USER MOD reduce.3.24.130724 H: found=0, std=0, add=1328, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1330 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 105 SER OG : rot 180:sc= 1.07 USER MOD Set 1.2: A 124 GLN : amide:sc= -1.58! C(o=0.68!,f=-2.2!) USER MOD Set 1.3: A 126 THR OG1 : rot 144:sc= 1.19 USER MOD Set 2.1: A 125 LYS NZ :NH3+ -169:sc= 0.36 (180deg=-0.0982) USER MOD Set 2.2: A 127 SER OG : rot -150:sc= 0.379 USER MOD Set 3.1: A 113 THR OG1 : rot 142:sc= 1.21 USER MOD Set 3.2: A 138 TYR OH : rot 149:sc= 2.61 USER MOD Set 4.1: A 96 ASN : amide:sc= -0.222 K(o=-0.14,f=-1.1) USER MOD Set 4.2: A 99 SER OG : rot 110:sc= 0.0855 USER MOD Set 5.1: A 86 SER OG : rot 141:sc= -0.12 USER MOD Set 5.2: A 91 GLN : amide:sc= -6.27! C(o=-6.4!,f=-9.8!) USER MOD Set 6.1: A 52 TYR OH : rot 180:sc= 0 USER MOD Set 6.2: A 134 LYS NZ :NH3+ -141:sc= -0.134 (180deg=-0.595) USER MOD Set 7.1: A 51 MET CE :methyl 133:sc= -1.76 (180deg=-1.46) USER MOD Set 7.2: A 169 SER OG : rot 38:sc= -1.33 USER MOD Single : A 15 SER OG : rot -150:sc= 0 USER MOD Single : A 19 GLN : amide:sc= -1.17 X(o=-1.2,f=-0.72) USER MOD Single : A 24 THR OG1 : rot -91:sc= 0.0421 USER MOD Single : A 28 GLN : amide:sc= -0.286 K(o=-0.29,f=-2.1!) USER MOD Single : A 39 ASN : amide:sc= -1.14 K(o=-1.1,f=-3.1!) USER MOD Single : A 42 GLN : amide:sc= -1.27! K(o=-1.3!,f=-0.0098) USER MOD Single : A 43 LYS NZ :NH3+ -107:sc= 2.38 (180deg=0.549) USER MOD Single : A 46 GLN : amide:sc= -1.2! K(o=-1.2!,f=-0.02) USER MOD Single : A 47 SER OG : rot 55:sc= 0.0243 USER MOD Single : A 50 THR OG1 : rot 33:sc= 0.682 USER MOD Single : A 53 SER OG : rot 149:sc= 0.0968 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 TYR OH : rot -140:sc= 0.492 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 ASN : amide:sc= -0.879 K(o=-0.88,f=-1.6) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= -0.0775 USER MOD Single : A 65 ASN : amide:sc= -2.86! C(o=-2.9!,f=-2.9!) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= -0.054 USER MOD Single : A 78 TYR OH : rot 68:sc= 1.05 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot -40:sc= -1.25! USER MOD Single : A 98 HIS : no HD1:sc= -0.125 X(o=-0.13,f=-0.011) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= -1.61! C(o=-1.6!,f=-2.5!) USER MOD Single : A 104 GLN : amide:sc= -2.25! K(o=-2.3!,f=-1.1) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 GLN : amide:sc= -4.15! C(o=-4.1!,f=-8.1!) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 120 MET CE :methyl -143:sc= -0.16 (180deg=-1.48) USER MOD Single : A 129 ASN : amide:sc= -0.0443 X(o=-0.044,f=-0.52) USER MOD Single : A 130 LYS NZ :NH3+ 158:sc= -0.014 (180deg=-0.167) USER MOD Single : A 131 GLN : amide:sc= -0.451 K(o=-0.45,f=-2.3) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 THR OG1 : rot 21:sc= 0.0135 USER MOD Single : A 141 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 LYS NZ :NH3+ 156:sc= -0.05 (180deg=-0.299) USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 SER OG : rot 78:sc= 0.279 USER MOD Single : A 157 LYS NZ :NH3+ -173:sc= -4.05! (180deg=-4.49!) USER MOD Single : A 158 SER OG : rot -92:sc= 0.638 USER MOD Single : A 162 LYS NZ :NH3+ 155:sc= -4.19! (180deg=-4.95!) USER MOD Single : A 164 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 165 ASN : amide:sc= -0.482 X(o=-0.48,f=-0.91) USER MOD Single : A 172 THR OG1 : rot 140:sc= -0.0182 USER MOD Single : A 174 GLN : amide:sc= -3.55! C(o=-3.5!,f=-7.5!) USER MOD ----------------------------------------------------------------- ATOM 88 N LEU A 7 -17.313 8.154 -0.809 1.00 0.58 N ATOM 89 CA LEU A 7 -16.050 7.729 -0.225 1.00 0.51 C ATOM 90 C LEU A 7 -16.269 7.205 1.186 1.00 0.45 C ATOM 91 O LEU A 7 -17.045 7.770 1.966 1.00 0.49 O ATOM 92 CB LEU A 7 -15.025 8.884 -0.233 1.00 0.52 C ATOM 93 CG LEU A 7 -15.519 10.217 0.333 1.00 0.80 C ATOM 94 CD1 LEU A 7 -15.298 10.269 1.833 1.00 1.73 C ATOM 95 CD2 LEU A 7 -14.825 11.382 -0.356 1.00 1.08 C ATOM 0 HA LEU A 7 -15.645 6.919 -0.832 1.00 0.51 H new ATOM 0 HB2 LEU A 7 -14.149 8.571 0.336 1.00 0.52 H new ATOM 0 HB3 LEU A 7 -14.697 9.046 -1.260 1.00 0.52 H new ATOM 0 HG LEU A 7 -16.589 10.299 0.141 1.00 0.80 H new ATOM 0 HD11 LEU A 7 -15.655 11.223 2.220 1.00 1.73 H new ATOM 0 HD12 LEU A 7 -15.846 9.456 2.310 1.00 1.73 H new ATOM 0 HD13 LEU A 7 -14.234 10.165 2.048 1.00 1.73 H new ATOM 0 HD21 LEU A 7 -15.190 12.321 0.061 1.00 1.08 H new ATOM 0 HD22 LEU A 7 -13.749 11.309 -0.198 1.00 1.08 H new ATOM 0 HD23 LEU A 7 -15.038 11.352 -1.425 1.00 1.08 H new ATOM 107 N ILE A 8 -15.611 6.103 1.493 1.00 0.43 N ATOM 108 CA ILE A 8 -15.627 5.559 2.827 1.00 0.40 C ATOM 109 C ILE A 8 -14.753 6.411 3.697 1.00 0.40 C ATOM 110 O ILE A 8 -13.676 6.823 3.271 1.00 0.62 O ATOM 111 CB ILE A 8 -15.142 4.085 2.853 1.00 0.41 C ATOM 112 CG1 ILE A 8 -16.333 3.141 2.681 1.00 0.48 C ATOM 113 CG2 ILE A 8 -14.344 3.747 4.126 1.00 0.67 C ATOM 114 CD1 ILE A 8 -15.935 1.691 2.539 1.00 0.47 C ATOM 0 H ILE A 8 -15.056 5.567 0.826 1.00 0.43 H new ATOM 0 HA ILE A 8 -16.652 5.563 3.199 1.00 0.40 H new ATOM 0 HB ILE A 8 -14.455 3.950 2.017 1.00 0.41 H new ATOM 0 HG12 ILE A 8 -16.996 3.245 3.540 1.00 0.48 H new ATOM 0 HG13 ILE A 8 -16.901 3.442 1.801 1.00 0.48 H new ATOM 0 HG21 ILE A 8 -14.029 2.704 4.092 1.00 0.67 H new ATOM 0 HG22 ILE A 8 -13.465 4.389 4.186 1.00 0.67 H new ATOM 0 HG23 ILE A 8 -14.972 3.908 5.002 1.00 0.67 H new ATOM 0 HD11 ILE A 8 -16.829 1.078 2.421 1.00 0.47 H new ATOM 0 HD12 ILE A 8 -15.296 1.573 1.664 1.00 0.47 H new ATOM 0 HD13 ILE A 8 -15.393 1.374 3.430 1.00 0.47 H new ATOM 126 N PRO A 9 -15.249 6.659 4.917 1.00 0.31 N ATOM 127 CA PRO A 9 -14.605 7.402 5.985 1.00 0.28 C ATOM 128 C PRO A 9 -13.138 7.708 5.734 1.00 0.32 C ATOM 129 O PRO A 9 -12.261 7.032 6.263 1.00 0.38 O ATOM 130 CB PRO A 9 -14.787 6.366 7.079 1.00 0.31 C ATOM 131 CG PRO A 9 -16.181 5.852 6.861 1.00 0.35 C ATOM 132 CD PRO A 9 -16.515 6.133 5.416 1.00 0.35 C ATOM 0 HA PRO A 9 -15.008 8.398 6.166 1.00 0.28 H new ATOM 0 HB2 PRO A 9 -14.050 5.567 7.000 1.00 0.31 H new ATOM 0 HB3 PRO A 9 -14.674 6.807 8.069 1.00 0.31 H new ATOM 0 HG2 PRO A 9 -16.239 4.784 7.073 1.00 0.35 H new ATOM 0 HG3 PRO A 9 -16.887 6.348 7.527 1.00 0.35 H new ATOM 0 HD2 PRO A 9 -16.822 5.232 4.884 1.00 0.35 H new ATOM 0 HD3 PRO A 9 -17.326 6.854 5.316 1.00 0.35 H new ATOM 140 N ALA A 10 -12.889 8.741 4.933 1.00 0.36 N ATOM 141 CA ALA A 10 -11.560 9.015 4.413 1.00 0.44 C ATOM 142 C ALA A 10 -10.730 9.841 5.396 1.00 0.42 C ATOM 143 O ALA A 10 -10.969 11.039 5.570 1.00 0.53 O ATOM 144 CB ALA A 10 -11.662 9.723 3.062 1.00 0.62 C ATOM 0 H ALA A 10 -13.601 9.406 4.630 1.00 0.36 H new ATOM 0 HA ALA A 10 -11.048 8.063 4.276 1.00 0.44 H new ATOM 0 HB1 ALA A 10 -10.661 9.924 2.680 1.00 0.62 H new ATOM 0 HB2 ALA A 10 -12.198 9.087 2.358 1.00 0.62 H new ATOM 0 HB3 ALA A 10 -12.200 10.663 3.184 1.00 0.62 H new ATOM 150 N PRO A 11 -9.755 9.199 6.056 1.00 0.35 N ATOM 151 CA PRO A 11 -8.834 9.836 6.983 1.00 0.35 C ATOM 152 C PRO A 11 -7.615 10.383 6.252 1.00 0.39 C ATOM 153 O PRO A 11 -7.173 9.814 5.256 1.00 0.45 O ATOM 154 CB PRO A 11 -8.427 8.680 7.929 1.00 0.35 C ATOM 155 CG PRO A 11 -9.070 7.451 7.372 1.00 0.41 C ATOM 156 CD PRO A 11 -9.460 7.780 5.963 1.00 0.38 C ATOM 0 HA PRO A 11 -9.276 10.685 7.504 1.00 0.35 H new ATOM 0 HB2 PRO A 11 -7.343 8.570 7.968 1.00 0.35 H new ATOM 0 HB3 PRO A 11 -8.765 8.871 8.947 1.00 0.35 H new ATOM 0 HG2 PRO A 11 -8.381 6.607 7.397 1.00 0.41 H new ATOM 0 HG3 PRO A 11 -9.943 7.168 7.961 1.00 0.41 H new ATOM 0 HD2 PRO A 11 -8.654 7.576 5.258 1.00 0.38 H new ATOM 0 HD3 PRO A 11 -10.325 7.204 5.634 1.00 0.38 H new ATOM 164 N PRO A 12 -7.082 11.516 6.708 1.00 0.42 N ATOM 165 CA PRO A 12 -5.862 12.088 6.158 1.00 0.46 C ATOM 166 C PRO A 12 -4.617 11.343 6.623 1.00 0.44 C ATOM 167 O PRO A 12 -4.684 10.547 7.561 1.00 0.41 O ATOM 168 CB PRO A 12 -5.843 13.532 6.681 1.00 0.50 C ATOM 169 CG PRO A 12 -7.148 13.723 7.396 1.00 0.55 C ATOM 170 CD PRO A 12 -7.631 12.352 7.777 1.00 0.48 C ATOM 0 HA PRO A 12 -5.853 12.026 5.070 1.00 0.46 H new ATOM 0 HB2 PRO A 12 -5.001 13.693 7.354 1.00 0.50 H new ATOM 0 HB3 PRO A 12 -5.738 14.244 5.862 1.00 0.50 H new ATOM 0 HG2 PRO A 12 -7.018 14.348 8.280 1.00 0.55 H new ATOM 0 HG3 PRO A 12 -7.872 14.225 6.754 1.00 0.55 H new ATOM 0 HD2 PRO A 12 -7.264 12.050 8.758 1.00 0.48 H new ATOM 0 HD3 PRO A 12 -8.719 12.301 7.814 1.00 0.48 H new ATOM 178 N LEU A 13 -3.498 11.609 5.967 1.00 0.50 N ATOM 179 CA LEU A 13 -2.206 11.008 6.304 1.00 0.51 C ATOM 180 C LEU A 13 -1.985 10.993 7.812 1.00 0.49 C ATOM 181 O LEU A 13 -1.567 9.996 8.381 1.00 0.48 O ATOM 182 CB LEU A 13 -1.123 11.875 5.651 1.00 0.61 C ATOM 183 CG LEU A 13 0.304 11.305 5.567 1.00 0.60 C ATOM 184 CD1 LEU A 13 0.902 11.105 6.943 1.00 0.50 C ATOM 185 CD2 LEU A 13 0.333 9.999 4.786 1.00 0.74 C ATOM 0 H LEU A 13 -3.455 12.253 5.178 1.00 0.50 H new ATOM 0 HA LEU A 13 -2.173 9.978 5.949 1.00 0.51 H new ATOM 0 HB2 LEU A 13 -1.449 12.110 4.638 1.00 0.61 H new ATOM 0 HB3 LEU A 13 -1.075 12.817 6.197 1.00 0.61 H new ATOM 0 HG LEU A 13 0.910 12.038 5.035 1.00 0.60 H new ATOM 0 HD11 LEU A 13 1.910 10.701 6.847 1.00 0.50 H new ATOM 0 HD12 LEU A 13 0.942 12.061 7.465 1.00 0.50 H new ATOM 0 HD13 LEU A 13 0.285 10.408 7.510 1.00 0.50 H new ATOM 0 HD21 LEU A 13 1.355 9.622 4.745 1.00 0.74 H new ATOM 0 HD22 LEU A 13 -0.304 9.266 5.280 1.00 0.74 H new ATOM 0 HD23 LEU A 13 -0.031 10.173 3.773 1.00 0.74 H new ATOM 197 N ILE A 14 -2.308 12.093 8.450 1.00 0.52 N ATOM 198 CA ILE A 14 -1.981 12.300 9.853 1.00 0.56 C ATOM 199 C ILE A 14 -2.703 11.301 10.777 1.00 0.54 C ATOM 200 O ILE A 14 -2.469 11.276 11.985 1.00 0.61 O ATOM 201 CB ILE A 14 -2.289 13.762 10.254 1.00 0.66 C ATOM 202 CG1 ILE A 14 -3.688 13.922 10.876 1.00 0.79 C ATOM 203 CG2 ILE A 14 -2.153 14.654 9.017 1.00 0.65 C ATOM 204 CD1 ILE A 14 -4.834 13.706 9.916 1.00 1.05 C ATOM 0 H ILE A 14 -2.804 12.872 8.018 1.00 0.52 H new ATOM 0 HA ILE A 14 -0.914 12.115 9.978 1.00 0.56 H new ATOM 0 HB ILE A 14 -1.572 14.060 11.019 1.00 0.66 H new ATOM 0 HG12 ILE A 14 -3.786 13.218 11.702 1.00 0.79 H new ATOM 0 HG13 ILE A 14 -3.770 14.923 11.299 1.00 0.79 H new ATOM 0 HG21 ILE A 14 -2.368 15.688 9.288 1.00 0.65 H new ATOM 0 HG22 ILE A 14 -1.137 14.585 8.628 1.00 0.65 H new ATOM 0 HG23 ILE A 14 -2.857 14.326 8.252 1.00 0.65 H new ATOM 0 HD11 ILE A 14 -5.779 13.839 10.442 1.00 1.05 H new ATOM 0 HD12 ILE A 14 -4.767 14.427 9.102 1.00 1.05 H new ATOM 0 HD13 ILE A 14 -4.784 12.695 9.511 1.00 1.05 H new ATOM 216 N SER A 15 -3.573 10.480 10.195 1.00 0.46 N ATOM 217 CA SER A 15 -4.244 9.410 10.922 1.00 0.46 C ATOM 218 C SER A 15 -3.357 8.168 11.012 1.00 0.46 C ATOM 219 O SER A 15 -3.585 7.289 11.844 1.00 0.51 O ATOM 220 CB SER A 15 -5.565 9.067 10.231 1.00 0.42 C ATOM 221 OG SER A 15 -6.499 10.126 10.374 1.00 0.92 O ATOM 0 H SER A 15 -3.831 10.538 9.210 1.00 0.46 H new ATOM 0 HA SER A 15 -4.445 9.754 11.936 1.00 0.46 H new ATOM 0 HB2 SER A 15 -5.388 8.873 9.173 1.00 0.42 H new ATOM 0 HB3 SER A 15 -5.977 8.153 10.658 1.00 0.42 H new ATOM 0 HG SER A 15 -7.409 9.761 10.379 1.00 0.92 H new ATOM 227 N VAL A 16 -2.346 8.101 10.156 1.00 0.43 N ATOM 228 CA VAL A 16 -1.429 6.974 10.151 1.00 0.43 C ATOM 229 C VAL A 16 -0.086 7.371 10.772 1.00 0.45 C ATOM 230 O VAL A 16 0.432 8.459 10.515 1.00 0.50 O ATOM 231 CB VAL A 16 -1.215 6.410 8.717 1.00 0.45 C ATOM 232 CG1 VAL A 16 -0.524 7.410 7.791 1.00 0.54 C ATOM 233 CG2 VAL A 16 -0.429 5.107 8.770 1.00 0.45 C ATOM 0 H VAL A 16 -2.142 8.815 9.457 1.00 0.43 H new ATOM 0 HA VAL A 16 -1.879 6.185 10.753 1.00 0.43 H new ATOM 0 HB VAL A 16 -2.204 6.218 8.300 1.00 0.45 H new ATOM 0 HG11 VAL A 16 -0.399 6.966 6.804 1.00 0.54 H new ATOM 0 HG12 VAL A 16 -1.132 8.311 7.709 1.00 0.54 H new ATOM 0 HG13 VAL A 16 0.453 7.668 8.199 1.00 0.54 H new ATOM 0 HG21 VAL A 16 -0.288 4.726 7.759 1.00 0.45 H new ATOM 0 HG22 VAL A 16 0.543 5.287 9.229 1.00 0.45 H new ATOM 0 HG23 VAL A 16 -0.979 4.374 9.361 1.00 0.45 H new ATOM 243 N PRO A 17 0.463 6.511 11.648 1.00 0.46 N ATOM 244 CA PRO A 17 1.781 6.725 12.264 1.00 0.50 C ATOM 245 C PRO A 17 2.919 6.676 11.245 1.00 0.43 C ATOM 246 O PRO A 17 2.764 6.134 10.151 1.00 0.48 O ATOM 247 CB PRO A 17 1.914 5.563 13.258 1.00 0.59 C ATOM 248 CG PRO A 17 0.530 5.042 13.440 1.00 0.53 C ATOM 249 CD PRO A 17 -0.167 5.277 12.134 1.00 0.50 C ATOM 0 HA PRO A 17 1.850 7.710 12.726 1.00 0.50 H new ATOM 0 HB2 PRO A 17 2.578 4.789 12.872 1.00 0.59 H new ATOM 0 HB3 PRO A 17 2.335 5.901 14.205 1.00 0.59 H new ATOM 0 HG2 PRO A 17 0.541 3.982 13.693 1.00 0.53 H new ATOM 0 HG3 PRO A 17 0.021 5.558 14.254 1.00 0.53 H new ATOM 0 HD2 PRO A 17 -0.020 4.448 11.442 1.00 0.50 H new ATOM 0 HD3 PRO A 17 -1.243 5.396 12.265 1.00 0.50 H new ATOM 257 N LEU A 18 4.052 7.257 11.617 1.00 0.42 N ATOM 258 CA LEU A 18 5.239 7.282 10.770 1.00 0.38 C ATOM 259 C LEU A 18 6.311 6.360 11.347 1.00 0.33 C ATOM 260 O LEU A 18 6.389 6.189 12.562 1.00 0.35 O ATOM 261 CB LEU A 18 5.773 8.720 10.694 1.00 0.46 C ATOM 262 CG LEU A 18 7.056 8.921 9.879 1.00 0.63 C ATOM 263 CD1 LEU A 18 6.781 8.788 8.390 1.00 1.15 C ATOM 264 CD2 LEU A 18 7.674 10.279 10.187 1.00 1.07 C ATOM 0 H LEU A 18 4.175 7.725 12.515 1.00 0.42 H new ATOM 0 HA LEU A 18 4.980 6.935 9.770 1.00 0.38 H new ATOM 0 HB2 LEU A 18 4.994 9.353 10.269 1.00 0.46 H new ATOM 0 HB3 LEU A 18 5.953 9.073 11.709 1.00 0.46 H new ATOM 0 HG LEU A 18 7.764 8.143 10.163 1.00 0.63 H new ATOM 0 HD11 LEU A 18 7.707 8.935 7.834 1.00 1.15 H new ATOM 0 HD12 LEU A 18 6.386 7.794 8.180 1.00 1.15 H new ATOM 0 HD13 LEU A 18 6.052 9.540 8.086 1.00 1.15 H new ATOM 0 HD21 LEU A 18 8.584 10.406 9.600 1.00 1.07 H new ATOM 0 HD22 LEU A 18 6.965 11.067 9.933 1.00 1.07 H new ATOM 0 HD23 LEU A 18 7.916 10.337 11.248 1.00 1.07 H new ATOM 276 N GLN A 19 7.122 5.762 10.475 1.00 0.36 N ATOM 277 CA GLN A 19 8.255 4.942 10.905 1.00 0.47 C ATOM 278 C GLN A 19 9.361 5.865 11.445 1.00 0.62 C ATOM 279 O GLN A 19 10.009 6.573 10.675 1.00 0.68 O ATOM 280 CB GLN A 19 8.784 4.111 9.712 1.00 0.49 C ATOM 281 CG GLN A 19 9.546 2.839 10.082 1.00 1.04 C ATOM 282 CD GLN A 19 10.743 3.074 10.978 1.00 2.08 C ATOM 283 OE1 GLN A 19 11.825 3.421 10.506 1.00 2.68 O ATOM 284 NE2 GLN A 19 10.579 2.809 12.264 1.00 2.93 N ATOM 0 H GLN A 19 7.015 5.830 9.463 1.00 0.36 H new ATOM 0 HA GLN A 19 7.940 4.256 11.691 1.00 0.47 H new ATOM 0 HB2 GLN A 19 7.939 3.837 9.080 1.00 0.49 H new ATOM 0 HB3 GLN A 19 9.438 4.744 9.113 1.00 0.49 H new ATOM 0 HG2 GLN A 19 8.863 2.151 10.580 1.00 1.04 H new ATOM 0 HG3 GLN A 19 9.881 2.350 9.167 1.00 1.04 H new ATOM 0 HE21 GLN A 19 9.664 2.524 12.613 1.00 2.93 H new ATOM 0 HE22 GLN A 19 11.368 2.889 12.906 1.00 2.93 H new ATOM 293 N PRO A 20 9.581 5.886 12.774 1.00 0.92 N ATOM 294 CA PRO A 20 10.580 6.766 13.392 1.00 1.20 C ATOM 295 C PRO A 20 12.008 6.351 13.052 1.00 1.19 C ATOM 296 O PRO A 20 12.360 5.172 13.130 1.00 1.36 O ATOM 297 CB PRO A 20 10.320 6.612 14.891 1.00 1.58 C ATOM 298 CG PRO A 20 9.674 5.278 15.034 1.00 1.65 C ATOM 299 CD PRO A 20 8.881 5.059 13.774 1.00 1.15 C ATOM 0 HA PRO A 20 10.490 7.793 13.037 1.00 1.20 H new ATOM 0 HB2 PRO A 20 11.248 6.664 15.460 1.00 1.58 H new ATOM 0 HB3 PRO A 20 9.673 7.406 15.263 1.00 1.58 H new ATOM 0 HG2 PRO A 20 10.421 4.495 15.165 1.00 1.65 H new ATOM 0 HG3 PRO A 20 9.027 5.251 15.911 1.00 1.65 H new ATOM 0 HD2 PRO A 20 8.868 4.008 13.486 1.00 1.15 H new ATOM 0 HD3 PRO A 20 7.843 5.369 13.895 1.00 1.15 H new ATOM 307 N GLY A 21 12.835 7.327 12.696 1.00 1.32 N ATOM 308 CA GLY A 21 14.190 7.031 12.278 1.00 1.38 C ATOM 309 C GLY A 21 14.220 6.382 10.914 1.00 1.06 C ATOM 310 O GLY A 21 15.030 5.496 10.651 1.00 1.29 O ATOM 0 H GLY A 21 12.590 8.317 12.690 1.00 1.32 H new ATOM 0 HA2 GLY A 21 14.774 7.951 12.257 1.00 1.38 H new ATOM 0 HA3 GLY A 21 14.660 6.371 13.007 1.00 1.38 H new ATOM 314 N PHE A 22 13.316 6.820 10.055 1.00 0.69 N ATOM 315 CA PHE A 22 13.197 6.276 8.714 1.00 0.51 C ATOM 316 C PHE A 22 14.341 6.758 7.826 1.00 0.51 C ATOM 317 O PHE A 22 14.763 7.915 7.904 1.00 0.68 O ATOM 318 CB PHE A 22 11.845 6.681 8.114 1.00 0.71 C ATOM 319 CG PHE A 22 11.624 6.198 6.709 1.00 1.19 C ATOM 320 CD1 PHE A 22 12.044 6.961 5.631 1.00 2.08 C ATOM 321 CD2 PHE A 22 10.991 4.992 6.463 1.00 0.91 C ATOM 322 CE1 PHE A 22 11.843 6.533 4.339 1.00 2.66 C ATOM 323 CE2 PHE A 22 10.786 4.561 5.173 1.00 1.43 C ATOM 324 CZ PHE A 22 11.213 5.331 4.109 1.00 2.32 