00 0.14 N ATOM 454 CA LEU A 33 12.509 -2.771 4.921 1.00 0.14 C ATOM 455 C LEU A 33 12.040 -1.783 5.960 1.00 0.13 C ATOM 456 O LEU A 33 11.436 -0.764 5.653 1.00 0.13 O ATOM 457 CB LEU A 33 11.548 -3.964 4.877 1.00 0.14 C ATOM 458 CG LEU A 33 12.040 -5.182 4.095 1.00 0.14 C ATOM 459 CD1 LEU A 33 10.917 -6.188 3.917 1.00 0.16 C ATOM 460 CD2 LEU A 33 12.601 -4.761 2.756 1.00 0.14 C ATOM 0 H LEU A 33 13.943 -4.173 5.524 1.00 0.14 H new ATOM 0 HA LEU A 33 12.523 -2.322 3.928 1.00 0.14 H new ATOM 0 HB2 LEU A 33 11.335 -4.274 5.900 1.00 0.14 H new ATOM 0 HB3 LEU A 33 10.605 -3.632 4.442 1.00 0.14 H new ATOM 0 HG LEU A 33 12.838 -5.659 4.663 1.00 0.14 H new ATOM 0 HD11 LEU A 33 11.285 -7.049 3.358 1.00 0.16 H new ATOM 0 HD12 LEU A 33 10.563 -6.515 4.895 1.00 0.16 H new ATOM 0 HD13 LEU A 33 10.096 -5.724 3.370 1.00 0.16 H new ATOM 0 HD21 LEU A 33 12.946 -5.641 2.213 1.00 0.14 H new ATOM 0 HD22 LEU A 33 11.825 -4.259 2.178 1.00 0.14 H new ATOM 0 HD23 LEU A 33 13.437 -4.079 2.910 1.00 0.14 H new ATOM 472 N GLU A 34 12.402 -2.081 7.192 1.00 0.14 N ATOM 473 CA GLU A 34 12.027 -1.271 8.332 1.00 0.14 C ATOM 474 C GLU A 34 12.728 0.083 8.279 1.00 0.14 C ATOM 475 O GLU A 34 12.159 1.107 8.653 1.00 0.19 O ATOM 476 CB GLU A 34 12.377 -2.023 9.616 1.00 0.15 C ATOM 477 CG GLU A 34 12.138 -3.523 9.512 1.00 0.16 C ATOM 478 CD GLU A 34 12.094 -4.202 10.863 1.00 0.23 C ATOM 479 OE1 GLU A 34 10.994 -4.323 11.438 1.00 0.43 O ATOM 480 OE2 GLU A 34 13.158 -4.613 11.359 1.00 0.43 O ATOM 0 H GLU A 34 12.967 -2.896 7.431 1.00 0.14 H new ATOM 0 HA GLU A 34 10.953 -1.085 8.312 1.00 0.14 H new ATOM 0 HB2 GLU A 34 13.424 -1.844 9.861 1.00 0.15 H new ATOM 0 HB3 GLU A 34 11.784 -1.622 10.438 1.00 0.15 H new ATOM 0 HG2 GLU A 34 11.198 -3.702 8.989 1.00 0.16 H new ATOM 0 HG3 GLU A 34 12.928 -3.972 8.910 1.00 0.16 H new ATOM 487 N GLN A 35 13.958 0.079 7.785 1.00 0.13 N ATOM 488 CA GLN A 35 14.723 1.308 7.642 1.00 0.14 C ATOM 489 C GLN A 35 14.195 2.128 6.474 1.00 0.12 C ATOM 490 O GLN A 35 14.094 3.350 6.556 1.00 0.15 O ATOM 491 CB GLN A 35 16.205 1.002 7.431 1.00 0.17 C ATOM 492 CG GLN A 35 17.075 2.246 7.399 1.00 0.24 C ATOM 493 CD GLN A 35 18.214 2.184 8.396 1.00 0.69 C ATOM 494 OE1 GLN A 35 18.665 3.207 8.906 1.00 1.45 O ATOM 495 NE2 GLN A 35 18.685 0.982 8.682 1.00 0.67 N ATOM 0 H GLN A 35 14.447 -0.762 7.477 1.00 0.13 H new ATOM 0 HA GLN A 35 14.613 1.884 8.561 1.00 0.14 H new ATOM 0 HB2 GLN A 35 16.551 0.345 8.229 1.00 0.17 H new ATOM 0 HB3 GLN A 35 16.327 0.457 6.495 1.00 0.17 H new ATOM 0 HG2 GLN A 35 17.481 2.375 6.396 1.00 0.24 H new ATOM 0 HG3 GLN A 35 16.460 3.121 7.609 1.00 0.24 H new ATOM 0 HE21 GLN A 35 18.283 0.157 8.237 1.00 0.67 H new ATOM 0 HE22 GLN A 35 19.451 0.879 9.348 1.00 0.67 H new ATOM 504 N CYS A 36 13.853 1.448 5.392 1.00 0.10 N ATOM 505 CA CYS A 36 13.311 2.116 4.221 1.00 0.09 C ATOM 506 C CYS A 36 11.903 2.629 4.513 1.00 0.10 C ATOM 507 O CYS A 36 11.485 3.669 4.001 1.00 0.10 O ATOM 508 CB CYS A 36 13.299 1.177 3.024 1.00 0.08 C ATOM 509 SG CYS A 36 12.417 1.856 1.582 1.00 0.08 S ATOM 0 H CYS A 36 13.941 0.436 5.300 1.00 0.10 H new ATOM 0 HA CYS A 36 13.950 2.966 3.980 1.00 0.09 H new ATOM 0 HB2 CYS A 36 14.326 0.950 2.739 1.00 0.08 H new ATOM 0 HB3 CYS A 36 12.834 0.235 3.315 1.00 0.08 H new ATOM 514 N ALA A 37 11.180 1.896 5.348 1.00 0.11 N ATOM 515 CA ALA A 37 9.879 2.336 5.819 1.00 0.12 C ATOM 516 C ALA A 37 10.029 3.636 6.594 1.00 0.14 C ATOM 517 O ALA A 37 9.231 4.563 6.452 1.00 0.16 O ATOM 518 CB ALA A 37 9.232 1.258 6.683 1.00 0.14 C ATOM 0 H ALA A 37 11.476 0.991 5.713 1.00 0.11 H new ATOM 0 HA ALA A 37 9.229 2.513 4.962 1.00 0.12 H new ATOM 0 HB1 ALA A 37 8.258 1.604 7.028 1.00 0.14 H new ATOM 0 HB2 ALA A 37 9.107 0.348 6.096 1.00 0.14 H new ATOM 0 HB3 ALA A 37 9.868 1.051 7.543 1.00 0.14 H new ATOM 524 N ALA A 38 11.091 3.705 7.384 1.00 0.15 N ATOM 525 CA ALA A 38 11.415 4.904 8.131 1.00 0.16 C ATOM 526 C ALA A 38 11.877 6.013 7.186 1.00 0.15 C ATOM 527 O ALA A 38 11.694 7.196 7.462 1.00 0.19 O ATOM 528 CB ALA A 38 12.491 4.594 9.163 1.00 0.19 C ATOM 0 H ALA A 38 11.746 2.935 7.522 1.00 0.15 H new ATOM 0 HA ALA A 38 10.522 5.251 8.650 1.00 0.16 H new ATOM 0 HB1 ALA A 38 12.731 5.499 9.722 1.00 0.19 H new ATOM 0 HB2 ALA A 38 12.127 3.829 9.849 1.00 0.19 H new ATOM 0 HB3 ALA A 38 13.386 4.232 8.658 1.00 0.19 H new ATOM 534 N GLN A 39 12.465 5.609 6.065 1.00 0.11 N ATOM 535 CA GLN A 39 12.930 6.539 5.039 1.00 0.10 C ATOM 536 C GLN A 39 11.761 7.300 4.431 1.00 0.10 C ATOM 537 O GLN A 39 11.829 8.511 4.243 1.00 0.11 O ATOM 538 CB GLN A 39 13.688 5.772 3.947 1.00 0.09 C ATOM 539 CG GLN A 39 14.040 6.597 2.722 1.00 0.10 C ATOM 540 CD GLN A 39 14.882 7.819 3.039 1.00 0.13 C ATOM 541 OE1 GLN A 39 15.700 7.808 3.960 1.00 0.43 O ATOM 542 NE2 GLN A 39 14.680 8.885 2.281 1.00 0.47 N ATOM 0 H GLN A 39 12.633 4.628 5.841 1.00 0.11 H new ATOM 0 HA GLN A 39 13.602 7.261 5.503 1.00 0.10 H new ATOM 0 HB2 GLN A 39 14.607 5.371 4.375 1.00 0.09 H new ATOM 0 HB3 GLN A 39 13.084 4.921 3.634 1.00 0.09 H new ATOM 0 HG2 GLN A 39 14.578 5.969 2.012 1.00 0.10 H new ATOM 0 HG3 GLN A 39 13.120 6.916 2.232 1.00 0.10 H new ATOM 0 HE21 GLN A 39 13.993 8.853 1.528 1.00 0.47 H new ATOM 0 HE22 GLN A 39 15.212 9.739 2.450 1.00 0.47 H new ATOM 551 N CYS A 40 10.682 6.590 4.149 1.00 0.10 N ATOM 552 CA CYS A 40 9.493 7.208 3.576 1.00 0.11 C ATOM 553 C CYS A 40 8.841 8.131 4.592 1.00 0.14 C ATOM 554 O CYS A 40 8.098 9.042 4.240 1.00 0.17 O ATOM 555 CB CYS A 40 8.520 6.127 3.112 1.00 0.12 C ATOM 556 SG CYS A 40 6.937 6.739 2.445 1.00 0.16 S ATOM 0 H CYS A 40 10.602 5.585 4.306 1.00 0.10 H new ATOM 0 HA CYS A 40 9.779 7.807 2.711 1.00 0.11 H new ATOM 0 HB2 CYS A 40 9.009 5.525 2.347 1.00 0.12 H new ATOM 0 HB3 CYS A 40 8.310 5.465 3.952 1.00 0.12 H new ATOM 561 N LYS A 41 9.145 7.899 5.860 1.00 0.14 N ATOM 562 CA LYS A 41 8.660 8.759 6.922 1.00 0.18 C ATOM 563 C LYS A 41 9.628 9.913 7.157 1.00 0.19 C ATOM 564 O LYS A 41 9.290 10.895 7.812 1.00 0.27 O ATOM 565 CB LYS A 41 8.466 7.956 8.206 1.00 0.20 C ATOM 566 CG LYS A 41 7.477 6.818 8.047 1.00 0.22 C ATOM 567 CD LYS A 41 7.323 6.025 9.330 1.00 0.28 C ATOM 568 CE LYS A 41 6.454 4.800 9.118 1.00 0.32 C ATOM 569 NZ LYS A 41 6.109 4.131 10.398 1.00 1.15 N ATOM 0 H LYS A 41 9.725 7.122 6.176 1.00 0.14 H new ATOM 0 HA LYS A 41 7.697 9.173 6.622 1.00 0.18 H new ATOM 0 HB2 LYS A 41 9.427 7.553 8.525 1.00 0.20 H new ATOM 0 HB3 LYS A 41 8.121 8.622 8.997 1.00 0.20 H new ATOM 0 HG2 LYS A 41 6.508 7.217 7.748 1.00 0.22 H new ATOM 0 HG3 LYS A 41 7.810 6.156 7.248 1.00 0.22 H new ATOM 0 HD2 LYS A 41 8.305 5.719 9.691 1.00 0.28 H new ATOM 0 HD3 LYS A 41 6.882 6.657 10.101 1.00 0.28 H new ATOM 0 HE2 LYS A 41 5.538 5.091 8.603 1.00 0.32 H new ATOM 0 HE3 LYS A 41 6.974 4.095 8.470 1.00 0.32 H new ATOM 0 HZ1 LYS A 41 5.515 3.299 10.206 1.00 1.15 H new ATOM 0 HZ2 LYS A 41 6.981 3.830 10.878 1.00 1.15 H new ATOM 0 HZ3 LYS A 41 5.589 4.794 11.007 1.00 1.15 H new ATOM 583 N ALA A 42 10.840 9.785 6.625 1.00 0.16 N ATOM 584 CA ALA A 42 11.837 10.833 6.744 1.00 0.17 C ATOM 585 C ALA A 42 11.658 11.867 5.640 1.00 0.16 C ATOM 586 O ALA A 42 11.903 13.057 5.839 1.00 0.19 O ATOM 587 CB ALA A 42 13.233 10.234 6.690 1.00 0.17 C ATOM 0 H ALA A 42 11.151 8.963 6.107 1.00 0.16 H new ATOM 0 HA ALA A 42 11.707 11.332 7.705 1.00 0.17 H new ATOM 0 HB1 ALA A 42 13.974 11.029 6.780 1.00 0.17 H new ATOM 0 HB2 ALA A 42 13.358 9.527 7.510 1.00 0.17 H new ATOM 0 HB3 ALA A 42 13.370 9.716 5.741 1.00 0.17 H new ATOM 593 N VAL A 43 11.216 11.407 4.477 1.00 0.14 N ATOM 594 CA VAL A 43 10.979 12.298 3.356 1.00 0.15 C ATOM 595 C VAL A 43 9.507 12.692 3.274 1.00 0.18 C ATOM 596 O VAL A 43 8.616 11.843 3.267 1.00 0.21 O ATOM 597 CB VAL A 43 11.438 11.679 2.014 1.00 0.13 C ATOM 598 CG1 VAL A 43 10.892 10.272 1.834 1.00 0.13 C ATOM 599 CG2 VAL A 43 11.024 12.561 0.847 1.00 0.16 C ATOM 0 H VAL A 43 11.016 10.425 4.288 1.00 0.14 H new ATOM 0 HA VAL A 43 11.576 13.193 3.532 1.00 0.15 H new ATOM 0 HB VAL A 43 12.526 11.615 2.036 1.00 0.13 H new ATOM 0 HG11 VAL A 43 11.234 9.868 0.881 1.00 0.13 H new ATOM 0 HG12 VAL A 43 11.247 9.637 2.646 1.00 0.13 H new ATOM 0 HG13 VAL A 43 9.802 10.300 1.846 1.00 0.13 H new ATOM 0 HG21 VAL A 43 11.356 12.108 -0.087 1.00 0.16 H new ATOM 0 HG22 VAL A 43 9.939 12.663 0.835 1.00 0.16 H new ATOM 0 HG23 VAL A 43 11.480 13.545 0.955 1.00 0.16 H new ATOM 609 N ASP A 44 9.265 13.991 3.227 1.00 0.27 N ATOM 610 CA ASP A 44 7.917 14.511 3.107 1.00 0.34 C ATOM 611 C ASP A 44 7.452 14.424 1.670 1.00 0.32 C ATOM 612 O ASP A 44 8.147 14.856 0.747 1.00 0.39 O ATOM 613 CB ASP A 44 7.840 15.961 3.593 1.00 0.49 C ATOM 614 CG ASP A 44 8.030 16.092 5.090 1.00 0.57 C ATOM 615 OD1 ASP A 44 9.183 16.277 5.531 1.00 0.63 O ATOM 616 OD2 ASP A 44 7.031 15.996 5.837 1.00 0.70 O ATOM 0 H ASP A 44 9.990 14.707 3.271 1.00 0.27 H new ATOM 0 HA ASP A 44 7.264 13.905 3.735 1.00 0.34 H new ATOM 0 HB2 ASP A 44 8.601 16.551 3.082 1.00 0.49 H new ATOM 0 HB3 ASP A 44 6.873 16.381 3.317 1.00 0.49 H new ATOM 621 N GLY A 45 6.284 13.845 1.488 1.00 0.29 N ATOM 622 CA GLY A 45 5.726 13.699 0.171 1.00 0.27 C ATOM 623 C GLY A 45 5.725 12.261 -0.296 1.00 0.22 C ATOM 624 O GLY A 45 5.523 11.989 -1.478 1.00 0.21 O ATOM 0 H GLY A 45 5.706 13.469 2.240 1.00 0.29 H new ATOM 0 HA2 GLY A 45 4.705 14.081 0.167 1.00 0.27 H new ATOM 0 HA3 GLY A 45 6.296 14.307 -0.532 1.00 0.27 H new ATOM 628 N CYS A 46 5.904 11.334 0.634 1.00 0.19 N ATOM 629 CA CYS A 46 5.998 9.923 0.286 1.00 0.15 C ATOM 630 C CYS A 46 4.775 9.172 0.787 1.00 0.14 C ATOM 631 O CYS A 46 4.355 9.327 1.933 1.00 0.19 O ATOM 632 CB CYS A 46 7.274 9.303 0.873 1.00 0.14 C ATOM 633 SG CYS A 46 7.419 7.502 0.629 1.00 0.13 S ATOM 0 H CYS A 46 5.987 11.532 1.631 1.00 0.19 H new ATOM 0 HA CYS A 46 6.041 9.842 -0.800 1.00 0.15 H new ATOM 0 HB2 CYS A 46 8.140 9.789 0.423 1.00 0.14 H new ATOM 0 HB3 CYS A 46 7.309 9.516 1.941 1.00 0.14 H new ATOM 638 N THR A 47 4.188 8.380 -0.093 1.00 0.12 N ATOM 639 CA THR A 47 2.994 7.623 0.244 1.00 0.12 C ATOM 640 C THR A 47 3.308 6.144 0.305 1.00 0.12 C ATOM 641 O THR A 47 2.709 5.393 1.078 1.00 0.13 O ATOM 642 CB THR A 47 1.888 7.848 -0.793 1.00 0.13 C ATOM 643 OG1 THR A 47 2.353 7.433 -2.087 1.00 0.18 O ATOM 644 CG2 THR A 47 1.489 9.313 -0.834 1.00 0.12 C ATOM 0 H THR A 47 4.519 8.244 -1.048 1.00 0.12 H new ATOM 0 HA THR A 47 2.649 7.970 1.218 1.00 0.12 H new ATOM 0 HB THR A 47 1.015 7.258 -0.513 1.00 0.13 H new ATOM 0 HG1 THR A 47 1.625 6.986 -2.568 1.00 0.18 H new ATOM 0 HG21 THR A 47 0.703 9.455 -1.575 1.00 0.12 H new ATOM 0 HG22 THR A 47 1.123 9.618 0.146 1.00 0.12 H new ATOM 0 HG23 THR A 47 2.355 9.919 -1.102 1.00 0.12 H new ATOM 652 N HIS A 48 4.252 5.732 -0.518 1.00 0.13 N ATOM 653 CA HIS A 48 4.646 4.334 -0.575 1.00 0.14 C ATOM 654 C HIS A 48 6.098 4.242 -0.995 1.00 0.13 C ATOM 655 O HIS A 48 6.617 5.136 -1.660 1.00 0.20 O ATOM 656 CB HIS A 48 3.760 3.527 -1.547 1.00 0.15 C ATOM 657 CG HIS A 48 3.984 3.843 -2.993 1.00 0.14 C ATOM 658 ND1 HIS A 48 3.467 4.956 -3.617 1.00 0.17 N ATOM 659 CD2 HIS A 48 4.686 3.179 -3.940 1.00 0.16 C ATOM 660 CE1 HIS A 48 3.840 4.959 -4.882 1.00 0.17 C ATOM 661 NE2 HIS A 48 4.583 3.893 -5.104 1.00 0.17 N ATOM 0 H HIS A 48 4.761 6.343 -1.157 1.00 0.13 H new ATOM 0 HA HIS A 48 4.516 3.902 0.417 1.00 0.14 H new ATOM 0 HB2 HIS A 48 3.941 2.464 -1.387 1.00 0.15 H new ATOM 0 HB3 HIS A 48 2.713 3.712 -1.305 1.00 0.15 H new ATOM 0 HD1 HIS A 48 2.887 5.667 -3.171 1.00 0.17 H new ATOM 0 HD2 HIS A 48 5.228 2.255 -3.803 1.00 0.16 H new ATOM 0 HE1 HIS A 48 3.580 5.710 -5.614 1.00 0.17 H new ATOM 669 N PHE A 49 6.734 3.160 -0.624 1.00 0.13 N ATOM 670 CA PHE A 49 8.132 2.959 -0.935 1.00 0.13 C ATOM 671 C PHE A 49 8.311 1.683 -1.734 1.00 0.13 C ATOM 672 O PHE A 49 7.367 0.913 -1.923 1.00 0.18 O ATOM 673 CB PHE A 49 8.963 2.901 0.354 1.00 0.13 C ATOM 674 CG PHE A 49 8.226 2.260 1.498 1.00 0.14 C ATOM 675 CD1 PHE A 49 7.648 1.013 1.359 1.00 0.21 C ATOM 676 CD2 PHE A 49 8.094 2.918 2.707 1.00 0.18 C ATOM 677 CE1 PHE A 49 6.953 0.440 2.399 1.00 0.27 C ATOM 678 CE2 PHE A 49 7.404 2.346 3.753 1.00 0.22 C ATOM 679 CZ PHE A 49 6.831 1.106 3.598 1.00 0.25 C ATOM 0 H PHE A 49 6.304 2.397 -0.101 1.00 0.13 H new ATOM 0 HA PHE A 49 8.481 3.800 -1.535 1.00 0.13 H new ATOM 0 HB2 PHE A 49 9.881 2.346 0.163 1.00 0.13 H new ATOM 0 HB3 PHE A 49 9.255 3.912 0.638 1.00 0.13 H new ATOM 0 HD1 PHE A 49 7.743 0.482 0.423 1.00 0.21 H new ATOM 0 HD2 PHE A 49 8.538 3.894 2.833 1.00 0.18 H new ATOM 0 HE1 PHE A 49 6.502 -0.534 2.275 1.00 0.27 H new ATOM 0 HE2 PHE A 49 7.313 2.870 4.693 1.00 0.22 H new ATOM 0 HZ PHE A 49 6.287 0.655 4.415 1.00 0.25 H new ATOM 689 N THR A 50 9.510 1.480 -2.221 1.00 0.11 N ATOM 690 CA THR A 50 9.852 0.266 -2.918 1.00 0.11 C ATOM 691 C THR A 50 11.232 -0.204 -2.500 1.00 0.10 C ATOM 692 O THR A 50 12.245 0.407 -2.845 1.00 0.11 O ATOM 693 CB THR A 50 9.812 0.461 -4.444 1.00 0.14 C ATOM 694 OG1 THR A 