C ATOM 0 H PHE A 22 12.646 7.560 10.266 1.00 0.69 H new ATOM 0 HA PHE A 22 13.254 5.189 8.770 1.00 0.51 H new ATOM 0 HB2 PHE A 22 11.048 6.294 8.749 1.00 0.71 H new ATOM 0 HB3 PHE A 22 11.765 7.768 8.129 1.00 0.71 H new ATOM 0 HD1 PHE A 22 12.536 7.906 5.808 1.00 2.08 H new ATOM 0 HD2 PHE A 22 10.655 4.385 7.291 1.00 0.91 H new ATOM 0 HE1 PHE A 22 12.178 7.137 3.509 1.00 2.66 H new ATOM 0 HE2 PHE A 22 10.290 3.619 4.992 1.00 1.43 H new ATOM 0 HZ PHE A 22 11.053 4.990 3.097 1.00 2.32 H new ATOM 334 N TRP A 23 14.826 5.861 6.979 1.00 0.48 N ATOM 335 CA TRP A 23 15.894 6.174 6.041 1.00 0.57 C ATOM 336 C TRP A 23 15.474 5.763 4.640 1.00 0.50 C ATOM 337 O TRP A 23 14.592 4.921 4.490 1.00 0.51 O ATOM 338 CB TRP A 23 17.189 5.444 6.410 1.00 0.78 C ATOM 339 CG TRP A 23 17.681 5.730 7.794 1.00 1.35 C ATOM 340 CD1 TRP A 23 18.118 6.928 8.278 1.00 2.36 C ATOM 341 CD2 TRP A 23 17.802 4.792 8.868 1.00 2.01 C ATOM 342 NE1 TRP A 23 18.493 6.795 9.592 1.00 3.05 N ATOM 343 CE2 TRP A 23 18.309 5.493 9.977 1.00 2.82 C ATOM 344 CE3 TRP A 23 17.523 3.428 9.001 1.00 2.70 C ATOM 345 CZ2 TRP A 23 18.549 4.874 11.200 1.00 3.70 C ATOM 346 CZ3 TRP A 23 17.763 2.816 10.216 1.00 3.72 C ATOM 347 CH2 TRP A 23 18.268 3.539 11.301 1.00 4.03 C ATOM 0 H TRP A 23 14.491 4.899 6.923 1.00 0.48 H new ATOM 0 HA TRP A 23 16.078 7.248 6.082 1.00 0.57 H new ATOM 0 HB2 TRP A 23 17.030 4.371 6.308 1.00 0.78 H new ATOM 0 HB3 TRP A 23 17.965 5.721 5.696 1.00 0.78 H new ATOM 0 HD1 TRP A 23 18.162 7.846 7.711 1.00 2.36 H new ATOM 0 HE1 TRP A 23 18.850 7.544 10.185 1.00 3.05 H new ATOM 0 HE3 TRP A 23 17.127 2.864 8.169 1.00 2.70 H new ATOM 0 HZ2 TRP A 23 18.943 5.428 12.039 1.00 3.70 H new ATOM 0 HZ3 TRP A 23 17.557 1.762 10.330 1.00 3.72 H new ATOM 0 HH2 TRP A 23 18.440 3.032 12.239 1.00 4.03 H new ATOM 358 N THR A 24 16.092 6.346 3.624 1.00 0.50 N ATOM 359 CA THR A 24 15.789 5.986 2.244 1.00 0.47 C ATOM 360 C THR A 24 15.924 4.482 2.022 1.00 0.46 C ATOM 361 O THR A 24 14.967 3.809 1.636 1.00 0.48 O ATOM 362 CB THR A 24 16.727 6.715 1.272 1.00 0.50 C ATOM 363 OG1 THR A 24 17.982 6.982 1.912 1.00 0.58 O ATOM 364 CG2 THR A 24 16.109 8.009 0.780 1.00 0.53 C ATOM 0 H THR A 24 16.805 7.069 3.727 1.00 0.50 H new ATOM 0 HA THR A 24 14.758 6.285 2.053 1.00 0.47 H new ATOM 0 HB THR A 24 16.891 6.070 0.409 1.00 0.50 H new ATOM 0 HG1 THR A 24 17.950 7.863 2.340 1.00 0.58 H new ATOM 0 HG21 THR A 24 16.797 8.503 0.093 1.00 0.53 H new ATOM 0 HG22 THR A 24 15.174 7.792 0.264 1.00 0.53 H new ATOM 0 HG23 THR A 24 15.911 8.664 1.629 1.00 0.53 H new ATOM 372 N GLU A 25 17.110 3.957 2.316 1.00 0.53 N ATOM 373 CA GLU A 25 17.423 2.560 2.049 1.00 0.60 C ATOM 374 C GLU A 25 16.666 1.636 3.004 1.00 0.60 C ATOM 375 O GLU A 25 16.578 0.428 2.780 1.00 0.63 O ATOM 376 CB GLU A 25 18.932 2.338 2.165 1.00 0.71 C ATOM 377 CG GLU A 25 19.421 1.051 1.521 1.00 1.31 C ATOM 378 CD GLU A 25 20.925 0.912 1.590 1.00 1.63 C ATOM 379 OE1 GLU A 25 21.618 1.515 0.746 1.00 1.94 O ATOM 380 OE2 GLU A 25 21.418 0.187 2.482 1.00 1.88 O ATOM 0 H GLU A 25 17.873 4.483 2.742 1.00 0.53 H new ATOM 0 HA GLU A 25 17.105 2.319 1.035 1.00 0.60 H new ATOM 0 HB2 GLU A 25 19.449 3.181 1.706 1.00 0.71 H new ATOM 0 HB3 GLU A 25 19.208 2.332 3.220 1.00 0.71 H new ATOM 0 HG2 GLU A 25 18.956 0.199 2.017 1.00 1.31 H new ATOM 0 HG3 GLU A 25 19.103 1.025 0.479 1.00 1.31 H new ATOM 387 N ARG A 26 16.120 2.218 4.069 1.00 0.64 N ATOM 388 CA ARG A 26 15.290 1.483 5.021 1.00 0.76 C ATOM 389 C ARG A 26 14.072 0.907 4.309 1.00 0.71 C ATOM 390 O ARG A 26 13.610 -0.189 4.620 1.00 0.87 O ATOM 391 CB ARG A 26 14.842 2.423 6.149 1.00 0.96 C ATOM 392 CG ARG A 26 13.834 1.824 7.124 1.00 1.62 C ATOM 393 CD ARG A 26 14.494 0.924 8.156 1.00 2.07 C ATOM 394 NE ARG A 26 15.082 -0.275 7.565 1.00 2.61 N ATOM 395 CZ ARG A 26 15.015 -1.481 8.118 1.00 3.42 C ATOM 396 NH1 ARG A 26 14.371 -1.656 9.266 1.00 3.88 N ATOM 397 NH2 ARG A 26 15.598 -2.508 7.517 1.00 4.18 N ATOM 0 H ARG A 26 16.239 3.205 4.296 1.00 0.64 H new ATOM 0 HA ARG A 26 15.871 0.665 5.447 1.00 0.76 H new ATOM 0 HB2 ARG A 26 15.722 2.740 6.709 1.00 0.96 H new ATOM 0 HB3 ARG A 26 14.407 3.318 5.705 1.00 0.96 H new ATOM 0 HG2 ARG A 26 13.303 2.628 7.633 1.00 1.62 H new ATOM 0 HG3 ARG A 26 13.091 1.252 6.569 1.00 1.62 H new ATOM 0 HD2 ARG A 26 15.270 1.485 8.678 1.00 2.07 H new ATOM 0 HD3 ARG A 26 13.755 0.631 8.902 1.00 2.07 H new ATOM 0 HE ARG A 26 15.573 -0.181 6.676 1.00 2.61 H new ATOM 0 HH11 ARG A 26 13.925 -0.863 9.727 1.00 3.88 H new ATOM 0 HH12 ARG A 26 14.322 -2.584 9.687 1.00 3.88 H new ATOM 0 HH21 ARG A 26 16.094 -2.369 6.636 1.00 4.18 H new ATOM 0 HH22 ARG A 26 15.551 -3.437 7.935 1.00 4.18 H new ATOM 411 N PHE A 27 13.584 1.656 3.336 1.00 0.59 N ATOM 412 CA PHE A 27 12.404 1.278 2.580 1.00 0.61 C ATOM 413 C PHE A 27 12.820 0.886 1.162 1.00 0.51 C ATOM 414 O PHE A 27 12.259 1.369 0.183 1.00 0.72 O ATOM 415 CB PHE A 27 11.442 2.468 2.546 1.00 0.71 C ATOM 416 CG PHE A 27 9.977 2.124 2.597 1.00 1.11 C ATOM 417 CD1 PHE A 27 9.317 2.001 3.816 1.00 0.95 C ATOM 418 CD2 PHE A 27 9.251 1.957 1.431 1.00 1.74 C ATOM 419 CE1 PHE A 27 7.968 1.720 3.862 1.00 1.39 C ATOM 420 CE2 PHE A 27 7.900 1.669 1.474 1.00 2.21 C ATOM 421 CZ PHE A 27 7.259 1.552 2.691 1.00 2.03 C ATOM 0 H PHE A 27 13.995 2.544 3.048 1.00 0.59 H new ATOM 0 HA PHE A 27 11.907 0.427 3.047 1.00 0.61 H new ATOM 0 HB2 PHE A 27 11.672 3.122 3.387 1.00 0.71 H new ATOM 0 HB3 PHE A 27 11.631 3.039 1.637 1.00 0.71 H new ATOM 0 HD1 PHE A 27 9.868 2.127 4.736 1.00 0.95 H new ATOM 0 HD2 PHE A 27 9.746 2.053 0.476 1.00 1.74 H new ATOM 0 HE1 PHE A 27 7.467 1.631 4.815 1.00 1.39 H new ATOM 0 HE2 PHE A 27 7.346 1.536 0.556 1.00 2.21 H new ATOM 0 HZ PHE A 27 6.203 1.329 2.726 1.00 2.03 H new ATOM 431 N GLN A 28 13.830 0.027 1.057 1.00 0.40 N ATOM 432 CA GLN A 28 14.355 -0.374 -0.244 1.00 0.31 C ATOM 433 C GLN A 28 14.426 -1.894 -0.356 1.00 0.30 C ATOM 434 O GLN A 28 14.808 -2.587 0.592 1.00 0.37 O ATOM 435 CB GLN A 28 15.743 0.243 -0.454 1.00 0.28 C ATOM 436 CG GLN A 28 16.228 0.276 -1.901 1.00 0.45 C ATOM 437 CD GLN A 28 17.023 -0.954 -2.303 1.00 0.77 C ATOM 438 OE1 GLN A 28 16.480 -1.925 -2.821 1.00 1.73 O ATOM 439 NE2 GLN A 28 18.322 -0.918 -2.064 1.00 1.23 N ATOM 0 H GLN A 28 14.299 -0.403 1.854 1.00 0.40 H new ATOM 0 HA GLN A 28 13.681 -0.011 -1.020 1.00 0.31 H new ATOM 0 HB2 GLN A 28 15.732 1.262 -0.068 1.00 0.28 H new ATOM 0 HB3 GLN A 28 16.465 -0.315 0.142 1.00 0.28 H new ATOM 0 HG2 GLN A 28 15.367 0.374 -2.562 1.00 0.45 H new ATOM 0 HG3 GLN A 28 16.846 1.162 -2.048 1.00 0.45 H new ATOM 0 HE21 GLN A 28 18.738 -0.093 -1.632 1.00 1.23 H new ATOM 0 HE22 GLN A 28 18.908 -1.715 -2.312 1.00 1.23 H new ATOM 448 N GLY A 29 14.061 -2.400 -1.519 1.00 0.29 N ATOM 449 CA GLY A 29 14.129 -3.822 -1.777 1.00 0.32 C ATOM 450 C GLY A 29 12.786 -4.422 -2.124 1.00 0.30 C ATOM 451 O GLY A 29 11.818 -3.701 -2.382 1.00 0.28 O ATOM 0 H GLY A 29 13.714 -1.844 -2.300 1.00 0.29 H new ATOM 0 HA2 GLY A 29 14.825 -4.005 -2.596 1.00 0.32 H new ATOM 0 HA3 GLY A 29 14.531 -4.327 -0.898 1.00 0.32 H new ATOM 455 N ARG A 30 12.735 -5.747 -2.130 1.00 0.35 N ATOM 456 CA ARG A 30 11.522 -6.471 -2.477 1.00 0.36 C ATOM 457 C ARG A 30 10.692 -6.742 -1.232 1.00 0.39 C ATOM 458 O ARG A 30 11.175 -7.361 -0.284 1.00 0.51 O ATOM 459 CB ARG A 30 11.847 -7.817 -3.143 1.00 0.46 C ATOM 460 CG ARG A 30 12.349 -7.730 -4.578 1.00 0.51 C ATOM 461 CD ARG A 30 13.736 -7.109 -4.681 1.00 0.66 C ATOM 462 NE ARG A 30 14.759 -7.916 -4.015 1.00 1.20 N ATOM 463 CZ ARG A 30 16.061 -7.633 -4.045 1.00 1.70 C ATOM 464 NH1 ARG A 30 16.507 -6.588 -4.733 1.00 1.65 N ATOM 465 NH2 ARG A 30 16.925 -8.408 -3.403 1.00 2.57 N ATOM 0 H ARG A 30 13.527 -6.346 -1.896 1.00 0.35 H new ATOM 0 HA ARG A 30 10.963 -5.848 -3.175 1.00 0.36 H new ATOM 0 HB2 ARG A 30 12.600 -8.328 -2.543 1.00 0.46 H new ATOM 0 HB3 ARG A 30 10.951 -8.437 -3.126 1.00 0.46 H new ATOM 0 HG2 ARG A 30 12.370 -8.730 -5.012 1.00 0.51 H new ATOM 0 HG3 ARG A 30 11.647 -7.141 -5.169 1.00 0.51 H new ATOM 0 HD2 ARG A 30 14.000 -6.988 -5.732 1.00 0.66 H new ATOM 0 HD3 ARG A 30 13.719 -6.113 -4.240 1.00 0.66 H new ATOM 0 HE ARG A 30 14.458 -8.742 -3.498 1.00 1.20 H new ATOM 0 HH11 ARG A 30 15.852 -5.996 -5.243 1.00 1.65 H new ATOM 0 HH12 ARG A 30 17.505 -6.378 -4.751 1.00 1.65 H new ATOM 0 HH21 ARG A 30 16.593 -9.222 -2.885 1.00 2.57 H new ATOM 0 HH22 ARG A 30 17.921 -8.190 -3.427 1.00 2.57 H new ATOM 479 N TRP A 31 9.456 -6.272 -1.224 1.00 0.34 N ATOM 480 CA TRP A 31 8.532 -6.619 -0.155 1.00 0.42 C ATOM 481 C TRP A 31 7.216 -7.140 -0.729 1.00 0.34 C ATOM 482 O TRP A 31 6.710 -6.621 -1.728 1.00 0.34 O ATOM 483 CB TRP A 31 8.297 -5.427 0.771 1.00 0.55 C ATOM 484 CG TRP A 31 9.231 -5.388 1.949 1.00 0.85 C ATOM 485 CD1 TRP A 31 9.176 -6.187 3.055 1.00 1.94 C ATOM 486 CD2 TRP A 31 10.339 -4.502 2.152 1.00 0.74 C ATOM 487 NE1 TRP A 31 10.178 -5.853 3.931 1.00 1.91 N ATOM 488 CE2 TRP A 31 10.907 -4.824 3.399 1.00 0.91 C ATOM 489 CE3 TRP A 31 10.908 -3.472 1.404 1.00 1.79 C ATOM 490 CZ2 TRP A 31 12.012 -4.147 3.913 1.00 0.90 C ATOM 491 CZ3 TRP A 31 12.003 -2.802 1.913 1.00 2.36 C ATOM 492 CH2 TRP A 31 12.547 -3.143 3.156 1.00 1.70 C ATOM 0 H TRP A 31 9.071 -5.654 -1.938 1.00 0.34 H new ATOM 0 HA TRP A 31 8.980 -7.416 0.438 1.00 0.42 H new ATOM 0 HB2 TRP A 31 8.408 -4.506 0.199 1.00 0.55 H new ATOM 0 HB3 TRP A 31 7.269 -5.456 1.133 1.00 0.55 H new ATOM 0 HD1 TRP A 31 8.449 -6.969 3.217 1.00 1.94 H new ATOM 0 HE1 TRP A 31 10.351 -6.299 4.832 1.00 1.91 H new ATOM 0 HE3 TRP A 31 10.499 -3.202 0.442 1.00 1.79 H new ATOM 0 HZ2 TRP A 31 12.430 -4.407 4.874 1.00 0.90 H new ATOM 0 HZ3 TRP A 31 12.447 -2.001 1.341 1.00 2.36 H new ATOM 0 HH2 TRP A 31 13.406 -2.602 3.524 1.00 1.70 H new ATOM 503 N PHE A 32 6.681 -8.176 -0.097 1.00 0.31 N ATOM 504 CA PHE A 32 5.487 -8.857 -0.586 1.00 0.30 C ATOM 505 C PHE A 32 4.273 -8.514 0.262 1.00 0.29 C ATOM 506 O PHE A 32 4.353 -8.488 1.489 1.00 0.33 O ATOM 507 CB PHE A 32 5.700 -10.372 -0.568 1.00 0.38 C ATOM 508 CG PHE A 32 6.607 -10.881 -1.648 1.00 0.63 C ATOM 509 CD1 PHE A 32 7.986 -10.826 -1.511 1.00 1.10 C ATOM 510 CD2 PHE A 32 6.073 -11.425 -2.800 1.00 0.68 C ATOM 511 CE1 PHE A 32 8.812 -11.305 -2.509 1.00 1.62 C ATOM 512 CE2 PHE A 32 6.891 -11.908 -3.799 1.00 1.17 C ATOM 513 CZ PHE A 32 8.265 -11.849 -3.655 1.00 1.64 C ATOM 0 H PHE A 32 7.059 -8.568 0.765 1.00 0.31 H new ATOM 0 HA PHE A 32 5.308 -8.521 -1.607 1.00 0.30 H new ATOM 0 HB2 PHE A 32 6.111 -10.658 0.400 1.00 0.38 H new ATOM 0 HB3 PHE A 32 4.732 -10.864 -0.661 1.00 0.38 H new ATOM 0 HD1 PHE A 32 8.418 -10.405 -0.615 1.00 1.10 H new ATOM 0 HD2 PHE A 32 5.001 -11.473 -2.920 1.00 0.68 H new ATOM 0 HE1 PHE A 32 9.885 -11.254 -2.394 1.00 1.62 H new ATOM 0 HE2 PHE A 32 6.459 -12.332 -4.693 1.00 1.17 H new ATOM 0 HZ PHE A 32 8.908 -12.227 -4.436 1.00 1.64 H new ATOM 523 N VAL A 33 3.148 -8.266 -0.399 1.00 0.28 N ATOM 524 CA VAL A 33 1.904 -7.952 0.297 1.00 0.30 C ATOM 525 C VAL A 33 1.358 -9.187 1.001 1.00 0.31 C ATOM 526 O VAL A 33 1.465 -10.299 0.486 1.00 0.52 O ATOM 527 CB VAL A 33 0.817 -7.429 -0.664 1.00 0.34 C ATOM 528 CG1 VAL A 33 -0.316 -6.779 0.112 1.00 0.74 C ATOM 529 CG2 VAL A 33 1.399 -6.463 -1.676 1.00 0.74 C ATOM 0 H VAL A 33 3.071 -8.276 -1.416 1.00 0.28 H new ATOM 0 HA VAL A 33 2.143 -7.173 1.020 1.00 0.30 H new ATOM 0 HB VAL A 33 0.414 -8.281 -1.211 1.00 0.34 H new ATOM 0 HG11 VAL A 33 -1.073 -6.417 -0.584 1.00 0.74 H new ATOM 0 HG12 VAL A 33 -0.763 -7.511 0.785 1.00 0.74 H new ATOM 0 HG13 VAL A 33 0.073 -5.943 0.692 1.00 0.74 H new ATOM 0 HG21 VAL A 33 0.609 -6.111 -2.340 1.00 0.74 H new ATOM 0 HG22 VAL A 33 1.841 -5.613 -1.156 1.00 0.74 H new ATOM 0 HG23 VAL A 33 2.167 -6.969 -2.262 1.00 0.74 H new ATOM 539 N VAL A 34 0.762 -8.984 2.168 1.00 0.20 N ATOM 540 CA VAL A 34 0.169 -10.078 2.930 1.00 0.25 C ATOM 541 C VAL A 34 -1.305 -9.771 3.245 1.00 0.28 C ATOM 542 O VAL A 34 -2.082 -10.662 3.602 1.00 0.47 O ATOM 543 CB VAL A 34 0.956 -10.342 4.238 1.00 0.30 C ATOM 544 CG1 VAL A 34 0.382 -11.524 5.006 1.00 0.40 C ATOM 545 CG2 VAL A 34 2.426 -10.577 3.928 1.00 0.29 C ATOM 0 H VAL A 34 0.675 -8.069 2.610 1.00 0.20 H new ATOM 0 HA VAL A 34 0.220 -10.980 2.320 1.00 0.25 H new ATOM 0 HB VAL A 34 0.861 -9.458 4.869 1.00 0.30 H new ATOM 0 HG11 VAL A 34 0.959 -11.680 5.918 1.00 0.40 H new ATOM 0 HG12 VAL A 34 -0.657 -11.320 5.264 1.00 0.40 H new ATOM 0 HG13 VAL A 34 0.433 -12.420 4.387 1.00 0.40 H new ATOM 0 HG21 VAL A 34 2.968 -10.761 4.855 1.00 0.29 H new ATOM 0 HG22 VAL A 34 2.526 -11.441 3.271 1.00 0.29 H new ATOM 0 HG23 VAL A 34 2.839 -9.697 3.435 1.00 0.29 H new ATOM 555 N GLY A 35 -1.690 -8.508 3.086 1.00 0.19 N ATOM 556 CA GLY A 35 -3.073 -8.119 3.299 1.00 0.19 C ATOM 557 C GLY A 35 -3.383 -6.751 2.723 1.00 0.17 C ATOM 558 O GLY A 35 -2.470 -5.975 2.431 1.00 0.18 O ATOM 0 H GLY A 35 -1.069 -7.747 2.813 1.00 0.19 H new ATOM 0 HA2 GLY A 35 -3.730 -8.860 2.844 1.00 0.19 H new ATOM 0 HA3 GLY A 35 -3.287 -8.117 4.368 1.00 0.19 H new ATOM 562 N LEU A 36 -4.667 -6.441 2.579 1.00 0.17 N ATOM 563 CA LEU A 36 -5.089 -5.177 1.995 1.00 0.18 C ATOM 564 C LEU A 36 -6.485 -4.811 2.480 1.00 0.16 C ATOM 565 O LEU A 36 -7.389 -5.635 2.462 1.00 0.18 O ATOM 566 CB LEU A 36 -5.095 -5.272 0.475 1.00 0.20 C ATOM 567 CG LEU A 36 -5.203 -3.932 -0.251 1.00 0.24 C ATOM 568 CD1 LEU A 36 -3.870 -3.210 -0.233 1.00 0.31 C ATOM 569 CD2 LEU A 36 -5.685 -4.138 -1.670 1.00 0.30 C ATOM 0 H LEU A 36 -5.434 -7.051 2.860 1.00 0.17 H new ATOM 0 HA LEU A 36 -4.384 -4.405 2.306 1.00 0.18 H new ATOM 0 HB2 LEU A 36 -4.181 -5.771 0.153 1.00 0.20 H new ATOM 0 HB3 LEU A 36 -5.928 -5.904 0.168 1.00 0.20 H new ATOM 0 HG LEU A 36 -5.932 -3.312 0.270 1.00 0.24 H new ATOM 0 HD11 LEU A 36 -3.965 -2.258 -0.754 1.00 0.31 H new ATOM 0 HD12 LEU A 36 -3.567 -3.030 0.799 1.00 0.31 H new ATOM 0 HD13 LEU A 36 -3.118 -3.822 -0.730 1.00 0.31 H new ATOM 0 HD21 LEU A 36 -5.757 -3.174 -2.174 1.00 0.30 H new ATOM 0 HD22 LEU A 36 -4.981 -4.775 -2.205 1.00 0.30 H new ATOM 0 HD23 LEU A 36 -6.666 -4.614 -1.656 1.00 0.30 H new ATOM 581 N ALA A 37 -6.663 -3.569 2.877 1.00 0.17 N ATOM 582 CA ALA A 37 -7.928 -3.122 3.443 1.00 0.18 C ATOM 583 C ALA A 37 -8.225 -1.703 2.996 1.00 0.24 C ATOM 584 O ALA A 37 -7.387 -0.827 3.143 1.00 0.43 O ATOM 585 CB ALA A 37 -7.850 -3.189 4.961 1.00 0.25 C ATOM 0 H ALA A 37 -5.947 -2.845 2.820 1.00 0.17 H new ATOM 0 HA ALA A 37 -8.732 -3.770 3.094 1.00 0.18 H new ATOM 0 HB1 ALA A 37 -8.795 -2.855 5.389 1.00 0.25 H new ATOM 0 HB2 ALA A 37 -7.654 -4.216 5.270 1.00 0.25 H new ATOM 0 HB3 ALA A 37 -7.045 -2.544 5.313 1.00 0.25 H new ATOM 591 N GLY A 38 -9.400 -1.464 2.448 1.00 0.22 N ATOM 592 CA GLY A 38 -9.694 -0.144 1.939 1.00 0.26 C ATOM 593 C GLY A 38 -10.901 -0.105 1.049 1.00 0.25 C ATOM 594 O GLY A 38 -11.281 -1.107 0.465 1.00 0.26 O ATOM 0 H GLY A 38 -10.149 -2.149 2.346 1.00 0.22 H new ATOM 0 HA2 GLY A 38 -9.848 0.535 2.778 1.00 0.26 H new ATOM 0 HA3 GLY A 38 -8.831 0.224 1.385 1.00 0.26 H new ATOM 598 N ASN A 39 -11.512 1.064 0.934 1.00 0.26 N ATOM 599 CA ASN A 39 -12.692 1.197 0.102 1.00 0.27 C ATOM 600 C ASN A 39 -12.296 1.103 -1.367 1.00 0.32 C ATOM 601 O ASN A 39 -13.114 0.780 -2.227 1.00 0.40 O ATOM 602 CB ASN A 39 -13.446 2.504 0.374 1.00 0.31 C ATOM 603 CG ASN A 39 -12.576 3.739 0.248 1.00 1.08 C ATOM 604 OD1 ASN A 39 -12.345 4.241 -0.845 1.00 1.94 O ATOM 605 ND2 ASN A 39 -12.114 4.255 1.374 1.00 1.73 N ATOM 0 H ASN A 39 -11.214 1.921 1.400 1.00 0.26 H new ATOM 0 HA ASN A 39 -13.371 0.381 0.350 1.00 0.27 H new ATOM 0 HB2 ASN A 39 -14.281 2.584 -0.322 1.00 0.31 H new ATOM 0 HB3 ASN A 39 -13.870 2.468 1.378 1.00 0.31 H new ATOM 0 HD21 ASN A 39 -11.544 5.100 1.351 1.00 1.73 H new ATOM 0 HD22 ASN A 39 -12.328 3.808 2.265 1.00 1.73 H new ATOM 612 N ALA A 40 -11.021 1.373 -1.634 1.00 0.34 N ATOM 613 CA ALA A 40 -10.466 1.228 -2.970 1.00 0.41 C ATOM 614 C ALA A 40 -9.944 -0.194 -3.175 1.00 0.39 C ATOM 615 O ALA A 40 -9.507 -0.559 -4.267 1.00 0.45 O ATOM 616 CB ALA A 40 -9.367 2.257 -3.199 1.00 0.46 C ATOM 0 H ALA A 40 -10.352 1.695 -0.935 1.00 0.34 H new ATOM 0 HA ALA A 40 -11.253 1.407 -3.703 1.00 0.41 H new ATOM 0 HB1 ALA A 40 -8.960 2.137 -4.203 1.00 0.46 H new ATOM 0 HB2 ALA A 40 -9.780 3.260 -3.092 1.00 0.46 H new ATOM 0 HB3 ALA A 40 -8.573 2.111 -2.466 1.00 0.46 H new ATOM 622 N VAL A 41 -9.990 -0.991 -2.110 1.00 0.34 N ATOM 623 CA VAL A 41 -9.700 -2.417 -2.198 1.00 0.33 C ATOM 624 C