50 8.506 0.905 -4.839 1.00 0.15 O ATOM 695 CG2 THR A 50 10.155 -0.835 -5.169 1.00 0.19 C ATOM 0 H THR A 50 10.275 2.151 -2.145 1.00 0.11 H new ATOM 0 HA THR A 50 9.112 -0.489 -2.652 1.00 0.11 H new ATOM 0 HB THR A 50 10.554 1.212 -4.715 1.00 0.14 H new ATOM 0 HG1 THR A 50 7.867 0.168 -4.743 1.00 0.15 H new ATOM 0 HG21 THR A 50 10.120 -0.670 -6.246 1.00 0.19 H new ATOM 0 HG22 THR A 50 11.157 -1.157 -4.884 1.00 0.19 H new ATOM 0 HG23 THR A 50 9.434 -1.606 -4.896 1.00 0.19 H new ATOM 703 N TYR A 51 11.266 -1.272 -1.732 1.00 0.11 N ATOM 704 CA TYR A 51 12.519 -1.889 -1.375 1.00 0.13 C ATOM 705 C TYR A 51 12.908 -2.833 -2.466 1.00 0.18 C ATOM 706 O TYR A 51 12.122 -3.679 -2.876 1.00 0.41 O ATOM 707 CB TYR A 51 12.432 -2.710 -0.094 1.00 0.20 C ATOM 708 CG TYR A 51 11.388 -2.297 0.909 1.00 0.11 C ATOM 709 CD1 TYR A 51 11.539 -1.154 1.653 1.00 0.23 C ATOM 710 CD2 TYR A 51 10.286 -3.104 1.159 1.00 0.09 C ATOM 711 CE1 TYR A 51 10.626 -0.815 2.629 1.00 0.33 C ATOM 712 CE2 TYR A 51 9.359 -2.768 2.119 1.00 0.18 C ATOM 713 CZ TYR A 51 9.540 -1.626 2.852 1.00 0.31 C ATOM 714 OH TYR A 51 8.653 -1.310 3.835 1.00 0.46 O ATOM 0 H TYR A 51 10.440 -1.728 -1.345 1.00 0.11 H new ATOM 0 HA TYR A 51 13.240 -1.085 -1.226 1.00 0.13 H new ATOM 0 HB2 TYR A 51 12.247 -3.749 -0.368 1.00 0.20 H new ATOM 0 HB3 TYR A 51 13.405 -2.678 0.396 1.00 0.20 H new ATOM 0 HD1 TYR A 51 12.386 -0.510 1.471 1.00 0.23 H new ATOM 0 HD2 TYR A 51 10.154 -4.012 0.590 1.00 0.09 H new ATOM 0 HE1 TYR A 51 10.764 0.082 3.214 1.00 0.33 H new ATOM 0 HE2 TYR A 51 8.499 -3.398 2.292 1.00 0.18 H new ATOM 0 HH TYR A 51 8.355 -0.383 3.721 1.00 0.46 H new ATOM 724 N ASN A 52 14.108 -2.709 -2.934 1.00 0.10 N ATOM 725 CA ASN A 52 14.620 -3.695 -3.830 1.00 0.12 C ATOM 726 C ASN A 52 15.372 -4.713 -3.004 1.00 0.13 C ATOM 727 O ASN A 52 16.390 -4.395 -2.419 1.00 0.17 O ATOM 728 CB ASN A 52 15.525 -3.053 -4.854 1.00 0.14 C ATOM 729 CG ASN A 52 15.674 -3.922 -6.090 1.00 0.15 C ATOM 730 OD1 ASN A 52 16.591 -4.730 -6.180 1.00 0.17 O ATOM 731 ND2 ASN A 52 14.751 -3.789 -7.033 1.00 0.16 N ATOM 0 H ASN A 52 14.746 -1.944 -2.714 1.00 0.10 H new ATOM 0 HA ASN A 52 13.810 -4.180 -4.374 1.00 0.12 H new ATOM 0 HB2 ASN A 52 15.122 -2.081 -5.138 1.00 0.14 H new ATOM 0 HB3 ASN A 52 16.506 -2.875 -4.413 1.00 0.14 H new ATOM 0 HD21 ASN A 52 14.789 -4.371 -7.870 1.00 0.16 H new ATOM 0 HD22 ASN A 52 14.003 -3.105 -6.921 1.00 0.16 H new ATOM 738 N ASP A 53 14.824 -5.901 -2.868 1.00 0.12 N ATOM 739 CA ASP A 53 15.437 -6.945 -2.068 1.00 0.14 C ATOM 740 C ASP A 53 16.673 -7.503 -2.770 1.00 0.17 C ATOM 741 O ASP A 53 17.528 -8.127 -2.147 1.00 0.23 O ATOM 742 CB ASP A 53 14.399 -8.038 -1.792 1.00 0.14 C ATOM 743 CG ASP A 53 14.900 -9.107 -0.850 1.00 0.25 C ATOM 744 OD1 ASP A 53 14.846 -8.907 0.378 1.00 0.36 O ATOM 745 OD2 ASP A 53 15.369 -10.152 -1.346 1.00 0.30 O ATOM 0 H ASP A 53 13.944 -6.172 -3.306 1.00 0.12 H new ATOM 0 HA ASP A 53 15.770 -6.533 -1.115 1.00 0.14 H new ATOM 0 HB2 ASP A 53 13.503 -7.582 -1.371 1.00 0.14 H new ATOM 0 HB3 ASP A 53 14.108 -8.501 -2.735 1.00 0.14 H new ATOM 750 N ASP A 54 16.776 -7.226 -4.064 1.00 0.18 N ATOM 751 CA ASP A 54 17.925 -7.652 -4.860 1.00 0.22 C ATOM 752 C ASP A 54 19.070 -6.637 -4.757 1.00 0.25 C ATOM 753 O ASP A 54 20.241 -7.005 -4.735 1.00 0.37 O ATOM 754 CB ASP A 54 17.506 -7.827 -6.326 1.00 0.23 C ATOM 755 CG ASP A 54 18.645 -8.286 -7.215 1.00 0.31 C ATOM 756 OD1 ASP A 54 19.317 -7.425 -7.818 1.00 0.46 O ATOM 757 OD2 ASP A 54 18.890 -9.505 -7.295 1.00 0.31 O ATOM 0 H ASP A 54 16.074 -6.705 -4.589 1.00 0.18 H new ATOM 0 HA ASP A 54 18.280 -8.606 -4.470 1.00 0.22 H new ATOM 0 HB2 ASP A 54 16.693 -8.551 -6.382 1.00 0.23 H new ATOM 0 HB3 ASP A 54 17.116 -6.881 -6.703 1.00 0.23 H new ATOM 762 N SER A 55 18.717 -5.359 -4.669 1.00 0.17 N ATOM 763 CA SER A 55 19.692 -4.282 -4.643 1.00 0.19 C ATOM 764 C SER A 55 19.743 -3.647 -3.267 1.00 0.19 C ATOM 765 O SER A 55 20.450 -2.669 -3.045 1.00 0.24 O ATOM 766 CB SER A 55 19.309 -3.236 -5.677 1.00 0.21 C ATOM 767 OG SER A 55 19.214 -3.806 -6.974 1.00 0.28 O ATOM 0 H SER A 55 17.748 -5.044 -4.614 1.00 0.17 H new ATOM 0 HA SER A 55 20.677 -4.687 -4.875 1.00 0.19 H new ATOM 0 HB2 SER A 55 18.355 -2.784 -5.405 1.00 0.21 H new ATOM 0 HB3 SER A 55 20.050 -2.437 -5.682 1.00 0.21 H new ATOM 0 HG SER A 55 18.350 -4.257 -7.070 1.00 0.28 H new ATOM 773 N LYS A 56 18.984 -4.244 -2.352 1.00 0.16 N ATOM 774 CA LYS A 56 18.795 -3.742 -0.998 1.00 0.16 C ATOM 775 C LYS A 56 18.627 -2.227 -0.946 1.00 0.14 C ATOM 776 O LYS A 56 19.000 -1.587 0.031 1.00 0.17 O ATOM 777 CB LYS A 56 19.960 -4.212 -0.157 1.00 0.21 C ATOM 778 CG LYS A 56 20.240 -5.682 -0.382 1.00 0.29 C ATOM 779 CD LYS A 56 21.377 -6.190 0.462 1.00 0.50 C ATOM 780 CE LYS A 56 22.660 -5.407 0.223 1.00 1.20 C ATOM 781 NZ LYS A 56 23.749 -5.839 1.132 1.00 1.31 N ATOM 0 H LYS A 56 18.474 -5.108 -2.537 1.00 0.16 H new ATOM 0 HA LYS A 56 17.863 -4.140 -0.598 1.00 0.16 H new ATOM 0 HB2 LYS A 56 20.847 -3.628 -0.402 1.00 0.21 H new ATOM 0 HB3 LYS A 56 19.745 -4.037 0.897 1.00 0.21 H new ATOM 0 HG2 LYS A 56 19.342 -6.257 -0.159 1.00 0.29 H new ATOM 0 HG3 LYS A 56 20.471 -5.847 -1.434 1.00 0.29 H new ATOM 0 HD2 LYS A 56 21.104 -6.125 1.515 1.00 0.50 H new ATOM 0 HD3 LYS A 56 21.549 -7.244 0.242 1.00 0.50 H new ATOM 0 HE2 LYS A 56 22.978 -5.537 -0.812 1.00 1.20 H new ATOM 0 HE3 LYS A 56 22.468 -4.344 0.366 1.00 1.20 H new ATOM 0 HZ1 LYS A 56 23.977 -5.068 1.792 1.00 1.31 H new ATOM 0 HZ2 LYS A 56 23.442 -6.675 1.669 1.00 1.31 H new ATOM 0 HZ3 LYS A 56 24.593 -6.077 0.574 1.00 1.31 H new ATOM 795 N MET A 57 18.006 -1.672 -1.977 1.00 0.12 N ATOM 796 CA MET A 57 17.902 -0.233 -2.115 1.00 0.13 C ATOM 797 C MET A 57 16.484 0.219 -1.790 1.00 0.13 C ATOM 798 O MET A 57 15.524 -0.534 -1.977 1.00 0.22 O ATOM 799 CB MET A 57 18.290 0.169 -3.537 1.00 0.13 C ATOM 800 CG MET A 57 17.181 0.007 -4.554 1.00 0.14 C ATOM 801 SD MET A 57 17.738 0.275 -6.248 1.00 0.24 S ATOM 802 CE MET A 57 18.590 1.841 -6.090 1.00 1.62 C ATOM 0 H MET A 57 17.567 -2.201 -2.730 1.00 0.12 H new ATOM 0 HA MET A 57 18.582 0.254 -1.416 1.00 0.13 H new ATOM 0 HB2 MET A 57 18.614 1.210 -3.532 1.00 0.13 H new ATOM 0 HB3 MET A 57 19.145 -0.429 -3.851 1.00 0.13 H new ATOM 0 HG2 MET A 57 16.761 -0.995 -4.469 1.00 0.14 H new ATOM 0 HG3 MET A 57 16.379 0.709 -4.325 1.00 0.14 H new ATOM 0 HE1 MET A 57 18.756 2.267 -7.080 1.00 1.62 H new ATOM 0 HE2 MET A 57 17.984 2.526 -5.497 1.00 1.62 H new ATOM 0 HE3 MET A 57 19.549 1.685 -5.597 1.00 1.62 H new ATOM 812 N CYS A 58 16.361 1.432 -1.285 1.00 0.08 N ATOM 813 CA CYS A 58 15.071 1.975 -0.905 1.00 0.07 C ATOM 814 C CYS A 58 14.626 3.075 -1.853 1.00 0.07 C ATOM 815 O CYS A 58 15.189 4.165 -1.854 1.00 0.09 O ATOM 816 CB CYS A 58 15.128 2.529 0.511 1.00 0.08 C ATOM 817 SG CYS A 58 13.607 3.384 1.013 1.00 0.08 S ATOM 0 H CYS A 58 17.146 2.064 -1.128 1.00 0.08 H new ATOM 0 HA CYS A 58 14.348 1.161 -0.956 1.00 0.07 H new ATOM 0 HB2 CYS A 58 15.322 1.712 1.205 1.00 0.08 H new ATOM 0 HB3 CYS A 58 15.967 3.220 0.589 1.00 0.08 H new ATOM 822 N HIS A 59 13.613 2.788 -2.647 1.00 0.08 N ATOM 823 CA HIS A 59 13.039 3.782 -3.539 1.00 0.08 C ATOM 824 C HIS A 59 11.761 4.364 -2.935 1.00 0.08 C ATOM 825 O HIS A 59 10.690 3.778 -3.069 1.00 0.09 O ATOM 826 CB HIS A 59 12.713 3.158 -4.902 1.00 0.10 C ATOM 827 CG HIS A 59 13.839 3.156 -5.893 1.00 0.12 C ATOM 828 ND1 HIS A 59 13.912 4.026 -6.956 1.00 0.16 N ATOM 829 CD2 HIS A 59 14.913 2.349 -6.005 1.00 0.14 C ATOM 830 CE1 HIS A 59 14.978 3.750 -7.680 1.00 0.18 C ATOM 831 NE2 HIS A 59 15.606 2.735 -7.125 1.00 0.17 N ATOM 0 H HIS A 59 13.168 1.872 -2.694 1.00 0.08 H new ATOM 0 HA HIS A 59 13.772 4.578 -3.674 1.00 0.08 H new ATOM 0 HB2 HIS A 59 12.389 2.129 -4.744 1.00 0.10 H new ATOM 0 HB3 HIS A 59 11.870 3.695 -5.336 1.00 0.10 H new ATOM 0 HD2 HIS A 59 15.180 1.545 -5.335 1.00 0.14 H new ATOM 0 HE1 HIS A 59 15.284 4.269 -8.576 1.00 0.18 H new ATOM 0 HE2 HIS A 59 16.465 2.307 -7.470 1.00 0.17 H new ATOM 839 N VAL A 60 11.874 5.503 -2.264 1.00 0.07 N ATOM 840 CA VAL A 60 10.697 6.208 -1.761 1.00 0.07 C ATOM 841 C VAL A 60 9.963 6.851 -2.924 1.00 0.08 C ATOM 842 O VAL A 60 10.587 7.437 -3.805 1.00 0.09 O ATOM 843 CB VAL A 60 11.046 7.293 -0.715 1.00 0.07 C ATOM 844 CG1 VAL A 60 11.148 6.689 0.679 1.00 0.08 C ATOM 845 CG2 VAL A 60 12.344 7.998 -1.080 1.00 0.09 C ATOM 0 H VAL A 60 12.763 5.958 -2.055 1.00 0.07 H new ATOM 0 HA VAL A 60 10.068 5.470 -1.262 1.00 0.07 H new ATOM 0 HB VAL A 60 10.241 8.028 -0.714 1.00 0.07 H new ATOM 0 HG11 VAL A 60 11.394 7.471 1.397 1.00 0.08 H new ATOM 0 HG12 VAL A 60 10.195 6.235 0.949 1.00 0.08 H new ATOM 0 HG13 VAL A 60 11.928 5.928 0.690 1.00 0.08 H new ATOM 0 HG21 VAL A 60 12.569 8.757 -0.330 1.00 0.09 H new ATOM 0 HG22 VAL A 60 13.155 7.271 -1.116 1.00 0.09 H new ATOM 0 HG23 VAL A 60 12.239 8.472 -2.056 1.00 0.09 H new ATOM 855 N LYS A 61 8.649 6.729 -2.943 1.00 0.09 N ATOM 856 CA LYS A 61 7.879 7.188 -4.086 1.00 0.11 C ATOM 857 C LYS A 61 6.682 8.027 -3.675 1.00 0.11 C ATOM 858 O LYS A 61 6.293 8.075 -2.505 1.00 0.11 O ATOM 859 CB LYS A 61 7.432 5.995 -4.922 1.00 0.14 C ATOM 860 CG LYS A 61 8.584 5.298 -5.624 1.00 0.13 C ATOM 861 CD LYS A 61 8.136 4.015 -6.294 1.00 0.22 C ATOM 862 CE LYS A 61 9.276 3.355 -7.056 1.00 0.20 C ATOM 863 NZ LYS A 61 9.043 1.913 -7.279 1.00 1.22 N ATOM 0 H LYS A 61 8.096 6.321 -2.189 1.00 0.09 H new ATOM 0 HA LYS A 61 8.527 7.830 -4.684 1.00 0.11 H new ATOM 0 HB2 LYS A 61 6.919 5.280 -4.279 1.00 0.14 H new ATOM 0 HB3 LYS A 61 6.709 6.330 -5.666 1.00 0.14 H new ATOM 0 HG2 LYS A 61 9.015 5.967 -6.369 1.00 0.13 H new ATOM 0 HG3 LYS A 61 9.370 5.077 -4.902 1.00 0.13 H new ATOM 0 HD2 LYS A 61 7.753 3.325 -5.542 1.00 0.22 H new ATOM 0 HD3 LYS A 61 7.315 4.228 -6.979 1.00 0.22 H new ATOM 0 HE2 LYS A 61 9.403 3.853 -8.017 1.00 0.20 H new ATOM 0 HE3 LYS A 61 10.205 3.489 -6.502 1.00 0.20 H new ATOM 0 HZ1 LYS A 61 9.943 1.449 -7.516 1.00 1.22 H new ATOM 0 HZ2 LYS A 61 8.651 1.487 -6.415 1.00 1.22 H new ATOM 0 HZ3 LYS A 61 8.371 1.787 -8.063 1.00 1.22 H new ATOM 877 N GLU A 62 6.082 8.656 -4.670 1.00 0.10 N ATOM 878 CA GLU A 62 5.005 9.605 -4.452 1.00 0.11 C ATOM 879 C GLU A 62 3.648 8.940 -4.600 1.00 0.12 C ATOM 880 O GLU A 62 3.564 7.769 -4.953 1.00 0.12 O ATOM 881 CB GLU A 62 5.088 10.796 -5.404 1.00 0.12 C ATOM 882 CG GLU A 62 6.450 11.469 -5.461 1.00 0.12 C ATOM 883 CD GLU A 62 6.356 12.884 -5.994 1.00 0.17 C ATOM 884 OE1 GLU A 62 6.369 13.060 -7.231 1.00 0.39 O ATOM 885 OE2 GLU A 62 6.298 13.828 -5.185 1.00 0.40 O ATOM 0 H GLU A 62 6.327 8.523 -5.651 1.00 0.10 H new ATOM 0 HA GLU A 62 5.119 9.970 -3.431 1.00 0.11 H new ATOM 0 HB2 GLU A 62 4.821 10.462 -6.406 1.00 0.12 H new ATOM 0 HB3 GLU A 62 4.345 11.535 -5.105 1.00 0.12 H new ATOM 0 HG2 GLU A 62 6.890 11.485 -4.464 1.00 0.12 H new ATOM 0 HG3 GLU A 62 7.118 10.885 -6.095 1.00 0.12 H new ATOM 892 N GLY A 63 2.609 9.696 -4.277 1.00 0.13 N ATOM 893 CA GLY A 63 1.250 9.185 -4.141 1.00 0.13 C ATOM 894 C GLY A 63 0.814 8.128 -5.139 1.00 0.14 C ATOM 895 O GLY A 63 1.153 8.168 -6.322 1.00 0.18 O ATOM 0 H GLY A 63 2.686 10.697 -4.099 1.00 0.13 H new ATOM 0 HA2 GLY A 63 1.141 8.771 -3.138 1.00 0.13 H new ATOM 0 HA3 GLY A 63 0.561 10.027 -4.215 1.00 0.13 H new ATOM 899 N LYS A 64 0.037 7.184 -4.608 1.00 0.16 N ATOM 900 CA LYS A 64 -0.539 6.075 -5.358 1.00 0.16 C ATOM 901 C LYS A 64 0.502 5.077 -5.851 1.00 0.15 C ATOM 902 O LYS A 64 1.368 5.392 -6.665 1.00 0.17 O ATOM 903 CB LYS A 64 -1.404 6.570 -6.505 1.00 0.19 C ATOM 904 CG LYS A 64 -2.727 7.140 -6.032 1.00 0.30 C ATOM 905 CD LYS A 64 -3.361 8.051 -7.063 1.00 0.73 C ATOM 906 CE LYS A 64 -2.714 9.422 -7.060 1.00 0.54 C ATOM 907 NZ LYS A 64 -3.378 10.350 -8.014 1.00 1.10 N ATOM 0 H LYS A 64 -0.214 7.172 -3.619 1.00 0.16 H new ATOM 0 HA LYS A 64 -1.174 5.536 -4.655 1.00 0.16 H new ATOM 0 HB2 LYS A 64 -0.861 7.334 -7.061 1.00 0.19 H new ATOM 0 HB3 LYS A 64 -1.593 5.747 -7.195 1.00 0.19 H new ATOM 0 HG2 LYS A 64 -3.411 6.323 -5.803 1.00 0.30 H new ATOM 0 HG3 LYS A 64 -2.571 7.695 -5.107 1.00 0.30 H new ATOM 0 HD2 LYS A 64 -3.267 7.604 -8.053 1.00 0.73 H new ATOM 0 HD3 LYS A 64 -4.427 8.149 -6.858 1.00 0.73 H new ATOM 0 HE2 LYS A 64 -2.758 9.842 -6.055 1.00 0.54 H new ATOM 0 HE3 LYS A 64 -1.660 9.327 -7.320 1.00 0.54 H new ATOM 0 HZ1 LYS A 64 -3.035 11.318 -7.852 1.00 1.10 H new ATOM 0 HZ2 LYS A 64 -3.156 10.063 -8.989 1.00 1.10 H new ATOM 0 HZ3 LYS A 64 -4.407 10.318 -7.869 1.00 1.10 H new ATOM 921 N PRO A 65 0.409 3.843 -5.348 1.00 0.17 N ATOM 922 CA PRO A 65 1.255 2.744 -5.760 1.00 0.19 C ATOM 923 C PRO A 65 0.742 2.100 -7.032 1.00 0.22 C ATOM 924 O PRO A 65 -0.414 1.690 -7.127 1.00 0.52 O ATOM 925 CB PRO A 65 1.204 1.769 -4.583 1.00 0.32 C ATOM 926 CG PRO A 65 0.078 2.218 -3.707 1.00 0.35 C ATOM 927 CD PRO A 65 -0.562 3.416 -4.352 1.00 0.19 C ATOM 0 HA PRO A 65 2.271 3.066 -5.988 1.00 0.19 H new ATOM 0 HB2 PRO A 65 1.041 0.749 -4.931 1.00 0.32 H new ATOM 0 HB3 PRO A 65 2.146 1.772 -4.035 1.00 0.32 H new ATOM 0 HG2 PRO A 65 -0.651 1.417 -3.583 1.00 0.35 H new ATOM 0 HG3 PRO A 65 0.446 2.471 -2.713 1.00 0.35 H new ATOM 0 HD2 PRO A 65 -1.517 3.159 -4.811 1.00 0.19 H new ATOM 0 HD3 PRO A 65 -0.759 4.203 -3.624 1.00 0.19 H new ATOM 935 N ASP A 66 1.619 2.030 -8.007 1.00 0.22 N ATOM 936 CA ASP A 66 1.277 1.537 -9.325 1.00 0.21 C ATOM 937 C ASP A 66 2.011 0.229 -9.561 1.00 0.20 C ATOM 938 O ASP A 66 3.068 0.200 -10.190 1.00 0.19 O ATOM 939 CB ASP A 66 1.684 2.577 -10.358 1.00 0.21 C ATOM 940 CG ASP A 66 1.052 2.342 -11.715 1.00 0.25 C ATOM 941 OD1 ASP A 66 0.000 2.955 -11.990 1.00 0.40 O ATOM 942 OD2 ASP A 66 1.597 1.552 -12.511 1.00 0.34 O ATOM 0 H ASP A 66 2.594 2.314 -7.910 1.00 0.22 H new ATOM 0 HA ASP A 66 0.205 1.360 -9.407 1.00 0.21 H new ATOM 0 HB2 ASP A 66 1.403 3.567 -9.999 1.00 0.21 H new ATOM 0 HB3 ASP A 66 2.769 2.572 -10.463 1.00 0.21 H new ATOM 947 N LEU A 67 1.456 -0.837 -9.022 1.00 0.21 N ATOM 948 CA LEU A 67 2.146 -2.108 -8.933 1.00 0.20 C ATOM 949 C LEU A 67 2.468 -2.727 -10.285 1.00 0.22 C ATOM 950 O LEU A 67 1.652 -2.738 -11.206 1.00 0.27 O ATOM 951 CB LEU A 67 1.325 -3.068 -8.092 1.00 0.23 C ATOM 952 CG LEU A 67 1.170 -2.631 -6.638 1.00 0.26 C ATOM 953 CD1 LEU A 67 0.319 -3.616 -5.869 1.00 0.31 C ATOM 954 CD2 LEU A 67 2.540 -2.482 -6.001 1.00 0.28 C ATOM 0 H LEU A 67 0.513 -0.847 -8.633 1.00 0.21 H new ATOM 0 HA LEU A 67 3.109 -1.914 -8.460 1.00 0.20 H new ATOM 0 HB2 LEU A 67 0.336 -3.173 -8.538 1.00 0.23 H new ATOM 0 HB3 LEU A 67 1.793 -4.052 -8.119 1.00 0.23 H new ATOM 0 HG LEU A 67 0.663 -1.666 -6.610 1.00 0.26 H new ATOM 0 HD11 LEU A 67 0.222 -3.284 -4.835 1.00 0.31 H new ATOM 0 HD12 LEU A 67 -0.669 -3.676 -6.325 1.00 0.31 H new ATOM 0 HD13 LEU A 67 0.790 -4.599 -5.892 1.00 0.31 H new ATOM 0 HD21 LEU A 67 2.427 -2.170 -4.963 1.00 0.28 H new ATOM 0 HD22 LEU A 67 3.064 -3.437 -6.038 1.00 0.28 H new ATOM 0 HD23 LEU A 67 3.114 -1.732 -6.545 1.00 0.28 H new ATOM 966 N TYR A 68 3.684 -3.236 -10.367 1.00 0.19 N ATOM 967 CA TYR A 68 4.162 -3.972 -11.525 1.00 0.21 C ATOM 968 C TYR A 68 5.142 -5.035 -11.054 1.00 0.22 C ATOM 969 O TYR A 68 5.694 -4.927 -9.955 1.00 0.21 O ATOM 970 CB TYR A 68 4.841 -3.043 -12.537 1.00 0.22 C ATOM 971 CG TYR A 68 6.109 -2.394 -12.029 1.00 0.21 C ATOM 972 CD1 TYR A 68 6.095 -1.108 -11.505 1.00 0.22 C ATOM 973 CD2 TYR A 68 7.315 -3.068 -12.074 1.00 0.25 C ATOM 974 CE1 TYR A 68 7.251 -0.512 -11.047 1.00 0.24 C ATOM 975 CE2 TYR A 68 8.475 -2.484 -11.614 1.00 0.28 C ATOM 976 CZ TYR A 68 8.433 -1.201 -11.089 1.00 0.27 C ATOM 977 OH TYR A 68 9.598 -0.612 -10.655 1.00 0.33 O ATOM 0 H TYR A 68 4.376 -3.149 -9.623 1.00 0.19 H new ATOM 0 HA TYR A 68 3.312 -4.436 -12.025 1.00 0.21 H new ATOM 0 HB2 TYR A 68 5.073 -3.612 -13.437 1.00 0.22 H new ATOM 0 HB3 TYR A 68 4.137 -2.262 -12.826 1.00 0.22 H new ATOM 0 HD1 TYR A 68 5.163 -0.565 -11.455 1.00 0.22 H new ATOM 0 HD2 TYR A 68 7.349 -4.070 -12.477 1.00 0.25 H new ATOM 0 HE1 TYR A 68 7.224 0.495 -10.657 1.00 0.24 H new ATOM 0 HE2 TYR A 68 9.410 -3.022 -11.662 1.00 0.28 H new ATOM 0 HH TYR A 68 10.341 -1.244 -10.755 1.00 0.33 H new ATOM 987 N ASP A 69 5.357 -6.051 -11.875 1.00 0.28 N ATOM 988 CA ASP A 69 6.257 -7.140 -11.520 1.00 0.31 C ATOM 989 C ASP A 69 7.699 -6.657 -11.455 1.00 0.25 C ATOM 990 O ASP A 69 8.236 -6.126 -12.426 1.00 0.31 O ATOM 991 CB ASP A 69 6.123 -8.298 -12.508 1.00 0.44 C ATOM 992 CG ASP A 69 4.792 -9.010 -12.377 1.00 1.40 C ATOM 993 OD1 ASP A 69 3.935 -8.860 -13.276 1.00 2.32 O ATOM 994 OD2 ASP A 69 4.587 -9.714 -11.367 1.00 1.40 O ATOM 0 H ASP A 69 4.921 -6.145 -12.792 1.00 0.28 H new ATOM 0 HA ASP A 69 5.975 -7.499 -10.530 1.00 0.31 H new ATOM 0 HB2 ASP A 69 6.233 -7.921 -13.525 1.00 0.44 H new ATOM 0 HB3 ASP A 69 6.932 -9.010 -12.343 1.00 0.44 H new ATOM 999 N LEU A 70 8.310 -6.847 -10.298 1.00 0.21 N ATOM 1000 CA LEU A 70 9.657 -6.368 -10.032 1.00 0.18 C ATOM 1001 C LEU A 70 10.447 -7.451 -9.307 1.00 0.17 C ATOM 1002 O LEU A 70 10.212 -7.698 -8.137 1.00 0.17 O ATOM 1003 CB LEU A 70 9.588 -5.086 -9.185 1.00 0.15 C ATOM 1004 CG LEU A 70 10.924 -4.546 -8.672 1.00 0.16 C ATOM 1005 CD1 LEU A 70 11.946 -4.469 -9.796 1.00 0.21 C ATOM 1006 CD2 LEU A 70 10.734 -3.175 -8.045 1.00 0.17 C ATOM 0 H LEU A 70 7.884 -7.340 -9.513 1.00 0.21 H new ATOM 0 HA LEU A 70 10.161 -6.138 -10.971 1.00 0.18 H new ATOM 0 HB2 LEU A 70 9.109 -4.308 -9.779 1.00 0.15 H new ATOM 0 HB3 LEU A 70 8.942 -5.276 -8.327 1.00 0.15 H new ATOM 0 HG LEU A 70 11.298 -5.234 -7.914 1.00 0.16 H new ATOM 0 HD11 LEU A 70 12.887 -4.082 -9.406 1.00 0.21 H new ATOM 0 HD12 LEU A 70 12.107 -5.464 -10.211 1.00 0.21 H new ATOM 0 HD13 LEU A 70 11.577 -3.805 -10.578 1.00 0.21 H new ATOM 0 HD21 LEU A 70 11.693 -2.804 -7.685 1.00 0.17 H new ATOM 0 HD22 LEU A 70 10.335 -2.486 -8.790 1.00 0.17 H new ATOM 0 HD23 LEU A 70 10.037 -3.250 -7.210 1.00 0.17 H new ATOM 1018 N THR A 71 11.362 -8.106 -10.007 1.00 0.26 N ATOM 1019 CA THR A 71 12.139 -9.197 -9.423 1.00 0.29 C ATOM 1020 C THR A 71 12.887 -8.750 -8.170 1.00 0.22 C ATOM 1021 O THR A 71 13.737 -7.857 -8.226 1.00 0.26 O ATOM 1022 CB THR A 71 13.160 -9.748 -10.425 1.00 0.42 C ATOM 1023 OG1 THR A 71 12.505 -10.086 -11.654 1.00 0.48 O ATOM 1024 CG2 THR A 71 13.856 -10.972 -9.857 1.00 0.49 C ATOM 0 H THR A 71 11.587 -7.903 -10.981 1.00 0.26 H new ATOM 0 HA THR A 71 11.424 -9.976 -9.157 1.00 0.29 H new ATOM 0 HB THR A 71 13.909 -8.979 -10.617 1.00 0.42 H new ATOM 0 HG1 THR A 71 13.163 -10.436 -12.290 1.00 0.48 H new ATOM 0 HG21 THR A 71 14.577 -11.350 -10.582 1.00 0.49 H new ATOM 0 HG22 THR A 71 14.374 -10.702 -8.937 1.00 0.49 H new ATOM 0 HG23 THR A 71 13.117 -11.745 -9.644 1.00 0.49 H new ATOM 1032 N GLY A 72 12.562 -9.375 -7.043 1.00 0.17 N ATOM 1033 CA GLY A 72 13.158 -8.994 -5.776 1.00 0.12 C ATOM 1034 C GLY A 72 12.563 -7.705 -5.264 1.00 0.13 C ATOM 1035 O GLY A 72 13.005 -7.147 -4.267 1.00 0.14 O ATOM 0 H GLY A 72 11.893 -10.143 -6.985 1.00 0.17 H new ATOM 0 HA2 GLY A 72 13.002 -9.786 -5.044 1.00 0.12 H new ATOM 0 HA3 GLY A 72 14.235 -8.879 -5.897 1.00 0.12 H new ATOM 1039 N GLY A 73 11.559 -7.229 -5.968 1.00 0.15 N ATOM 1040 CA GLY A 73 10.893 -6.014 -5.590 1.00 0.16 C ATOM 1041 C GLY A 73 10.000 -6.199 -4.394 1.00 0.14 C ATOM 1042 O GLY A 73 9.243 -7.166 -4.302 1.00 0.15 O ATOM 0 H GLY A 73 11.189 -7.672 -6.809 1.00 0.15 H new ATOM 0 HA2 GLY A 73 11.637 -5.248 -5.370 1.00 0.16 H new ATOM 0 HA3 GLY A 73 10.301 -5.651 -6.430 1.00 0.16 H new ATOM 1046 N LYS A 74 10.087 -5.273 -3.477 1.00 0.15 N ATOM 1047 CA LYS A 74 9.235 -5.277 -2.311 1.00 0.13 C ATOM 1048 C LYS A 74 8.628 -3.893 -2.118 1.00 0.12 C ATOM 1049 O LYS A 74 9.272 -2.982 -1.617 1.00 0.12 O ATOM 1050 CB LYS A 74 10.029 -5.722 -1.072 1.00 0.13 C ATOM 1051 CG LYS A 74 10.371 -7.207 -1.072 1.00 0.18 C ATOM 1052 CD LYS A 74 11.224 -7.615 0.119 1.00 0.22 C ATOM 1053 CE LYS A 74 11.454 -9.122 0.126 1.00 0.33 C ATOM 1054 NZ LYS A 74 12.337 -9.559 1.239 1.00 0.38 N ATOM 0 H LYS A 74 10.747 -4.496 -3.514 1.00 0.15 H new ATOM 0 HA LYS A 74 8.423 -5.990 -2.455 1.00 0.13 H new ATOM 0 HB2 LYS A 74 10.952 -5.145 -1.015 1.00 0.13 H new ATOM 0 HB3 LYS A 74 9.451 -5.490 -0.177 1.00 0.13 H new ATOM 0 HG2 LYS A 74 9.449 -7.788 -1.068 1.00 0.18 H new ATOM 0 HG3 LYS A 74 10.899 -7.454 -1.993 1.00 0.18 H new ATOM 0 HD2 LYS A 74 12.182 -7.096 0.081 1.00 0.22 H new ATOM 0 HD3 LYS A 74 10.734 -7.313 1.044 1.00 0.22 H new ATOM 0 HE2 LYS A 74 10.494 -9.632 0.207 1.00 0.33 H new ATOM 0 HE3 LYS A 74 11.896 -9.423 -0.824 1.00 0.33 H new ATOM 0 HZ1 LYS A 74 12.448 -10.593 1.209 1.00 0.38 H new ATOM 0 HZ2 LYS A 74 13.269 -9.108 1.140 1.00 0.38 H new ATOM 0 HZ3 LYS A 74 11.913 -9.283 2.148 1.00 0.38 H new ATOM 1068 N THR A 75 7.387 -3.746 -2.538 1.00 0.14 N ATOM 1069 CA THR A 75 6.678 -2.485 -2.410 1.00 0.15 C ATOM 1070 C THR A 75 5.577 -2.605 -1.365 1.00 0.16 C ATOM 1071 O THR A 75 5.048 -3.696 -1.148 1.00 0.22 O ATOM 1072 CB THR A 75 6.098 -2.026 -3.780 1.00 0.19 C ATOM 1073 OG1 THR A 75 7.139 -1.479 -4.588 1.00 0.26 O ATOM 1074 CG2 THR A 75 4.979 -0.997 -3.615 1.00 0.23 C ATOM 0 H THR A 75 6.844 -4.490 -2.975 1.00 0.14 H new ATOM 0 HA THR A 75 7.386 -1.724 -2.081 1.00 0.15 H new ATOM 0 HB THR A 75 5.671 -2.903 -4.266 1.00 0.19 H new ATOM 0 HG1 THR A 75 6.748 -1.036 -5.370 1.00 0.26 H new ATOM 0 HG21 THR A 75 4.605 -0.706 -4.596 1.00 0.23 H new ATOM 0 HG22 THR A 75 4.168 -1.432 -3.032 1.00 0.23 H new ATOM 0 HG23 THR A 75 5.366 -0.118 -3.099 1.00 0.23 H new ATOM 1082 N ALA A 76 5.289 -1.497 -0.692 1.00 0.14 N ATOM 1083 CA ALA A 76 4.196 -1.421 0.260 1.00 0.13 C ATOM 1084 C ALA A 76 3.928 0.039 0.610 1.00 0.13 C ATOM 1085 O ALA A 76 4.649 0.938 0.162 1.00 0.15 O ATOM 1086 CB ALA A 76 4.508 -2.234 1.510 1.00 0.14 C ATOM 0 H ALA A 76 5.810 -0.626 -0.794 1.00 0.14 H new ATOM 0 HA ALA A 76 3.300 -1.846 -0.192 1.00 0.13 H new ATOM 0 HB1 ALA A 76 3.674 -2.162 2.209 1.00 0.14 H new ATOM 0 HB2 ALA A 76 4.662 -3.278 1.236 1.00 0.14 H new ATOM 0 HB3 ALA A 76 5.411 -1.845 1.981 1.00 0.14 H new ATOM 1092 N SER A 77 2.889 0.267 1.387 1.00 0.14 N ATOM 1093 CA SER A 77 2.526 1.609 1.823 1.00 0.13 C ATOM 1094 C SER A 77 3.431 2.073 2.952 1.00 0.15 C ATOM 1095 O SER A 77 3.979 1.259 3.687 1.00 0.18 O ATOM 1096 CB SER A 77 1.079 1.620 2.303 1.00 0.15 C ATOM 1097 OG SER A 77 0.667 2.914 2.722 1.00 0.27 O ATOM 0 H SER A 77 2.272 -0.466 1.735 1.00 0.14 H new ATOM 0 HA SER A 77 2.642 2.287 0.978 1.00 0.13 H new ATOM 0 HB2 SER A 77 0.428 1.275 1.500 1.00 0.15 H new ATOM 0 HB3 SER A 77 0.966 0.918 3.129 1.00 0.15 H new ATOM 0 HG SER A 77 -0.302 2.917 2.868 1.00 0.27 H new ATOM 1103 N ARG A 78 3.546 3.393 3.096 1.00 0.15 N ATOM 1104 CA ARG A 78 4.336 4.002 4.166 1.00 0.18 C ATOM 1105 C ARG A 78 3.823 3.567 5.534 1.00 0.18 C ATOM 1106 O ARG A 78 4.536 3.633 6.534 1.00 0.21 O ATOM 1107 CB ARG A 78 4.261 5.525 4.075 1.00 0.18 C ATOM 1108 CG ARG A 78 2.848 6.063 4.233 1.00 0.14 C ATOM 1109 CD ARG A 78 2.835 7.562 4.477 1.00 0.19 C ATOM 1110 NE ARG A 78 3.681 7.935 5.610 1.00 0.21 N ATOM 1111 CZ ARG A 78 4.448 9.020 5.659 1.00 0.40 C ATOM 1112 NH1 ARG A 78 4.589 9.802 4.598 1.00 0.60 N ATOM 1113 NH2 ARG A 78 5.106 9.301 6.776 1.00 0.43 N ATOM 0 H ARG A 78 3.096 4.068 2.477 1.00 0.15 H new ATOM 0 HA ARG A 78 5.368 3.673 4.047 1.00 0.18 H new ATOM 0 HB2 ARG A 78 4.898 5.961 4.845 1.00 0.18 H new ATOM 0 HB3 ARG A 78 4.660 5.846 3.113 1.00 0.18 H new ATOM 0 HG2 ARG A 78 2.271 5.836 3.336 1.00 0.14 H new ATOM 0 HG3 ARG A 78 2.358 5.556 5.064 1.00 0.14 H new ATOM 0 HD2 ARG A 78 3.179 8.079 3.581 1.00 0.19 H new ATOM 0 HD3 ARG A 78 1.813 7.891 4.663 1.00 0.19 H new ATOM 0 HE ARG A 78 3.683 7.318 6.422 1.00 0.21 H new ATOM 0 HH11 ARG A 78 4.106 9.575 3.729 1.00 0.60 H new ATOM 0 HH12 ARG A 78 5.181 10.631 4.651 1.00 0.60 H new ATOM 0 HH21 ARG A 78 5.021 8.687 7.586 1.00 0.43 H new ATOM 0 HH22 ARG A 78 5.697 10.131 6.825 1.00 0.43 H new ATOM 1127 N SER A 79 2.570 3.151 5.560 1.00 0.17 N ATOM 1128 CA SER A 79 1.935 2.701 6.776 1.00 0.20 C ATOM 1129 C SER A 79 1.374 1.301 6.570 1.00 0.20 C ATOM 1130 O SER A 79 0.593 1.063 5.650 1.00 0.31 O ATOM 1131 CB SER A 79 0.821 3.679 7.173 1.00 0.22 C ATOM 1132 OG SER A 79 0.154 3.272 8.359 1.00 1.00 O ATOM 0 H SER A 79 1.968 3.117 4.737 1.00 0.17 H new ATOM 0 HA SER A 79 2.669 2.668 7.582 1.00 0.20 H new ATOM 0 HB2 SER A 79 1.245 4.672 7.318 1.00 0.22 H new ATOM 0 HB3 SER A 79 0.100 3.756 6.360 1.00 0.22 H new ATOM 0 HG SER A 79 0.814 2.983 9.023 1.00 1.00 H new ATOM 1138 N CYS A 80 1.800 0.373 7.407 1.00 0.15 N ATOM 1139 CA CYS A 80 1.280 -0.983 7.370 1.00 0.16 C ATOM 1140 C CYS A 80 0.188 -1.129 8.417 1.00 0.18 C ATOM 1141 O CYS A 80 -0.326 -2.222 8.656 1.00 0.29 O ATOM 1142 CB CYS A 80 2.398 -1.985 7.649 1.00 0.19 C ATOM 1143 SG CYS A 80 3.984 -1.559 6.876 1.00 0.20 S ATOM 0 H CYS A 80 2.508 0.534 8.124 1.00 0.15 H new ATOM 0 HA CYS A 80 0.870 -1.183 6.380 1.00 0.16 H new ATOM 0 HB2 CYS A 80 2.541 -2.063 8.727 1.00 0.19 H new ATOM 0 HB3 CYS A 80 2.087 -2.968 7.296 1.00 0.19 H new ATOM 1148 N ASP A 81 -0.151 -0.005 9.038 1.00 0.20 N ATOM 1149 CA ASP A 81 -1.115 0.019 10.122 1.00 0.23 C ATOM 1150 C ASP A 81 -2.511 -0.263 9.609 1.00 0.20 C ATOM 1151 O ASP A 81 -2.969 0.348 8.648 1.00 0.24 O ATOM 1152 CB ASP A 81 -1.087 1.369 10.839 1.00 0.31 C ATOM 1153 CG ASP A 81 0.260 1.663 11.460 1.00 0.99 C ATOM 1154 OD1 ASP A 81 1.114 2.269 10.776 1.00 1.78 O ATOM 1155 OD2 ASP A 81 0.468 1.297 12.637 1.00 1.03 O ATOM 0 H ASP A 81 0.235 0.909 8.803 1.00 0.20 H new ATOM 0 HA ASP A 81 -0.840 -0.762 10.831 1.00 0.23 H new ATOM 0 HB2 ASP A 81 -1.338 2.159 10.131 1.00 0.31 H new ATOM 0 HB3 ASP A 81 -1.852 1.381 11.615 1.00 0.31 H new ATOM 1160 N ARG A 82 -3.177 -1.195 10.261 1.00 0.19 N ATOM 1161 CA ARG A 82 -4.517 -1.594 9.879 1.00 0.18 C ATOM 1162 C ARG A 82 -5.504 -1.219 10.976 1.00 0.18 C ATOM 1163 O ARG A 82 -6.507 -1.899 11.196 1.00 0.29 O ATOM 1164 CB ARG A 82 -4.542 -3.098 9.622 1.00 0.25 C ATOM 1165 CG ARG A 82 -3.537 -3.544 8.584 1.00 0.37 C ATOM 1166 CD ARG A 82 -3.456 -5.051 8.539 1.00 0.53 C ATOM 1167 NE ARG A 82 -2.913 -5.601 9.781 1.00 1.31 N ATOM 1168 CZ ARG A 82 -2.799 -6.904 10.034 1.00 1.74 C ATOM 1169 NH1 ARG A 82 -3.204 -7.798 9.141 1.00 1.65 N ATOM 1170 NH2 ARG A 82 -2.285 -7.311 11.187 1.00 2.65 N ATOM 0 H ARG A 82 -2.806 -1.696 11.068 1.00 0.19 H new ATOM 0 HA ARG A 82 -4.808 -1.075 8.966 1.00 0.18 H new ATOM 0 HB2 ARG A 82 -4.345 -3.623 10.557 1.00 0.25 H new ATOM 0 HB3 ARG A 82 -5.542 -3.388 9.298 1.00 0.25 H new ATOM 0 HG2 ARG A 82 -3.822 -3.160 7.605 1.00 0.37 H new ATOM 0 HG3 ARG A 82 -2.557 -3.128 8.816 1.00 0.37 H new ATOM 0 HD2 ARG A 82 -4.449 -5.464 8.362 1.00 0.53 H new ATOM 0 HD3 ARG A 82 -2.830 -5.357 7.701 1.00 0.53 H new ATOM 0 HE ARG A 82 -2.602 -4.946 10.498 1.00 1.31 H new ATOM 0 HH11 ARG A 82 -3.605 -7.489 8.256 1.00 1.65 H new ATOM 0 HH12 ARG A 82 -3.114 -8.794 9.340 1.00 1.65 H new ATOM 0 HH21 ARG A 82 -1.978 -6.627 11.878 1.00 2.65 H new ATOM 0 HH22 ARG A 82 -2.197 -8.308 11.382 1.00 2.65 H new ATOM 1184 N SER A 83 -5.206 -0.129 11.664 1.00 0.18 N ATOM 1185 CA SER A 83 -6.012 0.322 12.785 1.00 0.26 C ATOM 1186 C SER A 83 -7.259 1.070 12.317 1.00 0.23 C ATOM 1187 O SER A 83 -8.287 1.061 12.995 1.00 0.27 O ATOM 1188 CB SER A 83 -5.162 1.209 13.694 1.00 0.40 C ATOM 1189 OG SER A 83 -4.362 2.094 12.927 1.00 1.28 O ATOM 0 H SER A 83 -4.402 0.465 11.462 1.00 0.18 H new ATOM 0 HA SER A 83 -6.351 -0.552 13.341 1.00 0.26 H new ATOM 0 HB2 SER A 83 -5.808 1.780 14.360 1.00 0.40 H new ATOM 0 HB3 SER A 83 -4.525 0.588 14.323 1.00 0.40 H new ATOM 0 HG SER A 83 -3.827 2.654 13.527 1.00 1.28 H new ATOM 1195 N CYS A 84 -7.172 1.704 11.153 1.00 0.20 N ATOM 1196 CA CYS A 84 -8.292 2.472 10.627 1.00 0.20 C ATOM 1197 C CYS A 84 -9.079 1.646 9.615 1.00 0.18 C ATOM 1198 O CYS A 84 -10.055 2.122 9.035 1.00 0.22 O ATOM 1199 CB CYS A 84 -7.813 3.786 9.985 1.00 0.25 C ATOM 1200 SG CYS A 84 -6.895 3.597 8.419 1.00 0.28 S ATOM 0 H CYS A 84 -6.342 1.701 10.559 1.00 0.20 H new ATOM 0 HA CYS A 84 -8.947 2.722 11.462 1.00 0.20 H new ATOM 0 HB2 CYS A 84 -8.681 4.421 9.805 1.00 0.25 H new ATOM 0 HB3 CYS A 84 -7.178 4.310 10.699 1.00 0.25 H new ATOM 1205 N PHE A 85 -8.655 0.402 9.407 1.00 0.16 N ATOM 1206 CA PHE A 85 -9.335 -0.478 8.473 1.00 0.16 C ATOM 1207 C PHE A 85 -10.512 -1.171 9.142 1.00 0.17 C ATOM 1208 O PHE A 85 -10.540 -1.365 10.361 1.00 0.21 O ATOM 1209 CB PHE A 85 -8.399 -1.558 7.918 1.00 0.15 C ATOM 1210 CG PHE A 85 -7.207 -1.056 7.145 1.00 0.15 C ATOM 1211 CD1 PHE A 85 -7.095 0.270 6.760 1.00 0.17 C ATOM 1212 CD2 PHE A 85 -6.191 -1.932 6.799 1.00 0.16 C ATOM 1213 CE1 PHE A 85 -5.993 0.708 6.050 1.00 0.18 C ATOM 1214 CE2 PHE A 85 -5.090 -1.499 6.090 1.00 0.18 C ATOM 1215 CZ PHE A 85 -4.989 -0.179 5.715 1.00 0.18 C ATOM 0 H PHE A 85 -7.848 -0.014 9.872 1.00 0.16 H new ATOM 0 HA PHE A 85 -9.681 0.152 7.654 1.00 0.16 H new ATOM 0 HB2 PHE A 85 -8.040 -2.164 8.750 1.00 0.15 H new ATOM 0 HB3 PHE A 85 -8.978 -2.216 7.270 1.00 0.15 H new ATOM 0 HD1 PHE A 85 -7.877 0.969 7.017 1.00 0.17 H new ATOM 0 HD2 PHE A 85 -6.262 -2.970 7.089 1.00 0.16 H new ATOM 0 HE1 PHE A 85 -5.917 1.745 5.757 1.00 0.18 H new ATOM 0 HE2 PHE A 85 -4.307 -2.196 5.829 1.00 0.18 H new ATOM 0 HZ PHE A 85 -4.127 0.162 5.160 1.00 0.18 H new ATOM 1225 N GLU A 86 -11.463 -1.552 8.322 1.00 0.16 N ATOM 1226 CA GLU A 86 -12.609 -2.327 8.746 1.00 0.17 C ATOM 1227 C GLU A 86 -12.568 -3.677 8.055 1.00 0.16 C ATOM 1228 O GLU A 86 -12.585 -3.751 6.829 1.00 0.17 O ATOM 1229 CB GLU A 86 -13.910 -1.598 8.401 1.00 0.20 C ATOM 1230 CG GLU A 86 -14.164 -0.373 9.257 1.00 0.34 C ATOM 1231 CD GLU A 86 -15.511 0.261 8.985 1.00 1.22 C ATOM 1232 OE1 GLU A 86 -15.548 1.447 8.600 1.00 2.18 O ATOM 1233 OE2 GLU A 86 -16.546 -0.427 9.162 1.00 1.18 O ATOM 0 H GLU A 86 -11.464 -1.330 7.326 1.00 0.16 H new ATOM 0 HA GLU A 86 -12.575 -2.462 9.827 1.00 0.17 H new ATOM 0 HB2 GLU A 86 -13.883 -1.299 7.353 1.00 0.20 H new ATOM 0 HB3 GLU A 86 -14.745 -2.289 8.514 1.00 0.20 H new ATOM 0 HG2 GLU A 86 -14.104 -0.651 10.309 1.00 0.34 H new ATOM 0 HG3 GLU A 86 -13.379 0.361 9.076 1.00 0.34 H new ATOM 1240 N GLN A 87 -12.485 -4.739 8.829 1.00 0.17 N ATOM 1241 CA GLN A 87 -12.402 -6.071 8.269 1.00 0.18 C ATOM 1242 C GLN A 87 -13.776 -6.615 7.920 1.00 0.14 C ATOM 1243 O GLN A 87 -14.772 -6.282 8.562 1.00 0.16 O ATOM 1244 CB GLN A 87 -11.702 -7.012 9.237 1.00 0.27 C ATOM 1245 CG GLN A 87 -10.260 -6.624 9.499 1.00 0.36 C ATOM 1246 CD GLN A 87 -9.502 -7.671 10.292 1.00 0.55 C ATOM 1247 OE1 GLN A 87 -8.593 -7.348 11.057 1.00 0.70 O ATOM 1248 NE2 GLN A 87 -9.850 -8.934 10.097 1.00 0.87 N ATOM 0 H GLN A 87 -12.473 -4.705 9.848 1.00 0.17 H new ATOM 0 HA GLN A 87 -11.820 -6.005 7.349 1.00 0.18 H new ATOM 0 HB2 GLN A 87 -12.247 -7.025 10.181 1.00 0.27 H new ATOM 0 HB3 GLN A 87 -11.733 -8.026 8.837 1.00 0.27 H new ATOM 0 HG2 GLN A 87 -9.755 -6.460 8.547 1.00 0.36 H new ATOM 0 HG3 GLN A 87 -10.236 -5.678 10.040 1.00 0.36 H new ATOM 0 HE21 GLN A 87 -10.609 -9.160 9.454 1.00 0.87 H new ATOM 0 HE22 GLN A 87 -9.359 -9.680 10.589 1.00 0.87 H new ATOM 1257 N HIS A 88 -13.800 -7.451 6.893 1.00 0.14 N ATOM 1258 CA HIS A 88 -15.011 -8.132 6.439 1.00 0.16 C ATOM 1259 C HIS A 88 -16.073 -7.145 5.980 1.00 0.15 C ATOM 1260 O HIS A 88 -17.226 -7.219 6.397 1.00 0.18 O ATOM 1261 CB HIS A 88 -15.591 -9.036 7.525 1.00 0.20 C ATOM 1262 CG HIS A 88 -14.603 -9.993 8.122 1.00 0.25 C ATOM 1263 ND1 HIS A 88 -14.669 -10.428 9.428 1.00 0.42 N ATOM 1264 CD2 HIS A 88 -13.519 -10.600 7.583 1.00 0.37 C ATOM 1265 CE1 HIS A 88 -13.671 -11.259 9.665 1.00 0.43 C ATOM 1266 NE2 HIS A 88 -12.960 -11.382 8.561 1.00 0.37 N ATOM 0 H HIS A 88 -12.972 -7.681 6.343 1.00 0.14 H new ATOM 0 HA HIS A 88 -14.717 -8.749 5.590 1.00 0.16 H new ATOM 0 HB2 HIS A 88 -16.002 -8.413 8.319 1.00 0.20 H new ATOM 0 HB3 HIS A 88 -16.421 -9.604 7.104 1.00 0.20 H new ATOM 0 HD2 HIS A 88 -13.161 -10.489 6.570 1.00 0.37 H new ATOM 0 HE1 HIS A 88 -13.471 -11.754 10.604 1.00 0.43 H new ATOM 0 HE2 HIS A 88 -12.129 -11.964 8.452 1.00 0.37 H new ATOM 1274 N VAL A 89 -15.684 -6.225 5.125 1.00 0.14 N ATOM 1275 CA VAL A 89 -16.608 -5.252 4.575 1.00 0.14 C ATOM 1276 C VAL A 89 -16.098 -4.749 3.235 1.00 0.15 C ATOM 1277 O VAL A 89 -14.917 -4.434 3.090 1.00 0.17 O ATOM 1278 CB VAL A 89 -16.827 -4.079 5.553 1.00 0.16 C ATOM 1279 CG1 VAL A 89 -15.558 -3.799 6.317 1.00 0.15 C ATOM 1280 CG2 VAL A 89 -17.291 -2.825 4.832 1.00 0.20 C ATOM 0 H VAL A 89 -14.725 -6.128 4.792 1.00 0.14 H new ATOM 0 HA VAL A 89 -17.571 -5.739 4.423 1.00 0.14 H new ATOM 0 HB VAL A 89 -17.613 -4.370 6.250 1.00 0.16 H new ATOM 0 HG11 VAL A 89 -15.723 -2.969 7.005 1.00 0.15 H new ATOM 0 HG12 VAL A 89 -15.270 -4.686 6.881 1.00 0.15 H new ATOM 0 HG13 VAL A 89 -14.763 -3.539 5.619 1.00 0.15 H new ATOM 0 HG21 VAL A 89 -17.434 -2.022 5.555 1.00 0.20 H new ATOM 0 HG22 VAL A 89 -16.539 -2.526 4.101 1.00 0.20 H new ATOM 0 HG23 VAL A 89 -18.233 -3.026 4.322 1.00 0.20 H new ATOM 1290 N SER A 90 -16.985 -4.702 2.258 1.00 0.17 N ATOM 1291 CA SER A 90 -16.607 -4.337 0.912 1.00 0.20 C ATOM 1292 C SER A 90 -17.464 -3.190 0.405 1.00 0.22 C ATOM 1293 O SER A 90 -18.677 -3.176 0.602 1.00 0.21 O ATOM 1294 CB SER A 90 -16.770 -5.546 -0.016 1.00 0.22 C ATOM 1295 OG SER A 90 -16.055 -5.376 -1.227 1.00 0.30 O ATOM 0 H SER A 90 -17.976 -4.914 2.376 1.00 0.17 H new ATOM 0 HA SER A 90 -15.565 -4.017 0.921 1.00 0.20 H new ATOM 0 HB2 SER A 90 -16.418 -6.444 0.491 1.00 0.22 H new ATOM 0 HB3 SER A 90 -17.827 -5.697 -0.235 1.00 0.22 H new ATOM 0 HG SER A 90 -16.488 -5.894 -1.938 1.00 0.30 H new ATOM 1301 N TYR A 91 -16.833 -2.211 -0.212 1.00 0.28 N ATOM 1302 CA TYR A 91 -17.571 -1.229 -0.980 1.00 0.28 C ATOM 1303 C TYR A 91 -17.279 -1.481 -2.451 1.00 0.32 C ATOM 1304 O TYR A 91 -16.127 -1.404 -2.879 1.00 0.38 O ATOM 1305 CB TYR A 91 -17.164 0.204 -0.625 1.00 0.33 C ATOM 1306 CG TYR A 91 -17.209 0.571 0.850 1.00 0.33 C ATOM 1307 CD1 TYR A 91 -16.298 0.048 1.768 1.00 0.32 C ATOM 1308 CD2 TYR A 91 -18.129 1.500 1.311 1.00 0.39 C ATOM 1309 CE1 TYR A 91 -16.311 0.445 3.091 1.00 0.36 C ATOM 1310 CE2 TYR A 91 -18.154 1.890 2.635 1.00 0.43 C ATOM 1311 CZ TYR A 91 -17.240 1.363 3.518 1.00 0.39 C ATOM 1312 OH TYR A 91 -17.247 1.770 4.832 1.00 0.46 O ATOM 0 H TYR A 91 -15.822 -2.075 -0.197 1.00 0.28 H new ATOM 0 HA TYR A 91 -18.633 -1.330 -0.755 1.00 0.28 H new ATOM 0 HB2 TYR A 91 -16.150 0.372 -0.989 1.00 0.33 H new ATOM 0 HB3 TYR A 91 -17.815 0.889 -1.168 1.00 0.33 H new ATOM 0 HD1 TYR A 91 -15.571 -0.679 1.439 1.00 0.32 H new ATOM 0 HD2 TYR A 91 -18.841 1.927 0.620 1.00 0.39 H new ATOM 0 HE1 TYR A 91 -15.594 0.035 3.787 1.00 0.36 H new ATOM 0 HE2 TYR A 91 -18.888 2.605 2.976 1.00 0.43 H new ATOM 0 HH TYR A 91 -17.965 2.422 4.969 1.00 0.46 H new ATOM 1322 N GLU A 92 -18.308 -1.766 -3.224 1.00 0.30 N ATOM 1323 CA GLU A 92 -18.127 -2.095 -4.631 1.00 0.36 C ATOM 1324 C GLU A 92 -19.204 -1.450 -5.479 1.00 0.32 C ATOM 1325 O GLU A 92 -18.943 -1.010 -6.598 1.00 0.32 O ATOM 1326 CB GLU A 92 -18.124 -3.613 -4.830 1.00 0.45 C ATOM 1327 CG GLU A 92 -16.910 -4.294 -4.224 1.00 0.51 C ATOM 1328 CD GLU A 92 -16.919 -5.796 -4.398 1.00 0.68 C ATOM 1329 OE1 GLU A 92 -17.294 -6.512 -3.443 1.00 0.91 O ATOM 1330 OE2 GLU A 92 -16.571 -6.272 -5.500 1.00 1.12 O ATOM 0 H GLU A 92 -19.277 -1.777 -2.906 1.00 0.30 H new ATOM 0 HA GLU A 92 -17.162 -1.702 -4.951 1.00 0.36 H new ATOM 0 HB2 GLU A 92 -19.027 -4.033 -4.387 1.00 0.45 H new ATOM 0 HB3 GLU A 92 -18.161 -3.833 -5.897 1.00 0.45 H new ATOM 0 HG2 GLU A 92 -16.008 -3.887 -4.681 1.00 0.51 H new ATOM 0 HG3 GLU A 92 -16.863 -4.058 -3.161 1.00 0.51 H new ATOM 1337 N GLY A 93 -20.409 -1.384 -4.933 1.00 0.31 N ATOM 1338 CA GLY A 93 -21.496 -0.701 -5.608 1.00 0.30 C ATOM 1339 C GLY A 93 -21.243 0.789 -5.725 1.00 0.28 C ATOM 1340 O GLY A 93 -21.865 1.474 -6.535 1.00 0.28 O ATOM 0 H GLY A 93 -20.655 -1.792 -4.031 1.00 0.31 H new ATOM 0 HA2 GLY A 93 -21.629 -1.126 -6.603 1.00 0.30 H new ATOM 0 HA3 GLY A 93 -22.425 -0.870 -5.063 1.00 0.30 H new ATOM 1344 N ALA A 94 -20.328 1.289 -4.904 1.00 0.28 N ATOM 1345 CA ALA A 94 -19.941 2.687 -4.953 1.00 0.28 C ATOM 1346 C ALA A 94 -19.107 2.958 -6.200 1.00 0.29 C ATOM 1347 O ALA A 94 -18.279 2.126 -6.589 1.00 0.33 O ATOM 1348 CB ALA A 94 -19.163 3.064 -3.696 1.00 0.28 C ATOM 0 H ALA A 94 -19.840 0.742 -4.195 1.00 0.28 H new ATOM 0 HA ALA A 94 -20.841 3.300 -4.998 1.00 0.28 H new ATOM 0 HB1 ALA A 94 -18.879 4.115 -3.746 1.00 0.28 H new ATOM 0 HB2 ALA A 94 -19.787 2.898 -2.818 1.00 0.28 H new ATOM 0 HB3 ALA A 94 -18.266 2.449 -3.625 1.00 0.28 H new ATOM 1354 N PRO A 95 -19.341 4.106 -6.857 1.00 0.33 N ATOM 1355 CA PRO A 95 -18.581 4.514 -8.042 1.00 0.37 C ATOM 1356 C PRO A 95 -17.078 4.473 -7.799 1.00 0.32 C ATOM 1357 O PRO A 95 -16.571 5.085 -6.853 1.00 0.31 O ATOM 1358 CB PRO A 95 -19.047 5.948 -8.288 1.00 0.47 C ATOM 1359 CG PRO A 95 -20.417 5.995 -7.711 1.00 0.52 C ATOM 1360 CD PRO A 95 -20.380 5.094 -6.508 1.00 0.43 C ATOM 0 HA PRO A 95 -18.752 3.849 -8.889 1.00 0.37 H new ATOM 0 HB2 PRO A 95 -18.387 6.669 -7.805 1.00 0.47 H new ATOM 0 HB3 PRO A 95 -19.055 6.186 -9.352 1.00 0.47 H new ATOM 0 HG2 PRO A 95 -20.690 7.012 -7.430 1.00 0.52 H new ATOM 0 HG3 PRO A 95 -21.159 5.654 -8.433 1.00 0.52 H new ATOM 0 HD2 PRO A 95 -20.125 5.643 -5.602 1.00 0.43 H new ATOM 0 HD3 PRO A 95 -21.345 4.618 -6.332 1.00 0.43 H new ATOM 1368 N ASP A 96 -16.376 3.735 -8.647 1.00 0.33 N ATOM 1369 CA ASP A 96 -14.936 3.572 -8.504 1.00 0.33 C ATOM 1370 C ASP A 96 -14.233 4.862 -8.872 1.00 0.35 C ATOM 1371 O ASP A 96 -14.576 5.513 -9.856 1.00 0.48 O ATOM 1372 CB ASP A 96 -14.391 2.441 -9.384 1.00 0.43 C ATOM 1373 CG ASP A 96 -15.460 1.481 -9.870 1.00 0.51 C ATOM 1374 OD1 ASP A 96 -15.547 0.360 -9.326 1.00 0.71 O ATOM 1375 OD2 ASP A 96 -16.221 1.842 -10.792 1.00 0.59 O ATOM 0 H ASP A 96 -16.780 3.239 -9.442 1.00 0.33 H new ATOM 0 HA ASP A 96 -14.743 3.315 -7.462 1.00 0.33 H new ATOM 0 HB2 ASP A 96 -13.885 2.875 -10.246 1.00 0.43 H new ATOM 0 HB3 ASP A 96 -13.642 1.883 -8.822 1.00 0.43 H new ATOM 1380 N VAL A 97 -13.254 5.228 -8.076 1.00 0.28 N ATOM 1381 CA VAL A 97 -12.507 6.454 -8.304 1.00 0.29 C ATOM 1382 C VAL A 97 -11.111 6.147 -8.822 1.00 0.29 C ATOM 1383 O VAL A 97 -10.417 7.026 -9.332 1.00 0.32 O ATOM 1384 CB VAL A 97 -12.419 7.285 -7.011 1.00 0.28 C ATOM 1385 CG1 VAL A 97 -13.798 7.789 -6.623 1.00 0.30 C ATOM 1386 CG2 VAL A 97 -11.822 6.454 -5.888 1.00 0.24 C ATOM 0 H VAL A 97 -12.952 4.695 -7.261 1.00 0.28 H new ATOM 0 HA VAL A 97 -13.038 7.035 -9.058 1.00 0.29 H new ATOM 0 HB VAL A 97 -11.769 8.142 -7.187 1.00 0.28 H new ATOM 0 HG11 VAL A 97 -13.727 8.376 -5.707 1.00 0.30 H new ATOM 0 HG12 VAL A 97 -14.196 8.413 -7.424 1.00 0.30 H new ATOM 0 HG13 VAL A 97 -14.463 6.941 -6.459 1.00 0.30 H new ATOM 0 HG21 VAL A 97 -11.766 7.055 -4.981 1.00 0.24 H new ATOM 0 HG22 VAL A 97 -12.450 