VAL A 41 -10.775 -3.094 -3.025 1.00 0.42 C ATOM 625 O VAL A 41 -11.964 -3.001 -2.706 1.00 0.46 O ATOM 626 CB VAL A 41 -9.622 -3.079 -0.793 1.00 0.28 C ATOM 627 CG1 VAL A 41 -9.779 -4.606 -0.858 1.00 0.32 C ATOM 628 CG2 VAL A 41 -8.308 -2.705 -0.128 1.00 0.30 C ATOM 0 H VAL A 41 -10.227 -0.669 -1.171 1.00 0.34 H new ATOM 0 HA VAL A 41 -8.726 -2.537 -2.673 1.00 0.33 H new ATOM 0 HB VAL A 41 -10.455 -2.703 -0.199 1.00 0.28 H new ATOM 0 HG11 VAL A 41 -9.717 -5.021 0.148 1.00 0.32 H new ATOM 0 HG12 VAL A 41 -10.747 -4.854 -1.294 1.00 0.32 H new ATOM 0 HG13 VAL A 41 -8.985 -5.028 -1.474 1.00 0.32 H new ATOM 0 HG21 VAL A 41 -8.254 -3.169 0.857 1.00 0.30 H new ATOM 0 HG22 VAL A 41 -7.477 -3.055 -0.741 1.00 0.30 H new ATOM 0 HG23 VAL A 41 -8.249 -1.622 -0.022 1.00 0.30 H new ATOM 638 N GLN A 42 -10.374 -3.735 -4.109 1.00 0.55 N ATOM 639 CA GLN A 42 -11.323 -4.472 -4.912 1.00 0.69 C ATOM 640 C GLN A 42 -11.629 -5.803 -4.241 1.00 0.60 C ATOM 641 O GLN A 42 -11.107 -6.856 -4.610 1.00 0.70 O ATOM 642 CB GLN A 42 -10.811 -4.660 -6.347 1.00 0.93 C ATOM 643 CG GLN A 42 -9.420 -5.268 -6.460 1.00 1.49 C ATOM 644 CD GLN A 42 -8.951 -5.364 -7.899 1.00 1.84 C ATOM 645 OE1 GLN A 42 -8.207 -6.272 -8.266 1.00 2.44 O ATOM 646 NE2 GLN A 42 -9.370 -4.415 -8.725 1.00 2.35 N ATOM 0 H GLN A 42 -9.412 -3.758 -4.447 1.00 0.55 H new ATOM 0 HA GLN A 42 -12.248 -3.901 -4.985 1.00 0.69 H new ATOM 0 HB2 GLN A 42 -11.513 -5.295 -6.887 1.00 0.93 H new ATOM 0 HB3 GLN A 42 -10.809 -3.691 -6.846 1.00 0.93 H new ATOM 0 HG2 GLN A 42 -8.714 -4.664 -5.889 1.00 1.49 H new ATOM 0 HG3 GLN A 42 -9.423 -6.262 -6.014 1.00 1.49 H new ATOM 0 HE21 GLN A 42 -9.987 -3.678 -8.384 1.00 2.35 H new ATOM 0 HE22 GLN A 42 -9.075 -4.422 -9.702 1.00 2.35 H new ATOM 655 N LYS A 43 -12.472 -5.733 -3.226 1.00 0.50 N ATOM 656 CA LYS A 43 -12.929 -6.915 -2.538 1.00 0.48 C ATOM 657 C LYS A 43 -14.262 -7.354 -3.125 1.00 0.59 C ATOM 658 O LYS A 43 -15.253 -6.630 -3.025 1.00 0.69 O ATOM 659 CB LYS A 43 -13.096 -6.667 -1.038 1.00 0.43 C ATOM 660 CG LYS A 43 -13.544 -7.935 -0.332 1.00 0.57 C ATOM 661 CD LYS A 43 -13.445 -7.858 1.174 1.00 0.55 C ATOM 662 CE LYS A 43 -12.961 -9.188 1.718 1.00 0.52 C ATOM 663 NZ LYS A 43 -13.083 -9.282 3.196 1.00 0.97 N ATOM 0 H LYS A 43 -12.853 -4.860 -2.862 1.00 0.50 H new ATOM 0 HA LYS A 43 -12.178 -7.694 -2.670 1.00 0.48 H new ATOM 0 HB2 LYS A 43 -12.153 -6.322 -0.614 1.00 0.43 H new ATOM 0 HB3 LYS A 43 -13.827 -5.876 -0.874 1.00 0.43 H new ATOM 0 HG2 LYS A 43 -14.576 -8.149 -0.609 1.00 0.57 H new ATOM 0 HG3 LYS A 43 -12.939 -8.770 -0.685 1.00 0.57 H new ATOM 0 HD2 LYS A 43 -12.758 -7.063 1.464 1.00 0.55 H new ATOM 0 HD3 LYS A 43 -14.417 -7.611 1.601 1.00 0.55 H new ATOM 0 HE2 LYS A 43 -13.533 -9.994 1.258 1.00 0.52 H new ATOM 0 HE3 LYS A 43 -11.919 -9.335 1.434 1.00 0.52 H new ATOM 0 HZ1 LYS A 43 -12.139 -9.216 3.627 1.00 0.97 H new ATOM 0 HZ2 LYS A 43 -13.678 -8.504 3.545 1.00 0.97 H new ATOM 0 HZ3 LYS A 43 -13.518 -10.192 3.451 1.00 0.97 H new ATOM 677 N GLU A 44 -14.287 -8.517 -3.759 1.00 0.68 N ATOM 678 CA GLU A 44 -15.542 -9.086 -4.224 1.00 0.80 C ATOM 679 C GLU A 44 -16.365 -9.481 -3.017 1.00 0.76 C ATOM 680 O GLU A 44 -17.541 -9.146 -2.886 1.00 0.88 O ATOM 681 CB GLU A 44 -15.325 -10.322 -5.123 1.00 0.94 C ATOM 682 CG GLU A 44 -14.716 -11.560 -4.460 1.00 0.95 C ATOM 683 CD GLU A 44 -13.216 -11.518 -4.285 1.00 1.59 C ATOM 684 OE1 GLU A 44 -12.711 -10.578 -3.639 1.00 2.22 O ATOM 685 OE2 GLU A 44 -12.545 -12.458 -4.748 1.00 2.00 O ATOM 0 H GLU A 44 -13.461 -9.080 -3.962 1.00 0.68 H new ATOM 0 HA GLU A 44 -16.057 -8.335 -4.823 1.00 0.80 H new ATOM 0 HB2 GLU A 44 -16.287 -10.604 -5.550 1.00 0.94 H new ATOM 0 HB3 GLU A 44 -14.681 -10.030 -5.953 1.00 0.94 H new ATOM 0 HG2 GLU A 44 -15.177 -11.693 -3.481 1.00 0.95 H new ATOM 0 HG3 GLU A 44 -14.973 -12.436 -5.056 1.00 0.95 H new ATOM 692 N ARG A 45 -15.675 -10.184 -2.150 1.00 0.70 N ATOM 693 CA ARG A 45 -16.190 -10.718 -0.906 1.00 0.79 C ATOM 694 C ARG A 45 -15.100 -11.599 -0.317 1.00 0.79 C ATOM 695 O ARG A 45 -14.989 -11.763 0.895 1.00 0.90 O ATOM 696 CB ARG A 45 -17.468 -11.534 -1.142 1.00 0.94 C ATOM 697 CG ARG A 45 -18.046 -12.170 0.117 1.00 1.54 C ATOM 698 CD ARG A 45 -19.325 -12.933 -0.190 1.00 1.86 C ATOM 699 NE ARG A 45 -19.113 -13.975 -1.195 1.00 2.25 N ATOM 700 CZ ARG A 45 -19.623 -13.935 -2.428 1.00 2.90 C ATOM 701 NH1 ARG A 45 -20.388 -12.918 -2.805 1.00 3.09 N ATOM 702 NH2 ARG A 45 -19.374 -14.923 -3.276 1.00 3.78 N ATOM 0 H ARG A 45 -14.692 -10.411 -2.298 1.00 0.70 H new ATOM 0 HA ARG A 45 -16.451 -9.909 -0.224 1.00 0.79 H new ATOM 0 HB2 ARG A 45 -18.223 -10.885 -1.587 1.00 0.94 H new ATOM 0 HB3 ARG A 45 -17.255 -12.319 -1.867 1.00 0.94 H new ATOM 0 HG2 ARG A 45 -17.312 -12.846 0.556 1.00 1.54 H new ATOM 0 HG3 ARG A 45 -18.250 -11.397 0.858 1.00 1.54 H new ATOM 0 HD2 ARG A 45 -19.707 -13.385 0.726 1.00 1.86 H new ATOM 0 HD3 ARG A 45 -20.086 -12.238 -0.544 1.00 1.86 H new ATOM 0 HE ARG A 45 -18.542 -14.780 -0.938 1.00 2.25 H new ATOM 0 HH11 ARG A 45 -20.589 -12.161 -2.151 1.00 3.09 H new ATOM 0 HH12 ARG A 45 -20.775 -12.893 -3.749 1.00 3.09 H new ATOM 0 HH21 ARG A 45 -18.794 -15.710 -2.986 1.00 3.78 H new ATOM 0 HH22 ARG A 45 -19.762 -14.896 -4.219 1.00 3.78 H new ATOM 716 N GLN A 46 -14.271 -12.138 -1.210 1.00 0.80 N ATOM 717 CA GLN A 46 -13.194 -13.037 -0.811 1.00 0.94 C ATOM 718 C GLN A 46 -11.848 -12.319 -0.782 1.00 0.86 C ATOM 719 O GLN A 46 -11.457 -11.752 0.241 1.00 0.94 O ATOM 720 CB GLN A 46 -13.109 -14.228 -1.766 1.00 1.13 C ATOM 721 CG GLN A 46 -14.460 -14.820 -2.105 1.00 1.36 C ATOM 722 CD GLN A 46 -14.379 -15.904 -3.159 1.00 1.85 C ATOM 723 OE1 GLN A 46 -15.173 -16.844 -3.159 1.00 2.42 O ATOM 724 NE2 GLN A 46 -13.429 -15.778 -4.074 1.00 2.45 N ATOM 0 H GLN A 46 -14.326 -11.967 -2.214 1.00 0.80 H new ATOM 0 HA GLN A 46 -13.422 -13.389 0.195 1.00 0.94 H new ATOM 0 HB2 GLN A 46 -12.617 -13.913 -2.686 1.00 1.13 H new ATOM 0 HB3 GLN A 46 -12.484 -15.000 -1.318 1.00 1.13 H new ATOM 0 HG2 GLN A 46 -14.908 -15.232 -1.201 1.00 1.36 H new ATOM 0 HG3 GLN A 46 -15.121 -14.027 -2.456 1.00 1.36 H new ATOM 0 HE21 GLN A 46 -12.790 -14.984 -4.040 1.00 2.45 H new ATOM 0 HE22 GLN A 46 -13.337 -16.475 -4.813 1.00 2.45 H new ATOM 733 N SER A 47 -11.166 -12.309 -1.927 1.00 0.79 N ATOM 734 CA SER A 47 -9.812 -11.773 -2.012 1.00 0.80 C ATOM 735 C SER A 47 -9.305 -11.758 -3.458 1.00 0.82 C ATOM 736 O SER A 47 -8.286 -12.370 -3.776 1.00 0.93 O ATOM 737 CB SER A 47 -8.875 -12.609 -1.135 1.00 0.93 C ATOM 738 OG SER A 47 -8.980 -13.989 -1.451 1.00 1.58 O ATOM 0 H SER A 47 -11.532 -12.667 -2.809 1.00 0.79 H new ATOM 0 HA SER A 47 -9.828 -10.743 -1.655 1.00 0.80 H new ATOM 0 HB2 SER A 47 -7.846 -12.277 -1.276 1.00 0.93 H new ATOM 0 HB3 SER A 47 -9.119 -12.453 -0.084 1.00 0.93 H new ATOM 0 HG SER A 47 -8.812 -14.119 -2.408 1.00 1.58 H new ATOM 744 N ARG A 48 -10.008 -11.050 -4.327 1.00 0.81 N ATOM 745 CA ARG A 48 -9.643 -10.987 -5.742 1.00 0.90 C ATOM 746 C ARG A 48 -8.423 -10.088 -5.961 1.00 0.92 C ATOM 747 O ARG A 48 -7.908 -9.982 -7.072 1.00 1.64 O ATOM 748 CB ARG A 48 -10.824 -10.464 -6.560 1.00 0.95 C ATOM 749 CG ARG A 48 -10.749 -10.808 -8.039 1.00 1.22 C ATOM 750 CD ARG A 48 -10.680 -12.314 -8.257 1.00 1.72 C ATOM 751 NE ARG A 48 -11.760 -13.020 -7.564 1.00 2.25 N ATOM 752 CZ ARG A 48 -12.020 -14.318 -7.712 1.00 2.93 C ATOM 753 NH1 ARG A 48 -11.277 -15.061 -8.522 1.00 3.36 N ATOM 754 NH2 ARG A 48 -13.023 -14.870 -7.041 1.00 3.61 N ATOM 0 H ARG A 48 -10.837 -10.508 -4.082 1.00 0.81 H new ATOM 0 HA ARG A 48 -9.387 -11.994 -6.071 1.00 0.90 H new ATOM 0 HB2 ARG A 48 -11.747 -10.872 -6.149 1.00 0.95 H new ATOM 0 HB3 ARG A 48 -10.877 -9.381 -6.451 1.00 0.95 H new ATOM 0 HG2 ARG A 48 -11.621 -10.404 -8.553 1.00 1.22 H new ATOM 0 HG3 ARG A 48 -9.872 -10.334 -8.480 1.00 1.22 H new ATOM 0 HD2 ARG A 48 -10.733 -12.528 -9.324 1.00 1.72 H new ATOM 0 HD3 ARG A 48 -9.718 -12.687 -7.905 1.00 1.72 H new ATOM 0 HE ARG A 48 -12.350 -12.484 -6.928 1.00 2.25 H new ATOM 0 HH11 ARG A 48 -10.503 -14.639 -9.035 1.00 3.36 H new ATOM 0 HH12 ARG A 48 -11.480 -16.055 -8.632 1.00 3.36 H new ATOM 0 HH21 ARG A 48 -13.592 -14.301 -6.414 1.00 3.61 H new ATOM 0 HH22 ARG A 48 -13.225 -15.864 -7.152 1.00 3.61 H new ATOM 768 N PHE A 49 -7.983 -9.445 -4.889 1.00 0.49 N ATOM 769 CA PHE A 49 -6.848 -8.528 -4.930 1.00 0.42 C ATOM 770 C PHE A 49 -5.573 -9.186 -5.459 1.00 0.59 C ATOM 771 O PHE A 49 -4.936 -8.644 -6.358 1.00 1.46 O ATOM 772 CB PHE A 49 -6.622 -7.932 -3.531 1.00 0.35 C ATOM 773 CG PHE A 49 -5.250 -7.362 -3.304 1.00 0.32 C ATOM 774 CD1 PHE A 49 -4.725 -6.397 -4.150 1.00 0.40 C ATOM 775 CD2 PHE A 49 -4.481 -7.804 -2.241 1.00 0.27 C ATOM 776 CE1 PHE A 49 -3.461 -5.885 -3.939 1.00 0.42 C ATOM 777 CE2 PHE A 49 -3.215 -7.298 -2.027 1.00 0.30 C ATOM 778 CZ PHE A 49 -2.703 -6.337 -2.876 1.00 0.37 C ATOM 0 H PHE A 49 -8.402 -9.543 -3.964 1.00 0.49 H new ATOM 0 HA PHE A 49 -7.089 -7.731 -5.633 1.00 0.42 H new ATOM 0 HB2 PHE A 49 -7.359 -7.147 -3.362 1.00 0.35 H new ATOM 0 HB3 PHE A 49 -6.806 -8.707 -2.787 1.00 0.35 H new ATOM 0 HD1 PHE A 49 -5.312 -6.042 -4.984 1.00 0.40 H new ATOM 0 HD2 PHE A 49 -4.876 -8.553 -1.571 1.00 0.27 H new ATOM 0 HE1 PHE A 49 -3.065 -5.132 -4.604 1.00 0.42 H new ATOM 0 HE2 PHE A 49 -2.625 -7.654 -1.195 1.00 0.30 H new ATOM 0 HZ PHE A 49 -1.713 -5.940 -2.710 1.00 0.37 H new ATOM 788 N THR A 50 -5.245 -10.354 -4.919 1.00 0.46 N ATOM 789 CA THR A 50 -3.968 -11.059 -5.190 1.00 0.42 C ATOM 790 C THR A 50 -2.727 -10.192 -4.885 1.00 0.47 C ATOM 791 O THR A 50 -2.646 -9.022 -5.254 1.00 0.84 O ATOM 792 CB THR A 50 -3.869 -11.650 -6.633 1.00 0.42 C ATOM 793 OG1 THR A 50 -4.427 -10.774 -7.623 1.00 0.89 O ATOM 794 CG2 THR A 50 -4.559 -13.004 -6.712 1.00 0.82 C ATOM 0 H THR A 50 -5.854 -10.855 -4.272 1.00 0.46 H new ATOM 0 HA THR A 50 -3.976 -11.900 -4.496 1.00 0.42 H new ATOM 0 HB THR A 50 -2.806 -11.766 -6.846 1.00 0.42 H new ATOM 0 HG1 THR A 50 -4.289 -9.843 -7.351 1.00 0.89 H new ATOM 0 HG21 THR A 50 -4.477 -13.396 -7.726 1.00 0.82 H new ATOM 0 HG22 THR A 50 -4.084 -13.696 -6.016 1.00 0.82 H new ATOM 0 HG23 THR A 50 -5.611 -12.892 -6.450 1.00 0.82 H new ATOM 802 N MET A 51 -1.759 -10.789 -4.191 1.00 0.25 N ATOM 803 CA MET A 51 -0.545 -10.074 -3.782 1.00 0.24 C ATOM 804 C MET A 51 0.342 -9.739 -4.964 1.00 0.26 C ATOM 805 O MET A 51 0.391 -10.465 -5.957 1.00 0.29 O ATOM 806 CB MET A 51 0.281 -10.882 -2.773 1.00 0.25 C ATOM 807 CG MET A 51 0.744 -12.234 -3.283 1.00 0.31 C ATOM 808 SD MET A 51 1.718 -13.144 -2.065 1.00 0.50 S ATOM 809 CE MET A 51 0.606 -13.200 -0.658 1.00 1.00 C ATOM 0 H MET A 51 -1.789 -11.766 -3.899 1.00 0.25 H new ATOM 0 HA MET A 51 -0.890 -9.151 -3.315 1.00 0.24 H new ATOM 0 HB2 MET A 51 1.155 -10.297 -2.485 1.00 0.25 H new ATOM 0 HB3 MET A 51 -0.313 -11.031 -1.872 1.00 0.25 H new ATOM 0 HG2 MET A 51 -0.125 -12.828 -3.564 1.00 0.31 H new ATOM 0 HG3 MET A 51 1.339 -12.093 -4.185 1.00 0.31 H new ATOM 0 HE1 MET A 51 0.573 -14.214 -0.260 1.00 1.00 H new ATOM 0 HE2 MET A 51 0.962 -12.519 0.115 1.00 1.00 H new ATOM 0 HE3 MET A 51 -0.394 -12.901 -0.972 1.00 1.00 H new ATOM 819 N TYR A 52 1.043 -8.635 -4.821 1.00 0.28 N ATOM 820 CA TYR A 52 2.073 -8.235 -5.755 1.00 0.32 C ATOM 821 C TYR A 52 3.320 -7.842 -4.977 1.00 0.30 C ATOM 822 O TYR A 52 3.290 -7.777 -3.746 1.00 0.30 O ATOM 823 CB TYR A 52 1.596 -7.083 -6.655 1.00 0.42 C ATOM 824 CG TYR A 52 0.838 -5.957 -5.964 1.00 0.48 C ATOM 825 CD1 TYR A 52 1.280 -5.394 -4.772 1.00 0.49 C ATOM 826 CD2 TYR A 52 -0.319 -5.439 -6.537 1.00 0.61 C ATOM 827 CE1 TYR A 52 0.589 -4.354 -4.173 1.00 0.61 C ATOM 828 CE2 TYR A 52 -1.016 -4.403 -5.941 1.00 0.72 C ATOM 829 CZ TYR A 52 -0.558 -3.864 -4.759 1.00 0.71 C ATOM 830 OH TYR A 52 -1.248 -2.828 -4.164 1.00 0.85 O ATOM 0 H TYR A 52 0.913 -7.984 -4.046 1.00 0.28 H new ATOM 0 HA TYR A 52 2.305 -9.074 -6.411 1.00 0.32 H new ATOM 0 HB2 TYR A 52 2.466 -6.655 -7.153 1.00 0.42 H new ATOM 0 HB3 TYR A 52 0.956 -7.499 -7.433 1.00 0.42 H new ATOM 0 HD1 TYR A 52 2.177 -5.774 -4.306 1.00 0.49 H new ATOM 0 HD2 TYR A 52 -0.681 -5.854 -7.466 1.00 0.61 H new ATOM 0 HE1 TYR A 52 0.948 -3.928 -3.248 1.00 0.61 H new ATOM 0 HE2 TYR A 52 -1.915 -4.019 -6.400 1.00 0.72 H new ATOM 0 HH TYR A 52 -2.032 -2.603 -4.707 1.00 0.85 H new ATOM 840 N SER A 53 4.409 -7.596 -5.676 1.00 0.33 N ATOM 841 CA SER A 53 5.626 -7.164 -5.022 1.00 0.33 C ATOM 842 C SER A 53 5.836 -5.687 -5.260 1.00 0.37 C ATOM 843 O SER A 53 5.889 -5.242 -6.401 1.00 0.52 O ATOM 844 CB SER A 53 6.848 -7.953 -5.523 1.00 0.40 C ATOM 845 OG SER A 53 6.644 -9.343 -5.379 1.00 0.93 O ATOM 0 H SER A 53 4.476 -7.687 -6.690 1.00 0.33 H new ATOM 0 HA SER A 53 5.520 -7.354 -3.954 1.00 0.33 H new ATOM 0 HB2 SER A 53 7.035 -7.715 -6.570 1.00 0.40 H new ATOM 0 HB3 SER A 53 7.734 -7.652 -4.965 1.00 0.40 H new ATOM 0 HG SER A 53 7.121 -9.819 -6.091 1.00 0.93 H new ATOM 851 N THR A 54 5.902 -4.928 -4.183 1.00 0.31 N ATOM 852 CA THR A 54 6.293 -3.539 -4.268 1.00 0.33 C ATOM 853 C THR A 54 7.776 -3.465 -3.967 1.00 0.29 C ATOM 854 O THR A 54 8.211 -3.653 -2.827 1.00 0.27 O ATOM 855 CB THR A 54 5.502 -2.660 -3.284 1.00 0.37 C ATOM 856 OG1 THR A 54 4.188 -3.204 -3.110 1.00 0.43 O ATOM 857 CG2 THR A 54 5.388 -1.233 -3.812 1.00 0.43 C ATOM 0 H THR A 54 5.689 -5.252 -3.240 1.00 0.31 H new ATOM 0 HA THR A 54 6.077 -3.160 -5.267 1.00 0.33 H new ATOM 0 HB THR A 54 6.029 -2.643 -2.330 1.00 0.37 H new ATOM 0 HG1 THR A 54 3.683 -2.646 -2.482 1.00 0.43 H new ATOM 0 HG21 THR A 54 4.825 -0.626 -3.102 1.00 0.43 H new ATOM 0 HG22 THR A 54 6.385 -0.811 -3.939 1.00 0.43 H new ATOM 0 HG23 THR A 54 4.872 -1.240 -4.772 1.00 0.43 H new ATOM 865 N ILE A 55 8.551 -3.255 -5.007 1.00 0.30 N ATOM 866 CA ILE A 55 9.990 -3.306 -4.896 1.00 0.28 C ATOM 867 C ILE A 55 10.581 -1.925 -5.076 1.00 0.24 C ATOM 868 O ILE A 55 10.785 -1.461 -6.195 1.00 0.26 O ATOM 869 CB ILE A 55 10.563 -4.283 -5.933 1.00 0.34 C ATOM 870 CG1 ILE A 55 9.864 -5.638 -5.777 1.00 0.50 C ATOM 871 CG2 ILE A 55 12.068 -4.418 -5.754 1.00 0.32 C ATOM 872 CD1 ILE A 55 10.088 -6.596 -6.924 1.00 0.72 C ATOM 0 H ILE A 55 8.206 -3.046 -5.944 1.00 0.30 H new ATOM 0 HA ILE A 55 10.256 -3.662 -3.901 1.00 0.28 H new ATOM 0 HB ILE A 55 10.383 -3.904 -6.939 1.00 0.34 H new ATOM 0 HG12 ILE A 55 10.210 -6.107 -4.856 1.00 0.50 H new ATOM 0 HG13 ILE A 55 8.793 -5.469 -5.666 1.00 0.50 H new ATOM 0 HG21 ILE A 55 12.462 -5.113 -6.495 1.00 0.32 H new ATOM 0 HG22 ILE A 55 12.539 -3.444 -5.885 1.00 0.32 H new ATOM 0 HG23 ILE A 55 12.283 -4.794 -4.754 1.00 0.32 H new ATOM 0 HD11 ILE A 55 9.557 -7.528 -6.729 1.00 0.72 H new ATOM 0 HD12 ILE A 55 9.715 -6.152 -7.847 1.00 0.72 H new ATOM 0 HD13 ILE A 55 11.154 -6.800 -7.025 1.00 0.72 H new ATOM 884 N TYR A 56 10.839 -1.271 -3.963 1.00 0.25 N ATOM 885 CA TYR A 56 11.300 0.107 -3.971 1.00 0.27 C ATOM 886 C TYR A 56 12.818 0.135 -4.072 1.00 0.30 C ATOM 887 O TYR A 56 13.504 -0.363 -3.189 1.00 0.36 O ATOM 888 CB TYR A 56 10.857 0.824 -2.692 1.00 0.32 C ATOM 889 CG TYR A 56 9.791 0.088 -1.897 1.00 0.39 C ATOM 890 CD1 TYR A 56 8.449 0.113 -2.270 1.00 0.32 C ATOM 891 CD2 TYR A 56 10.133 -0.625 -0.756 1.00 0.79 C ATOM 892 CE1 TYR A 56 7.494 -0.552 -1.529 1.00 0.43 C ATOM 893 CE2 TYR A 56 9.179 -1.292 -0.016 1.00 1.01 C ATOM 894 CZ TYR A 56 7.863 -1.252 -0.405 1.00 0.79 C ATOM 895 OH TYR A 56 6.909 -1.918 0.329 1.00 1.02 O ATOM 0 H TYR A 56 10.737 -1.674 -3.031 1.00 0.25 H new ATOM 0 HA TYR A 56 10.866 0.619 -4.830 1.00 0.27 H new ATOM 0 HB2 TYR A 56 11.728 0.976 -2.055 1.00 0.32 H new ATOM 0 HB3 TYR A 56 10.479 1.812 -2.956 1.00 0.32 H new ATOM 0 HD1 TYR A 56 8.152 0.661 -3.152 1.00 0.32 H new ATOM 0 HD2 TYR A 56 11.166 -0.658 -0.442 1.00 0.79 H new ATOM 0 HE1 TYR A 56 6.458 -0.523 -1.832 1.00 0.43 H new ATOM 0 HE2 TYR A 56 9.466 -1.844 0.867 1.00 1.01 H new ATOM 0 HH TYR A 56 7.100 -1.814 1.285 1.00 1.02 H new ATOM 905 N GLU A 57 13.341 0.691 -5.149 1.00 0.33 N ATOM 906 CA GLU A 57 14.784 0.754 -5.331 1.00 0.41 C ATOM 907 C GLU A 57 15.259 2.204 -5.306 1.00 0.36 C ATOM 908 O GLU A 57 14.681 3.073 -5.963 1.00 0.42 O ATOM 909 CB GLU A 57 15.191 0.061 -6.633 1.00 0.52 C ATOM 910 CG GLU A 57 16.695 -0.101 -6.795 1.00 1.13 C ATOM 911 CD GLU A 57 17.068 -0.910 -8.022 1.00 1.56 C ATOM 912 OE1 GLU A 57 17.140 -2.154 -7.920 1.00 1.84 O ATOM 913 OE2 GLU A 57 17.286 -0.303 -9.094 1.00 2.33 O ATOM 0 H GLU A 57 12.796 1.103 -5.906 1.00 0.33 H new ATOM 0 HA GLU A 57 15.265 0.227 -4.507 1.00 0.41 H new ATOM 0 HB2 GLU A 57 14.722 -0.922 -6.673 1.00 0.52 H new ATOM 0 HB3 GLU A 57 14.803 0.633 -7.476 1.00 0.52 H new ATOM 0 HG2 GLU A 57 17.157 0.884 -6.860 1.00 1.13 H new ATOM 0 HG3 GLU A 57 17.102 -0.586 -5.908 1.00 1.13 H new ATOM 920 N LEU A 58 16.307 2.450 -4.533 1.00 0.41 N ATOM 921 CA LEU A 58 16.809 3.802 -4.307 1.00 0.42 C ATOM 922 C LEU A 58 17.528 4.369 -5.523 1.00 0.43 C ATOM 923 O LEU A 58 18.514 3.803 -5.992 1.00 0.60 O ATOM 924 CB LEU A 58 17.781 3.815 -3.123 1.00 0.62 C ATOM 925 CG LEU A 58 17.299 4.550 -1.875 1.00 0.58 C ATOM 926 CD1 LEU A 58 16.889 5.975 -2.218 1.00 1.24 C ATOM 927 CD2 LEU A 58 16.156 3.793 -1.229 1.00 1.24 C ATOM 0 H LEU A 58 16.832 1.724 -4.046 1.00 0.41 H new ATOM 0 HA LEU A 58 15.938 4.424 -4.101 1.00 0.42 H new ATOM 0 HB2 LEU A 58 18.005 2.784 -2.850 1.00 0.62 H new ATOM 0 HB3 LEU A 58 18.716 4.269 -3.450 1.00 0.62 H new ATOM 0 HG LEU A 58 18.120 4.602 -1.160 1.00 0.58 H new ATOM 0 HD11 LEU A 58 16.548 6.483 -1.316 1.00 1.24 H new ATOM 0 HD12 LEU A 58 17.743 6.509 -2.634 1.00 1.24 H new ATOM 0 HD13 LEU A 58 16.082 5.955 -2.950 1.00 1.24 H new ATOM 0 HD21 LEU A 58 15.822 4.328 -0.340 1.00 1.24 H new ATOM 0 HD22 LEU A 58 15.330 3.710 -1.935 1.00 1.24 H new ATOM 0 HD23 LEU A 58 16.494 2.796 -0.947 1.00 1.24 H new ATOM 939 N GLN A 59 17.036 5.500 -6.012 1.00 0.37 N ATOM 940 CA GLN A 59 17.771 6.296 -6.974 1.00 0.48 C ATOM 941 C GLN A 59 18.724 7.185 -6.184 1.00 0.57 C ATOM 942 O GLN A 59 18.604 7.290 -4.961 1.00 0.58 O ATOM 943 CB GLN A 59 16.804 7.149 -7.804 1.00 0.53 C ATOM 944 CG GLN A 59 17.442 7.877 -8.975 1.00 1.13 C ATOM 945 CD GLN A 59 16.551 8.978 -9.515 1.00 1.75 C ATOM 946 OE1 GLN A 59 16.628 10.123 -9.068 1.00 2.50 O ATOM 947 NE2 GLN A 59 15.699 8.643 -10.469 1.00 2.33 N ATOM 0 H GLN A 59 16.127 5.884 -5.754 1.00 0.37 H new ATOM 0 HA GLN A 59 18.324 5.660 -7.665 1.00 0.48 H new ATOM 0 HB2 GLN A 59 16.009 6.507 -8.183 1.00 0.53 H new ATOM 0 HB3 GLN A 59 16.336 7.884 -7.149 1.00 0.53 H new ATOM 0 HG2 GLN A 59 18.395 8.303 -8.661 1.00 1.13 H new ATOM 0 HG3 GLN A 59 17.659 7.164 -9.770 1.00 1.13 H new ATOM 0 HE21 GLN A 59 15.668 7.682 -10.811 1.00 2.33 H new ATOM 0 HE22 GLN A 59 15.073 9.345 -10.863 1.00 2.33 H new ATOM 956 N GLU A 60 19.645 7.834 -6.871 1.00 0.69 N ATOM 957 CA GLU A 60 20.654 8.658 -6.216 1.00 0.82 C ATOM 958 C GLU A 60 20.048 9.896 -5.554 1.00 0.75 C ATOM 959 O GLU A 60 20.764 10.685 -4.938 1.00 0.89 O ATOM 960 CB GLU A 60 21.711 9.078 -7.229 1.00 1.05 C ATOM 961 CG GLU A 60 21.144 9.910 -8.363 1.00 1.11 C ATOM 962 CD GLU A 60 22.155 10.151 -9.458 1.00 1.47 C ATOM 963 OE1 GLU A 60 22.242 9.319 -10.384 1.00 1.73 O ATOM 964 OE2 GLU A 60 22.876 11.165 -9.391 1.00 1.79 O ATOM 0 H GLU A 60 19.719 7.809 -7.888 1.00 0.69 H new ATOM 0 HA GLU A 60 21.109 8.057 -5.429 1.00 0.82 H new ATOM 0 HB2 GLU A 60 22.488 9.648 -6.720 1.00 1.05 H new ATOM 0 HB3 GLU A 60 22.186 8.188 -7.641 1.00 1.05 H new ATOM 0 HG2 GLU A 60 20.273 9.405 -8.781 1.00 1.11 H new ATOM 0 HG3 GLU A 60 20.800 10.868 -7.972 1.00 1.11 H new ATOM 971 N ASP A 61 18.735 10.078 -5.687 1.00 0.64 N ATOM 972 CA ASP A 61 18.071 11.199 -5.039 1.00 0.70 C ATOM 973 C ASP A 61 16.723 10.776 -4.471 1.00 0.54 C ATOM 974 O ASP A 61 15.687 11.352 -4.802 1.00 0.50 O ATOM 975 CB ASP A 61 17.903 12.370 -6.006 1.00 0.92 C ATOM 976 CG ASP A 61 17.534 13.648 -5.283 1.00 1.18 C ATOM 977 OD1 ASP A 61 18.305 14.088 -4.406 1.00 1.41 O ATOM 978 OD2 ASP A 61 16.457 14.211 -5.585 1.00 1.26 O ATOM 0 H ASP A 61 18.121 9.471 -6.230 1.00 0.64 H new ATOM 0 HA ASP A 61 18.702 11.529 -4.214 1.00 0.70 H new ATOM 0 HB2 ASP A 61 18.830 12.520 -6.559 1.00 0.92 H new ATOM 0 HB3 ASP A 61 17.131 12.130 -6.737 1.00 0.92 H new ATOM 983 N ASN A 62 16.766 9.733 -3.636 1.00 0.52 N ATOM 984 CA ASN A 62 15.612 9.213 -2.866 1.00 0.46 C ATOM 985 C ASN A 62 14.330 9.006 -3.680 1.00 0.36 C ATOM 986 O ASN A 62 13.267 8.777 -3.108 1.00 0.41 O ATOM 987 CB ASN A 62 15.305 10.067 -1.622 1.00 0.57 C ATOM 988 CG ASN A 62 15.059 11.538 -1.910 1.00 0.70 C ATOM 989 OD1 ASN A 62 13.932 11.953 -2.186 1.00 1.36 O ATOM 990 ND2 ASN A 62 16.108 12.342 -1.821 1.00 1.35 N ATOM 0 H ASN A 62 17.623 9.207 -3.467 1.00 0.52 H new ATOM 0 HA ASN A 62 15.942 8.222 -2.554 1.00 0.46 H new ATOM 0 HB2 ASN A 62 14.427 9.656 -1.123 1.00 0.57 H new ATOM 0 HB3 ASN A 62 16.138 9.981 -0.924 1.00 0.57 H new ATOM 0 HD21 ASN A 62 15.999 13.343 -1.983 1.00 1.35 H new ATOM 0 HD22 ASN A 62 17.025 11.960 -1.590 1.00 1.35 H new ATOM 997 N SER A 63 14.417 9.067 -4.995 1.00 0.34 N ATOM 998 CA SER A 63 13.300 8.674 -5.824 1.00 0.30 C ATOM 999 C SER A 63 13.340 7.169 -5.962 1.00 0.29 C ATOM 1000 O SER A 63 14.319 6.617 -6.453 1.00 0.31 O ATOM 1001 CB SER A 63 13.373 9.333 -7.201 1.00 0.35 C ATOM 1002 OG SER A 63 13.652 10.719 -7.086 1.00 0.96 O ATOM 0 H SER A 63 15.242 9.382 -5.506 1.00 0.34 H new ATOM 0 HA SER A 63 12.367 8.996 -5.363 1.00 0.30 H new ATOM 0 HB2 SER A 63 14.147 8.851 -7.799 1.00 0.35 H new ATOM 0 HB3 SER A 63 12.429 9.191 -7.727 1.00 0.35 H new ATOM 0 HG SER A 63 13.696 11.119 -7.980 1.00 0.96 H new ATOM 1008 N TYR A 64 12.314 6.493 -5.507 1.00 0.28 N ATOM 1009 CA TYR A 64 12.329 5.051 -5.560 1.00 0.28 C ATOM 1010 C TYR A 64 11.727 4.600 -6.869 1.00 0.29 C ATOM 1011 O TYR A 64 10.646 5.054 -7.248 1.00 0.30 O ATOM 1012 CB TYR A 64 11.512 4.456 -4.403 1.00 0.28 C ATOM 1013 CG TYR A 64 11.845 5.026 -3.036 1.00 0.31 C ATOM 1014 CD1 TYR A 64 13.136 5.417 -2.706 1.00 0.31 C ATOM 1015 CD2 TYR A 64 10.851 5.180 -2.076 1.00 0.39 C ATOM 1016 CE1 TYR A 64 13.426 5.948 -1.460 1.00 0.36 C ATOM 1017 CE2 TYR A 64 11.134 5.706 -0.832 1.00 0.45 C ATOM 1018 CZ TYR A 64 12.420 6.088 -0.528 1.00 0.42 C ATOM 1019 OH TYR A 64 12.701 6.620 0.711 1.00 0.49 O ATOM 0 H TYR A 64 11.474 6.907 -5.103 1.00 0.28 H new ATOM 0 HA TYR A 64 13.360 4.708 -5.475 1.00 0.28 H new ATOM 0 HB2 TYR A 64 10.453 4.619 -4.602 1.00 0.28 H new ATOM 0 HB3 TYR A 64 11.670 3.378 -4.381 1.00 0.28 H new ATOM 0 HD1 TYR A 64 13.927 5.305 -3.433 1.00 0.31 H new ATOM 0 HD2 TYR A 64 9.839 4.883 -2.308 1.00 0.39 H new ATOM 0 HE1 TYR A 64 14.435 6.251 -1.220 1.00 0.36 H new ATOM 0 HE2 TYR A 64 10.348 5.817 -0.099 1.00 0.45 H new ATOM 0 HH TYR A 64 11.881 6.650 1.247 1.00 0.49 H new ATOM 1029 N ASN A 65 12.409 3.702 -7.555 1.00 0.32 N ATOM 1030 CA ASN A 65 11.805 3.046 -8.689 1.00 0.36 C ATOM 1031 C ASN A 65 11.145 1.794 -8.161 1.00 0.32 C ATOM 1032 O ASN A 65 11.787 0.794 -7.856 1.00 0.37 O ATOM 1033 CB ASN A 65 12.810 2.759 -9.827 1.00 0.48 C ATOM 1034 CG ASN A 65 13.934 1.803 -9.459 1.00 1.24 C ATOM 1035 OD1 ASN A 65 13.825 0.590 -9.650 1.00 2.02 O ATOM 1036 ND2 ASN A 65 15.032 2.344 -8.960 1.00 1.96 N ATOM 0 H ASN A 65 13.366 3.416 -7.348 1.00 0.32 H new ATOM 0 HA ASN A 65 11.067 3.699 -9.155 1.00 0.36 H new ATOM 0 HB2 ASN A 65 12.266 2.348 -10.678 1.00 0.48 H new ATOM 0 HB3 ASN A 65 13.247 3.703 -10.154 1.00 0.48 H new ATOM 0 HD21 ASN A 65 15.827 1.753 -8.718 1.00 1.96 H new ATOM 0 HD22 ASN A 65 15.084 3.353 -8.817 1.00 1.96 H new ATOM 1043 N VAL A 66 9.850 1.892 -7.989 1.00 0.31 N ATOM 1044 CA VAL A 66 9.106 0.868 -7.311 1.00 0.29 C ATOM 1045 C VAL A 66 8.539 -0.118 -8.297 1.00 0.31 C ATOM 1046 O VAL A 66 7.663 0.198 -9.105 1.00 0.37 O ATOM 1047 CB VAL A 66 8.021 1.475 -6.411 1.00 0.37 C ATOM 1048 CG1 VAL A 66 6.854 0.515 -6.193 1.00 0.67 C ATOM 1049 CG2 VAL A 66 8.656 1.852 -5.084 1.00 0.65 C ATOM 0 H VAL A 66 9.288 2.679 -8.314 1.00 0.31 H new ATOM 0 HA VAL A 66 9.787 0.321 -6.659 1.00 0.29 H new ATOM 0 HB VAL A 66 7.611 2.358 -6.901 1.00 0.37 H new ATOM 0 HG11 VAL A 66 6.110 0.986 -5.550 1.00 0.67 H new ATOM 0 HG12 VAL A 66 6.401 0.270 -7.153 1.00 0.67 H new ATOM 0 HG13 VAL A 66 7.217 -0.397 -5.719 1.00 0.67 H new ATOM 0 HG21 VAL A 66 7.900 2.286 -4.429 1.00 0.65 H new ATOM 0 HG22 VAL A 66 9.075 0.962 -4.615 1.00 0.65 H new ATOM 0 HG23 VAL A 66 9.450 2.580 -5.254 1.00 0.65 H new ATOM 1059 N THR A 67 9.062 -1.315 -8.209 1.00 0.34 N ATOM 1060 CA THR A 67 8.771 -2.350 -9.162 1.00 0.39 C ATOM 1061 C THR A 67 7.547 -3.123 -8.700 1.00 0.47 C ATOM 1062 O THR A 67 7.662 -4.028 -7.883 1.00 0.71 O ATOM 1063 CB THR A 67 9.975 -3.303 -9.283 1.00 0.48 C ATOM 1064 OG1 THR A 67 11.188 -2.537 -9.354 1.00 0.58 O ATOM 1065 CG2 THR A 67 9.864 -4.176 -10.517 1.00 0.74 C ATOM 0 H THR A 67 9.705 -1.598 -7.469 1.00 0.34 H new ATOM 0 HA THR A 67 8.575 -1.904 -10.137 1.00 0.39 H new ATOM 0 HB THR A 67 9.987 -3.948 -8.404 1.00 0.48 H new ATOM 0 HG1 THR A 67 11.954 -3.144 -9.429 1.00 0.58 H new ATOM 0 HG21 THR A 67 10.729 -4.837 -10.574 1.00 0.74 H new ATOM 0 HG22 THR A 67 8.954 -4.773 -10.460 1.00 0.74 H new ATOM 0 HG23 THR A 67 9.830 -3.546 -11.406 1.00 0.74 H new ATOM 1073 N SER A 68 6.385 -2.752 -9.211 1.00 0.44 N ATOM 1074 CA SER A 68 5.139 -3.372 -8.798 1.00 0.52 C ATOM 1075 C SER A 68 4.683 -4.381 -9.840 1.00 0.53 C ATOM 1076 O SER A 68 4.073 -4.028 -10.845 1.00 0.65 O ATOM 1077 CB SER A 68 4.067 -2.302 -8.585 1.00 0.60 C ATOM 1078 OG SER A 68 4.531 -1.291 -7.706 1.00 1.14 O ATOM 0 H SER A 68 6.279 -2.022 -9.915 1.00 0.44 H new ATOM 0 HA SER A 68 5.301 -3.897 -7.856 1.00 0.52 H new ATOM 0 HB2 SER A 68 3.793 -1.860 -9.543 1.00 0.60 H new ATOM 0 HB3 SER A 68 3.166 -2.760 -8.176 1.00 0.60 H new ATOM 0 HG SER A 68 3.831 -0.616 -7.585 1.00 1.14 H new ATOM 1084 N ILE A 69 5.006 -5.637 -9.608 1.00 0.53 N ATOM 1085 CA ILE A 69 4.659 -6.693 -10.540 1.00 0.53 C ATOM 1086 C ILE A 69 3.188 -7.043 -10.464 1.00 0.60 C ATOM 1087 O ILE A 69 2.630 -7.231 -9.390 1.00 0.74 O ATOM 1088 CB ILE A 69 5.505 -7.959 -10.296 1.00 0.54 C ATOM 1089 CG1 ILE A 69 4.986 -9.116 -11.158 1.00 0.66 C ATOM 1090 CG2 ILE A 69 5.483 -8.326 -8.815 1.00 0.57 C ATOM 1091 CD1 ILE A 69 6.066 -10.058 -11.628 1.00 0.78 C ATOM 0 H ILE A 69 5.510 -5.953 -8.779 1.00 0.53 H new ATOM 0 HA ILE A 69 4.875 -6.313 -11.538 1.00 0.53 H new ATOM 0 HB ILE A 69 6.538 -7.760 -10.583 1.00 0.54 H new ATOM 0 HG12 ILE A 69 4.249 -9.680 -10.587 1.00 0.66 H new ATOM 0 HG13 ILE A 69 4.471 -8.707 -12.027 1.00 0.66 H new ATOM 0 HG21 ILE A 69 6.083 -9.221 -8.653 1.00 0.57 H new ATOM 0 HG22 ILE A 69 5.894 -7.503 -8.230 1.00 0.57 H new ATOM 0 HG23 ILE A 69 4.456 -8.516 -8.502 1.00 0.57 H new ATOM 0 HD11 ILE A 69 5.621 -10.849 -12.231 1.00 0.78 H new ATOM 0 HD12 ILE A 69 6.792 -9.509 -12.228 1.00 0.78 H new ATOM 0 HD13 ILE A 69 6.566 -10.497 -10.765 1.00 0.78 H new ATOM 1103 N LEU A 70 2.579 -7.123 -11.622 1.00 0.56 N ATOM 1104 CA LEU A 70 1.184 -7.472 -11.734 1.00 0.64 C ATOM 1105 C LEU A 70 0.982 -8.346 -12.946 1.00 0.64 C ATOM 1106 O LEU A 70 1.701 -8.235 -13.942 1.00 0.67 O ATOM 1107 CB LEU A 70 0.307 -6.212 -11.812 1.00 0.74 C ATOM 1108 CG LEU A 70 1.043 -4.880 -12.044 1.00 0.66 C ATOM 1109 CD1 LEU A 70 1.684 -4.823 -13.426 1.00 0.96 C ATOM 1110 CD2 LEU A 70 0.089 -3.711 -11.853 1.00 1.18 C ATOM 0 H LEU A 70 3.038 -6.947 -12.516 1.00 0.56 H new ATOM 0 HA LEU A 70 0.883 -8.024 -10.844 1.00 0.64 H new ATOM 0 HB2 LEU A 70 -0.416 -6.348 -12.617 1.00 0.74 H new ATOM 0 HB3 LEU A 70 -0.260 -6.132 -10.884 1.00 0.74 H new ATOM 0 HG LEU A 70 1.843 -4.811 -11.307 1.00 0.66 H new ATOM 0 HD11 LEU A 70 2.194 -3.868 -13.552 1.00 0.96 H new ATOM 0 HD12 LEU A 70 2.404 -5.635 -13.527 1.00 0.96 H new ATOM 0 HD13 LEU A 70 0.913 -4.926 -14.189 1.00 0.96 H new ATOM 0 HD21 LEU A 70 0.622 -2.775 -12.020 1.00 1.18 H new ATOM 0 HD22 LEU A 70 -0.733 -3.792 -12.564 1.00 1.18 H new ATOM 0 HD23 LEU A 70 -0.307 -3.727 -10.838 1.00 1.18 H new ATOM 1122 N VAL A 71 0.023 -9.236 -12.842 1.00 0.70 N ATOM 1123 CA VAL A 71 -0.236 -10.187 -13.893 1.00 0.74 C ATOM 1124 C VAL A 71 -1.022 -9.525 -15.011 1.00 0.83 C ATOM 1125 O VAL A 71 -2.207 -9.220 -14.866 1.00 0.99 O ATOM 1126 CB VAL A 71 -0.985 -11.413 -13.350 1.00 0.82 C ATOM 1127 CG1 VAL A 71 -1.033 -12.509 -14.400 1.00 0.88 C ATOM 1128 CG2 VAL A 71 -0.313 -11.909 -12.076 1.00 0.84 C ATOM 0 H VAL A 71 -0.594 -9.320 -12.034 1.00 0.70 H new ATOM 0 HA VAL A 71 0.718 -10.531 -14.294 1.00 0.74 H new ATOM 0 HB VAL A 71 -2.010 -11.128 -13.112 1.00 0.82 H new ATOM 0 HG11 VAL A 71 -1.567 -13.372 -14.001 1.00 0.88 H new ATOM 0 HG12 VAL A 71 -1.549 -12.141 -15.287 1.00 0.88 H new ATOM 0 HG13 VAL A 71 -0.018 -12.802 -14.667 1.00 0.88 H new ATOM 0 HG21 VAL A 71 -0.850 -12.779 -11.696 1.00 0.84 H new ATOM 0 HG22 VAL A 71 0.719 -12.185 -12.293 1.00 0.84 H new ATOM 0 HG23 VAL A 71 -0.327 -11.118 -11.326 1.00 0.84 H new ATOM 1186 N GLY A 75 0.041 -13.383 -18.269 1.00 0.97 N ATOM 1187 CA GLY A 75 1.479 -13.370 -18.079 1.00 0.88 C ATOM 1188 C GLY A 75 1.895 -12.467 -16.937 1.00 0.81 C ATOM 1189 O GLY A 75 1.062 -11.794 -16.340 1.00 0.81 O ATOM 0 HA2 GLY A 75 1.828 -14.384 -17.884 1.00 0.88 H new ATOM 0 HA3 GLY A 75 1.963 -13.038 -18.998 1.00 0.88 H new ATOM 1193 N CYS A 76 3.186 -12.412 -16.661 1.00 0.79 N ATOM 1194 CA CYS A 76 3.691 -11.631 -15.539 1.00 0.73 C ATOM 1195 C CYS A 76 4.487 -10.444 -16.071 1.00 0.75 C ATOM 1196 O CYS A 76 5.149 -10.556 -17.102 1.00 0.92 O ATOM 1197 CB CYS A 76 4.616 -12.489 -14.664 1.00 0.78 C ATOM 1198 SG CYS A 76 6.137 -13.044 -15.516 1.00 1.26 S ATOM 0 H CYS A 76 3.906 -12.898 -17.196 1.00 0.79 H new ATOM 0 HA CYS A 76 2.846 -11.287 -14.943 1.00 0.73 H new ATOM 0 HB2 CYS A 76 4.895 -11.918 -13.779 1.00 0.78 H new ATOM 0 HB3 CYS A 76 4.065 -13.364 -14.319 1.00 0.78 H new ATOM 1203 N ARG A 77 4.414 -9.310 -15.394 1.00 0.65 N ATOM 1204 CA ARG A 77 5.214 -8.157 -15.779 1.00 0.67 C ATOM 1205 C ARG A 77 5.405 -7.238 -14.585 1.00 0.57 C ATOM 1206 O ARG A 77 4.485 -7.036 -13.791 1.00 0.56 O ATOM 1207 CB ARG A 77 4.541 -7.383 -16.917 1.00 0.79 C ATOM 1208 CG ARG A 77 5.412 -6.302 -17.547 1.00 1.22 C ATOM 1209 CD ARG A 77 6.321 -6.860 -18.633 1.00 1.46 C ATOM 1210 NE ARG A 77 7.323 -7.791 -18.113 1.00 2.14 N ATOM 1211 CZ ARG A 77 7.693 -8.914 -18.732 1.00 2.81 C ATOM 1212 NH1 ARG A 77 7.141 -9.253 -19.893 1.00 3.04 N ATOM 1213 NH2 ARG A 77 8.620 -9.691 -18.189 1.00 3.68 N ATOM 0 H ARG A 77 3.815 -9.162 -14.582 1.00 0.65 H new ATOM 0 HA ARG A 77 6.184 -8.514 -16.125 1.00 0.67 H new ATOM 0 HB2 ARG A 77 4.242 -8.088 -17.692 1.00 0.79 H new ATOM 0 HB3 ARG A 77 3.630 -6.922 -16.537 1.00 0.79 H new ATOM 0 HG2 ARG A 77 4.775 -5.526 -17.971 1.00 1.22 H new ATOM 0 HG3 ARG A 77 6.019 -5.830 -16.774 1.00 1.22 H new ATOM 0 HD2 ARG A 77 5.714 -7.368 -19.382 1.00 1.46 H new ATOM 0 HD3 ARG A 77 6.825 -6.035 -19.137 1.00 1.46 H new ATOM 0 HE ARG A 77 7.766 -7.568 -17.222 1.00 2.14 H new ATOM 0 HH11 ARG A 77 6.431 -8.654 -20.315 1.00 3.04 H new ATOM 0 HH12 ARG A 77 7.427 -10.112 -20.362 1.00 3.04 H new ATOM 0 HH21 ARG A 77 9.048 -9.430 -17.301 1.00 3.68 H new ATOM 0 HH22 ARG A 77 8.905 -10.550 -18.659 1.00 3.68 H new ATOM 1227 N TYR A 78 6.600 -6.699 -14.453 1.00 0.56 N ATOM 1228 CA TYR A 78 6.886 -5.740 -13.405 1.00 0.48 C ATOM 1229 C TYR A 78 6.504 -4.343 -13.876 1.00 0.47 C ATOM 1230 O TYR A 78 7.013 -3.869 -14.890 1.00 0.53 O ATOM 1231 CB TYR A 78 8.371 -5.774 -13.027 1.00 0.47 C ATOM 1232 CG TYR A 78 8.834 -7.097 -12.446 1.00 0.53 C ATOM 1233 CD1 TYR A 78 8.477 -7.483 -11.158 1.00 0.47 C ATOM 1234 CD2 TYR A 78 9.628 -7.962 -13.188 1.00 0.70 C ATOM 1235 CE1 TYR A 78 8.898 -8.691 -10.631 1.00 0.54 C ATOM 1236 CE2 TYR A 78 10.053 -9.170 -12.667 1.00 0.79 C ATOM 1237 CZ TYR A 78 9.685 -9.530 -11.388 1.00 0.70 C ATOM 1238 OH TYR A 78 10.104 -10.733 -10.866 1.00 0.80 O ATOM 0 H TYR A 78 7.392 -6.910 -15.061 1.00 0.56 H new ATOM 0 HA TYR A 78 6.302 -6.002 -12.523 1.00 0.48 H new ATOM 0 HB2 TYR A 78 8.965 -5.551 -13.913 1.00 0.47 H new ATOM 0 HB3 TYR A 78 8.569 -4.983 -12.303 1.00 0.47 H new ATOM 0 HD1 TYR A 78 7.861 -6.829 -10.559 1.00 0.47 H new ATOM 0 HD2 TYR A 78 9.919 -7.686 -14.191 1.00 0.70 H new ATOM 0 HE1 TYR A 78 8.610 -8.975 -9.629 1.00 0.54 H new ATOM 0 HE2 TYR A 78 10.671 -9.829 -13.259 1.00 0.79 H new ATOM 0 HH TYR A 78 9.334 -11.330 -10.760 1.00 0.80 H new ATOM 1248 N TRP A 79 5.596 -3.696 -13.168 1.00 0.47 N ATOM 1249 CA TRP A 79 5.232 -2.326 -13.487 1.00 0.51 C ATOM 1250 C TRP A 79 5.929 -1.384 -12.519 1.00 0.46 C ATOM 1251 O TRP A 79 5.572 -1.304 -11.346 1.00 0.45 O ATOM 1252 CB TRP A 79 3.717 -2.132 -13.415 1.00 0.61 C ATOM 1253 CG TRP A 79 3.280 -0.799 -13.947 1.00 0.72 C ATOM 1254 CD1 TRP A 79 2.679 0.210 -13.250 1.00 1.33 C ATOM 1255 CD2 TRP A 79 3.438 -0.323 -15.288 1.00 1.44 C ATOM 1256 NE1 TRP A 79 2.446 1.281 -14.081 1.00 1.23 N ATOM 1257 CE2 TRP A 79 2.903 0.977 -15.337 1.00 1.32 C ATOM 1258 CE3 TRP A 79 3.976 -0.874 -16.455 1.00 2.64 C ATOM 1259 CZ2 TRP A 79 2.895 1.735 -16.503 1.00 2.09 C ATOM 1260 CZ3 TRP A 79 3.969 -0.121 -17.612 1.00 3.53 C ATOM 1261 CH2 TRP A 79 3.432 1.170 -17.629 1.00 3.20 C ATOM 0 H TRP A 79 5.099 -4.094 -12.372 1.00 0.47 H new ATOM 0 HA TRP A 79 5.550 -2.105 -14.506 1.00 0.51 H new ATOM 0 HB2 TRP A 79 3.226 -2.924 -13.981 1.00 0.61 H new ATOM 0 HB3 TRP A 79 3.391 -2.231 -12.380 1.00 0.61 H new ATOM 0 HD1 TRP A 79 2.424 0.173 -12.201 1.00 1.33 H new ATOM 0 HE1 TRP A 79 2.005 2.159 -13.807 1.00 1.23 H new ATOM 0 HE3 TRP A 79 4.390 -1.872 -16.451 1.00 2.64 H new ATOM 0 HZ2 TRP A 79 2.481 2.732 -16.520 1.00 2.09 H new ATOM 0 HZ3 TRP A 79 4.385 -0.536 -18.518 1.00 3.53 H new ATOM 0 HH2 TRP A 79 3.441 1.734 -18.550 1.00 3.20 H new ATOM 1272 N ILE A 80 6.931 -0.679 -13.004 1.00 0.46 N ATOM 1273 CA ILE A 80 7.755 0.133 -12.133 1.00 0.42 C ATOM 1274 C ILE A 80 7.330 1.603 -12.176 1.00 0.42 C ATOM 1275 O ILE A 80 7.332 2.237 -13.231 1.00 0.49 O ATOM 1276 CB ILE A 80 9.264 0.004 -12.464 1.00 0.43 C ATOM 1277 CG1 ILE A 80 9.718 -1.466 -12.469 1.00 0.48 C ATOM 1278 CG2 ILE A 80 10.082 0.774 -11.446 1.00 0.40 C ATOM 1279 CD1 ILE A 80 9.420 -2.213 -13.750 1.00 0.55 C ATOM 0 H ILE A 80 7.193 -0.652 -13.989 1.00 0.46 H new ATOM 0 HA ILE A 80 7.603 -0.246 -11.122 1.00 0.42 H new ATOM 0 HB ILE A 80 9.421 0.416 -13.461 1.00 0.43 H new ATOM 0 HG12 ILE A 80 10.792 -1.502 -12.285 1.00 0.48 H new ATOM 0 HG13 ILE A 80 9.235 -1.985 -11.641 1.00 0.48 H new ATOM 0 HG21 ILE A 80 11.141 0.679 -11.684 1.00 0.40 H new ATOM 0 HG22 ILE A 80 9.797 1.826 -11.471 1.00 0.40 H new ATOM 0 HG23 ILE A 80 9.896 0.371 -10.450 1.00 0.40 H new ATOM 0 HD11 ILE A 80 9.775 -3.240 -13.663 1.00 0.55 H new ATOM 0 HD12 ILE A 80 8.345 -2.214 -13.929 1.00 0.55 H new ATOM 0 HD13 ILE A 80 9.926 -1.724 -14.583 1.00 0.55 H new ATOM 1291 N ARG A 81 6.952 2.119 -11.014 1.00 0.41 N ATOM 1292 CA ARG A 81 6.537 3.510 -10.858 1.00 0.44 C ATOM 1293 C ARG A 81 7.551 4.216 -9.954 1.00 0.35 C ATOM 1294 O ARG A 81 8.581 3.636 -9.626 1.00 0.42 O ATOM 1295 CB ARG A 81 5.128 3.559 -10.253 1.00 0.57 C ATOM 1296 CG ARG A 81 4.298 4.762 -10.685 1.00 1.21 C ATOM 1297 CD ARG A 81 2.864 4.643 -10.187 1.00 1.97 C ATOM 1298 NE ARG A 81 1.998 5.719 -10.679 1.00 2.78 N ATOM 1299 CZ ARG A 81 0.667 5.622 -10.769 1.00 3.79 C ATOM 1300 NH1 ARG A 81 0.053 4.497 -10.417 1.00 4.16 N ATOM 1301 NH2 ARG A 81 -0.051 6.645 -11.217 1.00 4.76 N ATOM 0 H ARG A 81 6.924 1.582 -10.147 1.00 0.41 H new ATOM 0 HA ARG A 81 6.506 4.015 -11.823 1.00 0.44 H new ATOM 0 HB2 ARG A 81 4.596 2.648 -10.528 1.00 0.57 H new ATOM 0 HB3 ARG A 81 5.212 3.563 -9.166 1.00 0.57 H new ATOM 0 HG2 ARG A 81 4.747 5.676 -10.297 1.00 1.21 H new ATOM 0 HG3 ARG A 81 4.304 4.841 -11.772 1.00 1.21 H new ATOM 0 HD2 ARG A 81 2.455 3.682 -10.500 1.00 1.97 H new ATOM 0 HD3 ARG A 81 2.861 4.651 -9.097 1.00 1.97 H new ATOM 0 HE ARG A 81 2.436 6.593 -10.970 1.00 2.78 H new ATOM 0 HH11 ARG A 81 0.597 3.704 -10.077 1.00 4.16 H new ATOM 0 HH12 ARG A 81 -0.962 4.427 -10.487 1.00 4.16 H new ATOM 0 HH21 ARG A 81 0.412 7.510 -11.495 1.00 4.76 H new ATOM 0 HH22 ARG A 81 -1.066 6.566 -11.284 1.00 4.76 H new ATOM 1315 N THR A 82 7.282 5.446 -9.538 1.00 0.41 N ATOM 1316 CA THR A 82 8.250 6.175 -8.728 1.00 0.35 C ATOM 1317 C THR A 82 7.617 6.646 -7.429 1.00 0.32 C ATOM 1318 O THR A 82 6.572 7.295 -7.440 1.00 0.36 O ATOM 1319 CB THR A 82 8.834 7.387 -9.491 1.00 0.38 C ATOM 1320 OG1 THR A 82 9.113 7.012 -10.844 1.00 0.45 O ATOM 1321 CG2 THR A 82 10.122 7.901 -8.835 1.00 0.36 C ATOM 0 H THR A 82 6.420 5.952 -9.742 1.00 0.41 H new ATOM 0 HA THR A 82 9.065 5.487 -8.503 1.00 0.35 H new ATOM 0 HB THR A 82 8.094 8.187 -9.464 1.00 0.38 H new ATOM 0 HG1 THR A 82 9.481 7.781 -11.327 1.00 0.45 H new ATOM 0 HG21 THR A 82 10.503 8.753 -9.399 1.00 0.36 H new ATOM 0 HG22 THR A 82 9.911 8.209 -7.811 1.00 0.36 H new ATOM 0 HG23 THR A 82 10.869 7.107 -8.828 1.00 0.36 H new ATOM 1329 N PHE A 83 8.243 6.291 -6.320 1.00 0.27 N ATOM 1330 CA PHE A 83 7.824 6.762 -5.011 1.00 0.26 C ATOM 1331 C PHE A 83 8.889 7.681 -4.451 1.00 0.26 C ATOM 1332 O PHE A 83 10.066 7.340 -4.426 1.00 0.36 O ATOM 1333 CB PHE A 83 7.587 5.595 -4.041 1.00 0.26 C ATOM 1334 CG PHE A 83 6.277 4.873 -4.215 1.00 0.29 C ATOM 1335 CD1 PHE A 83 5.076 5.558 -4.277 1.00 0.37 C ATOM 1336 CD2 PHE A 83 6.257 3.498 -4.301 1.00 0.33 C ATOM 1337 CE1 PHE A 83 3.881 4.872 -4.428 1.00 0.44 C ATOM 1338 CE2 PHE A 83 5.078 2.801 -4.449 1.00 0.38 C ATOM 1339 CZ PHE A 83 3.883 3.491 -4.514 1.00 0.42 C ATOM 0 H PHE A 83 9.053 5.671 -6.301 1.00 0.27 H new ATOM 0 HA PHE A 83 6.882 7.299 -5.124 1.00 0.26 H new ATOM 0 HB2 PHE A 83 8.398 4.876 -4.158 1.00 0.26 H new ATOM 0 HB3 PHE A 83 7.642 5.975 -3.021 1.00 0.26 H new ATOM 0 HD1 PHE A 83 5.070 6.636 -4.207 1.00 0.37 H new ATOM 0 HD2 PHE A 83 7.188 2.953 -4.251 1.00 0.33 H new ATOM 0 HE1 PHE A 83 2.949 5.415 -4.478 1.00 0.44 H new ATOM 0 HE2 PHE A 83 5.088 1.723 -4.514 1.00 0.38 H new ATOM 0 HZ PHE A 83 2.953 2.954 -4.632 1.00 0.42 H new ATOM 1349 N VAL A 84 8.478 8.847 -4.023 1.00 0.24 N ATOM 1350 CA VAL A 84 9.403 9.833 -3.506 1.00 0.24 C ATOM 1351 C VAL A 84 8.885 10.385 -2.183 1.00 0.24 C ATOM 1352 O VAL A 84 7.711 10.744 -2.066 1.00 0.27 O ATOM 1353 CB VAL A 84 9.609 10.988 -4.515 1.00 0.27 C ATOM 1354 CG1 VAL A 84 10.403 10.527 -5.732 1.00 0.30 C ATOM 1355 CG2 VAL A 84 8.271 11.541 -4.956 1.00 0.29 C ATOM 0 H VAL A 84 7.502 9.142 -4.021 1.00 0.24 H new ATOM 0 HA VAL A 84 10.365 9.347 -3.345 1.00 0.24 H new ATOM 0 HB VAL A 84 10.178 11.771 -4.014 1.00 0.27 H new ATOM 0 HG11 VAL A 84 10.530 11.362 -6.421 1.00 0.30 H new ATOM 0 HG12 VAL A 84 11.381 10.167 -5.413 1.00 0.30 H new ATOM 0 HG13 VAL A 84 9.866 9.722 -6.233 1.00 0.30 H new ATOM 0 HG21 VAL A 84 8.429 12.353 -5.666 1.00 0.29 H new ATOM 0 HG22 VAL A 84 7.690 10.751 -5.432 1.00 0.29 H new ATOM 0 HG23 VAL A 84 7.729 11.918 -4.088 1.00 0.29 H new ATOM 1365 N PRO A 85 9.742 10.418 -1.154 1.00 0.35 N ATOM 1366 CA PRO A 85 9.377 10.952 0.158 1.00 0.34 C ATOM 1367 C PRO A 85 8.911 12.400 0.066 1.00 0.38 C ATOM 1368 O PRO A 85 9.492 13.208 -0.661 1.00 0.52 O ATOM 1369 CB PRO A 85 10.671 10.851 0.976 1.00 0.49 C ATOM 1370 CG PRO A 85 11.760 10.636 -0.021 1.00 0.78 C ATOM 1371 CD PRO A 85 11.127 9.936 -1.187 1.00 0.56 C ATOM 0 HA PRO A 85 8.547 10.405 0.605 1.00 0.34 H new ATOM 0 HB2 PRO A 85 10.842 11.760 1.553 1.00 0.49 H new ATOM 0 HB3 PRO A 85 10.622 10.026 1.687 1.00 0.49 H new ATOM 0 HG2 PRO A 85 12.199 11.585 -0.328 1.00 0.78 H new ATOM 0 HG3 PRO A 85 12.564 10.035 0.404 1.00 0.78 H new ATOM 0 HD2 PRO A 85 11.620 10.190 -2.125 1.00 0.56 H new ATOM 0 HD3 PRO A 85 11.179 8.852 -1.083 1.00 0.56 H new ATOM 1379 N SER A 86 7.850 12.704 0.797 1.00 0.34 N ATOM 1380 CA SER A 86 7.272 14.039 0.831 1.00 0.46 C ATOM 1381 C SER A 86 8.167 14.990 1.636 1.00 0.58 C ATOM 1382 O SER A 86 9.394 14.975 1.508 1.00 0.93 O ATOM 1383 CB SER A 86 5.889 13.970 1.467 1.00 0.53 C ATOM 1384 OG SER A 86 5.983 13.516 2.803 1.00 1.27 O ATOM 0 H SER A 86 7.363 12.029 1.386 1.00 0.34 H new ATOM 0 HA SER A 86 7.191 14.419 -0.187 1.00 0.46 H new ATOM 0 HB2 SER A 86 5.421 14.954 1.443 1.00 0.53 H new ATOM 0 HB3 SER A 86 5.250 13.299 0.892 1.00 0.53 H new ATOM 0 HG SER A 86 5.355 14.017 3.364 1.00 1.27 H new ATOM 1390 N SER A 87 7.539 15.817 2.467 1.00 0.75 N ATOM 1391 CA SER A 87 8.253 16.729 3.342 1.00 0.90 C ATOM 1392 C SER A 87 9.043 15.951 4.391 1.00 0.79 C ATOM 1393 O SER A 87 10.006 16.457 4.970 1.00 0.89 O ATOM 1394 CB SER A 87 7.254 17.659 4.025 1.00 1.12 C ATOM 1395 OG SER A 87 6.345 18.196 3.077 1.00 1.70 O ATOM 0 H SER A 87 6.524 15.871 2.549 1.00 0.75 H new ATOM 0 HA SER A 87 8.953 17.318 2.750 1.00 0.90 H new ATOM 0 HB2 SER A 87 6.707 17.113 4.793 1.00 1.12 H new ATOM 0 HB3 SER A 87 7.785 18.468 4.526 1.00 1.12 H new ATOM 0 HG SER A 87 5.710 18.789 3.532 1.00 1.70 H new ATOM 1401 N ARG A 88 8.633 14.711 4.620 1.00 0.64 N ATOM 1402 CA ARG A 88 9.282 13.862 5.606 1.00 0.58 C ATOM 1403 C ARG A 88 9.368 12.424 5.108 1.00 0.49 C ATOM 1404 O ARG A 88 8.376 11.854 4.643 1.00 0.46 O ATOM 1405 CB ARG A 88 8.547 13.909 6.954 1.00 0.66 C ATOM 1406 CG ARG A 88 7.090 13.469 6.894 1.00 0.75 C ATOM 1407 CD ARG A 88 6.172 14.596 6.455 1.00 1.11 C ATOM 1408 NE ARG A 88 6.171 15.716 7.392 1.00 1.51 N ATOM 1409 CZ ARG A 88 5.190 16.612 7.469 1.00 1.84 C ATOM 1410 NH1 ARG A 88 4.121 16.494 6.693 1.00 1.95 N ATOM 1411 NH2 ARG A 88 5.268 17.623 8.324 1.00 2.59 N ATOM 0 H ARG A 88 7.852 14.271 4.134 1.00 0.64 H new ATOM 0 HA ARG A 88 10.292 14.245 5.754 1.00 0.58 H new ATOM 0 HB2 ARG A 88 9.076 13.274 7.665 1.00 0.66 H new ATOM 0 HB3 ARG A 88 8.590 14.927 7.342 1.00 0.66 H new ATOM 0 HG2 ARG A 88 6.992 12.632 6.203 1.00 0.75 H new ATOM 0 HG3 ARG A 88 6.779 13.110 7.875 1.00 0.75 H new ATOM 0 HD2 ARG A 88 6.482 14.950 5.472 1.00 1.11 H new ATOM 0 HD3 ARG A 88 5.157 14.213 6.351 1.00 1.11 H new ATOM 0 HE ARG A 88 6.966 15.817 8.023 1.00 1.51 H new ATOM 0 HH11 ARG A 88 4.050 15.716 6.037 1.00 1.95 H new ATOM 0 HH12 ARG A 88 3.369 17.181 6.752 1.00 1.95 H new ATOM 0 HH21 ARG A 88 6.084 17.718 8.928 1.00 2.59 H new ATOM 0 HH22 ARG A 88 4.512 18.306 8.377 1.00 2.59 H new ATOM 1425 N PRO A 89 10.571 11.833 5.175 1.00 0.49 N ATOM 1426 CA PRO A 89 10.795 10.432 4.815 1.00 0.48 C ATOM 1427 C PRO A 89 9.853 9.500 5.569 1.00 0.48 C ATOM 1428 O PRO A 89 9.818 9.493 6.799 1.00 0.62 O ATOM 1429 CB PRO A 89 12.248 10.185 5.225 1.00 0.58 C ATOM 1430 CG PRO A 89 12.884 11.528 5.177 1.00 0.70 C ATOM 1431 CD PRO A 89 11.817 12.496 5.599 1.00 0.56 C ATOM 0 HA PRO A 89 10.608 10.239 3.759 1.00 0.48 H new ATOM 0 HB2 PRO A 89 12.310 9.752 6.223 1.00 0.58 H new ATOM 0 HB3 PRO A 89 12.739 9.489 4.545 1.00 0.58 H new ATOM 0 HG2 PRO A 89 13.745 11.578 5.844 1.00 0.70 H new ATOM 0 HG3 PRO A 89 13.245 11.755 4.174 1.00 0.70 H new ATOM 0 HD2 PRO A 89 11.834 12.670 6.675 1.00 0.56 H new ATOM 0 HD3 PRO A 89 11.941 13.466 5.117 1.00 0.56 H new ATOM 1439 N GLY A 90 9.093 8.724 4.818 1.00 0.41 N ATOM 1440 CA GLY A 90 8.060 7.893 5.390 1.00 0.42 C ATOM 1441 C GLY A 90 6.741 8.156 4.706 1.00 0.38 C ATOM 1442 O GLY A 90 6.094 7.234 4.216 1.00 0.43 O ATOM 0 H GLY A 90 9.176 8.655 3.804 1.00 0.41 H new ATOM 0 HA2 GLY A 90 8.329 6.842 5.285 1.00 0.42 H new ATOM 0 HA3 GLY A 90 7.971 8.094 6.458 1.00 0.42 H new ATOM 1446 N GLN A 91 6.369 9.429 4.651 1.00 0.33 N ATOM 1447 CA GLN A 91 5.199 9.871 3.897 1.00 0.31 C ATOM 1448 C GLN A 91 5.590 9.952 2.425 1.00 0.26 C ATOM 1449 O GLN A 91 6.492 10.704 2.059 1.00 0.30 O ATOM 1450 CB GLN A 91 4.731 11.240 4.407 1.00 0.39 C ATOM 1451 CG GLN A 91 3.484 11.765 3.710 1.00 0.61 C ATOM 1452 CD GLN A 91 3.114 13.173 4.149 1.00 0.61 C ATOM 1453 OE1 GLN A 91 3.976 13.972 4.511 1.00 1.11 O ATOM 1454 NE2 GLN A 91 1.834 13.497 4.103 1.00 1.03 N ATOM 0 H GLN A 91 6.867 10.183 5.125 1.00 0.33 H new ATOM 0 HA GLN A 91 4.376 9.168 4.024 1.00 0.31 H new ATOM 0 HB2 GLN A 91 4.535 11.170 5.477 1.00 0.39 H new ATOM 0 HB3 GLN A 91 5.538 11.961 4.277 1.00 0.39 H new ATOM 0 HG2 GLN A 91 3.644 11.756 2.632 1.00 0.61 H new ATOM 0 HG3 GLN A 91 2.649 11.094 3.914 1.00 0.61 H new ATOM 0 HE21 GLN A 91 1.145 12.810 3.798 1.00 1.03 H new ATOM 0 HE22 GLN A 91 1.535 14.434 4.373 1.00 1.03 H new ATOM 1463 N PHE A 92 4.948 9.158 1.586 1.00 0.24 N ATOM 1464 CA PHE A 92 5.389 9.019 0.212 1.00 0.24 C ATOM 1465 C PHE A 92 4.442 9.667 -0.771 1.00 0.26 C ATOM 1466 O PHE A 92 3.221 9.623 -0.623 1.00 0.35 O ATOM 1467 CB PHE A 92 5.577 7.547 -0.148 1.00 0.31 C ATOM 1468 CG PHE A 92 6.645 6.875 0.658 1.00 0.33 C ATOM 1469 CD1 PHE A 92 7.915 7.424 0.736 1.00 0.32 C ATOM 1470 CD2 PHE A 92 6.382 5.698 1.337 1.00 0.42 C ATOM 1471 CE1 PHE A 92 8.902 6.809 1.478 1.00 0.40 C ATOM 1472 CE2 PHE A 92 7.365 5.080 2.080 1.00 0.50 C ATOM 1473 CZ PHE A 92 8.626 5.636 2.151 1.00 0.48 C ATOM 0 H PHE A 92 4.127 8.605 1.830 1.00 0.24 H new ATOM 0 HA PHE A 92 6.344 9.539 0.139 1.00 0.24 H new ATOM 0 HB2 PHE A 92 4.634 7.020 -0.001 1.00 0.31 H new ATOM 0 HB3 PHE A 92 5.825 7.467 -1.206 1.00 0.31 H new ATOM 0 HD1 PHE A 92 8.134 8.342 0.211 1.00 0.32 H new ATOM 0 HD2 PHE A 92 5.397 5.259 1.284 1.00 0.42 H new ATOM 0 HE1 PHE A 92 9.889 7.245 1.532 1.00 0.40 H new ATOM 0 HE2 PHE A 92 7.149 4.162 2.606 1.00 0.50 H new ATOM 0 HZ PHE A 92 9.397 5.153 2.733 1.00 0.48 H new ATOM 1483 N THR A 93 5.051 10.272 -1.767 1.00 0.23 N ATOM 1484 CA THR A 93 4.363 10.861 -2.891 1.00 0.27 C ATOM 1485 C THR A 93 4.864 10.161 -4.156 1.00 0.26 C ATOM 1486 O THR A 93 5.725 9.280 -4.067 1.00 0.25 O ATOM 1487 CB THR A 93 4.623 12.390 -2.978 1.00 0.35 C ATOM 1488 OG1 THR A 93 6.014 12.651 -3.196 1.00 1.29 O ATOM 1489 CG2 THR A 93 4.193 13.104 -1.704 1.00 0.92 C ATOM 0 H THR A 93 6.065 10.370 -1.817 1.00 0.23 H new ATOM 0 HA THR A 93 3.287 10.729 -2.776 1.00 0.27 H new ATOM 0 HB THR A 93 4.034 12.766 -3.814 1.00 0.35 H new ATOM 0 HG1 THR A 93 6.551 12.033 -2.657 1.00 1.29 H new ATOM 0 HG21 THR A 93 4.390 14.172 -1.801 1.00 0.92 H new ATOM 0 HG22 THR A 93 3.127 12.945 -1.540 1.00 0.92 H new ATOM 0 HG23 THR A 93 4.754 12.707 -0.858 1.00 0.92 H new ATOM 1497 N LEU A 94 4.361 10.529 -5.325 1.00 0.34 N ATOM 1498 CA LEU A 94 4.814 9.880 -6.556 1.00 0.37 C ATOM 1499 C LEU A 94 5.947 10.678 -7.174 1.00 0.34 C ATOM 1500 O LEU A 94 5.951 11.904 -7.139 1.00 0.39 O ATOM 1501 CB LEU A 94 3.692 9.781 -7.600 1.00 0.54 C ATOM 1502 CG LEU A 94 2.498 8.903 -7.241 1.00 0.50 C ATOM 1503 CD1 LEU A 94 2.957 7.608 -6.591 1.00 0.88 C ATOM 1504 CD2 LEU A 94 1.510 9.667 -6.368 1.00 0.75 C ATOM 0 H LEU A 94 3.656 11.255 -5.452 1.00 0.34 H new ATOM 0 HA LEU A 94 5.140 8.876 -6.283 1.00 0.37 H new ATOM 0 HB2 LEU A 94 3.326 10.787 -7.802 1.00 0.54 H new ATOM 0 HB3 LEU A 94 4.123 9.406 -8.528 1.00 0.54 H new ATOM 0 HG LEU A 94 1.975 8.633 -8.158 1.00 0.50 H new ATOM 0 HD11 LEU A 94 2.089 6.997 -6.343 1.00 0.88 H new ATOM 0 HD12 LEU A 94 3.599 7.062 -7.282 1.00 0.88 H new ATOM 0 HD13 LEU A 94 3.513 7.835 -5.681 1.00 0.88 H new ATOM 0 HD21 LEU A 94 0.666 9.022 -6.124 1.00 0.75 H new ATOM 0 HD22 LEU A 94 2.004 9.982 -5.449 1.00 0.75 H new ATOM 0 HD23 LEU A 94 1.152 10.545 -6.906 1.00 0.75 H new ATOM 1516 N GLY A 95 6.915 9.949 -7.735 1.00 0.32 N ATOM 1517 CA GLY A 95 8.091 10.556 -8.342 1.00 0.34 C ATOM 1518 C GLY A 95 7.739 11.622 -9.362 1.00 0.46 C ATOM 1519 O GLY A 95 8.530 12.523 -9.629 1.00 0.88 O ATOM 0 H GLY A 95 6.902 8.930 -7.779 1.00 0.32 H new ATOM 0 HA2 GLY A 95 8.711 10.997 -7.561 1.00 0.34 H new ATOM 0 HA3 GLY A 95 8.687 9.781 -8.824 1.00 0.34 H new ATOM 1523 N ASN A 96 6.544 11.507 -9.933 1.00 0.57 N ATOM 1524 CA ASN A 96 5.997 12.540 -10.798 1.00 0.71 C ATOM 1525 C ASN A 96 4.529 12.780 -10.443 1.00 0.61 C ATOM 1526 O ASN A 96 3.648 12.768 -11.302 1.00 0.66 O ATOM 1527 CB ASN A 96 6.152 12.161 -12.279 1.00 0.98 C ATOM 1528 CG ASN A 96 5.717 13.278 -13.221 1.00 1.89 C ATOM 1529 OD1 ASN A 96 5.756 14.461 -12.871 1.00 2.72 O ATOM 1530 ND2 ASN A 96 5.308 12.913 -14.427 1.00 2.42 N ATOM 0 H ASN A 96 5.933 10.700 -9.809 1.00 0.57 H new ATOM 0 HA ASN A 96 6.554 13.463 -10.640 1.00 0.71 H new ATOM 0 HB2 ASN A 96 7.193 11.908 -12.478 1.00 0.98 H new ATOM 0 HB3 ASN A 96 5.562 11.268 -12.485 1.00 0.98 H new ATOM 0 HD21 ASN A 96 5.012 13.619 -15.101 1.00 2.42 H new ATOM 0 HD22 ASN A 96 5.289 11.926 -14.682 1.00 2.42 H new ATOM 1537 N ILE A 97 4.268 12.954 -9.151 1.00 0.55 N ATOM 1538 CA ILE A 97 2.939 13.310 -8.672 1.00 0.57 C ATOM 1539 C ILE A 97 2.694 14.779 -8.921 1.00 0.74 C ATOM 1540 O ILE A 97 1.577 15.204 -9.142 1.00 0.88 O ATOM 1541 CB ILE A 97 2.776 13.049 -7.153 1.00 0.54 C ATOM 1542 CG1 ILE A 97 1.369 13.437 -6.674 1.00 0.68 C ATOM 1543 CG2 ILE A 97 3.833 13.831 -6.367 1.00 0.60 C ATOM 1544 CD1 ILE A 97 1.158 13.196 -5.199 1.00 1.20 C ATOM 0 H ILE A 97 4.965 12.853 -8.414 1.00 0.55 H new ATOM 0 HA ILE A 97 2.224 12.689 -9.211 1.00 0.57 H new ATOM 0 HB ILE A 97 2.914 11.983 -6.975 1.00 0.54 H new ATOM 0 HG12 ILE A 97 1.195 14.491 -6.892 1.00 0.68 H new ATOM 0 HG13 ILE A 97 0.630 12.868 -7.238 1.00 0.68 H new ATOM 0 HG21 ILE A 97 3.709 13.640 -5.301 1.00 0.60 H new ATOM 0 HG22 ILE A 97 4.828 13.513 -6.679 1.00 0.60 H new ATOM 0 HG23 ILE A 97 3.716 14.897 -6.561 1.00 0.60 H new ATOM 0 HD11 ILE A 97 0.145 13.490 -4.924 1.00 1.20 H new ATOM 0 HD12 ILE A 97 1.301 12.138 -4.979 1.00 1.20 H new ATOM 0 HD13 ILE A 97 1.875 