5.582 -5.707 1.00 0.24 H new ATOM 0 HG23 VAL A 97 -10.821 6.128 -6.169 1.00 0.24 H new ATOM 1396 N MET A 98 -10.711 4.889 -8.687 1.00 0.27 N ATOM 1397 CA MET A 98 -9.401 4.434 -9.133 1.00 0.27 C ATOM 1398 C MET A 98 -9.505 3.013 -9.667 1.00 0.27 C ATOM 1399 O MET A 98 -10.505 2.328 -9.435 1.00 0.27 O ATOM 1400 CB MET A 98 -8.397 4.466 -7.980 1.00 0.26 C ATOM 1401 CG MET A 98 -8.154 5.845 -7.395 1.00 0.36 C ATOM 1402 SD MET A 98 -7.143 6.891 -8.461 1.00 1.01 S ATOM 1403 CE MET A 98 -5.641 5.921 -8.566 1.00 0.65 C ATOM 0 H MET A 98 -11.284 4.157 -8.266 1.00 0.27 H new ATOM 0 HA MET A 98 -9.055 5.102 -9.922 1.00 0.27 H new ATOM 0 HB2 MET A 98 -8.752 3.807 -7.188 1.00 0.26 H new ATOM 0 HB3 MET A 98 -7.447 4.061 -8.330 1.00 0.26 H new ATOM 0 HG2 MET A 98 -9.112 6.333 -7.218 1.00 0.36 H new ATOM 0 HG3 MET A 98 -7.665 5.742 -6.426 1.00 0.36 H new ATOM 0 HE1 MET A 98 -4.849 6.524 -9.009 1.00 0.65 H new ATOM 0 HE2 MET A 98 -5.341 5.605 -7.567 1.00 0.65 H new ATOM 0 HE3 MET A 98 -5.818 5.042 -9.186 1.00 0.65 H new ATOM 1413 N THR A 99 -8.475 2.578 -10.373 1.00 0.31 N ATOM 1414 CA THR A 99 -8.412 1.230 -10.895 1.00 0.32 C ATOM 1415 C THR A 99 -8.064 0.249 -9.781 1.00 0.28 C ATOM 1416 O THR A 99 -7.161 0.506 -8.986 1.00 0.30 O ATOM 1417 CB THR A 99 -7.348 1.145 -12.003 1.00 0.38 C ATOM 1418 OG1 THR A 99 -7.672 2.063 -13.059 1.00 0.45 O ATOM 1419 CG2 THR A 99 -7.245 -0.262 -12.558 1.00 0.41 C ATOM 0 H THR A 99 -7.662 3.151 -10.598 1.00 0.31 H new ATOM 0 HA THR A 99 -9.387 0.971 -11.308 1.00 0.32 H new ATOM 0 HB THR A 99 -6.383 1.410 -11.570 1.00 0.38 H new ATOM 0 HG1 THR A 99 -6.991 2.007 -13.762 1.00 0.45 H new ATOM 0 HG21 THR A 99 -6.485 -0.290 -13.339 1.00 0.41 H new ATOM 0 HG22 THR A 99 -6.969 -0.949 -11.758 1.00 0.41 H new ATOM 0 HG23 THR A 99 -8.207 -0.559 -12.976 1.00 0.41 H new ATOM 1427 N ALA A 100 -8.795 -0.862 -9.714 1.00 0.27 N ATOM 1428 CA ALA A 100 -8.509 -1.893 -8.731 1.00 0.24 C ATOM 1429 C ALA A 100 -7.103 -2.423 -8.913 1.00 0.24 C ATOM 1430 O ALA A 100 -6.631 -2.597 -10.037 1.00 0.34 O ATOM 1431 CB ALA A 100 -9.490 -3.043 -8.822 1.00 0.25 C ATOM 0 H ALA A 100 -9.584 -1.066 -10.327 1.00 0.27 H new ATOM 0 HA ALA A 100 -8.606 -1.434 -7.747 1.00 0.24 H new ATOM 0 HB1 ALA A 100 -9.242 -3.793 -8.071 1.00 0.25 H new ATOM 0 HB2 ALA A 100 -10.501 -2.674 -8.647 1.00 0.25 H new ATOM 0 HB3 ALA A 100 -9.434 -3.491 -9.814 1.00 0.25 H new ATOM 1437 N MET A 101 -6.454 -2.703 -7.806 1.00 0.17 N ATOM 1438 CA MET A 101 -5.073 -3.119 -7.828 1.00 0.17 C ATOM 1439 C MET A 101 -4.937 -4.503 -7.227 1.00 0.14 C ATOM 1440 O MET A 101 -5.767 -4.922 -6.447 1.00 0.15 O ATOM 1441 CB MET A 101 -4.227 -2.129 -7.042 1.00 0.21 C ATOM 1442 CG MET A 101 -2.736 -2.410 -7.092 1.00 0.26 C ATOM 1443 SD MET A 101 -2.002 -2.024 -8.695 1.00 1.07 S ATOM 1444 CE MET A 101 -2.404 -0.285 -8.859 1.00 0.90 C ATOM 0 H MET A 101 -6.865 -2.649 -6.874 1.00 0.17 H new ATOM 0 HA MET A 101 -4.727 -3.148 -8.861 1.00 0.17 H new ATOM 0 HB2 MET A 101 -4.410 -1.126 -7.427 1.00 0.21 H new ATOM 0 HB3 MET A 101 -4.552 -2.135 -6.002 1.00 0.21 H new ATOM 0 HG2 MET A 101 -2.235 -1.827 -6.319 1.00 0.26 H new ATOM 0 HG3 MET A 101 -2.562 -3.461 -6.862 1.00 0.26 H new ATOM 0 HE1 MET A 101 -1.717 0.182 -9.564 1.00 0.90 H new ATOM 0 HE2 MET A 101 -3.426 -0.181 -9.225 1.00 0.90 H new ATOM 0 HE3 MET A 101 -2.315 0.202 -7.888 1.00 0.90 H new ATOM 1454 N VAL A 102 -3.900 -5.202 -7.599 1.00 0.15 N ATOM 1455 CA VAL A 102 -3.635 -6.528 -7.053 1.00 0.14 C ATOM 1456 C VAL A 102 -2.386 -6.504 -6.175 1.00 0.14 C ATOM 1457 O VAL A 102 -1.282 -6.234 -6.653 1.00 0.18 O ATOM 1458 CB VAL A 102 -3.489 -7.582 -8.171 1.00 0.15 C ATOM 1459 CG1 VAL A 102 -3.007 -8.916 -7.615 1.00 0.16 C ATOM 1460 CG2 VAL A 102 -4.812 -7.763 -8.900 1.00 0.16 C ATOM 0 H VAL A 102 -3.213 -4.883 -8.282 1.00 0.15 H new ATOM 0 HA VAL A 102 -4.491 -6.811 -6.440 1.00 0.14 H new ATOM 0 HB VAL A 102 -2.740 -7.222 -8.876 1.00 0.15 H new ATOM 0 HG11 VAL A 102 -2.914 -9.637 -8.427 1.00 0.16 H new ATOM 0 HG12 VAL A 102 -2.037 -8.782 -7.137 1.00 0.16 H new ATOM 0 HG13 VAL A 102 -3.725 -9.285 -6.882 1.00 0.16 H new ATOM 0 HG21 VAL A 102 -4.695 -8.509 -9.686 1.00 0.16 H new ATOM 0 HG22 VAL A 102 -5.574 -8.095 -8.195 1.00 0.16 H new ATOM 0 HG23 VAL A 102 -5.116 -6.814 -9.342 1.00 0.16 H new ATOM 1470 N THR A 103 -2.574 -6.775 -4.891 1.00 0.15 N ATOM 1471 CA THR A 103 -1.496 -6.688 -3.918 1.00 0.14 C ATOM 1472 C THR A 103 -1.714 -7.680 -2.774 1.00 0.15 C ATOM 1473 O THR A 103 -2.826 -8.163 -2.566 1.00 0.18 O ATOM 1474 CB THR A 103 -1.380 -5.253 -3.358 1.00 0.15 C ATOM 1475 OG1 THR A 103 -0.357 -5.182 -2.355 1.00 0.18 O ATOM 1476 CG2 THR A 103 -2.704 -4.785 -2.778 1.00 0.19 C ATOM 0 H THR A 103 -3.471 -7.059 -4.497 1.00 0.15 H new ATOM 0 HA THR A 103 -0.566 -6.942 -4.426 1.00 0.14 H new ATOM 0 HB THR A 103 -1.111 -4.595 -4.185 1.00 0.15 H new ATOM 0 HG1 THR A 103 0.372 -4.608 -2.671 1.00 0.18 H new ATOM 0 HG21 THR A 103 -2.594 -3.772 -2.391 1.00 0.19 H new ATOM 0 HG22 THR A 103 -3.466 -4.795 -3.557 1.00 0.19 H new ATOM 0 HG23 THR A 103 -3.003 -5.452 -1.969 1.00 0.19 H new ATOM 1484 N SER A 104 -0.654 -7.983 -2.027 1.00 0.16 N ATOM 1485 CA SER A 104 -0.751 -8.940 -0.936 1.00 0.19 C ATOM 1486 C SER A 104 -0.888 -8.227 0.412 1.00 0.18 C ATOM 1487 O SER A 104 -0.609 -8.805 1.460 1.00 0.26 O ATOM 1488 CB SER A 104 0.478 -9.848 -0.935 1.00 0.25 C ATOM 1489 OG SER A 104 0.737 -10.341 -2.238 1.00 1.03 O ATOM 0 H SER A 104 0.274 -7.581 -2.159 1.00 0.16 H new ATOM 0 HA SER A 104 -1.645 -9.546 -1.086 1.00 0.19 H new ATOM 0 HB2 SER A 104 1.344 -9.296 -0.571 1.00 0.25 H new ATOM 0 HB3 SER A 104 0.320 -10.681 -0.250 1.00 0.25 H new ATOM 0 HG SER A 104 1.446 -9.808 -2.655 1.00 1.03 H new ATOM 1495 N GLN A 105 -1.301 -6.965 0.378 1.00 0.15 N ATOM 1496 CA GLN A 105 -1.499 -6.184 1.596 1.00 0.14 C ATOM 1497 C GLN A 105 -2.518 -5.078 1.370 1.00 0.13 C ATOM 1498 O GLN A 105 -2.541 -4.447 0.317 1.00 0.15 O ATOM 1499 CB GLN A 105 -0.180 -5.565 2.072 1.00 0.15 C ATOM 1500 CG GLN A 105 0.594 -4.852 0.973 1.00 0.15 C ATOM 1501 CD GLN A 105 1.883 -5.563 0.624 1.00 0.24 C ATOM 1502 OE1 GLN A 105 2.835 -4.944 0.169 1.00 0.67 O ATOM 1503 NE2 GLN A 105 1.927 -6.868 0.854 1.00 0.21 N ATOM 0 H GLN A 105 -1.506 -6.458 -0.483 1.00 0.15 H new ATOM 0 HA GLN A 105 -1.871 -6.864 2.362 1.00 0.14 H new ATOM 0 HB2 GLN A 105 -0.390 -4.857 2.874 1.00 0.15 H new ATOM 0 HB3 GLN A 105 0.447 -6.350 2.495 1.00 0.15 H new ATOM 0 HG2 GLN A 105 -0.030 -4.777 0.082 1.00 0.15 H new ATOM 0 HG3 GLN A 105 0.818 -3.834 1.291 1.00 0.15 H new ATOM 0 HE21 GLN A 105 1.111 -7.347 1.234 1.00 0.21 H new ATOM 0 HE22 GLN A 105 2.777 -7.393 0.651 1.00 0.21 H new ATOM 1512 N SER A 106 -3.350 -4.842 2.375 1.00 0.13 N ATOM 1513 CA SER A 106 -4.335 -3.773 2.321 1.00 0.13 C ATOM 1514 C SER A 106 -3.643 -2.422 2.439 1.00 0.14 C ATOM 1515 O SER A 106 -4.233 -1.381 2.146 1.00 0.15 O ATOM 1516 CB SER A 106 -5.362 -3.939 3.447 1.00 0.17 C ATOM 1517 OG SER A 106 -6.395 -2.972 3.353 1.00 1.31 O ATOM 0 H SER A 106 -3.361 -5.380 3.241 1.00 0.13 H new ATOM 0 HA SER A 106 -4.855 -3.823 1.364 1.00 0.13 H new ATOM 0 HB2 SER A 106 -5.793 -4.939 3.404 1.00 0.17 H new ATOM 0 HB3 SER A 106 -4.864 -3.848 4.412 1.00 0.17 H new ATOM 0 HG SER A 106 -6.302 -2.322 4.080 1.00 1.31 H new ATOM 1523 N ALA A 107 -2.385 -2.456 2.874 1.00 0.14 N ATOM 1524 CA ALA A 107 -1.579 -1.256 3.000 1.00 0.16 C ATOM 1525 C ALA A 107 -1.467 -0.517 1.671 1.00 0.14 C ATOM 1526 O ALA A 107 -1.594 0.706 1.617 1.00 0.15 O ATOM 1527 CB ALA A 107 -0.201 -1.632 3.503 1.00 0.20 C ATOM 0 H ALA A 107 -1.903 -3.313 3.146 1.00 0.14 H new ATOM 0 HA ALA A 107 -2.064 -0.586 3.710 1.00 0.16 H new ATOM 0 HB1 ALA A 107 0.409 -0.734 3.599 1.00 0.20 H new ATOM 0 HB2 ALA A 107 -0.288 -2.117 4.475 1.00 0.20 H new ATOM 0 HB3 ALA A 107 0.270 -2.316 2.797 1.00 0.20 H new ATOM 1533 N ASP A 108 -1.249 -1.269 0.599 1.00 0.14 N ATOM 1534 CA ASP A 108 -1.061 -0.692 -0.724 1.00 0.15 C ATOM 1535 C ASP A 108 -2.278 0.128 -1.128 1.00 0.13 C ATOM 1536 O ASP A 108 -2.154 1.259 -1.599 1.00 0.14 O ATOM 1537 CB ASP A 108 -0.835 -1.811 -1.731 1.00 0.17 C ATOM 1538 CG ASP A 108 0.560 -1.825 -2.324 1.00 0.51 C ATOM 1539 OD1 ASP A 108 1.187 -0.753 -2.419 1.00 0.83 O ATOM 1540 OD2 ASP A 108 1.019 -2.925 -2.708 1.00 0.98 O ATOM 0 H ASP A 108 -1.198 -2.287 0.622 1.00 0.14 H new ATOM 0 HA ASP A 108 -0.193 -0.033 -0.704 1.00 0.15 H new ATOM 0 HB2 ASP A 108 -1.023 -2.768 -1.245 1.00 0.17 H new ATOM 0 HB3 ASP A 108 -1.562 -1.714 -2.537 1.00 0.17 H new ATOM 1545 N CYS A 109 -3.462 -0.437 -0.909 1.00 0.11 N ATOM 1546 CA CYS A 109 -4.705 0.246 -1.239 1.00 0.11 C ATOM 1547 C CYS A 109 -4.847 1.516 -0.399 1.00 0.10 C ATOM 1548 O CYS A 109 -5.456 2.496 -0.831 1.00 0.11 O ATOM 1549 CB CYS A 109 -5.911 -0.667 -0.988 1.00 0.13 C ATOM 1550 SG CYS A 109 -5.577 -2.453 -1.176 1.00 0.14 S ATOM 0 H CYS A 109 -3.585 -1.365 -0.505 1.00 0.11 H new ATOM 0 HA CYS A 109 -4.676 0.509 -2.296 1.00 0.11 H new ATOM 0 HB2 CYS A 109 -6.281 -0.486 0.021 1.00 0.13 H new ATOM 0 HB3 CYS A 109 -6.709 -0.387 -1.676 1.00 0.13 H new ATOM 1555 N GLN A 110 -4.262 1.494 0.797 1.00 0.10 N ATOM 1556 CA GLN A 110 -4.295 2.642 1.692 1.00 0.10 C ATOM 1557 C GLN A 110 -3.512 3.803 1.095 1.00 0.10 C ATOM 1558 O GLN A 110 -4.027 4.910 0.984 1.00 0.13 O ATOM 1559 CB GLN A 110 -3.738 2.255 3.066 1.00 0.12 C ATOM 1560 CG GLN A 110 -3.335 3.435 3.936 1.00 0.13 C ATOM 1561 CD GLN A 110 -2.945 3.013 5.333 1.00 0.26 C ATOM 1562 OE1 GLN A 110 -3.758 3.023 6.247 1.00 1.33 O ATOM 1563 NE2 GLN A 110 -1.700 2.619 5.506 1.00 0.80 N ATOM 0 H GLN A 110 -3.758 0.688 1.167 1.00 0.10 H new ATOM 0 HA GLN A 110 -5.329 2.962 1.819 1.00 0.10 H new ATOM 0 HB2 GLN A 110 -4.488 1.668 3.596 1.00 0.12 H new ATOM 0 HB3 GLN A 110 -2.870 1.611 2.924 1.00 0.12 H new ATOM 0 HG2 GLN A 110 -2.499 3.958 3.471 1.00 0.13 H new ATOM 0 HG3 GLN A 110 -4.163 4.142 3.991 1.00 0.13 H new ATOM 0 HE21 GLN A 110 -1.050 2.624 4.720 1.00 0.80 H new ATOM 0 HE22 GLN A 110 -1.386 2.309 6.426 1.00 0.80 H new ATOM 1572 N ALA A 111 -2.282 3.536 0.671 1.00 0.10 N ATOM 1573 CA ALA A 111 -1.442 4.568 0.069 1.00 0.11 C ATOM 1574 C ALA A 111 -2.048 5.062 -1.231 1.00 0.11 C ATOM 1575 O ALA A 111 -1.862 6.213 -1.626 1.00 0.13 O ATOM 1576 CB ALA A 111 -0.043 4.041 -0.184 1.00 0.15 C ATOM 0 H ALA A 111 -1.844 2.617 0.732 1.00 0.10 H new ATOM 0 HA ALA A 111 -1.383 5.402 0.769 1.00 0.11 H new ATOM 0 HB1 ALA A 111 0.566 4.826 -0.633 1.00 0.15 H new ATOM 0 HB2 ALA A 111 0.405 3.729 0.760 1.00 0.15 H new ATOM 0 HB3 ALA A 111 -0.092 3.188 -0.861 1.00 0.15 H new ATOM 1582 N ALA A 112 -2.759 4.170 -1.893 1.00 0.10 N ATOM 1583 CA ALA A 112 -3.390 4.472 -3.156 1.00 0.13 C ATOM 1584 C ALA A 112 -4.508 5.489 -2.994 1.00 0.13 C ATOM 1585 O ALA A 112 -4.567 6.483 -3.713 1.00 0.19 O ATOM 1586 CB ALA A 112 -3.910 3.187 -3.752 1.00 0.17 C ATOM 0 H ALA A 112 -2.914 3.216 -1.567 1.00 0.10 H new ATOM 0 HA ALA A 112 -2.656 4.919 -3.826 1.00 0.13 H new ATOM 0 HB1 ALA A 112 -4.390 3.397 -4.708 1.00 0.17 H new ATOM 0 HB2 ALA A 112 -3.081 2.496 -3.907 1.00 0.17 H new ATOM 0 HB3 ALA A 112 -4.635 2.738 -3.073 1.00 0.17 H new ATOM 1592 N CYS A 113 -5.380 5.253 -2.037 1.00 0.12 N ATOM 1593 CA CYS A 113 -6.537 6.109 -1.866 1.00 0.14 C ATOM 1594 C CYS A 113 -6.210 7.334 -1.019 1.00 0.13 C ATOM 1595 O CYS A 113 -6.783 8.406 -1.219 1.00 0.15 O ATOM 1596 CB CYS A 113 -7.680 5.327 -1.243 1.00 0.17 C ATOM 1597 SG CYS A 113 -9.260 6.225 -1.238 1.00 0.25 S ATOM 0 H CYS A 113 -5.312 4.484 -1.371 1.00 0.12 H new ATOM 0 HA CYS A 113 -6.840 6.461 -2.852 1.00 0.14 H new ATOM 0 HB2 CYS A 113 -7.806 4.390 -1.786 1.00 0.17 H new ATOM 0 HB3 CYS A 113 -7.416 5.068 -0.218 1.00 0.17 H new ATOM 1602 N ALA A 114 -5.271 7.184 -0.090 1.00 0.14 N ATOM 1603 CA ALA A 114 -4.893 8.284 0.796 1.00 0.16 C ATOM 1604 C ALA A 114 -4.178 9.390 0.030 1.00 0.17 C ATOM 1605 O ALA A 114 -4.037 10.511 0.519 1.00 0.25 O ATOM 1606 CB ALA A 114 -4.012 7.775 1.930 1.00 0.18 C ATOM 0 H ALA A 114 -4.759 6.316 0.070 1.00 0.14 H new ATOM 0 HA ALA A 114 -5.807 8.702 1.218 1.00 0.16 H new ATOM 0 HB1 ALA A 114 -3.740 8.606 2.580 1.00 0.18 H new ATOM 0 HB2 ALA A 114 -4.557 7.027 2.506 1.00 0.18 H new ATOM 0 HB3 ALA A 114 -3.109 7.327 1.516 1.00 0.18 H new ATOM 1612 N ALA A 115 -3.730 9.073 -1.174 1.00 0.16 N ATOM 1613 CA ALA A 115 -2.974 10.018 -1.970 1.00 0.19 C ATOM 1614 C ALA A 115 -3.839 10.719 -3.005 1.00 0.22 C ATOM 1615 O ALA A 115 -3.443 11.747 -3.553 1.00 0.31 O ATOM 1616 CB ALA A 115 -1.832 9.312 -2.666 1.00 0.18 C ATOM 0 H ALA A 115 -3.878 8.167 -1.619 1.00 0.16 H new ATOM 0 HA ALA A 115 -2.587 10.776 -1.289 1.00 0.19 H new ATOM 0 HB1 ALA A 115 -1.269 10.030 -3.262 1.00 0.18 H new ATOM 0 HB2 ALA A 115 -1.174 8.863 -1.922 1.00 0.18 H new ATOM 0 HB3 ALA A 115 -2.229 8.532 -3.317 1.00 0.18 H new ATOM 1622 N ASP A 116 -5.008 10.167 -3.288 1.00 0.22 N ATOM 1623 CA ASP A 116 -5.833 10.710 -4.351 1.00 0.26 