13.786 -4.628 1.00 1.20 H new ATOM 1556 N HIS A 98 3.775 15.531 -8.937 1.00 0.85 N ATOM 1557 CA HIS A 98 3.727 16.980 -8.855 1.00 1.12 C ATOM 1558 C HIS A 98 3.189 17.619 -10.141 1.00 1.14 C ATOM 1559 O HIS A 98 3.176 18.842 -10.279 1.00 1.38 O ATOM 1560 CB HIS A 98 5.131 17.470 -8.513 1.00 1.38 C ATOM 1561 CG HIS A 98 5.180 18.805 -7.838 1.00 2.01 C ATOM 1562 ND1 HIS A 98 6.346 19.523 -7.686 1.00 2.88 N ATOM 1563 CD2 HIS A 98 4.212 19.534 -7.237 1.00 2.69 C ATOM 1564 CE1 HIS A 98 6.093 20.631 -7.021 1.00 3.63 C ATOM 1565 NE2 HIS A 98 4.805 20.665 -6.732 1.00 3.56 N ATOM 0 H HIS A 98 4.720 15.153 -9.008 1.00 0.85 H new ATOM 0 HA HIS A 98 3.027 17.282 -8.076 1.00 1.12 H new ATOM 0 HB2 HIS A 98 5.611 16.734 -7.868 1.00 1.38 H new ATOM 0 HB3 HIS A 98 5.717 17.520 -9.431 1.00 1.38 H new ATOM 0 HD2 HIS A 98 3.166 19.275 -7.167 1.00 2.69 H new ATOM 0 HE1 HIS A 98 6.818 21.386 -6.756 1.00 3.63 H new ATOM 0 HE2 HIS A 98 4.330 21.408 -6.219 1.00 3.56 H new ATOM 1574 N SER A 99 2.745 16.786 -11.073 1.00 0.99 N ATOM 1575 CA SER A 99 2.087 17.256 -12.284 1.00 1.16 C ATOM 1576 C SER A 99 0.648 16.729 -12.337 1.00 1.22 C ATOM 1577 O SER A 99 0.000 16.752 -13.387 1.00 1.30 O ATOM 1578 CB SER A 99 2.868 16.789 -13.514 1.00 1.24 C ATOM 1579 OG SER A 99 4.222 17.217 -13.449 1.00 1.79 O ATOM 0 H SER A 99 2.830 15.771 -11.011 1.00 0.99 H new ATOM 0 HA SER A 99 2.060 18.346 -12.276 1.00 1.16 H new ATOM 0 HB2 SER A 99 2.829 15.702 -13.583 1.00 1.24 H new ATOM 0 HB3 SER A 99 2.401 17.183 -14.417 1.00 1.24 H new ATOM 0 HG SER A 99 4.803 16.442 -13.303 1.00 1.79 H new ATOM 1585 N TYR A 100 0.171 16.267 -11.181 1.00 1.23 N ATOM 1586 CA TYR A 100 -1.137 15.623 -11.043 1.00 1.30 C ATOM 1587 C TYR A 100 -2.285 16.422 -11.672 1.00 1.17 C ATOM 1588 O TYR A 100 -2.419 17.626 -11.463 1.00 1.30 O ATOM 1589 CB TYR A 100 -1.427 15.345 -9.556 1.00 1.63 C ATOM 1590 CG TYR A 100 -1.325 16.548 -8.621 1.00 2.74 C ATOM 1591 CD1 TYR A 100 -2.264 17.573 -8.643 1.00 3.75 C ATOM 1592 CD2 TYR A 100 -0.289 16.639 -7.698 1.00 2.85 C ATOM 1593 CE1 TYR A 100 -2.169 18.650 -7.781 1.00 4.83 C ATOM 1594 CE2 TYR A 100 -0.189 17.709 -6.833 1.00 3.91 C ATOM 1595 CZ TYR A 100 -1.130 18.712 -6.878 1.00 4.89 C ATOM 1596 OH TYR A 100 -1.031 19.780 -6.015 1.00 5.98 O ATOM 0 H TYR A 100 0.687 16.330 -10.304 1.00 1.23 H new ATOM 0 HA TYR A 100 -1.085 14.686 -11.597 1.00 1.30 H new ATOM 0 HB2 TYR A 100 -2.431 14.929 -9.473 1.00 1.63 H new ATOM 0 HB3 TYR A 100 -0.735 14.579 -9.208 1.00 1.63 H new ATOM 0 HD1 TYR A 100 -3.082 17.527 -9.346 1.00 3.75 H new ATOM 0 HD2 TYR A 100 0.453 15.855 -7.657 1.00 2.85 H new ATOM 0 HE1 TYR A 100 -2.906 19.439 -7.815 1.00 4.83 H new ATOM 0 HE2 TYR A 100 0.624 17.759 -6.124 1.00 3.91 H new ATOM 0 HH TYR A 100 -0.242 19.667 -5.444 1.00 5.98 H new ATOM 1606 N PRO A 101 -3.101 15.744 -12.503 1.00 1.09 N ATOM 1607 CA PRO A 101 -4.306 16.333 -13.091 1.00 1.04 C ATOM 1608 C PRO A 101 -5.507 16.346 -12.135 1.00 0.89 C ATOM 1609 O PRO A 101 -6.124 17.386 -11.918 1.00 0.94 O ATOM 1610 CB PRO A 101 -4.582 15.423 -14.287 1.00 1.19 C ATOM 1611 CG PRO A 101 -4.029 14.093 -13.898 1.00 1.28 C ATOM 1612 CD PRO A 101 -2.886 14.355 -12.951 1.00 1.21 C ATOM 0 HA PRO A 101 -4.157 17.382 -13.347 1.00 1.04 H new ATOM 0 HB2 PRO A 101 -5.650 15.360 -14.497 1.00 1.19 H new ATOM 0 HB3 PRO A 101 -4.102 15.801 -15.189 1.00 1.19 H new ATOM 0 HG2 PRO A 101 -4.794 13.481 -13.420 1.00 1.28 H new ATOM 0 HG3 PRO A 101 -3.686 13.546 -14.776 1.00 1.28 H new ATOM 0 HD2 PRO A 101 -2.896 13.659 -12.112 1.00 1.21 H new ATOM 0 HD3 PRO A 101 -1.923 14.241 -13.448 1.00 1.21 H new ATOM 1620 N GLN A 102 -5.833 15.189 -11.555 1.00 0.82 N ATOM 1621 CA GLN A 102 -7.021 15.068 -10.705 1.00 0.74 C ATOM 1622 C GLN A 102 -6.640 14.728 -9.271 1.00 0.63 C ATOM 1623 O GLN A 102 -7.503 14.631 -8.394 1.00 0.59 O ATOM 1624 CB GLN A 102 -7.954 13.977 -11.235 1.00 0.83 C ATOM 1625 CG GLN A 102 -7.500 12.567 -10.874 1.00 0.98 C ATOM 1626 CD GLN A 102 -8.444 11.493 -11.373 1.00 1.30 C ATOM 1627 OE1 GLN A 102 -9.651 11.708 -11.477 1.00 1.95 O ATOM 1628 NE2 GLN A 102 -7.904 10.328 -11.688 1.00 1.73 N ATOM 0 H GLN A 102 -5.296 14.328 -11.657 1.00 0.82 H new ATOM 0 HA GLN A 102 -7.530 16.032 -10.723 1.00 0.74 H new ATOM 0 HB2 GLN A 102 -8.956 14.141 -10.838 1.00 0.83 H new ATOM 0 HB3 GLN A 102 -8.023 14.063 -12.319 1.00 0.83 H new ATOM 0 HG2 GLN A 102 -6.508 12.393 -11.291 1.00 0.98 H new ATOM 0 HG3 GLN A 102 -7.409 12.487 -9.791 1.00 0.98 H new ATOM 0 HE21 GLN A 102 -6.899 10.188 -11.588 1.00 1.73 H new ATOM 0 HE22 GLN A 102 -8.493 9.569 -12.031 1.00 1.73 H new ATOM 1637 N ILE A 103 -5.355 14.519 -9.045 1.00 0.60 N ATOM 1638 CA ILE A 103 -4.873 14.074 -7.752 1.00 0.51 C ATOM 1639 C ILE A 103 -4.892 15.229 -6.761 1.00 0.52 C ATOM 1640 O ILE A 103 -4.085 16.149 -6.834 1.00 0.65 O ATOM 1641 CB ILE A 103 -3.445 13.494 -7.868 1.00 0.54 C ATOM 1642 CG1 ILE A 103 -3.429 12.329 -8.858 1.00 0.63 C ATOM 1643 CG2 ILE A 103 -2.904 13.051 -6.510 1.00 0.43 C ATOM 1644 CD1 ILE A 103 -2.039 11.967 -9.322 1.00 1.10 C ATOM 0 H ILE A 103 -4.625 14.651 -9.745 1.00 0.60 H new ATOM 0 HA ILE A 103 -5.534 13.286 -7.392 1.00 0.51 H new ATOM 0 HB ILE A 103 -2.792 14.284 -8.238 1.00 0.54 H new ATOM 0 HG12 ILE A 103 -3.889 11.457 -8.392 1.00 0.63 H new ATOM 0 HG13 ILE A 103 -4.039 12.587 -9.724 1.00 0.63 H new ATOM 0 HG21 ILE A 103 -1.898 12.649 -6.633 1.00 0.43 H new ATOM 0 HG22 ILE A 103 -2.873 13.906 -5.834 1.00 0.43 H new ATOM 0 HG23 ILE A 103 -3.554 12.282 -6.093 1.00 0.43 H new ATOM 0 HD11 ILE A 103 -2.095 11.134 -10.022 1.00 1.10 H new ATOM 0 HD12 ILE A 103 -1.585 12.826 -9.816 1.00 1.10 H new ATOM 0 HD13 ILE A 103 -1.432 11.679 -8.463 1.00 1.10 H new ATOM 1656 N GLN A 104 -5.837 15.166 -5.850 1.00 0.45 N ATOM 1657 CA GLN A 104 -6.047 16.215 -4.865 1.00 0.48 C ATOM 1658 C GLN A 104 -4.907 16.205 -3.862 1.00 0.50 C ATOM 1659 O GLN A 104 -4.467 17.251 -3.383 1.00 0.63 O ATOM 1660 CB GLN A 104 -7.383 15.960 -4.176 1.00 0.46 C ATOM 1661 CG GLN A 104 -8.408 15.396 -5.144 1.00 0.43 C ATOM 1662 CD GLN A 104 -9.154 16.478 -5.899 1.00 0.52 C ATOM 1663 OE1 GLN A 104 -9.416 17.557 -5.369 1.00 1.40 O ATOM 1664 NE2 GLN A 104 -9.456 16.214 -7.158 1.00 0.98 N ATOM 0 H GLN A 104 -6.487 14.384 -5.767 1.00 0.45 H new ATOM 0 HA GLN A 104 -6.068 17.195 -5.341 1.00 0.48 H new ATOM 0 HB2 GLN A 104 -7.240 15.264 -3.349 1.00 0.46 H new ATOM 0 HB3 GLN A 104 -7.757 16.891 -3.749 1.00 0.46 H new ATOM 0 HG2 GLN A 104 -7.907 14.740 -5.856 1.00 0.43 H new ATOM 0 HG3 GLN A 104 -9.122 14.783 -4.594 1.00 0.43 H new ATOM 0 HE21 GLN A 104 -9.221 15.306 -7.559 1.00 0.98 H new ATOM 0 HE22 GLN A 104 -9.924 16.918 -7.729 1.00 0.98 H new ATOM 1673 N SER A 105 -4.439 14.999 -3.572 1.00 0.40 N ATOM 1674 CA SER A 105 -3.299 14.776 -2.711 1.00 0.41 C ATOM 1675 C SER A 105 -2.960 13.291 -2.718 1.00 0.36 C ATOM 1676 O SER A 105 -3.857 12.448 -2.814 1.00 0.39 O ATOM 1677 CB SER A 105 -3.603 15.251 -1.283 1.00 0.48 C ATOM 1678 OG SER A 105 -4.799 14.668 -0.789 1.00 1.13 O ATOM 0 H SER A 105 -4.850 14.140 -3.936 1.00 0.40 H new ATOM 0 HA SER A 105 -2.446 15.347 -3.079 1.00 0.41 H new ATOM 0 HB2 SER A 105 -2.772 14.992 -0.627 1.00 0.48 H new ATOM 0 HB3 SER A 105 -3.693 16.337 -1.270 1.00 0.48 H new ATOM 0 HG SER A 105 -4.966 14.987 0.122 1.00 1.13 H new ATOM 1684 N TYR A 106 -1.679 12.968 -2.671 1.00 0.35 N ATOM 1685 CA TYR A 106 -1.258 11.583 -2.545 1.00 0.34 C ATOM 1686 C TYR A 106 -0.167 11.481 -1.502 1.00 0.36 C ATOM 1687 O TYR A 106 0.936 12.003 -1.687 1.00 0.40 O ATOM 1688 CB TYR A 106 -0.742 11.010 -3.870 1.00 0.37 C ATOM 1689 CG TYR A 106 -0.570 9.506 -3.836 1.00 0.38 C ATOM 1690 CD1 TYR A 106 0.605 8.939 -3.362 1.00 0.41 C ATOM 1691 CD2 TYR A 106 -1.582 8.656 -4.258 1.00 0.39 C ATOM 1692 CE1 TYR A 106 0.769 7.568 -3.313 1.00 0.45 C ATOM 1693 CE2 TYR A 106 -1.427 7.282 -4.216 1.00 0.43 C ATOM 1694 CZ TYR A 106 -0.251 6.744 -3.743 1.00 0.46 C ATOM 1695 OH TYR A 106 -0.094 5.378 -3.701 1.00 0.52 O ATOM 0 H TYR A 106 -0.915 13.642 -2.718 1.00 0.35 H new ATOM 0 HA TYR A 106 -2.131 11.001 -2.248 1.00 0.34 H new ATOM 0 HB2 TYR A 106 -1.436 11.273 -4.668 1.00 0.37 H new ATOM 0 HB3 TYR A 106 0.214 11.474 -4.113 1.00 0.37 H new ATOM 0 HD1 TYR A 106 1.405 9.581 -3.025 1.00 0.41 H new ATOM 0 HD2 TYR A 106 -2.507 9.074 -4.626 1.00 0.39 H new ATOM 0 HE1 TYR A 106 1.690 7.144 -2.940 1.00 0.45 H new ATOM 0 HE2 TYR A 106 -2.224 6.635 -4.552 1.00 0.43 H new ATOM 0 HH TYR A 106 -0.906 4.945 -4.038 1.00 0.52 H new ATOM 1705 N ASP A 107 -0.483 10.838 -0.403 1.00 0.34 N ATOM 1706 CA ASP A 107 0.492 10.591 0.634 1.00 0.36 C ATOM 1707 C ASP A 107 0.244 9.252 1.293 1.00 0.38 C ATOM 1708 O ASP A 107 -0.853 8.960 1.761 1.00 0.46 O ATOM 1709 CB ASP A 107 0.535 11.712 1.684 1.00 0.48 C ATOM 1710 CG ASP A 107 -0.820 12.295 2.057 1.00 1.27 C ATOM 1711 OD1 ASP A 107 -1.833 11.584 1.999 1.00 1.31 O ATOM 1712 OD2 ASP A 107 -0.862 13.491 2.420 1.00 2.25 O ATOM 0 H ASP A 107 -1.414 10.474 -0.203 1.00 0.34 H new ATOM 0 HA ASP A 107 1.469 10.572 0.151 1.00 0.36 H new ATOM 0 HB2 ASP A 107 1.009 11.326 2.587 1.00 0.48 H new ATOM 0 HB3 ASP A 107 1.169 12.516 1.310 1.00 0.48 H new ATOM 1717 N VAL A 108 1.259 8.414 1.278 1.00 0.38 N ATOM 1718 CA VAL A 108 1.183 7.131 1.954 1.00 0.44 C ATOM 1719 C VAL A 108 2.353 6.995 2.911 1.00 0.47 C ATOM 1720 O VAL A 108 3.479 7.318 2.560 1.00 0.58 O ATOM 1721 CB VAL A 108 1.173 5.950 0.944 1.00 0.48 C ATOM 1722 CG1 VAL A 108 0.393 6.332 -0.294 1.00 0.68 C ATOM 1723 CG2 VAL A 108 2.574 5.501 0.549 1.00 0.70 C ATOM 0 H VAL A 108 2.145 8.595 0.807 1.00 0.38 H new ATOM 0 HA VAL A 108 0.246 7.092 2.510 1.00 0.44 H new ATOM 0 HB VAL A 108 0.693 5.110 1.445 1.00 0.48 H new ATOM 0 HG11 VAL A 108 0.392 5.498 -0.995 1.00 0.68 H new ATOM 0 HG12 VAL A 108 -0.633 6.574 -0.017 1.00 0.68 H new ATOM 0 HG13 VAL A 108 0.857 7.200 -0.763 1.00 0.68 H new ATOM 0 HG21 VAL A 108 2.505 4.674 -0.158 1.00 0.70 H new ATOM 0 HG22 VAL A 108 3.105 6.332 0.085 1.00 0.70 H new ATOM 0 HG23 VAL A 108 3.116 5.175 1.437 1.00 0.70 H new ATOM 1733 N GLN A 109 2.105 6.565 4.130 1.00 0.44 N ATOM 1734 CA GLN A 109 3.210 6.313 5.030 1.00 0.50 C ATOM 1735 C GLN A 109 2.928 5.115 5.900 1.00 0.30 C ATOM 1736 O GLN A 109 1.775 4.782 6.188 1.00 0.29 O ATOM 1737 CB GLN A 109 3.586 7.540 5.872 1.00 0.85 C ATOM 1738 CG GLN A 109 2.565 7.985 6.895 1.00 0.92 C ATOM 1739 CD GLN A 109 3.130 9.050 7.817 1.00 2.08 C ATOM 1740 OE1 GLN A 109 3.989 9.834 7.422 1.00 2.86 O ATOM 1741 NE2 GLN A 109 2.645 9.100 9.044 1.00 2.81 N ATOM 0 H GLN A 109 1.176 6.387 4.513 1.00 0.44 H new ATOM 0 HA GLN A 109 4.079 6.093 4.410 1.00 0.50 H new ATOM 0 HB2 GLN A 109 4.520 7.326 6.391 1.00 0.85 H new ATOM 0 HB3 GLN A 109 3.780 8.373 5.196 1.00 0.85 H new ATOM 0 HG2 GLN A 109 1.683 8.374 6.385 1.00 0.92 H new ATOM 0 HG3 GLN A 109 2.241 7.127 7.484 1.00 0.92 H new ATOM 0 HE21 GLN A 109 1.932 8.433 9.338 1.00 2.81 H new ATOM 0 HE22 GLN A 109 2.983 9.806 9.698 1.00 2.81 H new ATOM 1750 N VAL A 110 3.997 4.454 6.274 1.00 0.33 N ATOM 1751 CA VAL A 110 3.911 3.214 6.999 1.00 0.27 C ATOM 1752 C VAL A 110 3.902 3.486 8.504 1.00 0.30 C ATOM 1753 O VAL A 110 4.671 4.309 9.002 1.00 0.41 O ATOM 1754 CB VAL A 110 5.104 2.299 6.634 1.00 0.37 C ATOM 1755 CG1 VAL A 110 6.421 2.903 7.102 1.00 0.76 C ATOM 1756 CG2 VAL A 110 4.917 0.904 7.195 1.00 0.77 C ATOM 0 H VAL A 110 4.950 4.763 6.083 1.00 0.33 H new ATOM 0 HA VAL A 110 2.984 2.710 6.725 1.00 0.27 H new ATOM 0 HB VAL A 110 5.139 2.219 5.548 1.00 0.37 H new ATOM 0 HG11 VAL A 110 7.242 2.239 6.832 1.00 0.76 H new ATOM 0 HG12 VAL A 110 6.567 3.872 6.625 1.00 0.76 H new ATOM 0 HG13 VAL A 110 6.398 3.031 8.184 1.00 0.76 H new ATOM 0 HG21 VAL A 110 5.771 0.284 6.922 1.00 0.77 H new ATOM 0 HG22 VAL A 110 4.839 0.956 8.281 1.00 0.77 H new ATOM 0 HG23 VAL A 110 4.006 0.467 6.786 1.00 0.77 H new ATOM 1766 N ALA A 111 3.010 2.803 9.215 1.00 0.29 N ATOM 1767 CA ALA A 111 2.944 2.899 10.665 1.00 0.36 C ATOM 1768 C ALA A 111 4.245 2.400 11.275 1.00 0.37 C ATOM 1769 O ALA A 111 4.741 2.959 12.252 1.00 0.44 O ATOM 1770 CB ALA A 111 1.761 2.108 11.201 1.00 0.42 C ATOM 0 H ALA A 111 2.320 2.174 8.805 1.00 0.29 H new ATOM 0 HA ALA A 111 2.804 3.944 10.943 1.00 0.36 H new ATOM 0 HB1 ALA A 111 1.729 2.192 12.287 1.00 0.42 H new ATOM 0 HB2 ALA A 111 0.837 2.504 10.779 1.00 0.42 H new ATOM 0 HB3 ALA A 111 1.868 1.060 10.921 1.00 0.42 H new ATOM 1776 N ASP A 112 4.775 1.326 10.698 1.00 0.35 N ATOM 1777 CA ASP A 112 6.115 0.851 11.039 1.00 0.46 C ATOM 1778 C ASP A 112 6.589 -0.144 9.990 1.00 0.37 C ATOM 1779 O ASP A 112 5.816 -0.998 9.559 1.00 0.35 O ATOM 1780 CB ASP A 112 6.129 0.206 12.423 1.00 0.67 C ATOM 1781 CG ASP A 112 7.533 0.008 12.953 1.00 1.36 C ATOM 1782 OD1 ASP A 112 8.354 0.939 12.824 1.00 2.20 O ATOM 1783 OD2 ASP A 112 7.825 -1.089 13.478 1.00 1.88 O ATOM 0 H ASP A 112 4.298 0.766 9.991 1.00 0.35 H new ATOM 0 HA ASP A 112 6.792 1.705 11.058 1.00 0.46 H new ATOM 0 HB2 ASP A 112 5.566 0.830 13.117 1.00 0.67 H new ATOM 0 HB3 ASP A 112 5.622 -0.758 12.377 1.00 0.67 H new ATOM 1788 N THR A 113 7.839 -0.016 9.560 1.00 0.37 N ATOM 1789 CA THR A 113 8.365 -0.853 8.489 1.00 0.36 C ATOM 1790 C THR A 113 9.753 -1.403 8.842 1.00 0.44 C ATOM 1791 O THR A 113 10.621 -0.669 9.323 1.00 0.55 O ATOM 1792 CB THR A 113 8.425 -0.080 7.141 1.00 0.37 C ATOM 1793 OG1 THR A 113 8.794 -0.973 6.086 1.00 0.44 O ATOM 1794 CG2 THR A 113 9.426 1.082 7.180 1.00 0.51 C ATOM 0 H THR A 113 8.506 0.658 9.936 1.00 0.37 H new ATOM 0 HA THR A 113 7.679 -1.692 8.374 1.00 0.36 H new ATOM 0 HB THR A 113 7.432 0.334 6.965 1.00 0.37 H new ATOM 0 HG1 THR A 113 8.286 -0.752 5.278 1.00 0.44 H new ATOM 0 HG21 THR A 113 9.431 1.590 6.216 1.00 0.51 H new ATOM 0 HG22 THR A 113 9.136 1.786 7.960 1.00 0.51 H new ATOM 0 HG23 THR A 113 10.423 0.696 7.392 1.00 0.51 H new ATOM 1802 N ASP A 114 9.946 -2.704 8.636 1.00 0.43 N ATOM 1803 CA ASP A 114 11.243 -3.337 8.859 1.00 0.57 C ATOM 1804 C ASP A 114 11.515 -4.391 7.787 1.00 0.64 C ATOM 1805 O ASP A 114 10.601 -4.801 7.073 1.00 0.61 O ATOM 1806 CB ASP A 114 11.312 -3.961 10.257 1.00 0.60 C ATOM 1807 CG ASP A 114 12.646 -4.628 10.525 1.00 1.24 C ATOM 1808 OD1 ASP A 114 13.686 -3.936 10.455 1.00 1.17 O ATOM 1809 OD2 ASP A 114 12.667 -5.846 10.792 1.00 2.10 O ATOM 0 H ASP A 114 9.218 -3.342 8.314 1.00 0.43 H new ATOM 0 HA ASP A 114 12.013 -2.569 8.792 1.00 0.57 H new ATOM 0 HB2 ASP A 114 11.138 -3.189 11.006 1.00 0.60 H new ATOM 0 HB3 ASP A 114 10.513 -4.695 10.364 1.00 0.60 H new ATOM 1814 N TYR A 115 12.770 -4.820 7.672 1.00 0.84 N ATOM 1815 CA TYR A 115 13.151 -5.816 6.678 1.00 0.99 C ATOM 1816 C TYR A 115 12.661 -7.209 7.067 1.00 0.90 C ATOM 1817 O TYR A 115 12.255 -7.983 6.210 1.00 1.07 O ATOM 1818 CB TYR A 115 14.674 -5.827 6.452 1.00 1.25 C ATOM 1819 CG TYR A 115 15.497 -6.265 7.648 1.00 1.46 C ATOM 1820 CD1 TYR A 115 15.761 -5.392 8.695 1.00 1.77 C ATOM 1821 CD2 TYR A 115 16.023 -7.551 7.722 1.00 1.67 C ATOM 1822 CE1 TYR A 115 16.520 -5.784 9.781 1.00 2.16 C ATOM 1823 CE2 TYR A 115 16.781 -7.950 8.806 1.00 2.05 C ATOM 1824 CZ TYR A 115 17.027 -7.064 9.831 1.00 2.26 C ATOM 1825 OH TYR A 115 17.786 -7.458 10.908 1.00 2.75 O ATOM 0 H TYR A 115 13.539 -4.492 8.256 1.00 0.84 H new ATOM 0 HA TYR A 115 12.669 -5.536 5.742 1.00 0.99 H new ATOM 0 HB2 TYR A 115 14.897 -6.488 5.615 1.00 1.25 H new ATOM 0 HB3 TYR A 115 14.990 -4.826 6.160 1.00 1.25 H new ATOM 0 HD1 TYR A 115 15.366 -4.388 8.660 1.00 1.77 H new ATOM 0 HD2 TYR A 115 15.836 -8.249 6.919 1.00 1.67 H new ATOM 0 HE1 TYR A 115 16.715 -5.091 10.586 1.00 2.16 H new ATOM 0 HE2 TYR A 115 17.179 -8.953 8.849 1.00 2.05 H new ATOM 0 HH TYR A 115 18.065 -8.390 10.788 1.00 2.75 H new ATOM 1835 N ASP A 116 12.694 -7.520 8.360 1.00 0.77 N ATOM 1836 CA ASP A 116 12.294 -8.843 8.846 1.00 0.74 C ATOM 1837 C ASP A 116 10.883 -8.794 9.409 1.00 0.64 C ATOM 1838 O ASP A 116 10.065 -9.688 9.171 1.00 0.66 O ATOM 1839 CB ASP A 116 13.269 -9.340 9.916 1.00 0.82 C ATOM 1840 CG ASP A 116 12.850 -10.669 10.519 1.00 1.03 C ATOM 1841 OD1 ASP A 116 13.090 -11.720 9.889 1.00 1.46 O ATOM 1842 OD2 ASP A 116 12.301 -10.669 11.644 1.00 1.40 O ATOM 0 H ASP A 116 12.993 -6.876 9.092 1.00 0.77 H new ATOM 0 HA ASP A 116 12.315 -9.538 8.006 1.00 0.74 H new ATOM 0 HB2 ASP A 116 14.262 -9.441 9.478 1.00 0.82 H new ATOM 0 HB3 ASP A 116 13.344 -8.594 10.707 1.00 0.82 H new ATOM 1847 N GLN A 117 10.612 -7.738 