C ATOM 1624 C ASP A 116 -6.928 11.604 -3.785 1.00 0.28 C ATOM 1625 O ASP A 116 -7.637 11.224 -2.856 1.00 0.31 O ATOM 1626 CB ASP A 116 -6.458 9.598 -5.188 1.00 0.30 C ATOM 1627 CG ASP A 116 -6.931 10.101 -6.537 1.00 0.40 C ATOM 1628 OD1 ASP A 116 -8.156 10.307 -6.704 1.00 0.44 O ATOM 1629 OD2 ASP A 116 -6.087 10.283 -7.437 1.00 0.51 O ATOM 0 H ASP A 116 -5.400 9.358 -2.806 1.00 0.22 H new ATOM 0 HA ASP A 116 -5.185 11.307 -4.993 1.00 0.26 H new ATOM 0 HB2 ASP A 116 -5.729 8.800 -5.333 1.00 0.30 H new ATOM 0 HB3 ASP A 116 -7.300 9.166 -4.647 1.00 0.30 H new ATOM 1634 N PRO A 117 -7.091 12.797 -4.367 1.00 0.30 N ATOM 1635 CA PRO A 117 -8.039 13.801 -3.883 1.00 0.34 C ATOM 1636 C PRO A 117 -9.472 13.482 -4.288 1.00 0.35 C ATOM 1637 O PRO A 117 -10.421 14.099 -3.803 1.00 0.40 O ATOM 1638 CB PRO A 117 -7.565 15.077 -4.574 1.00 0.38 C ATOM 1639 CG PRO A 117 -6.970 14.603 -5.855 1.00 0.36 C ATOM 1640 CD PRO A 117 -6.365 13.256 -5.560 1.00 0.31 C ATOM 0 HA PRO A 117 -8.057 13.863 -2.795 1.00 0.34 H new ATOM 0 HB2 PRO A 117 -8.392 15.765 -4.750 1.00 0.38 H new ATOM 0 HB3 PRO A 117 -6.832 15.609 -3.968 1.00 0.38 H new ATOM 0 HG2 PRO A 117 -7.729 14.527 -6.633 1.00 0.36 H new ATOM 0 HG3 PRO A 117 -6.213 15.300 -6.215 1.00 0.36 H new ATOM 0 HD2 PRO A 117 -6.494 12.568 -6.396 1.00 0.31 H new ATOM 0 HD3 PRO A 117 -5.294 13.331 -5.372 1.00 0.31 H new ATOM 1648 N SER A 118 -9.619 12.522 -5.184 1.00 0.36 N ATOM 1649 CA SER A 118 -10.927 12.115 -5.647 1.00 0.40 C ATOM 1650 C SER A 118 -11.317 10.797 -4.993 1.00 0.35 C ATOM 1651 O SER A 118 -12.419 10.287 -5.201 1.00 0.32 O ATOM 1652 CB SER A 118 -10.928 11.980 -7.172 1.00 0.46 C ATOM 1653 OG SER A 118 -12.246 11.834 -7.676 1.00 1.13 O ATOM 0 H SER A 118 -8.843 12.010 -5.605 1.00 0.36 H new ATOM 0 HA SER A 118 -11.658 12.874 -5.369 1.00 0.40 H new ATOM 0 HB2 SER A 118 -10.461 12.859 -7.617 1.00 0.46 H new ATOM 0 HB3 SER A 118 -10.328 11.118 -7.463 1.00 0.46 H new ATOM 0 HG SER A 118 -12.768 11.269 -7.068 1.00 1.13 H new ATOM 1659 N CYS A 119 -10.415 10.262 -4.179 1.00 0.35 N ATOM 1660 CA CYS A 119 -10.645 8.983 -3.537 1.00 0.31 C ATOM 1661 C CYS A 119 -11.005 9.184 -2.071 1.00 0.32 C ATOM 1662 O CYS A 119 -10.381 9.985 -1.375 1.00 0.37 O ATOM 1663 CB CYS A 119 -9.411 8.087 -3.650 1.00 0.31 C ATOM 1664 SG CYS A 119 -9.726 6.343 -3.210 1.00 0.31 S ATOM 0 H CYS A 119 -9.521 10.696 -3.951 1.00 0.35 H new ATOM 0 HA CYS A 119 -11.476 8.495 -4.045 1.00 0.31 H new ATOM 0 HB2 CYS A 119 -9.033 8.132 -4.671 1.00 0.31 H new ATOM 0 HB3 CYS A 119 -8.627 8.480 -3.002 1.00 0.31 H new ATOM 1669 N GLU A 120 -12.020 8.467 -1.614 1.00 0.28 N ATOM 1670 CA GLU A 120 -12.465 8.565 -0.230 1.00 0.29 C ATOM 1671 C GLU A 120 -12.085 7.312 0.530 1.00 0.27 C ATOM 1672 O GLU A 120 -11.397 7.364 1.550 1.00 0.32 O ATOM 1673 CB GLU A 120 -13.983 8.736 -0.162 1.00 0.29 C ATOM 1674 CG GLU A 120 -14.510 9.891 -0.987 1.00 0.31 C ATOM 1675 CD GLU A 120 -14.043 11.240 -0.480 1.00 0.36 C ATOM 1676 OE1 GLU A 120 -14.233 11.528 0.718 1.00 0.53 O ATOM 1677 OE2 GLU A 120 -13.483 12.022 -1.277 1.00 0.70 O ATOM 0 H GLU A 120 -12.553 7.809 -2.182 1.00 0.28 H new ATOM 0 HA GLU A 120 -11.981 9.433 0.217 1.00 0.29 H new ATOM 0 HB2 GLU A 120 -14.458 7.815 -0.500 1.00 0.29 H new ATOM 0 HB3 GLU A 120 -14.276 8.882 0.878 1.00 0.29 H new ATOM 0 HG2 GLU A 120 -14.191 9.767 -2.022 1.00 0.31 H new ATOM 0 HG3 GLU A 120 -15.600 9.865 -0.985 1.00 0.31 H new ATOM 1684 N ILE A 121 -12.543 6.180 0.021 1.00 0.21 N ATOM 1685 CA ILE A 121 -12.367 4.915 0.712 1.00 0.19 C ATOM 1686 C ILE A 121 -11.754 3.859 -0.205 1.00 0.15 C ATOM 1687 O ILE A 121 -11.591 4.074 -1.409 1.00 0.15 O ATOM 1688 CB ILE A 121 -13.720 4.384 1.250 1.00 0.21 C ATOM 1689 CG1 ILE A 121 -14.618 3.903 0.106 1.00 0.21 C ATOM 1690 CG2 ILE A 121 -14.443 5.457 2.047 1.00 0.27 C ATOM 1691 CD1 ILE A 121 -14.554 2.415 -0.133 1.00 0.21 C ATOM 0 H ILE A 121 -13.039 6.112 -0.868 1.00 0.21 H new ATOM 0 HA ILE A 121 -11.690 5.101 1.545 1.00 0.19 H new ATOM 0 HB ILE A 121 -13.503 3.540 1.904 1.00 0.21 H new ATOM 0 HG12 ILE A 121 -15.649 4.183 0.323 1.00 0.21 H new ATOM 0 HG13 ILE A 121 -14.333 4.421 -0.810 1.00 0.21 H new ATOM 0 HG21 ILE A 121 -15.390 5.061 2.414 1.00 0.27 H new ATOM 0 HG22 ILE A 121 -13.825 5.762 2.891 1.00 0.27 H new ATOM 0 HG23 ILE A 121 -14.634 6.319 1.407 1.00 0.27 H new ATOM 0 HD11 ILE A 121 -15.216 2.150 -0.957 1.00 0.21 H new ATOM 0 HD12 ILE A 121 -13.532 2.130 -0.382 1.00 0.21 H new ATOM 0 HD13 ILE A 121 -14.868 1.888 0.768 1.00 0.21 H new ATOM 1703 N PHE A 122 -11.467 2.702 0.373 1.00 0.13 N ATOM 1704 CA PHE A 122 -10.922 1.574 -0.371 1.00 0.13 C ATOM 1705 C PHE A 122 -11.284 0.258 0.308 1.00 0.12 C ATOM 1706 O PHE A 122 -11.774 0.243 1.439 1.00 0.20 O ATOM 1707 CB PHE A 122 -9.399 1.686 -0.511 1.00 0.14 C ATOM 1708 CG PHE A 122 -8.672 1.835 0.795 1.00 0.15 C ATOM 1709 CD1 PHE A 122 -8.255 0.719 1.501 1.00 0.17 C ATOM 1710 CD2 PHE A 122 -8.406 3.089 1.316 1.00 0.15 C ATOM 1711 CE1 PHE A 122 -7.587 0.852 2.700 1.00 0.20 C ATOM 1712 CE2 PHE A 122 -7.739 3.229 2.515 1.00 0.18 C ATOM 1713 CZ PHE A 122 -7.329 2.110 3.208 1.00 0.20 C ATOM 0 H PHE A 122 -11.604 2.518 1.367 1.00 0.13 H new ATOM 0 HA PHE A 122 -11.362 1.593 -1.368 1.00 0.13 H new ATOM 0 HB2 PHE A 122 -9.026 0.799 -1.023 1.00 0.14 H new ATOM 0 HB3 PHE A 122 -9.165 2.542 -1.144 1.00 0.14 H new ATOM 0 HD1 PHE A 122 -8.455 -0.267 1.108 1.00 0.17 H new ATOM 0 HD2 PHE A 122 -8.725 3.969 0.777 1.00 0.15 H new ATOM 0 HE1 PHE A 122 -7.266 -0.026 3.241 1.00 0.20 H new ATOM 0 HE2 PHE A 122 -7.538 4.214 2.910 1.00 0.18 H new ATOM 0 HZ PHE A 122 -6.807 2.217 4.147 1.00 0.20 H new ATOM 1723 N THR A 123 -11.059 -0.836 -0.397 1.00 0.13 N ATOM 1724 CA THR A 123 -11.255 -2.173 0.149 1.00 0.13 C ATOM 1725 C THR A 123 -10.237 -3.133 -0.451 1.00 0.13 C ATOM 1726 O THR A 123 -9.974 -3.110 -1.650 1.00 0.22 O ATOM 1727 CB THR A 123 -12.683 -2.706 -0.121 1.00 0.15 C ATOM 1728 OG1 THR A 123 -13.654 -1.757 0.343 1.00 0.17 O ATOM 1729 CG2 THR A 123 -12.910 -4.050 0.575 1.00 0.16 C ATOM 0 H THR A 123 -10.735 -0.826 -1.364 1.00 0.13 H new ATOM 0 HA THR A 123 -11.118 -2.107 1.228 1.00 0.13 H new ATOM 0 HB THR A 123 -12.793 -2.850 -1.196 1.00 0.15 H new ATOM 0 HG1 THR A 123 -14.220 -2.175 1.025 1.00 0.17 H new ATOM 0 HG21 THR A 123 -13.921 -4.401 0.368 1.00 0.16 H new ATOM 0 HG22 THR A 123 -12.190 -4.779 0.203 1.00 0.16 H new ATOM 0 HG23 THR A 123 -12.781 -3.929 1.651 1.00 0.16 H new ATOM 1737 N TYR A 124 -9.650 -3.946 0.399 1.00 0.12 N ATOM 1738 CA TYR A 124 -8.692 -4.935 -0.017 1.00 0.12 C ATOM 1739 C TYR A 124 -9.287 -6.331 0.065 1.00 0.10 C ATOM 1740 O TYR A 124 -9.580 -6.840 1.140 1.00 0.09 O ATOM 1741 CB TYR A 124 -7.435 -4.854 0.844 1.00 0.13 C ATOM 1742 CG TYR A 124 -6.496 -6.016 0.636 1.00 0.13 C ATOM 1743 CD1 TYR A 124 -6.205 -6.886 1.676 1.00 0.15 C ATOM 1744 CD2 TYR A 124 -5.893 -6.235 -0.596 1.00 0.17 C ATOM 1745 CE1 TYR A 124 -5.338 -7.941 1.498 1.00 0.17 C ATOM 1746 CE2 TYR A 124 -5.026 -7.294 -0.783 1.00 0.20 C ATOM 1747 CZ TYR A 124 -4.786 -8.166 0.242 1.00 0.20 C ATOM 1748 OH TYR A 124 -3.887 -9.198 0.092 1.00 0.23 O ATOM 0 H TYR A 124 -9.828 -3.936 1.403 1.00 0.12 H new ATOM 0 HA TYR A 124 -8.425 -4.732 -1.054 1.00 0.12 H new ATOM 0 HB2 TYR A 124 -6.909 -3.926 0.621 1.00 0.13 H new ATOM 0 HB3 TYR A 124 -7.724 -4.812 1.894 1.00 0.13 H new ATOM 0 HD1 TYR A 124 -6.666 -6.734 2.641 1.00 0.15 H new ATOM 0 HD2 TYR A 124 -6.105 -5.568 -1.419 1.00 0.17 H new ATOM 0 HE1 TYR A 124 -5.089 -8.588 2.326 1.00 0.17 H new ATOM 0 HE2 TYR A 124 -4.539 -7.433 -1.737 1.00 0.20 H new ATOM 0 HH TYR A 124 -4.234 -9.842 -0.560 1.00 0.23 H new ATOM 1758 N ASN A 125 -9.482 -6.916 -1.088 1.00 0.13 N ATOM 1759 CA ASN A 125 -9.861 -8.295 -1.226 1.00 0.14 C ATOM 1760 C ASN A 125 -8.693 -9.170 -0.821 1.00 0.16 C ATOM 1761 O ASN A 125 -7.727 -9.308 -1.558 1.00 0.20 O ATOM 1762 CB ASN A 125 -10.234 -8.543 -2.688 1.00 0.20 C ATOM 1763 CG ASN A 125 -11.414 -7.713 -3.160 1.00 0.34 C ATOM 1764 OD1 ASN A 125 -11.560 -7.461 -4.350 1.00 0.66 O ATOM 1765 ND2 ASN A 125 -12.226 -7.239 -2.231 1.00 0.24 N ATOM 0 H ASN A 125 -9.378 -6.432 -1.980 1.00 0.13 H new ATOM 0 HA ASN A 125 -10.713 -8.532 -0.588 1.00 0.14 H new ATOM 0 HB2 ASN A 125 -9.371 -8.324 -3.317 1.00 0.20 H new ATOM 0 HB3 ASN A 125 -10.466 -9.600 -2.821 1.00 0.20 H new ATOM 0 HD21 ASN A 125 -13.008 -6.640 -2.495 1.00 0.24 H new ATOM 0 HD22 ASN A 125 -12.070 -7.472 -1.250 1.00 0.24 H new ATOM 1772 N GLU A 126 -8.786 -9.740 0.363 1.00 0.17 N ATOM 1773 CA GLU A 126 -7.732 -10.579 0.905 1.00 0.20 C ATOM 1774 C GLU A 126 -7.735 -11.930 0.204 1.00 0.23 C ATOM 1775 O GLU A 126 -6.768 -12.686 0.276 1.00 0.30 O ATOM 1776 CB GLU A 126 -7.934 -10.762 2.410 1.00 0.22 C ATOM 1777 CG GLU A 126 -8.526 -9.535 3.082 1.00 0.23 C ATOM 1778 CD GLU A 126 -8.410 -9.575 4.590 1.00 0.31 C ATOM 1779 OE1 GLU A 126 -9.138 -10.363 5.232 1.00 0.50 O ATOM 1780 OE2 GLU A 126 -7.595 -8.808 5.143 1.00 0.57 O ATOM 0 H GLU A 126 -9.593 -9.636 0.978 1.00 0.17 H new ATOM 0 HA GLU A 126 -6.769 -10.098 0.737 1.00 0.20 H new ATOM 0 HB2 GLU A 126 -8.590 -11.616 2.582 1.00 0.22 H new ATOM 0 HB3 GLU A 126 -6.976 -10.997 2.874 1.00 0.22 H new ATOM 0 HG2 GLU A 126 -8.023 -8.644 2.708 1.00 0.23 H new ATOM 0 HG3 GLU A 126 -9.577 -9.447 2.806 1.00 0.23 H new ATOM 1787 N HIS A 127 -8.842 -12.218 -0.467 1.00 0.21 N ATOM 1788 CA HIS A 127 -8.981 -13.446 -1.234 1.00 0.23 C ATOM 1789 C HIS A 127 -8.533 -13.227 -2.669 1.00 0.26 C ATOM 1790 O HIS A 127 -7.765 -14.010 -3.222 1.00 0.35 O ATOM 1791 CB HIS A 127 -10.437 -13.906 -1.222 1.00 0.25 C ATOM 1792 CG HIS A 127 -10.651 -15.262 -1.830 1.00 0.71 C ATOM 1793 ND1 HIS A 127 -11.502 -15.483 -2.890 1.00 1.26 N ATOM 1794 CD2 HIS A 127 -10.127 -16.471 -1.515 1.00 0.95 C ATOM 1795 CE1 HIS A 127 -11.490 -16.765 -3.201 1.00 1.74 C ATOM 1796 NE2 HIS A 127 -10.663 -17.387 -2.384 1.00 1.56 N ATOM 0 H HIS A 127 -9.662 -11.612 -0.495 1.00 0.21 H new ATOM 0 HA HIS A 127 -8.354 -14.212 -0.778 1.00 0.23 H new ATOM 0 HB2 HIS A 127 -10.795 -13.919 -0.193 1.00 0.25 H new ATOM 0 HB3 HIS A 127 -11.043 -13.177 -1.761 1.00 0.25 H new ATOM 0 HD2 HIS A 127 -9.419 -16.676 -0.726 1.00 0.95 H new ATOM 0 HE1 HIS A 127 -12.062 -17.227 -3.992 1.00 1.74 H new ATOM 0 HE2 HIS A 127 -10.456 -18.386 -2.396 1.00 1.56 H new ATOM 1804 N ASP A 128 -9.031 -12.156 -3.266 1.00 0.25 N ATOM 1805 CA ASP A 128 -8.723 -11.831 -4.653 1.00 0.29 C ATOM 1806 C ASP A 128 -7.376 -11.138 -4.755 1.00 0.27 C ATOM 1807 O ASP A 128 -6.892 -10.859 -5.851 1.00 0.32 O ATOM 1808 CB ASP A 128 -9.801 -10.922 -5.251 1.00 0.32 C ATOM 1809 CG ASP A 128 -11.189 -11.522 -5.174 1.00 0.72 C ATOM 1810 OD1 ASP A 128 -11.655 -12.084 -6.186 1.00 0.72 O ATOM 1811 OD2 ASP A 128 -11.821 -11.439 -4.100 1.00 1.33 O ATOM 0 H ASP A 128 -9.655 -11.491 -2.809 1.00 0.25 H new ATOM 0 HA ASP A 128 -8.691 -12.766 -5.212 1.00 0.29 H new ATOM 0 HB2 ASP A 128 -9.795 -9.966 -4.727 1.00 0.32 H new ATOM 0 HB3 ASP A 128 -9.557 -10.716 -6.293 1.00 0.32 H new ATOM 1816 N GLN A 129 -6.789 -10.859 -3.588 1.00 0.21 N ATOM 1817 CA GLN A 129 -5.524 -10.134 -3.491 1.00 0.21 C ATOM 1818 C GLN A 129 -5.663 -8.786 -4.179 1.00 0.18 C ATOM 1819 O GLN A 129 -4.770 -8.350 -4.894 1.00 0.18 O ATOM 1820 CB GLN A 129 -4.386 -10.936 -4.140 1.00 0.30 C ATOM 1821 CG GLN A 129 -4.335 -12.392 -3.706 1.00 0.53 C ATOM 1822 CD GLN A 129 -4.096 -12.557 -2.221 1.00 0.72 C ATOM 1823 OE1 GLN A 129 -3.428 -11.740 -1.588 1.00 1.75 O ATOM 1824 NE2 GLN A 129 -4.646 -13.616 -1.655 1.00 0.69 N ATOM 0 H GLN A 129 -7.179 -11.130 -2.685 1.00 0.21 H new ATOM 0 HA GLN A 129 -5.282 -9.987 -2.438 1.00 0.21 H new ATOM 0 HB2 GLN A 129 -4.496 -10.893 -5.224 1.00 0.30 H new ATOM 0 HB3 GLN A 129 -3.435 -10.461 -3.898 1.00 0.30 H new ATOM 0 HG2 GLN A 129 -5.273 -12.879 -3.974 1.00 0.53 H new ATOM 0 HG3 GLN A 129 -3.543 -12.902 -4.255 1.00 0.53 H new ATOM 0 HE21 GLN A 129 -5.192 -14.269 -2.217 1.00 0.69 H new ATOM 0 HE22 GLN A 129 -4.524 -13.781 -0.656 1.00 0.69 H new ATOM 1833 N LYS A 130 -6.787 -8.120 -3.959 1.00 0.17 N ATOM 1834 CA LYS A 130 -7.155 -7.008 -4.813 1.00 0.16 C ATOM 1835 C LYS A 130 -7.699 -5.807 -4.052 1.00 0.18 C ATOM 1836 O LYS A 130 -8.493 -5.942 -3.147 1.00 0.26 O ATOM 1837 CB LYS A 130 -8.208 -7.467 -5.804 1.00 0.18 C ATOM 1838 CG LYS A 130 -8.258 -6.581 -7.035 1.00 0.18 C ATOM 1839 CD LYS A 130 -9.439 -6.871 -7.942 1.00 0.22 C ATOM 1840 CE LYS A 130 -10.782 -6.617 -7.264 1.00 0.26 C ATOM 1841 NZ LYS A 130 -10.702 -5.615 -6.170 1.00 1.15 N ATOM 0 H LYS A 130 -7.447 -8.327 -3.210 1.00 0.17 H new ATOM 0 HA LYS A 130 -6.241 -6.686 -5.312 1.00 0.16 H new ATOM 0 HB2 LYS A 130 -7.999 -8.494 -6.105 1.00 0.18 H new ATOM 0 HB3 LYS A 130 -9.184 -7.469 -5.320 1.00 0.18 H new ATOM 0 HG2 LYS A 130 -8.299 -5.538 -6.721 1.00 0.18 H new ATOM 0 HG3 LYS A 130 -7.335 -6.707 -7.601 1.00 0.18 H new ATOM 0 HD2 LYS A 130 -9.366 -6.251 -8.836 1.00 0.22 H new ATOM 0 HD3 LYS A 