10.158 1.00 0.59 N ATOM 1848 CA GLN A 117 9.281 -7.475 10.681 1.00 0.50 C ATOM 1849 C GLN A 117 8.334 -7.087 9.556 1.00 0.37 C ATOM 1850 O GLN A 117 8.738 -6.958 8.400 1.00 0.39 O ATOM 1851 CB GLN A 117 9.316 -6.382 11.747 1.00 0.56 C ATOM 1852 CG GLN A 117 10.006 -6.816 13.030 1.00 1.22 C ATOM 1853 CD GLN A 117 9.949 -5.759 14.115 1.00 1.68 C ATOM 1854 OE1 GLN A 117 9.011 -4.965 14.178 1.00 2.16 O ATOM 1855 NE2 GLN A 117 10.953 -5.742 14.980 1.00 2.51 N ATOM 0 H GLN A 117 11.307 -7.039 10.421 1.00 0.59 H new ATOM 0 HA GLN A 117 8.915 -8.390 11.146 1.00 0.50 H new ATOM 0 HB2 GLN A 117 9.828 -5.508 11.345 1.00 0.56 H new ATOM 0 HB3 GLN A 117 8.296 -6.076 11.977 1.00 0.56 H new ATOM 0 HG2 GLN A 117 9.540 -7.731 13.396 1.00 1.22 H new ATOM 0 HG3 GLN A 117 11.048 -7.053 12.814 1.00 1.22 H new ATOM 0 HE21 GLN A 117 11.712 -6.418 14.893 1.00 2.51 H new ATOM 0 HE22 GLN A 117 10.966 -5.053 15.732 1.00 2.51 H new ATOM 1864 N PHE A 118 7.073 -6.906 9.896 1.00 0.30 N ATOM 1865 CA PHE A 118 6.057 -6.610 8.905 1.00 0.25 C ATOM 1866 C PHE A 118 5.761 -5.127 8.928 1.00 0.26 C ATOM 1867 O PHE A 118 6.189 -4.410 9.833 1.00 0.40 O ATOM 1868 CB PHE A 118 4.764 -7.368 9.203 1.00 0.31 C ATOM 1869 CG PHE A 118 4.026 -6.863 10.413 1.00 0.30 C ATOM 1870 CD1 PHE A 118 4.619 -6.838 11.667 1.00 0.36 C ATOM 1871 CD2 PHE A 118 2.739 -6.388 10.280 1.00 0.32 C ATOM 1872 CE1 PHE A 118 3.934 -6.353 12.763 1.00 0.41 C ATOM 1873 CE2 PHE A 118 2.047 -5.898 11.370 1.00 0.38 C ATOM 1874 CZ PHE A 118 2.645 -5.880 12.614 1.00 0.42 C ATOM 0 H PHE A 118 6.727 -6.959 10.854 1.00 0.30 H new ATOM 0 HA PHE A 118 6.430 -6.917 7.928 1.00 0.25 H new ATOM 0 HB2 PHE A 118 4.107 -7.302 8.335 1.00 0.31 H new ATOM 0 HB3 PHE A 118 4.998 -8.423 9.346 1.00 0.31 H new ATOM 0 HD1 PHE A 118 5.629 -7.202 11.787 1.00 0.36 H new ATOM 0 HD2 PHE A 118 2.265 -6.399 9.310 1.00 0.32 H new ATOM 0 HE1 PHE A 118 4.405 -6.343 13.735 1.00 0.41 H new ATOM 0 HE2 PHE A 118 1.039 -5.529 11.249 1.00 0.38 H new ATOM 0 HZ PHE A 118 2.106 -5.497 13.468 1.00 0.42 H new ATOM 1884 N ALA A 119 5.020 -4.677 7.945 1.00 0.23 N ATOM 1885 CA ALA A 119 4.774 -3.258 7.792 1.00 0.23 C ATOM 1886 C ALA A 119 3.310 -2.963 7.502 1.00 0.21 C ATOM 1887 O ALA A 119 2.640 -3.694 6.770 1.00 0.28 O ATOM 1888 CB ALA A 119 5.668 -2.683 6.711 1.00 0.25 C ATOM 0 H ALA A 119 4.577 -5.267 7.240 1.00 0.23 H new ATOM 0 HA ALA A 119 5.015 -2.775 8.739 1.00 0.23 H new ATOM 0 HB1 ALA A 119 5.472 -1.616 6.607 1.00 0.25 H new ATOM 0 HB2 ALA A 119 6.712 -2.836 6.983 1.00 0.25 H new ATOM 0 HB3 ALA A 119 5.463 -3.184 5.765 1.00 0.25 H new ATOM 1894 N MET A 120 2.839 -1.874 8.085 1.00 0.19 N ATOM 1895 CA MET A 120 1.448 -1.456 7.980 1.00 0.21 C ATOM 1896 C MET A 120 1.366 -0.087 7.324 1.00 0.22 C ATOM 1897 O MET A 120 1.733 0.911 7.933 1.00 0.25 O ATOM 1898 CB MET A 120 0.834 -1.396 9.375 1.00 0.27 C ATOM 1899 CG MET A 120 -0.148 -2.529 9.660 1.00 0.48 C ATOM 1900 SD MET A 120 -0.852 -2.439 11.320 1.00 0.63 S ATOM 1901 CE MET A 120 0.618 -2.593 12.335 1.00 1.47 C ATOM 0 H MET A 120 3.414 -1.249 8.649 1.00 0.19 H new ATOM 0 HA MET A 120 0.900 -2.174 7.370 1.00 0.21 H new ATOM 0 HB2 MET A 120 1.633 -1.424 10.116 1.00 0.27 H new ATOM 0 HB3 MET A 120 0.320 -0.442 9.496 1.00 0.27 H new ATOM 0 HG2 MET A 120 -0.953 -2.500 8.926 1.00 0.48 H new ATOM 0 HG3 MET A 120 0.361 -3.485 9.537 1.00 0.48 H new ATOM 0 HE1 MET A 120 0.388 -3.183 13.222 1.00 1.47 H new ATOM 0 HE2 MET A 120 1.404 -3.088 11.764 1.00 1.47 H new ATOM 0 HE3 MET A 120 0.957 -1.602 12.637 1.00 1.47 H new ATOM 1911 N VAL A 121 0.884 -0.028 6.095 1.00 0.25 N ATOM 1912 CA VAL A 121 0.952 1.215 5.337 1.00 0.26 C ATOM 1913 C VAL A 121 -0.430 1.765 4.999 1.00 0.29 C ATOM 1914 O VAL A 121 -1.269 1.058 4.445 1.00 0.39 O ATOM 1915 CB VAL A 121 1.721 1.033 4.017 1.00 0.28 C ATOM 1916 CG1 VAL A 121 2.490 2.300 3.687 1.00 0.34 C ATOM 1917 CG2 VAL A 121 2.646 -0.172 4.074 1.00 0.28 C ATOM 0 H VAL A 121 0.448 -0.809 5.605 1.00 0.25 H new ATOM 0 HA VAL A 121 1.475 1.920 5.983 1.00 0.26 H new ATOM 0 HB VAL A 121 1.000 0.845 3.222 1.00 0.28 H new ATOM 0 HG11 VAL A 121 3.032 2.163 2.751 1.00 0.34 H new ATOM 0 HG12 VAL A 121 1.793 3.132 3.585 1.00 0.34 H new ATOM 0 HG13 VAL A 121 3.197 2.515 4.488 1.00 0.34 H new ATOM 0 HG21 VAL A 121 3.173 -0.271 3.125 1.00 0.28 H new ATOM 0 HG22 VAL A 121 3.369 -0.038 4.879 1.00 0.28 H new ATOM 0 HG23 VAL A 121 2.060 -1.072 4.259 1.00 0.28 H new ATOM 1927 N PHE A 122 -0.647 3.034 5.312 1.00 0.25 N ATOM 1928 CA PHE A 122 -1.862 3.731 4.906 1.00 0.27 C ATOM 1929 C PHE A 122 -1.570 4.500 3.618 1.00 0.27 C ATOM 1930 O PHE A 122 -0.745 5.414 3.597 1.00 0.26 O ATOM 1931 CB PHE A 122 -2.349 4.657 6.055 1.00 0.29 C ATOM 1932 CG PHE A 122 -3.527 5.585 5.764 1.00 0.37 C ATOM 1933 CD1 PHE A 122 -3.780 6.073 4.491 1.00 0.87 C ATOM 1934 CD2 PHE A 122 -4.374 5.993 6.794 1.00 0.33 C ATOM 1935 CE1 PHE A 122 -4.834 6.924 4.245 1.00 0.99 C ATOM 1936 CE2 PHE A 122 -5.427 6.851 6.547 1.00 0.38 C ATOM 1937 CZ PHE A 122 -5.656 7.312 5.273 1.00 0.63 C ATOM 0 H PHE A 122 0.005 3.606 5.849 1.00 0.25 H new ATOM 0 HA PHE A 122 -2.669 3.026 4.707 1.00 0.27 H new ATOM 0 HB2 PHE A 122 -2.619 4.027 6.903 1.00 0.29 H new ATOM 0 HB3 PHE A 122 -1.506 5.272 6.371 1.00 0.29 H new ATOM 0 HD1 PHE A 122 -3.136 5.779 3.675 1.00 0.87 H new ATOM 0 HD2 PHE A 122 -4.204 5.633 7.798 1.00 0.33 H new ATOM 0 HE1 PHE A 122 -5.014 7.286 3.243 1.00 0.99 H new ATOM 0 HE2 PHE A 122 -6.072 7.160 7.356 1.00 0.38 H new ATOM 0 HZ PHE A 122 -6.483 7.980 5.081 1.00 0.63 H new ATOM 1947 N PHE A 123 -2.237 4.093 2.547 1.00 0.34 N ATOM 1948 CA PHE A 123 -2.132 4.759 1.253 1.00 0.34 C ATOM 1949 C PHE A 123 -3.349 5.650 1.036 1.00 0.35 C ATOM 1950 O PHE A 123 -4.481 5.162 1.048 1.00 0.38 O ATOM 1951 CB PHE A 123 -2.073 3.729 0.117 1.00 0.37 C ATOM 1952 CG PHE A 123 -0.752 3.022 -0.058 1.00 0.37 C ATOM 1953 CD1 PHE A 123 -0.179 2.282 0.967 1.00 0.32 C ATOM 1954 CD2 PHE A 123 -0.094 3.082 -1.277 1.00 0.45 C ATOM 1955 CE1 PHE A 123 1.022 1.626 0.774 1.00 0.33 C ATOM 1956 CE2 PHE A 123 1.107 2.430 -1.470 1.00 0.47 C ATOM 1957 CZ PHE A 123 1.666 1.700 -0.445 1.00 0.41 C ATOM 0 H PHE A 123 -2.867 3.291 2.549 1.00 0.34 H new ATOM 0 HA PHE A 123 -1.219 5.355 1.248 1.00 0.34 H new ATOM 0 HB2 PHE A 123 -2.845 2.979 0.291 1.00 0.37 H new ATOM 0 HB3 PHE A 123 -2.322 4.232 -0.818 1.00 0.37 H new ATOM 0 HD1 PHE A 123 -0.676 2.218 1.924 1.00 0.32 H new ATOM 0 HD2 PHE A 123 -0.528 3.648 -2.088 1.00 0.45 H new ATOM 0 HE1 PHE A 123 1.458 1.054 1.579 1.00 0.33 H new ATOM 0 HE2 PHE A 123 1.608 2.492 -2.425 1.00 0.47 H new ATOM 0 HZ PHE A 123 2.605 1.187 -0.594 1.00 0.41 H new ATOM 1967 N GLN A 124 -3.129 6.943 0.846 1.00 0.36 N ATOM 1968 CA GLN A 124 -4.228 7.856 0.561 1.00 0.39 C ATOM 1969 C GLN A 124 -4.085 8.451 -0.831 1.00 0.34 C ATOM 1970 O GLN A 124 -3.044 9.025 -1.169 1.00 0.33 O ATOM 1971 CB GLN A 124 -4.304 8.994 1.581 1.00 0.45 C ATOM 1972 CG GLN A 124 -5.483 9.924 1.336 1.00 0.67 C ATOM 1973 CD GLN A 124 -5.470 11.154 2.220 1.00 0.82 C ATOM 1974 OE1 GLN A 124 -4.972 11.124 3.342 1.00 1.54 O ATOM 1975 NE2 GLN A 124 -6.019 12.253 1.716 1.00 1.57 N ATOM 0 H GLN A 124 -2.209 7.381 0.883 1.00 0.36 H new ATOM 0 HA GLN A 124 -5.146 7.272 0.622 1.00 0.39 H new ATOM 0 HB2 GLN A 124 -4.381 8.573 2.584 1.00 0.45 H new ATOM 0 HB3 GLN A 124 -3.379 9.570 1.547 1.00 0.45 H new ATOM 0 HG2 GLN A 124 -5.480 10.236 0.292 1.00 0.67 H new ATOM 0 HG3 GLN A 124 -6.410 9.375 1.502 1.00 0.67 H new ATOM 0 HE21 GLN A 124 -6.423 12.238 0.779 1.00 1.57 H new ATOM 0 HE22 GLN A 124 -6.037 13.112 2.265 1.00 1.57 H new ATOM 1984 N LYS A 125 -5.132 8.314 -1.633 1.00 0.37 N ATOM 1985 CA LYS A 125 -5.159 8.908 -2.955 1.00 0.38 C ATOM 1986 C LYS A 125 -6.468 9.656 -3.156 1.00 0.35 C ATOM 1987 O LYS A 125 -7.543 9.056 -3.177 1.00 0.41 O ATOM 1988 CB LYS A 125 -5.006 7.837 -4.040 1.00 0.53 C ATOM 1989 CG LYS A 125 -4.816 8.407 -5.441 1.00 0.98 C ATOM 1990 CD LYS A 125 -4.663 7.306 -6.477 1.00 1.06 C ATOM 1991 CE LYS A 125 -5.997 6.658 -6.808 1.00 1.36 C ATOM 1992 NZ LYS A 125 -6.855 7.549 -7.633 1.00 1.55 N ATOM 0 H LYS A 125 -5.974 7.794 -1.387 1.00 0.37 H new ATOM 0 HA LYS A 125 -4.323 9.603 -3.036 1.00 0.38 H new ATOM 0 HB2 LYS A 125 -4.153 7.204 -3.796 1.00 0.53 H new ATOM 0 HB3 LYS A 125 -5.889 7.198 -4.034 1.00 0.53 H new ATOM 0 HG2 LYS A 125 -5.670 9.033 -5.698 1.00 0.98 H new ATOM 0 HG3 LYS A 125 -3.934 9.048 -5.457 1.00 0.98 H new ATOM 0 HD2 LYS A 125 -4.224 7.719 -7.385 1.00 1.06 H new ATOM 0 HD3 LYS A 125 -3.973 6.549 -6.105 1.00 1.06 H new ATOM 0 HE2 LYS A 125 -5.824 5.724 -7.342 1.00 1.36 H new ATOM 0 HE3 LYS A 125 -6.518 6.406 -5.884 1.00 1.36 H new ATOM 0 HZ1 LYS A 125 -7.817 7.157 -7.682 1.00 1.55 H new ATOM 0 HZ2 LYS A 125 -6.888 8.495 -7.202 1.00 1.55 H new ATOM 0 HZ3 LYS A 125 -6.461 7.619 -8.593 1.00 1.55 H new ATOM 2006 N THR A 126 -6.375 10.960 -3.305 1.00 0.31 N ATOM 2007 CA THR A 126 -7.541 11.774 -3.580 1.00 0.31 C ATOM 2008 C THR A 126 -7.575 12.092 -5.062 1.00 0.34 C ATOM 2009 O THR A 126 -6.571 12.525 -5.628 1.00 0.39 O ATOM 2010 CB THR A 126 -7.485 13.091 -2.796 1.00 0.35 C ATOM 2011 OG1 THR A 126 -6.658 12.925 -1.635 1.00 0.42 O ATOM 2012 CG2 THR A 126 -8.867 13.541 -2.356 1.00 0.47 C ATOM 0 H THR A 126 -5.501 11.481 -3.240 1.00 0.31 H new ATOM 0 HA THR A 126 -8.432 11.223 -3.279 1.00 0.31 H new ATOM 0 HB THR A 126 -7.069 13.852 -3.456 1.00 0.35 H new ATOM 0 HG1 THR A 126 -6.154 13.750 -1.472 1.00 0.42 H new ATOM 0 HG21 THR A 126 -8.786 14.477 -1.804 1.00 0.47 H new ATOM 0 HG22 THR A 126 -9.497 13.690 -3.233 1.00 0.47 H new ATOM 0 HG23 THR A 126 -9.311 12.779 -1.715 1.00 0.47 H new ATOM 2020 N SER A 127 -8.703 11.870 -5.703 1.00 0.37 N ATOM 2021 CA SER A 127 -8.812 12.112 -7.127 1.00 0.45 C ATOM 2022 C SER A 127 -10.261 12.430 -7.474 1.00 0.51 C ATOM 2023 O SER A 127 -11.169 11.802 -6.937 1.00 0.52 O ATOM 2024 CB SER A 127 -8.350 10.874 -7.907 1.00 0.54 C ATOM 2025 OG SER A 127 -7.057 10.450 -7.494 1.00 0.87 O ATOM 0 H SER A 127 -9.555 11.523 -5.263 1.00 0.37 H new ATOM 0 HA SER A 127 -8.178 12.956 -7.399 1.00 0.45 H new ATOM 0 HB2 SER A 127 -9.064 10.063 -7.761 1.00 0.54 H new ATOM 0 HB3 SER A 127 -8.337 11.099 -8.974 1.00 0.54 H new ATOM 0 HG SER A 127 -6.596 10.024 -8.247 1.00 0.87 H new ATOM 2031 N GLU A 128 -10.474 13.409 -8.353 1.00 0.63 N ATOM 2032 CA GLU A 128 -11.828 13.813 -8.750 1.00 0.74 C ATOM 2033 C GLU A 128 -12.645 14.222 -7.515 1.00 0.66 C ATOM 2034 O GLU A 128 -13.840 13.942 -7.418 1.00 0.71 O ATOM 2035 CB GLU A 128 -12.518 12.663 -9.507 1.00 0.89 C ATOM 2036 CG GLU A 128 -13.830 13.047 -10.181 1.00 1.26 C ATOM 2037 CD GLU A 128 -13.635 13.940 -11.386 1.00 1.59 C ATOM 2038 OE1 GLU A 128 -13.192 15.094 -11.214 1.00 1.98 O ATOM 2039 OE2 GLU A 128 -13.921 13.489 -12.514 1.00 2.13 O ATOM 0 H GLU A 128 -9.728 13.938 -8.805 1.00 0.63 H new ATOM 0 HA GLU A 128 -11.763 14.675 -9.414 1.00 0.74 H new ATOM 0 HB2 GLU A 128 -11.833 12.281 -10.264 1.00 0.89 H new ATOM 0 HB3 GLU A 128 -12.708 11.848 -8.809 1.00 0.89 H new ATOM 0 HG2 GLU A 128 -14.354 12.141 -10.487 1.00 1.26 H new ATOM 0 HG3 GLU A 128 -14.468 13.555 -9.458 1.00 1.26 H new ATOM 2046 N ASN A 129 -11.959 14.843 -6.549 1.00 0.64 N ATOM 2047 CA ASN A 129 -12.569 15.314 -5.299 1.00 0.70 C ATOM 2048 C ASN A 129 -12.903 14.141 -4.378 1.00 0.59 C ATOM 2049 O ASN A 129 -13.186 14.321 -3.196 1.00 0.71 O ATOM 2050 CB ASN A 129 -13.821 16.161 -5.575 1.00 0.91 C ATOM 2051 CG ASN A 129 -14.379 16.828 -4.330 1.00 1.28 C ATOM 2052 OD1 ASN A 129 -15.232 16.273 -3.634 1.00 1.64 O ATOM 2053 ND2 ASN A 129 -13.903 18.030 -4.046 1.00 2.21 N ATOM 0 H ASN A 129 -10.959 15.034 -6.612 1.00 0.64 H new ATOM 0 HA ASN A 129 -11.840 15.948 -4.794 1.00 0.70 H new ATOM 0 HB2 ASN A 129 -13.578 16.927 -6.312 1.00 0.91 H new ATOM 0 HB3 ASN A 129 -14.591 15.527 -6.016 1.00 0.91 H new ATOM 0 HD21 ASN A 129 -14.242 18.532 -3.225 1.00 2.21 H new ATOM 0 HD22 ASN A 129 -13.197 18.454 -4.648 1.00 2.21 H new ATOM 2060 N LYS A 130 -12.831 12.933 -4.916 1.00 0.45 N ATOM 2061 CA LYS A 130 -13.159 11.745 -4.154 1.00 0.49 C ATOM 2062 C LYS A 130 -11.906 11.186 -3.509 1.00 0.42 C ATOM 2063 O LYS A 130 -10.857 11.077 -4.148 1.00 0.45 O ATOM 2064 CB LYS A 130 -13.811 10.685 -5.047 1.00 0.64 C ATOM 2065 CG LYS A 130 -15.044 11.178 -5.793 1.00 1.02 C ATOM 2066 CD LYS A 130 -16.093 11.745 -4.845 1.00 1.36 C ATOM 2067 CE LYS A 130 -16.371 13.213 -5.141 1.00 2.08 C ATOM 2068 NZ LYS A 130 -16.954 13.407 -6.495 1.00 2.80 N ATOM 0 H LYS A 130 -12.548 12.753 -5.879 1.00 0.45 H new ATOM 0 HA LYS A 130 -13.872 12.019 -3.377 1.00 0.49 H new ATOM 0 HB2 LYS A 130 -13.077 10.333 -5.772 1.00 0.64 H new ATOM 0 HB3 LYS A 130 -14.089 9.828 -4.433 1.00 0.64 H new ATOM 0 HG2 LYS A 130 -14.752 11.944 -6.511 1.00 1.02 H new ATOM 0 HG3 LYS A 130 -15.476 10.356 -6.363 1.00 1.02 H new ATOM 0 HD2 LYS A 130 -17.016 11.172 -4.936 1.00 1.36 H new ATOM 0 HD3 LYS A 130 -15.752 11.638 -3.815 1.00 1.36 H new ATOM 0 HE2 LYS A 130 -17.055 13.611 -4.391 1.00 2.08 H new ATOM 0 HE3 LYS A 130 -15.444 13.781 -5.060 1.00 2.08 H new ATOM 0 HZ1 LYS A 130 -17.463 14.314 -6.527 1.00 2.80 H new ATOM 0 HZ2 LYS A 130 -16.193 13.412 -7.203 1.00 2.80 H new ATOM 0 HZ3 LYS A 130 -17.615 12.631 -6.703 1.00 2.80 H new ATOM 2082 N GLN A 131 -12.010 10.854 -2.239 1.00 0.43 N ATOM 2083 CA GLN A 131 -10.878 10.341 -1.501 1.00 0.44 C ATOM 2084 C GLN A 131 -10.976 8.834 -1.375 1.00 0.48 C ATOM 2085 O GLN A 131 -11.994 8.305 -0.931 1.00 0.59 O ATOM 2086 CB GLN A 131 -10.827 10.955 -0.110 1.00 0.55 C ATOM 2087 CG GLN A 131 -10.735 12.470 -0.129 1.00 0.56 C ATOM 2088 CD GLN A 131 -11.160 13.110 1.177 1.00 0.77 C ATOM 2089 OE1 GLN A 131 -12.055 12.616 1.863 1.00 1.11 O ATOM 2090 NE2 GLN A 131 -10.514 14.205 1.541 1.00 1.57 N ATOM 0 H GLN A 131 -12.870 10.931 -1.696 1.00 0.43 H new ATOM 0 HA GLN A 131 -9.970 10.604 -2.044 1.00 0.44 H new ATOM 0 HB2 GLN A 131 -11.718 10.658 0.444 1.00 0.55 H new ATOM 0 HB3 GLN A 131 -9.968 10.552 0.427 1.00 0.55 H new ATOM 0 HG2 GLN A 131 -9.709 12.763 -0.353 1.00 0.56 H new ATOM 0 HG3 GLN A 131 -11.359 12.855 -0.935 1.00 0.56 H new ATOM 0 HE21 GLN A 131 -9.778 14.585 0.946 1.00 1.57 H new ATOM 0 HE22 GLN A 131 -10.752 14.670 2.417 1.00 1.57 H new ATOM 2099 N TYR A 132 -9.927 8.149 -1.770 1.00 0.45 N ATOM 2100 CA TYR A 132 -9.854 6.711 -1.599 1.00 0.50 C ATOM 2101 C TYR A 132 -8.586 6.380 -0.852 1.00 0.44 C ATOM 2102 O TYR A 132 -7.524 6.935 -1.133 1.00 0.51 O ATOM 2103 CB TYR A 132 -9.867 5.962 -2.934 1.00 0.57 C ATOM 2104 CG TYR A 132 -11.012 6.333 -3.852 1.00 0.68 C ATOM 2105 CD1 TYR A 132 -12.225 5.659 -3.785 1.00 0.87 C ATOM 2106 CD2 TYR A 132 -10.879 7.351 -4.789 1.00 0.68 C ATOM 2107 CE1 TYR A 132 -13.274 5.987 -4.622 1.00 1.01 C ATOM 2108 CE2 TYR A 132 -11.922 7.685 -5.630 1.00 0.81 C ATOM 2109 CZ TYR A 132 -13.116 7.002 -5.542 1.00 0.96 C ATOM 2110 OH TYR A 132 -14.155 7.330 -6.382 1.00 1.12 O ATOM 0 H TYR A 132 -9.108 8.564 -2.214 1.00 0.45 H new ATOM 0 HA TYR A 132 -10.735 6.392 -1.042 1.00 0.50 H new ATOM 0 HB2 TYR A 132 -8.927 6.152 -3.452 1.00 0.57 H new ATOM 0 HB3 TYR A 132 -9.910 4.891 -2.735 1.00 0.57 H new ATOM 0 HD1 TYR A 132 -12.350 4.864 -3.065 1.00 0.87 H new ATOM 0 HD2 TYR A 132 -9.945 7.889 -4.860 1.00 0.68 H new ATOM 0 HE1 TYR A 132 -14.210 5.453 -4.556 1.00 1.01 H new ATOM 0 HE2 TYR A 132 -11.803 8.478 -6.354 1.00 0.81 H new ATOM 0 HH TYR A 132 -13.882 8.066 -6.968 1.00 1.12 H new ATOM 2120 N PHE A 133 -8.694 5.484 0.097 1.00 0.40 N ATOM 2121 CA PHE A 133 -7.559 5.118 0.909 1.00 0.30 C ATOM 2122 C PHE A 133 -7.608 3.642 1.233 1.00 0.25 C ATOM 2123 O PHE A 133 -8.646 2.985 1.077 1.00 0.30 O ATOM 2124 CB PHE A 133 -7.517 5.938 2.203 1.00 0.45 C ATOM 2125 CG PHE A 133 -8.536 5.517 3.222 1.00 0.82 C ATOM 2126 CD1 PHE A 133 -9.879 5.802 3.039 1.00 1.20 C ATOM 2127 CD2 PHE A 133 -8.149 4.837 4.357 1.00 1.31 C ATOM 2128 CE1 PHE A 133 -10.816 5.416 3.976 1.00 1.74 C ATOM 2129 CE2 PHE A 133 -9.078 4.447 5.299 1.00 1.82 C ATOM 2130 CZ PHE A 133 -10.422 4.739 5.101 1.00 1.95 C ATOM 0 H PHE A 133 -9.558 4.993 0.327 1.00 0.40 H new ATOM 0 HA PHE A 133 -6.653 5.332 0.342 1.00 0.30 H new ATOM 0 HB2 PHE A 133 -6.523 5.856 2.642 1.00 0.45 H new ATOM 0 HB3 PHE A 133 -7.672 6.989 1.961 1.00 0.45 H new ATOM 0 HD1 PHE A 133 -10.197 6.332 2.153 1.00 1.20 H new ATOM 0 HD2 PHE A 133 -7.105 4.607 4.511 1.00 1.31 H new ATOM 0 HE1 PHE A 133 -11.860 