130 -9.393 -7.910 -8.270 1.00 0.22 H new ATOM 0 HE2 LYS A 130 -11.500 -6.275 -8.010 1.00 0.26 H new ATOM 0 HE3 LYS A 130 -11.163 -7.556 -6.862 1.00 0.26 H new ATOM 0 HZ1 LYS A 130 -11.634 -5.173 -6.035 1.00 1.15 H new ATOM 0 HZ2 LYS A 130 -10.411 -6.085 -5.289 1.00 1.15 H new ATOM 0 HZ3 LYS A 130 -10.005 -4.884 -6.419 1.00 1.15 H new ATOM 1855 N CYS A 131 -7.315 -4.631 -4.488 1.00 0.16 N ATOM 1856 CA CYS A 131 -7.823 -3.395 -3.944 1.00 0.16 C ATOM 1857 C CYS A 131 -9.011 -2.921 -4.768 1.00 0.14 C ATOM 1858 O CYS A 131 -9.134 -3.271 -5.937 1.00 0.20 O ATOM 1859 CB CYS A 131 -6.747 -2.317 -4.000 1.00 0.20 C ATOM 1860 SG CYS A 131 -5.188 -2.720 -3.152 1.00 0.26 S ATOM 0 H CYS A 131 -6.635 -4.504 -5.237 1.00 0.16 H new ATOM 0 HA CYS A 131 -8.123 -3.570 -2.911 1.00 0.16 H new ATOM 0 HB2 CYS A 131 -6.526 -2.103 -5.046 1.00 0.20 H new ATOM 0 HB3 CYS A 131 -7.151 -1.403 -3.565 1.00 0.20 H new ATOM 1865 N THR A 132 -9.885 -2.164 -4.146 1.00 0.17 N ATOM 1866 CA THR A 132 -10.913 -1.417 -4.847 1.00 0.18 C ATOM 1867 C THR A 132 -11.019 -0.030 -4.245 1.00 0.19 C ATOM 1868 O THR A 132 -10.925 0.128 -3.029 1.00 0.25 O ATOM 1869 CB THR A 132 -12.287 -2.106 -4.789 1.00 0.20 C ATOM 1870 OG1 THR A 132 -12.468 -2.762 -3.526 1.00 0.22 O ATOM 1871 CG2 THR A 132 -12.443 -3.103 -5.919 1.00 0.25 C ATOM 0 H THR A 132 -9.906 -2.046 -3.133 1.00 0.17 H new ATOM 0 HA THR A 132 -10.622 -1.363 -5.896 1.00 0.18 H new ATOM 0 HB THR A 132 -13.052 -1.337 -4.900 1.00 0.20 H new ATOM 0 HG1 THR A 132 -13.347 -3.194 -3.505 1.00 0.22 H new ATOM 0 HG21 THR A 132 -13.423 -3.576 -5.854 1.00 0.25 H new ATOM 0 HG22 THR A 132 -12.351 -2.587 -6.875 1.00 0.25 H new ATOM 0 HG23 THR A 132 -11.667 -3.865 -5.842 1.00 0.25 H new ATOM 1879 N PHE A 133 -11.185 0.971 -5.088 1.00 0.17 N ATOM 1880 CA PHE A 133 -11.213 2.347 -4.625 1.00 0.18 C ATOM 1881 C PHE A 133 -12.525 3.003 -5.007 1.00 0.18 C ATOM 1882 O PHE A 133 -12.888 3.052 -6.183 1.00 0.20 O ATOM 1883 CB PHE A 133 -10.041 3.105 -5.233 1.00 0.19 C ATOM 1884 CG PHE A 133 -8.736 2.392 -5.040 1.00 0.18 C ATOM 1885 CD1 PHE A 133 -8.149 1.711 -6.090 1.00 0.18 C ATOM 1886 CD2 PHE A 133 -8.085 2.424 -3.817 1.00 0.19 C ATOM 1887 CE1 PHE A 133 -6.939 1.074 -5.926 1.00 0.18 C ATOM 1888 CE2 PHE A 133 -6.875 1.784 -3.645 1.00 0.19 C ATOM 1889 CZ PHE A 133 -6.342 1.039 -4.668 1.00 0.18 C ATOM 0 H PHE A 133 -11.302 0.859 -6.095 1.00 0.17 H new ATOM 0 HA PHE A 133 -11.127 2.366 -3.539 1.00 0.18 H new ATOM 0 HB2 PHE A 133 -10.219 3.249 -6.299 1.00 0.19 H new ATOM 0 HB3 PHE A 133 -9.980 4.096 -4.783 1.00 0.19 H new ATOM 0 HD1 PHE A 133 -8.644 1.678 -7.049 1.00 0.18 H new ATOM 0 HD2 PHE A 133 -8.530 2.956 -2.989 1.00 0.19 H new ATOM 0 HE1 PHE A 133 -6.455 0.604 -6.769 1.00 0.18 H new ATOM 0 HE2 PHE A 133 -6.347 1.869 -2.706 1.00 0.19 H new ATOM 0 HZ PHE A 133 -5.466 0.430 -4.498 1.00 0.18 H new ATOM 1899 N LYS A 134 -13.219 3.527 -4.014 1.00 0.18 N ATOM 1900 CA LYS A 134 -14.559 4.052 -4.205 1.00 0.20 C ATOM 1901 C LYS A 134 -14.693 5.433 -3.583 1.00 0.21 C ATOM 1902 O LYS A 134 -14.066 5.737 -2.564 1.00 0.20 O ATOM 1903 CB LYS A 134 -15.594 3.079 -3.632 1.00 0.21 C ATOM 1904 CG LYS A 134 -15.997 1.984 -4.623 1.00 0.26 C ATOM 1905 CD LYS A 134 -14.946 0.897 -4.767 1.00 0.55 C ATOM 1906 CE LYS A 134 -14.838 0.419 -6.211 1.00 0.56 C ATOM 1907 NZ LYS A 134 -16.148 -0.005 -6.779 1.00 0.72 N ATOM 0 H LYS A 134 -12.873 3.601 -3.057 1.00 0.18 H new ATOM 0 HA LYS A 134 -14.745 4.156 -5.274 1.00 0.20 H new ATOM 0 HB2 LYS A 134 -15.190 2.616 -2.732 1.00 0.21 H new ATOM 0 HB3 LYS A 134 -16.482 3.636 -3.333 1.00 0.21 H new ATOM 0 HG2 LYS A 134 -16.935 1.534 -4.297 1.00 0.26 H new ATOM 0 HG3 LYS A 134 -16.182 2.434 -5.598 1.00 0.26 H new ATOM 0 HD2 LYS A 134 -13.980 1.276 -4.434 1.00 0.55 H new ATOM 0 HD3 LYS A 134 -15.199 0.056 -4.121 1.00 0.55 H new ATOM 0 HE2 LYS A 134 -14.424 1.220 -6.824 1.00 0.56 H new ATOM 0 HE3 LYS A 134 -14.138 -0.415 -6.261 1.00 0.56 H new ATOM 0 HZ1 LYS A 134 -16.227 0.333 -7.759 1.00 0.72 H new ATOM 0 HZ2 LYS A 134 -16.213 -1.043 -6.765 1.00 0.72 H new ATOM 0 HZ3 LYS A 134 -16.920 0.398 -6.210 1.00 0.72 H new ATOM 1921 N GLY A 135 -15.487 6.276 -4.224 1.00 0.25 N ATOM 1922 CA GLY A 135 -15.618 7.647 -3.787 1.00 0.29 C ATOM 1923 C GLY A 135 -16.936 7.926 -3.108 1.00 0.31 C ATOM 1924 O GLY A 135 -17.577 7.016 -2.581 1.00 0.35 O ATOM 0 H GLY A 135 -16.045 6.033 -5.043 1.00 0.25 H new ATOM 0 HA2 GLY A 135 -14.805 7.883 -3.101 1.00 0.29 H new ATOM 0 HA3 GLY A 135 -15.511 8.308 -4.647 1.00 0.29 H new ATOM 1928 N ARG A 136 -17.342 9.191 -3.138 1.00 0.33 N ATOM 1929 CA ARG A 136 -18.554 9.639 -2.462 1.00 0.40 C ATOM 1930 C ARG A 136 -19.780 8.857 -2.922 1.00 0.39 C ATOM 1931 O ARG A 136 -20.054 8.741 -4.121 1.00 0.43 O ATOM 1932 CB ARG A 136 -18.748 11.134 -2.673 1.00 0.51 C ATOM 1933 CG ARG A 136 -17.651 11.952 -2.019 1.00 0.55 C ATOM 1934 CD ARG A 136 -18.071 13.389 -1.818 1.00 1.03 C ATOM 1935 NE ARG A 136 -18.133 14.140 -3.071 1.00 1.91 N ATOM 1936 CZ ARG A 136 -18.479 15.425 -3.149 1.00 2.55 C ATOM 1937 NH1 ARG A 136 -18.805 16.097 -2.049 1.00 2.53 N ATOM 1938 NH2 ARG A 136 -18.496 16.036 -4.325 1.00 3.44 N ATOM 0 H ARG A 136 -16.842 9.932 -3.630 1.00 0.33 H new ATOM 0 HA ARG A 136 -18.436 9.448 -1.395 1.00 0.40 H new ATOM 0 HB2 ARG A 136 -18.771 11.348 -3.741 1.00 0.51 H new ATOM 0 HB3 ARG A 136 -19.714 11.434 -2.267 1.00 0.51 H new ATOM 0 HG2 ARG A 136 -17.392 11.510 -1.057 1.00 0.55 H new ATOM 0 HG3 ARG A 136 -16.754 11.918 -2.637 1.00 0.55 H new ATOM 0 HD2 ARG A 136 -19.048 13.413 -1.336 1.00 1.03 H new ATOM 0 HD3 ARG A 136 -17.370 13.877 -1.141 1.00 1.03 H new ATOM 0 HE ARG A 136 -17.898 13.652 -3.936 1.00 1.91 H new ATOM 0 HH11 ARG A 136 -18.791 15.629 -1.143 1.00 2.53 H new ATOM 0 HH12 ARG A 136 -19.069 17.080 -2.112 1.00 2.53 H new ATOM 0 HH21 ARG A 136 -18.244 15.523 -5.170 1.00 3.44 H new ATOM 0 HH22 ARG A 136 -18.761 17.019 -4.385 1.00 3.44 H new ATOM 1952 N GLY A 137 -20.510 8.325 -1.954 1.00 0.37 N ATOM 1953 CA GLY A 137 -21.626 7.445 -2.242 1.00 0.37 C ATOM 1954 C GLY A 137 -21.390 6.061 -1.678 1.00 0.33 C ATOM 1955 O GLY A 137 -22.250 5.185 -1.753 1.00 0.35 O ATOM 0 H GLY A 137 -20.347 8.489 -0.961 1.00 0.37 H new ATOM 0 HA2 GLY A 137 -22.540 7.862 -1.819 1.00 0.37 H new ATOM 0 HA3 GLY A 137 -21.774 7.381 -3.320 1.00 0.37 H new ATOM 1959 N PHE A 138 -20.212 5.879 -1.099 1.00 0.31 N ATOM 1960 CA PHE A 138 -19.794 4.598 -0.555 1.00 0.30 C ATOM 1961 C PHE A 138 -20.633 4.196 0.660 1.00 0.35 C ATOM 1962 O PHE A 138 -20.780 3.011 0.952 1.00 0.38 O ATOM 1963 CB PHE A 138 -18.305 4.667 -0.182 1.00 0.29 C ATOM 1964 CG PHE A 138 -17.980 5.718 0.852 1.00 0.33 C ATOM 1965 CD1 PHE A 138 -17.623 7.002 0.474 1.00 0.36 C ATOM 1966 CD2 PHE A 138 -18.034 5.416 2.204 1.00 0.38 C ATOM 1967 CE1 PHE A 138 -17.324 7.963 1.422 1.00 0.42 C ATOM 1968 CE2 PHE A 138 -17.736 6.372 3.156 1.00 0.43 C ATOM 1969 CZ PHE A 138 -17.382 7.661 2.751 1.00 0.44 C ATOM 0 H PHE A 138 -19.518 6.619 -0.994 1.00 0.31 H new ATOM 0 HA PHE A 138 -19.947 3.834 -1.317 1.00 0.30 H new ATOM 0 HB2 PHE A 138 -17.989 3.693 0.193 1.00 0.29 H new ATOM 0 HB3 PHE A 138 -17.724 4.866 -1.083 1.00 0.29 H new ATOM 0 HD1 PHE A 138 -17.578 7.256 -0.575 1.00 0.36 H new ATOM 0 HD2 PHE A 138 -18.313 4.421 2.517 1.00 0.38 H new ATOM 0 HE1 PHE A 138 -17.043 8.958 1.109 1.00 0.42 H new ATOM 0 HE2 PHE A 138 -17.777 6.124 4.206 1.00 0.43 H new ATOM 0 HZ PHE A 138 -17.155 8.417 3.488 1.00 0.44 H new ATOM 1979 N SER A 139 -21.198 5.185 1.344 1.00 0.41 N ATOM 1980 CA SER A 139 -21.919 4.954 2.592 1.00 0.50 C ATOM 1981 C SER A 139 -23.112 4.013 2.400 1.00 0.44 C ATOM 1982 O SER A 139 -23.389 3.168 3.253 1.00 0.49 O ATOM 1983 CB SER A 139 -22.395 6.287 3.166 1.00 0.60 C ATOM 1984 OG SER A 139 -21.317 7.202 3.283 1.00 1.47 O ATOM 0 H SER A 139 -21.170 6.162 1.053 1.00 0.41 H new ATOM 0 HA SER A 139 -21.232 4.474 3.289 1.00 0.50 H new ATOM 0 HB2 SER A 139 -23.167 6.709 2.523 1.00 0.60 H new ATOM 0 HB3 SER A 139 -22.848 6.125 4.144 1.00 0.60 H new ATOM 0 HG SER A 139 -21.645 8.049 3.651 1.00 1.47 H new ATOM 1990 N ALA A 140 -23.802 4.155 1.278 1.00 0.37 N ATOM 1991 CA ALA A 140 -24.986 3.359 1.001 1.00 0.38 C ATOM 1992 C ALA A 140 -24.610 1.985 0.471 1.00 0.39 C ATOM 1993 O ALA A 140 -25.290 0.992 0.736 1.00 0.53 O ATOM 1994 CB ALA A 140 -25.864 4.079 -0.005 1.00 0.39 C ATOM 0 H ALA A 140 -23.560 4.818 0.542 1.00 0.37 H new ATOM 0 HA ALA A 140 -25.535 3.225 1.933 1.00 0.38 H new ATOM 0 HB1 ALA A 140 -26.750 3.479 -0.210 1.00 0.39 H new ATOM 0 HB2 ALA A 140 -26.166 5.045 0.401 1.00 0.39 H new ATOM 0 HB3 ALA A 140 -25.308 4.232 -0.930 1.00 0.39 H new ATOM 2000 N PHE A 141 -23.511 1.931 -0.262 1.00 0.31 N ATOM 2001 CA PHE A 141 -23.090 0.705 -0.914 1.00 0.30 C ATOM 2002 C PHE A 141 -22.081 -0.053 -0.062 1.00 0.30 C ATOM 2003 O PHE A 141 -21.222 -0.764 -0.585 1.00 0.31 O ATOM 2004 CB PHE A 141 -22.495 1.022 -2.284 1.00 0.28 C ATOM 2005 CG PHE A 141 -23.475 1.652 -3.232 1.00 0.28 C ATOM 2006 CD1 PHE A 141 -24.465 0.891 -3.833 1.00 0.30 C ATOM 2007 CD2 PHE A 141 -23.405 3.002 -3.525 1.00 0.29 C ATOM 2008 CE1 PHE A 141 -25.366 1.467 -4.707 1.00 0.33 C ATOM 2009 CE2 PHE A 141 -24.303 3.584 -4.398 1.00 0.31 C ATOM 2010 CZ PHE A 141 -25.285 2.816 -4.989 1.00 0.32 C ATOM 0 H PHE A 141 -22.892 2.726 -0.420 1.00 0.31 H new ATOM 0 HA PHE A 141 -23.965 0.068 -1.042 1.00 0.30 H new ATOM 0 HB2 PHE A 141 -21.644 1.691 -2.156 1.00 0.28 H new ATOM 0 HB3 PHE A 141 -22.113 0.102 -2.727 1.00 0.28 H new ATOM 0 HD1 PHE A 141 -24.533 -0.165 -3.615 1.00 0.30 H new ATOM 0 HD2 PHE A 141 -22.639 3.608 -3.065 1.00 0.29 H new ATOM 0 HE1 PHE A 141 -26.133 0.863 -5.169 1.00 0.33 H new ATOM 0 HE2 PHE A 141 -24.237 4.639 -4.618 1.00 0.31 H new ATOM 0 HZ PHE A 141 -25.989 3.269 -5.671 1.00 0.32 H new ATOM 2020 N LYS A 142 -22.180 0.108 1.246 1.00 0.31 N ATOM 2021 CA LYS A 142 -21.300 -0.603 2.156 1.00 0.30 C ATOM 2022 C LYS A 142 -21.815 -2.015 2.414 1.00 0.28 C ATOM 2023 O LYS A 142 -22.940 -2.206 2.877 1.00 0.35 O ATOM 2024 CB LYS A 142 -21.168 0.135 3.483 1.00 0.32 C ATOM 2025 CG LYS A 142 -20.052 -0.421 4.344 1.00 0.37 C ATOM 2026 CD LYS A 142 -20.083 0.141 5.747 1.00 0.38 C ATOM 2027 CE LYS A 142 -18.800 -0.190 6.489 1.00 0.46 C ATOM 2028 NZ LYS A 142 -18.896 0.091 7.947 1.00 0.50 N ATOM 0 H LYS A 142 -22.857 0.721 1.700 1.00 0.31 H new ATOM 0 HA LYS A 142 -20.319 -0.658 1.683 1.00 0.30 H new ATOM 0 HB2 LYS A 142 -20.983 1.192 3.291 1.00 0.32 H new ATOM 0 HB3 LYS A 142 -22.110 0.070 4.027 1.00 0.32 H new ATOM 0 HG2 LYS A 142 -20.135 -1.507 4.387 1.00 0.37 H new ATOM 0 HG3 LYS A 142 -19.091 -0.192 3.883 1.00 0.37 H new ATOM 0 HD2 LYS A 142 -20.217 1.222 5.708 1.00 0.38 H new ATOM 0 HD3 LYS A 142 -20.937 -0.267 6.288 1.00 0.38 H new ATOM 0 HE2 LYS A 142 -18.559 -1.243 6.340 1.00 0.46 H new ATOM 0 HE3 LYS A 142 -17.979 0.388 6.064 1.00 0.46 H new ATOM 0 HZ1 LYS A 142 -18.111 -0.377 8.443 1.00 0.50 H new ATOM 0 HZ2 LYS A 142 -18.844 1.117 8.107 1.00 0.50 H new ATOM 0 HZ3 LYS A 142 -19.800 -0.271 8.311 1.00 0.50 H new ATOM 2042 N GLU A 143 -20.975 -2.995 2.134 1.00 0.25 N ATOM 2043 CA GLU A 143 -21.327 -4.392 2.324 1.00 0.25 C ATOM 2044 C GLU A 143 -20.612 -4.926 3.556 1.00 0.23 C ATOM 2045 O GLU A 143 -19.392 -5.049 3.560 1.00 0.23 O ATOM 2046 CB GLU A 143 -20.930 -5.210 1.089 1.00 0.29 C ATOM 2047 CG GLU A 143 -21.748 -6.476 0.909 1.00 0.33 C ATOM 2048 CD GLU A 143 -21.516 -7.131 -0.437 1.00 0.43 C ATOM 2049 OE1 GLU A 143 -20.476 -7.797 -0.616 1.00 0.73 O ATOM 2050 OE2 GLU A 143 -22.386 -6.989 -1.325 1.00 0.52 O ATOM 0 H GLU A 143 -20.034 -2.847 1.770 1.00 0.25 H new ATOM 0 HA GLU A 143 -22.405 -4.477 2.464 1.00 0.25 H new ATOM 0 HB2 GLU A 143 -21.039 -4.588 0.201 1.00 0.29 H new ATOM 0 HB3 GLU A 143 -19.876 -5.476 1.164 1.00 0.29 H new ATOM 0 HG2 GLU A 143 -21.498 -7.182 1.701 1.00 0.33 H new ATOM 0 HG3 GLU A 143 -22.806 -6.239 1.016 1.00 0.33 H new ATOM 2057 N ARG A 144 -21.360 -5.223 4.605 1.00 0.23 N ATOM 2058 CA ARG A 144 -20.755 -5.671 5.852 1.00 0.23 C ATOM 2059 C ARG A 144 -20.879 -7.177 5.998 1.00 0.23 C ATOM 2060 O ARG A 144 -21.913 -7.759 5.664 1.00 0.29 O ATOM 2061 CB ARG A 144 -21.389 -4.983 7.065 1.00 0.30 C ATOM 2062 CG ARG A 144 -21.310 -3.466 7.031 1.00 0.35 C ATOM 2063 CD ARG A 144 -22.445 -2.859 6.215 1.00 0.34 C ATOM 2064 NE ARG A 144 -23.750 -3.146 6.805 1.00 0.49 N ATOM 2065 CZ ARG A 144 -24.915 -2.946 6.188 1.00 0.57 C ATOM 2066 NH1 ARG A 144 -24.947 -2.488 4.940 1.00 0.71 N ATOM 2067 NH2 ARG A 144 -26.050 -3.217 6.819 1.00 0.77 N ATOM 0 H ARG A 144 -22.378 -5.164 4.621 1.00 0.23 H new ATOM 0 HA ARG A 144 -19.700 -5.399 5.815 1.00 0.23 H new ATOM 0 HB2 ARG A 144 -22.436 -5.280 7.131 1.00 0.30 H new ATOM 0 HB3 ARG A 144 -20.898 -5.341 7.970 1.00 0.30 H new ATOM 0 HG2 ARG A 144 -21.345 -3.077 8.049 1.00 0.35 H new ATOM 0 HG3 ARG A 144 -20.353 -3.161 6.606 1.00 0.35 H new ATOM 0 HD2 ARG A 144 -22.307 -1.780 6.146 1.00 0.34 H new ATOM 0 HD3 ARG A 144 -22.412 -3.250 5.198 1.00 0.34 H new ATOM 0 HE ARG A 144 -23.772 -3.525 7.752 1.00 0.49 H new ATOM 0 HH11 ARG A 144 -24.076 -2.287 4.448 1.00 0.71 H new ATOM 0 HH12 ARG A 144 -25.842 -2.338 4.475 1.00 0.71 H new ATOM 0 HH21 ARG A 144 -26.030 -3.577 7.773 1.00 0.77 H new ATOM 0 HH22 ARG A 144 -26.943 -3.065 6.350 1.00 0.77 H new ATOM 2081 N GLY A 145 -19.821 -7.800 6.494 1.00 0.21 N ATOM 2082 CA GLY A 145 -19.822 -9.234 6.687 1.00 0.25 C ATOM 2083 C GLY A 145 -19.270 -9.962 5.485 1.00 0.22 C ATOM 2084 O GLY A 145 -19.632 -11.106 5.218 1.00 0.25 O ATOM 0 H GLY A 145 -18.956 -7.334 6.768 1.00 0.21 H new ATOM 0 HA2 GLY A 145 -19.228 -9.483 7.567 1.00 0.25 H new ATOM 0 HA3 GLY A 145 -20.839 -9.574 6.882 1.00 0.25 H new ATOM 2088 N VAL A 146 -18.381 -9.294 4.775 1.00 0.19 N ATOM 2089 CA VAL A 146 -17.801 -9.834 3.557 1.00 0.18 C ATOM 2090 C VAL A 146 -16.475 -10.512 3.860 1.00 0.17 C ATOM 2091 O VAL A 146 -15.494 -9.852 4.195 1.00 0.17 O ATOM 2092 CB VAL A 146 -17.573 -8.720 2.514 1.00 0.16 C ATOM 2093 CG1 VAL A 146 -17.122 -9.296 1.182 1.00 0.17 C ATOM 2094 CG2 VAL A 146 -18.826 -7.889 2.338 1.00 0.20 C ATOM 0 H VAL A 146 -18.041 -8.365 5.024 1.00 0.19 H new ATOM 0 HA VAL A 146 -18.501 -10.564 3.150 1.00 0.18 H new ATOM 0 HB VAL A 146 -16.778 -8.073 2.885 1.00 0.16 H new ATOM 0 HG11 VAL A 146 -16.970 -8.486 0.468 1.00 0.17 H new ATOM 0 HG12 VAL A 146 -16.187 -9.840 1.319 1.00 0.17 H new ATOM 0 HG13 VAL A 146 -17.885 -9.976 0.802 1.00 0.17 H new ATOM 0 HG21 VAL A 146 -18.644 -7.109 1.599 1.00 0.20 H new ATOM 0 HG22 VAL A 146 -19.642 -8.528 1.999 1.00 0.20 H new ATOM 0 HG23 VAL A 146 -19.095 -7.431 3.290 1.00 0.20 H new ATOM 2104 N LEU A 147 -16.445 -11.826 3.764 1.00 0.21 N ATOM 2105 CA LEU A 147 -15.227 -12.565 4.033 1.00 0.22 C ATOM 2106 C LEU A 147 -14.229 -12.387 2.908 1.00 0.21 C ATOM 2107 O LEU A 147 -14.575 -12.469 1.727 1.00 0.23 O ATOM 2108 CB LEU A 147 -15.520 -14.041 4.237 1.00 0.29 C ATOM 2109 CG LEU A 147 -16.461 -14.349 5.401 1.00 0.35 C ATOM 2110 CD1 LEU A 147 -16.662 -15.848 5.551 1.00 0.41 C ATOM 2111 CD2 LEU A 147 -15.915 -13.751 6.687 1.00 0.37 C ATOM 0 H LEU A 147 -17.245 -12.402 3.503 1.00 0.21 H new ATOM 0 HA LEU A 147 -14.795 -12.167 4.951 1.00 0.22 H new ATOM 0 HB2 LEU A 147 -15.954 -14.442 3.321 1.00 0.29 H new ATOM 0 HB3 LEU A 147 -14.578 -14.566 4.400 1.00 0.29 H new ATOM 0 HG LEU A 147 -17.431 -13.899 5.190 1.00 0.35 H new ATOM 0 HD11 LEU A 147 -17.335 -16.043 6.386 1.00 0.41 H new ATOM 0 HD12 LEU A 147 -17.094 -16.251 4.635 1.00 0.41 H new ATOM 0 HD13 LEU A 147 -15.701 -16.327 5.740 1.00 0.41 H new ATOM 0 HD21 LEU A 147 -16.593 -13.976 7.510 1.00 0.37 H new ATOM 0 HD22 LEU A 147 -14.934 -14.177 6.898 1.00 0.37 H new ATOM 0 HD23 LEU A 147 -15.825 -12.670 6.576 1.00 0.37 H new ATOM 2123 N GLY A 148 -12.993 -12.128 3.284 1.00 0.22 N ATOM 2124 CA GLY A 148 -11.943 -11.991 2.312 1.00 0.24 C ATOM 2125 C GLY A 148 -11.774 -10.580 1.830 1.00 0.19 C ATOM 2126 O GLY A 148 -11.255 -10.364 0.738 1.00 0.19 O ATOM 0 H GLY A 148 -12.698 -12.010 4.253 1.00 0.22 H new ATOM 0 HA2 GLY A 148 -11.005 -12.336 2.747 1.00 0.24 H new ATOM 0 HA3 GLY A 148 -12.156 -12.637 1.461 1.00 0.24 H new ATOM 2130 N VAL A 149 -12.225 -9.612 2.616 1.00 0.17 N ATOM 2131 CA VAL A 149 -12.027 -8.214 2.269 1.00 0.13 C ATOM 2132 C VAL A 149 -11.782 -7.360 3.504 1.00 0.13 C ATOM 2133 O VAL A 149 -12.238 -7.674 4.603 1.00 0.17 O ATOM 2134 CB VAL A 149 -13.219 -7.621 1.494 1.00 0.13 C ATOM 2135 CG1 VAL A 149 -13.519 -8.416 0.242 1.00 0.15 C ATOM 2136 CG2 VAL A 149 -14.432 -7.561 2.376 1.00 0.15 C ATOM 0 H VAL A 149 -12.726 -9.768 3.491 1.00 0.17 H new ATOM 0 HA VAL A 149 -11.147 -8.196 1.626 1.00 0.13 H new ATOM 0 HB VAL A 149 -12.949 -6.610 1.188 1.00 0.13 H new ATOM 0 HG11 VAL A 149 -14.366 -7.969 -0.279 1.00 0.15 H new ATOM 0 HG12 VAL A 149 -12.646 -8.409 -0.411 1.00 0.15 H new ATOM 0 HG13 VAL A 149 -13.762 -9.444 0.513 1.00 0.15 H new ATOM 0 HG21 VAL A 149 -15.268 -7.140 1.817 1.00 0.15 H new ATOM 0 HG22 VAL A 149 -14.689 -8.566 2.711 1.00 0.15 H new ATOM 0 HG23 VAL A 149 -14.222 -6.933 3.242 1.00 0.15 H new ATOM 2146 N THR A 150 -11.062 -6.284 3.289 1.00 0.13 N ATOM 2147 CA THR A 150 -10.744 -5.323 4.324 1.00 0.15 C ATOM 2148 C THR A 150 -10.917 -3.910 3.778 1.00 0.14 C ATOM 2149 O THR A 150 -10.291 -3.548 2.798 1.00 0.15 O ATOM 2150 CB THR A 150 -9.294 -5.518 4.810 1.00 0.17 C ATOM 2151 OG1 THR A 150 -9.209 -6.675 5.655 1.00 0.20 O ATOM 2152 CG2 THR A 150 -8.785 -4.290 5.547 1.00 0.19 C ATOM 0 H THR A 150 -10.674 -6.046 2.376 1.00 0.13 H new ATOM 0 HA THR A 150 -11.419 -5.475 5.166 1.00 0.15 H new ATOM 0 HB THR A 150 -8.663 -5.666 3.934 1.00 0.17 H new ATOM 0 HG1 THR A 150 -8.480 -7.253 5.346 1.00 0.20 H new ATOM 0 HG21 THR A 150 -7.760 -4.462 5.876 1.00 0.19 H new ATOM 0 HG22 THR A 150 -8.813 -3.428 4.880 1.00 0.19 H new ATOM 0 HG23 THR A 150 -9.417 -4.098 6.414 1.00 0.19 H new ATOM 2160 N SER A 151 -11.741 -3.106 4.411 1.00 0.15 N ATOM 2161 CA SER A 151 -12.015 -1.782 3.891 1.00 0.16 C ATOM 2162 C SER A 151 -11.309 -0.725 4.718 1.00 0.20 C ATOM 2163 O SER A 151 -10.955 -0.956 5.864 1.00 0.45 O ATOM 2164 CB SER A 151 -13.519 -1.511 3.875 1.00 0.20 C ATOM 2165 OG SER A 151 -14.033 -1.386 5.186 1.00 1.06 O ATOM 0 H SER A 151 -12.229 -3.340 5.276 1.00 0.15 H new ATOM 0 HA SER A 151 -11.638 -1.737 2.869 1.00 0.16 H new ATOM 0 HB2 SER A 151 -13.720 -0.598 3.315 1.00 0.20 H new ATOM 0 HB3 SER A 151 -14.031 -2.322 3.357 1.00 0.20 H new ATOM 0 HG SER A 151 -15.012 -1.372 5.153 1.00 1.06 H new ATOM 2171 N GLY A 152 -11.079 0.418 4.113 1.00 0.14 N ATOM 2172 CA GLY A 152 -10.501 1.531 4.819 1.00 0.15 C ATOM 2173 C GLY A 152 -11.111 2.825 4.353 1.00 0.13 C ATOM 2174 O GLY A 152 -10.958 3.200 3.193 1.00 0.15 O ATOM 0 H GLY A 152 -11.285 0.598 3.130 1.00 0.14 H new ATOM 0 HA2 GLY A 152 -10.661 1.412 5.891 1.00 0.15 H new ATOM 0 HA3 GLY A 152 -9.423 1.551 4.658 1.00 0.15 H new ATOM 2178 N PRO A 153 -11.848 3.510 5.221 1.00 0.16 N ATOM 2179 CA PRO A 153 -12.524 4.746 4.872 1.00 0.19 C ATOM 2180 C PRO A 153 -11.700 5.986 5.196 1.00 0.19 C ATOM 2181 O PRO A 153 -12.246 7.080 5.352 1.00 0.24 O ATOM 2182 CB PRO A 153 -13.759 4.674 5.764 1.00 0.23 C ATOM 2183 CG PRO A 153 -13.278 4.007 7.013 1.00 0.25 C ATOM 2184 CD PRO A 153 -12.118 3.123 6.618 1.00 0.22 C ATOM 0 HA PRO A 153 -12.726 4.833 3.805 1.00 0.19 H new ATOM 0 HB2 PRO A 153 -14.157 5.667 5.972 1.00 0.23 H new ATOM 0 HB3 PRO A 153 -14.558 4.103 5.291 1.00 0.23 H new ATOM 0 HG2 PRO A 153 -12.967 4.747 7.751 1.00 0.25 H new ATOM 0 HG3 PRO A 153 -14.075 3.419 7.468 1.00 0.25 H new ATOM 0 HD2 PRO A 153 -11.250 3.291 7.256 1.00 0.22 H new ATOM 0 HD3 PRO A 153 -12.373 2.066 6.699 1.00 0.22 H new ATOM 2192 N LYS A 154 -10.385 5.824 5.290 1.00 0.17 N ATOM 2193 CA LYS A 154 -9.531 6.905 5.755 1.00 0.17 C ATOM 2194 C LYS A 154 -8.186 6.939 5.042 1.00 0.18 C ATOM 2195 O LYS A 154 -7.968 6.244 4.050 1.00 0.21 O ATOM 2196 CB LYS A 154 -9.300 6.776 7.267 1.00 0.19 C ATOM 2197 CG LYS A 154 -10.495 7.158 8.116 1.00 0.21 C ATOM 2198 CD LYS A 154 -10.209 6.941 9.589 1.00 0.29 C ATOM 2199 CE LYS A 154 -11.424 7.249 10.436 1.00 0.40 C ATOM 2200 NZ LYS A 154 -11.188 6.965 11.876 1.00 0.70 N ATOM 0 H LYS A 154 -9.893 4.963 5.052 1.00 0.17 H new ATOM 0 HA LYS A 154 -10.048 7.837 5.527 1.00 0.17 H new ATOM 0 HB2 LYS A 154 -9.023 5.747 7.494 1.00 0.19 H new ATOM 0 HB3 LYS A 154 -8.454 7.403 7.548 1.00 0.19 H new ATOM 0 HG2 LYS A 154 -10.750 8.203 7.942 1.00 0.21 H new ATOM 0 HG3 LYS A 154 -11.360 6.565 7.819 1.00 0.21 H new ATOM 0 HD2 LYS A 154 -9.901 5.909 9.754 1.00 0.29 H new ATOM 0 HD3 LYS A 154 -9.378 7.575 9.898 1.00 0.29 H new ATOM 0 HE2 LYS A 154 -11.695 8.298 10.313 1.00 0.40 H new ATOM 0 HE3 LYS A 154 -12.270 6.658 10.084 1.00 0.40 H new ATOM 0 HZ1 LYS A 154 -12.046 7.190 12.419 1.00 0.70 H new ATOM 0 HZ2 LYS A 154 -10.955 5.959 11.998 1.00 0.70 H new ATOM 0 HZ3 LYS A 154 -10.398 7.547 12.220 1.00 0.70 H new ATOM 2214 N GLN A 155 -7.297 7.775 5.570 1.00 0.18 N ATOM 2215 CA GLN A 155 -5.932 7.902 5.077 1.00 0.18 C ATOM 2216 C GLN A 155 -5.064 6.794 5.664 1.00 0.15 C ATOM 2217 O GLN A 155 -5.569 5.759 6.089 1.00 0.17 O ATOM 2218 CB GLN A 155 -5.360 9.260 5.500 1.00 0.20 C ATOM 2219 CG GLN A 155 -6.212 10.450 5.089 1.00 0.23 C ATOM 2220 CD GLN A 155 -6.002 10.857 3.645 1.00 0.75 C ATOM 2221 OE1 GLN A 155 -6.932 11.305 2.976 1.00 1.78 O ATOM 2222 NE2 GLN A 155 -4.769 10.770 3.175 1.00 0.92 N ATOM 0 H GLN A 155 -7.507 8.388 6.358 1.00 0.18 H new ATOM 0 HA GLN A 155 -5.938 7.824 3.990 1.00 0.18 H new ATOM 0 HB2 GLN A 155 -5.240 9.270 6.583 1.00 0.20 H new ATOM 0 HB3 GLN A 155 -4.365 9.373 5.069 1.00 0.20 H new ATOM 0 HG2 GLN A 155 -7.263 10.208 5.243 1.00 0.23 H new ATOM 0 HG3 GLN A 155 -5.981 11.296 5.737 1.00 0.23 H new ATOM 0 HE21 GLN A 155 -4.025 10.392 3.762 1.00 0.92 H new ATOM 0 HE22 GLN A 155 -4.562 11.081 2.226 1.00 0.92 H new ATOM 2231 N PHE A 156 -3.757 7.021 5.686 1.00 0.14 N ATOM 2232 CA PHE A 156 -2.837 6.140 6.393 1.00 0.11 C ATOM 2233 C PHE A 156 -3.234 6.084 7.867 1.00 0.14 C ATOM 2234 O PHE A 156 -3.232 7.111 8.541 1.00 0.20 O ATOM 2235 CB PHE A 156 -1.416 6.669 6.280 1.00 0.11 C ATOM 2236 CG PHE A 156 -0.965 6.960 4.873 1.00 0.14 C ATOM 2237 CD1 PHE A 156 -0.628 5.927 4.016 1.00 0.23 C ATOM 2238 CD2 PHE A 156 -0.876 8.261 4.411 1.00 0.24 C ATOM 2239 CE1 PHE A 156 -0.208 6.183 2.726 1.00 0.27 C ATOM 2240 CE2 PHE A 156 -0.459 8.523 3.122 1.00 0.30 C ATOM 2241 CZ PHE A 156 -0.142 7.510 2.277 1.00 0.26 C ATOM 0 H PHE A 156 -3.309 7.810 5.221 1.00 0.14 H new ATOM 0 HA PHE A 156 -2.884 5.144 5.952 1.00 0.11 H new ATOM 0 HB2 PHE A 156 -1.334 7.582 6.870 1.00 0.11 H new ATOM 0 HB3 PHE A 156 -0.735 5.942 6.723 1.00 0.11 H new ATOM 0 HD1 PHE A 156 -0.695 4.906 4.361 1.00 0.23 H new ATOM 0 HD2 PHE A 156 -1.135 9.080 5.066 1.00 0.24 H new ATOM 0 HE1 PHE A 156 0.067 5.370 2.070 1.00 0.27 H new ATOM 0 HE2 PHE A 156 -0.384 9.545 2.782 1.00 0.30 H new ATOM 0 HZ PHE A 156 0.160 7.725 1.263 1.00 0.26 H new ATOM 2251 N CYS A 157 -3.568 4.895 8.356 1.00 0.17 N ATOM 2252 CA CYS A 157 -4.122 4.727 9.707 1.00 0.24 C ATOM 2253 C CYS A 157 -3.254 5.350 10.805 1.00 0.37 C ATOM 2254 O CYS A 157 -3.751 5.643 11.894 1.00 0.81 O ATOM 2255 CB CYS A 157 -4.328 3.248 10.031 1.00 0.28 C ATOM 2256 SG CYS A 157 -5.366 2.335 8.848 1.00 0.31 S ATOM 0 H CYS A 157 -3.466 4.023 7.837 1.00 0.17 H new ATOM 0 HA CYS A 157 -5.076 5.254 9.696 1.00 0.24 H new ATOM 0 HB2 CYS A 157 -3.353 2.764 10.083 1.00 0.28 H new ATOM 0 HB3 CYS A 157 -4.777 3.168 11.021 1.00 0.28 H new ATOM 2261 N ASP A 158 -1.968 5.535 10.547 1.00 0.42 N ATOM 2262 CA ASP A 158 -1.084 6.105 11.560 1.00 0.51 C ATOM 2263 C ASP A 158 -0.484 7.429 11.097 1.00 0.40 C ATOM 2264 O ASP A 158 0.098 8.165 11.890 1.00 0.53 O ATOM 2265 CB ASP A 158 0.033 5.118 11.902 1.00 0.71 C ATOM 2266 CG ASP A 158 0.741 5.455 13.201 1.00 1.00 C ATOM 2267 OD1 ASP A 158 0.262 5.046 14.281 1.00 1.24 O ATOM 2268 OD2 ASP A 158 1.780 6.146 13.150 1.00 1.43 O ATOM 0 H ASP A 158 -1.516 5.304 9.662 1.00 0.42 H new ATOM 0 HA ASP A 158 -1.681 6.298 12.451 1.00 0.51 H new ATOM 0 HB2 ASP A 158 -0.385 4.114 11.972 1.00 0.71 H new ATOM 0 HB3 ASP A 158 0.760 5.105 11.090 1.00 0.71 H new ATOM 2273 N GLU A 159 -0.653 7.752 9.820 1.00 0.31 N ATOM 2274 CA GLU A 159 0.005 8.913 9.245 1.00 0.41 C ATOM 2275 C GLU A 159 -1.002 10.007 8.900 1.00 0.55 C ATOM 2276 O GLU A 159 -0.612 11.107 8.513 1.00 0.98 O ATOM 2277 CB GLU A 159 0.762 8.508 7.982 1.00 0.49 C ATOM 2278 CG GLU A 159 1.507 7.189 8.105 1.00 0.49 C ATOM 2279 CD GLU A 159 2.855 7.332 8.779 1.00 0.57 C ATOM 2280 OE1 GLU A 159 3.877 7.072 8.119 1.00 0.83 O ATOM 2281 OE2 GLU A 159 2.901 7.718 9.961 1.00 0.95 O ATOM 0 H GLU A 159 -1.237 7.228 9.168 1.00 0.31 H new ATOM 0 HA GLU A 159 0.701 9.305 9.987 1.00 0.41 H new ATOM 0 HB2 GLU A 159 0.056 8.439 7.154 1.00 0.49 H new ATOM 0 HB3 GLU A 159 1.474 9.294 7.730 1.00 0.49 H new ATOM 0 HG2 GLU A 159 0.897 6.485 8.671 1.00 0.49 H new ATOM 0 HG3 GLU A 159 1.647 6.763 7.111 1.00 0.49 H new ATOM 2288 N GLY A 160 -2.291 9.712 9.032 1.00 0.40 N ATOM 2289 CA GLY A 160 -3.298 10.688 8.661 1.00 0.49 C ATOM 2290 C GLY A 160 -4.706 10.303 9.084 1.00 0.53 C ATOM 2291 O GLY A 160 -5.446 11.132 9.617 1.00 0.75 O ATOM 0 H GLY A 160 -2.653 8.826 9.385 1.00 0.40 H new ATOM 0 HA2 GLY A 160 -3.043 11.648 9.109 1.00 0.49 H new ATOM 0 HA3 GLY A 160 -3.278 10.825 7.580 1.00 0.49 H new ATOM 2295 N GLY A 161 -5.076 9.051 8.847 1.00 0.39 N ATOM 2296 CA GLY A 161 -6.430 8.606 9.123 1.00 0.53 C ATOM 2297 C GLY A 161 -6.743 8.582 10.603 1.00 0.67 C ATOM 2298 O GLY A 161 -5.818 8.341 11.406 1.00 1.29 O ATOM 2299 OXT GLY A 161 -7.910 8.818 10.970 1.00 1.35 O ATOM 0 H GLY A 161 -4.460 8.332 8.467 1.00 0.39 H new ATOM 0 HA2 GLY A 161 -7.136 9.265 8.617 1.00 0.53 H new ATOM 0 HA3 GLY A 161 -6.572 7.608 8.709 1.00 0.53 H new TER 2303 GLY A 161