5.647 3.823 1.00 1.74 H new ATOM 0 HE2 PHE A 133 -8.762 3.917 6.186 1.00 1.82 H new ATOM 0 HZ PHE A 133 -11.155 4.433 5.832 1.00 1.95 H new ATOM 2140 N LYS A 134 -6.483 3.134 1.673 1.00 0.21 N ATOM 2141 CA LYS A 134 -6.360 1.744 2.048 1.00 0.24 C ATOM 2142 C LYS A 134 -5.264 1.599 3.091 1.00 0.17 C ATOM 2143 O LYS A 134 -4.340 2.410 3.146 1.00 0.20 O ATOM 2144 CB LYS A 134 -6.009 0.891 0.819 1.00 0.38 C ATOM 2145 CG LYS A 134 -4.541 0.981 0.418 1.00 0.53 C ATOM 2146 CD LYS A 134 -4.227 0.137 -0.805 1.00 0.76 C ATOM 2147 CE LYS A 134 -2.729 -0.125 -0.922 1.00 0.61 C ATOM 2148 NZ LYS A 134 -2.389 -0.841 -2.184 1.00 1.30 N ATOM 0 H LYS A 134 -5.624 3.673 1.782 1.00 0.21 H new ATOM 0 HA LYS A 134 -7.310 1.402 2.458 1.00 0.24 H new ATOM 0 HB2 LYS A 134 -6.258 -0.150 1.025 1.00 0.38 H new ATOM 0 HB3 LYS A 134 -6.627 1.206 -0.021 1.00 0.38 H new ATOM 0 HG2 LYS A 134 -4.285 2.021 0.215 1.00 0.53 H new ATOM 0 HG3 LYS A 134 -3.918 0.656 1.251 1.00 0.53 H new ATOM 0 HD2 LYS A 134 -4.761 -0.811 -0.743 1.00 0.76 H new ATOM 0 HD3 LYS A 134 -4.582 0.645 -1.702 1.00 0.76 H new ATOM 0 HE2 LYS A 134 -2.190 0.822 -0.885 1.00 0.61 H new ATOM 0 HE3 LYS A 134 -2.395 -0.715 -0.068 1.00 0.61 H new ATOM 0 HZ1 LYS A 134 -1.646 -1.543 -1.995 1.00 1.30 H new ATOM 0 HZ2 LYS A 134 -3.236 -1.322 -2.549 1.00 1.30 H new ATOM 0 HZ3 LYS A 134 -2.048 -0.158 -2.890 1.00 1.30 H new ATOM 2162 N VAL A 135 -5.369 0.579 3.912 1.00 0.16 N ATOM 2163 CA VAL A 135 -4.269 0.185 4.753 1.00 0.17 C ATOM 2164 C VAL A 135 -3.759 -1.167 4.252 1.00 0.20 C ATOM 2165 O VAL A 135 -4.471 -2.172 4.259 1.00 0.30 O ATOM 2166 CB VAL A 135 -4.650 0.159 6.264 1.00 0.24 C ATOM 2167 CG1 VAL A 135 -5.475 -1.063 6.660 1.00 0.39 C ATOM 2168 CG2 VAL A 135 -3.401 0.274 7.122 1.00 0.78 C ATOM 0 H VAL A 135 -6.208 0.008 4.013 1.00 0.16 H new ATOM 0 HA VAL A 135 -3.472 0.925 4.685 1.00 0.17 H new ATOM 0 HB VAL A 135 -5.291 1.022 6.441 1.00 0.24 H new ATOM 0 HG11 VAL A 135 -5.705 -1.017 7.724 1.00 0.39 H new ATOM 0 HG12 VAL A 135 -6.403 -1.076 6.088 1.00 0.39 H new ATOM 0 HG13 VAL A 135 -4.907 -1.969 6.450 1.00 0.39 H new ATOM 0 HG21 VAL A 135 -3.680 0.255 8.175 1.00 0.78 H new ATOM 0 HG22 VAL A 135 -2.734 -0.561 6.908 1.00 0.78 H new ATOM 0 HG23 VAL A 135 -2.891 1.211 6.899 1.00 0.78 H new ATOM 2178 N THR A 136 -2.552 -1.171 3.724 1.00 0.20 N ATOM 2179 CA THR A 136 -2.003 -2.372 3.137 1.00 0.22 C ATOM 2180 C THR A 136 -0.961 -2.975 4.063 1.00 0.24 C ATOM 2181 O THR A 136 -0.199 -2.260 4.719 1.00 0.47 O ATOM 2182 CB THR A 136 -1.394 -2.110 1.738 1.00 0.43 C ATOM 2183 OG1 THR A 136 -0.947 -3.334 1.142 1.00 1.41 O ATOM 2184 CG2 THR A 136 -0.238 -1.129 1.800 1.00 0.65 C ATOM 0 H THR A 136 -1.936 -0.359 3.690 1.00 0.20 H new ATOM 0 HA THR A 136 -2.822 -3.079 3.006 1.00 0.22 H new ATOM 0 HB THR A 136 -2.183 -1.673 1.125 1.00 0.43 H new ATOM 0 HG1 THR A 136 -1.408 -4.090 1.562 1.00 1.41 H new ATOM 0 HG21 THR A 136 0.161 -0.973 0.798 1.00 0.65 H new ATOM 0 HG22 THR A 136 -0.588 -0.179 2.203 1.00 0.65 H new ATOM 0 HG23 THR A 136 0.545 -1.530 2.444 1.00 0.65 H new ATOM 2192 N LEU A 137 -0.959 -4.287 4.136 1.00 0.18 N ATOM 2193 CA LEU A 137 -0.010 -5.001 4.955 1.00 0.21 C ATOM 2194 C LEU A 137 0.961 -5.756 4.069 1.00 0.17 C ATOM 2195 O LEU A 137 0.539 -6.522 3.203 1.00 0.25 O ATOM 2196 CB LEU A 137 -0.738 -5.992 5.854 1.00 0.33 C ATOM 2197 CG LEU A 137 0.169 -6.810 6.761 1.00 0.34 C ATOM 2198 CD1 LEU A 137 0.487 -6.044 8.033 1.00 0.97 C ATOM 2199 CD2 LEU A 137 -0.467 -8.150 7.068 1.00 0.68 C ATOM 0 H LEU A 137 -1.613 -4.885 3.631 1.00 0.18 H new ATOM 0 HA LEU A 137 0.533 -4.284 5.571 1.00 0.21 H new ATOM 0 HB2 LEU A 137 -1.451 -5.446 6.472 1.00 0.33 H new ATOM 0 HB3 LEU A 137 -1.315 -6.674 5.229 1.00 0.33 H new ATOM 0 HG LEU A 137 1.110 -6.994 6.243 1.00 0.34 H new ATOM 0 HD11 LEU A 137 1.137 -6.647 8.668 1.00 0.97 H new ATOM 0 HD12 LEU A 137 0.991 -5.111 7.780 1.00 0.97 H new ATOM 0 HD13 LEU A 137 -0.438 -5.824 8.566 1.00 0.97 H new ATOM 0 HD21 LEU A 137 0.192 -8.725 7.718 1.00 0.68 H new ATOM 0 HD22 LEU A 137 -1.423 -7.993 7.568 1.00 0.68 H new ATOM 0 HD23 LEU A 137 -0.629 -8.697 6.139 1.00 0.68 H new ATOM 2211 N TYR A 138 2.246 -5.542 4.267 1.00 0.18 N ATOM 2212 CA TYR A 138 3.242 -6.290 3.526 1.00 0.26 C ATOM 2213 C TYR A 138 4.303 -6.826 4.477 1.00 0.20 C ATOM 2214 O TYR A 138 4.475 -6.310 5.584 1.00 0.25 O ATOM 2215 CB TYR A 138 3.852 -5.446 2.393 1.00 0.44 C ATOM 2216 CG TYR A 138 4.770 -4.323 2.824 1.00 0.59 C ATOM 2217 CD1 TYR A 138 6.083 -4.588 3.183 1.00 1.36 C ATOM 2218 CD2 TYR A 138 4.344 -2.997 2.835 1.00 0.54 C ATOM 2219 CE1 TYR A 138 6.943 -3.575 3.547 1.00 2.04 C ATOM 2220 CE2 TYR A 138 5.206 -1.980 3.192 1.00 1.18 C ATOM 2221 CZ TYR A 138 6.502 -2.276 3.547 1.00 1.94 C ATOM 2222 OH TYR A 138 7.361 -1.268 3.900 1.00 2.64 O ATOM 0 H TYR A 138 2.623 -4.863 4.928 1.00 0.18 H new ATOM 0 HA TYR A 138 2.757 -7.141 3.048 1.00 0.26 H new ATOM 0 HB2 TYR A 138 4.408 -6.110 1.731 1.00 0.44 H new ATOM 0 HB3 TYR A 138 3.039 -5.019 1.806 1.00 0.44 H new ATOM 0 HD1 TYR A 138 6.438 -5.608 3.177 1.00 1.36 H new ATOM 0 HD2 TYR A 138 3.326 -2.762 2.561 1.00 0.54 H new ATOM 0 HE1 TYR A 138 7.960 -3.803 3.831 1.00 2.04 H new ATOM 0 HE2 TYR A 138 4.864 -0.955 3.193 1.00 1.18 H new ATOM 0 HH TYR A 138 7.124 -0.451 3.413 1.00 2.64 H new ATOM 2232 N GLY A 139 4.991 -7.871 4.050 1.00 0.28 N ATOM 2233 CA GLY A 139 5.933 -8.546 4.915 1.00 0.29 C ATOM 2234 C GLY A 139 7.226 -8.876 4.213 1.00 0.33 C ATOM 2235 O GLY A 139 7.329 -8.723 2.992 1.00 0.45 O ATOM 0 H GLY A 139 4.913 -8.266 3.113 1.00 0.28 H new ATOM 0 HA2 GLY A 139 6.143 -7.917 5.780 1.00 0.29 H new ATOM 0 HA3 GLY A 139 5.483 -9.465 5.291 1.00 0.29 H new ATOM 2239 N ARG A 140 8.197 -9.342 4.992 1.00 0.37 N ATOM 2240 CA ARG A 140 9.532 -9.659 4.493 1.00 0.49 C ATOM 2241 C ARG A 140 9.486 -10.551 3.256 1.00 0.38 C ATOM 2242 O ARG A 140 10.006 -10.193 2.201 1.00 0.51 O ATOM 2243 CB ARG A 140 10.341 -10.358 5.589 1.00 0.78 C ATOM 2244 CG ARG A 140 11.749 -10.728 5.159 1.00 1.61 C ATOM 2245 CD ARG A 140 12.545 -11.330 6.305 1.00 1.91 C ATOM 2246 NE ARG A 140 13.882 -11.735 5.877 1.00 2.46 N ATOM 2247 CZ ARG A 140 14.641 -12.617 6.528 1.00 3.13 C ATOM 2248 NH1 ARG A 140 14.263 -13.080 7.714 1.00 3.38 N ATOM 2249 NH2 ARG A 140 15.803 -13.001 6.013 1.00 3.99 N ATOM 0 H ARG A 140 8.080 -9.511 5.991 1.00 0.37 H new ATOM 0 HA ARG A 140 10.007 -8.719 4.211 1.00 0.49 H new ATOM 0 HB2 ARG A 140 10.395 -9.706 6.461 1.00 0.78 H new ATOM 0 HB3 ARG A 140 9.815 -11.261 5.898 1.00 0.78 H new ATOM 0 HG2 ARG A 140 11.703 -11.439 4.334 1.00 1.61 H new ATOM 0 HG3 ARG A 140 12.261 -9.841 4.786 1.00 1.61 H new ATOM 0 HD2 ARG A 140 12.626 -10.604 7.114 1.00 1.91 H new ATOM 0 HD3 ARG A 140 12.013 -12.194 6.704 1.00 1.91 H new ATOM 0 HE ARG A 140 14.259 -11.317 5.026 1.00 2.46 H new ATOM 0 HH11 ARG A 140 13.388 -12.761 8.131 1.00 3.38 H new ATOM 0 HH12 ARG A 140 14.847 -13.755 8.208 1.00 3.38 H new ATOM 0 HH21 ARG A 140 16.115 -12.621 5.119 1.00 3.99 H new ATOM 0 HH22 ARG A 140 16.384 -13.676 6.511 1.00 3.99 H new ATOM 2263 N THR A 141 8.853 -11.706 3.388 1.00 0.40 N ATOM 2264 CA THR A 141 8.887 -12.697 2.325 1.00 0.58 C ATOM 2265 C THR A 141 7.815 -13.781 2.516 1.00 0.64 C ATOM 2266 O THR A 141 8.104 -14.913 2.910 1.00 1.14 O ATOM 2267 CB THR A 141 10.297 -13.330 2.226 1.00 0.85 C ATOM 2268 OG1 THR A 141 10.325 -14.373 1.246 1.00 1.13 O ATOM 2269 CG2 THR A 141 10.754 -13.861 3.580 1.00 0.94 C ATOM 0 H THR A 141 8.315 -11.978 4.211 1.00 0.40 H new ATOM 0 HA THR A 141 8.663 -12.186 1.389 1.00 0.58 H new ATOM 0 HB THR A 141 10.989 -12.548 1.913 1.00 0.85 H new ATOM 0 HG1 THR A 141 11.226 -14.756 1.201 1.00 1.13 H new ATOM 0 HG21 THR A 141 11.747 -14.300 3.482 1.00 0.94 H new ATOM 0 HG22 THR A 141 10.788 -13.043 4.299 1.00 0.94 H new ATOM 0 HG23 THR A 141 10.054 -14.621 3.928 1.00 0.94 H new ATOM 2277 N LYS A 142 6.563 -13.397 2.262 1.00 0.79 N ATOM 2278 CA LYS A 142 5.419 -14.328 2.239 1.00 0.87 C ATOM 2279 C LYS A 142 5.127 -14.968 3.596 1.00 0.84 C ATOM 2280 O LYS A 142 4.178 -15.744 3.729 1.00 1.09 O ATOM 2281 CB LYS A 142 5.644 -15.444 1.209 1.00 1.02 C ATOM 2282 CG LYS A 142 5.919 -14.975 -0.212 1.00 1.17 C ATOM 2283 CD LYS A 142 4.733 -14.244 -0.817 1.00 0.84 C ATOM 2284 CE LYS A 142 4.683 -14.438 -2.327 1.00 0.85 C ATOM 2285 NZ LYS A 142 4.325 -15.838 -2.686 1.00 1.57 N ATOM 0 H LYS A 142 6.306 -12.430 2.065 1.00 0.79 H new ATOM 0 HA LYS A 142 4.556 -13.721 1.965 1.00 0.87 H new ATOM 0 HB2 LYS A 142 6.482 -16.057 1.540 1.00 1.02 H new ATOM 0 HB3 LYS A 142 4.764 -16.087 1.197 1.00 1.02 H new ATOM 0 HG2 LYS A 142 6.788 -14.317 -0.213 1.00 1.17 H new ATOM 0 HG3 LYS A 142 6.169 -15.834 -0.834 1.00 1.17 H new ATOM 0 HD2 LYS A 142 3.809 -14.610 -0.369 1.00 0.84 H new ATOM 0 HD3 LYS A 142 4.800 -13.181 -0.586 1.00 0.84 H new ATOM 0 HE2 LYS A 142 3.954 -13.753 -2.759 1.00 0.85 H new ATOM 0 HE3 LYS A 142 5.652 -14.187 -2.759 1.00 0.85 H new ATOM 0 HZ1 LYS A 142 3.908 -15.856 -3.639 1.00 1.57 H new ATOM 0 HZ2 LYS A 142 5.180 -16.430 -2.670 1.00 1.57 H new ATOM 0 HZ3 LYS A 142 3.636 -16.207 -2.000 1.00 1.57 H new ATOM 2299 N GLY A 143 5.915 -14.644 4.595 1.00 0.67 N ATOM 2300 CA GLY A 143 5.800 -15.321 5.869 1.00 0.70 C ATOM 2301 C GLY A 143 5.482 -14.385 7.010 1.00 0.62 C ATOM 2302 O GLY A 143 6.379 -13.955 7.736 1.00 0.74 O ATOM 0 H GLY A 143 6.636 -13.924 4.553 1.00 0.67 H new ATOM 0 HA2 GLY A 143 5.021 -16.080 5.801 1.00 0.70 H new ATOM 0 HA3 GLY A 143 6.734 -15.841 6.083 1.00 0.70 H new ATOM 2306 N LEU A 144 4.211 -14.060 7.162 1.00 0.52 N ATOM 2307 CA LEU A 144 3.767 -13.215 8.259 1.00 0.46 C ATOM 2308 C LEU A 144 2.666 -13.908 9.046 1.00 0.48 C ATOM 2309 O LEU A 144 1.745 -14.489 8.468 1.00 0.53 O ATOM 2310 CB LEU A 144 3.268 -11.861 7.747 1.00 0.43 C ATOM 2311 CG LEU A 144 4.332 -10.949 7.137 1.00 0.40 C ATOM 2312 CD1 LEU A 144 3.764 -9.555 6.940 1.00 0.56 C ATOM 2313 CD2 LEU A 144 5.571 -10.894 8.018 1.00 0.56 C ATOM 0 H LEU A 144 3.465 -14.369 6.538 1.00 0.52 H new ATOM 0 HA LEU A 144 4.621 -13.040 8.914 1.00 0.46 H new ATOM 0 HB2 LEU A 144 2.496 -12.039 6.998 1.00 0.43 H new ATOM 0 HB3 LEU A 144 2.794 -11.333 8.574 1.00 0.43 H new ATOM 0 HG LEU A 144 4.624 -11.357 6.169 1.00 0.40 H new ATOM 0 HD11 LEU A 144 4.527 -8.909 6.505 1.00 0.56 H new ATOM 0 HD12 LEU A 144 2.905 -9.603 6.271 1.00 0.56 H new ATOM 0 HD13 LEU A 144 3.452 -9.150 7.903 1.00 0.56 H new ATOM 0 HD21 LEU A 144 6.313 -10.239 7.562 1.00 0.56 H new ATOM 0 HD22 LEU A 144 5.302 -10.508 9.001 1.00 0.56 H new ATOM 0 HD23 LEU A 144 5.988 -11.896 8.123 1.00 0.56 H new ATOM 2325 N SER A 145 2.783 -13.846 10.364 1.00 0.51 N ATOM 2326 CA SER A 145 1.830 -14.468 11.268 1.00 0.56 C ATOM 2327 C SER A 145 0.437 -13.869 11.090 1.00 0.50 C ATOM 2328 O SER A 145 0.285 -12.687 10.771 1.00 0.49 O ATOM 2329 CB SER A 145 2.299 -14.282 12.716 1.00 0.65 C ATOM 2330 OG SER A 145 1.417 -14.910 13.631 1.00 1.43 O ATOM 0 H SER A 145 3.545 -13.361 10.837 1.00 0.51 H new ATOM 0 HA SER A 145 1.774 -15.531 11.036 1.00 0.56 H new ATOM 0 HB2 SER A 145 3.301 -14.696 12.831 1.00 0.65 H new ATOM 0 HB3 SER A 145 2.366 -13.218 12.945 1.00 0.65 H new ATOM 0 HG SER A 145 1.744 -14.775 14.545 1.00 1.43 H new ATOM 2336 N ASP A 146 -0.578 -14.703 11.309 1.00 0.53 N ATOM 2337 CA ASP A 146 -1.973 -14.281 11.228 1.00 0.51 C ATOM 2338 C ASP A 146 -2.246 -13.169 12.225 1.00 0.48 C ATOM 2339 O ASP A 146 -3.140 -12.345 12.027 1.00 0.46 O ATOM 2340 CB ASP A 146 -2.903 -15.469 11.501 1.00 0.62 C ATOM 2341 CG ASP A 146 -4.374 -15.096 11.450 1.00 1.15 C ATOM 2342 OD1 ASP A 146 -4.969 -15.150 10.355 1.00 1.24 O ATOM 2343 OD2 ASP A 146 -4.945 -14.757 12.509 1.00 2.08 O ATOM 0 H ASP A 146 -0.456 -15.687 11.547 1.00 0.53 H new ATOM 0 HA ASP A 146 -2.164 -13.907 10.222 1.00 0.51 H new ATOM 0 HB2 ASP A 146 -2.707 -16.252 10.769 1.00 0.62 H new ATOM 0 HB3 ASP A 146 -2.673 -15.885 12.482 1.00 0.62 H new ATOM 2348 N GLU A 147 -1.443 -13.144 13.278 1.00 0.51 N ATOM 2349 CA GLU A 147 -1.542 -12.122 14.300 1.00 0.53 C ATOM 2350 C GLU A 147 -1.404 -10.734 13.689 1.00 0.45 C ATOM 2351 O GLU A 147 -2.241 -9.859 13.917 1.00 0.46 O ATOM 2352 CB GLU A 147 -0.440 -12.326 15.338 1.00 0.62 C ATOM 2353 CG GLU A 147 -0.443 -11.280 16.438 1.00 0.72 C ATOM 2354 CD GLU A 147 0.951 -10.853 16.834 1.00 1.25 C ATOM 2355 OE1 GLU A 147 1.594 -11.579 17.621 1.00 1.48 O ATOM 2356 OE2 GLU A 147 1.418 -9.801 16.353 1.00 1.99 O ATOM 0 H GLU A 147 -0.708 -13.831 13.445 1.00 0.51 H new ATOM 0 HA GLU A 147 -2.520 -12.203 14.775 1.00 0.53 H new ATOM 0 HB2 GLU A 147 -0.552 -13.313 15.786 1.00 0.62 H new ATOM 0 HB3 GLU A 147 0.528 -12.312 14.837 1.00 0.62 H new ATOM 0 HG2 GLU A 147 -1.006 -10.408 16.104 1.00 0.72 H new ATOM 0 HG3 GLU A 147 -0.960 -11.678 17.312 1.00 0.72 H new ATOM 2363 N LEU A 148 -0.366 -10.544 12.885 1.00 0.41 N ATOM 2364 CA LEU A 148 -0.033 -9.220 12.393 1.00 0.37 C ATOM 2365 C LEU A 148 -1.002 -8.747 11.308 1.00 0.31 C ATOM 2366 O LEU A 148 -1.264 -7.551 11.192 1.00 0.29 O ATOM 2367 CB LEU A 148 1.437 -9.157 11.935 1.00 0.37 C ATOM 2368 CG LEU A 148 1.866 -10.133 10.835 1.00 0.35 C ATOM 2369 CD1 LEU A 148 1.442 -9.637 9.467 1.00 0.33 C ATOM 2370 CD2 LEU A 148 3.371 -10.322 10.863 1.00 0.38 C ATOM 0 H LEU A 148 0.254 -11.287 12.563 1.00 0.41 H new ATOM 0 HA LEU A 148 -0.146 -8.522 13.222 1.00 0.37 H new ATOM 0 HB2 LEU A 148 1.640 -8.144 11.587 1.00 0.37 H new ATOM 0 HB3 LEU A 148 2.070 -9.328 12.805 1.00 0.37 H new ATOM 0 HG LEU A 148 1.375 -11.088 11.024 1.00 0.35 H new ATOM 0 HD11 LEU A 148 1.760 -10.350 8.707 1.00 0.33 H new ATOM 0 HD12 LEU A 148 0.357 -9.535 9.437 1.00 0.33 H new ATOM 0 HD13 LEU A 148 1.903 -8.669 9.272 1.00 0.33 H new ATOM 0 HD21 LEU A 148 3.665 -11.018 10.077 1.00 0.38 H new ATOM 0 HD22 LEU A 148 3.861 -9.362 10.700 1.00 0.38 H new ATOM 0 HD23 LEU A 148 3.669 -10.722 11.832 1.00 0.38 H new ATOM 2382 N LYS A 149 -1.562 -9.670 10.528 1.00 0.31 N ATOM 2383 CA LYS A 149 -2.523 -9.266 9.509 1.00 0.29 C ATOM 2384 C LYS A 149 -3.856 -8.912 10.142 1.00 0.29 C ATOM 2385 O LYS A 149 -4.478 -7.919 9.787 1.00 0.28 O ATOM 2386 CB LYS A 149 -2.720 -10.322 8.415 1.00 0.35 C ATOM 2387 CG LYS A 149 -2.748 -11.767 8.878 1.00 0.78 C ATOM 2388 CD LYS A 149 -3.065 -12.685 7.706 1.00 0.80 C ATOM 2389 CE LYS A 149 -3.007 -14.152 8.094 1.00 0.83 C ATOM 2390 NZ LYS A 149 -3.421 -15.039 6.976 1.00 1.22 N ATOM 0 H LYS A 149 -1.374 -10.671 10.579 1.00 0.31 H new ATOM 0 HA LYS A 149 -2.104 -8.384 9.024 1.00 0.29 H new ATOM 0 HB2 LYS A 149 -3.656 -10.109 7.898 1.00 0.35 H new ATOM 0 HB3 LYS A 149 -1.919 -10.212 7.684 1.00 0.35 H new ATOM 0 HG2 LYS A 149 -1.785 -12.037 9.311 1.00 0.78 H new ATOM 0 HG3 LYS A 149 -3.496 -11.892 9.661 1.00 0.78 H new ATOM 0 HD2 LYS A 149 -4.058 -12.452 7.322 1.00 0.80 H new ATOM 0 HD3 LYS A 149 -2.358 -12.497 6.898 1.00 0.80 H new ATOM 0 HE2 LYS A 149 -1.993 -14.406 8.402 1.00 0.83 H new ATOM 0 HE3 LYS A 149 -3.654 -14.326 8.954 1.00 0.83 H new ATOM 0 HZ1 LYS A 149 -3.367 -16.031 7.282 1.00 1.22 H new ATOM 0 HZ2 LYS A 149 -4.398 -14.815 6.698 1.00 1.22 H new ATOM 0 HZ3 LYS A 149 -2.788 -14.892 6.164 1.00 1.22 H new ATOM 2404 N GLU A 150 -4.293 -9.716 11.087 1.00 0.33 N ATOM 2405 CA GLU A 150 -5.489 -9.388 11.850 1.00 0.35 C ATOM 2406 C GLU A 150 -5.332 -8.009 12.496 1.00 0.34 C ATOM 2407 O GLU A 150 -6.287 -7.244 12.599 1.00 0.35 O ATOM 2408 CB GLU A 150 -5.751 -10.451 12.915 1.00 0.42 C ATOM 2409 CG GLU A 150 -7.078 -10.285 13.638 1.00 1.02 C ATOM 2410 CD GLU A 150 -7.291 -11.343 14.700 1.00 1.39 C ATOM 2411 OE1 GLU A 150 -7.421 -12.534 14.345 1.00 1.83 O ATOM 2412 OE2 GLU A 150 -7.343 -10.990 15.896 1.00 2.00 O ATOM 0 H GLU A 150 -3.846 -10.595 11.348 1.00 0.33 H new ATOM 0 HA GLU A 150 -6.344 -9.365 11.174 1.00 0.35 H new ATOM 0 HB2 GLU A 150 -5.724 -11.435 12.447 1.00 0.42 H new ATOM 0 HB3 GLU A 150 -4.944 -10.425 13.647 1.00 0.42 H new ATOM 0 HG2 GLU A 150 -7.117 -9.298 14.099 1.00 1.02 H new ATOM 0 HG3 GLU A 150 -7.892 -10.331 12.914 1.00 1.02 H new ATOM 2419 N ARG A 151 -4.111 -7.693 12.910 1.00 0.33 N ATOM 2420 CA ARG A 151 -3.808 -6.378 13.459 1.00 0.35 C ATOM 2421 C ARG A 151 -4.029 -5.277 12.417 1.00 0.30 C ATOM 2422 O ARG A 151 -4.492 -4.187 12.757 1.00 0.32 O ATOM 2423 CB ARG A 151 -2.371 -6.339 13.993 1.00 0.41 C ATOM 2424 CG ARG A 151 -2.193 -7.115 15.290 1.00 1.21 C ATOM 2425 CD ARG A 151 -0.725 -7.349 15.630 1.00 1.20 C ATOM 2426 NE ARG A 151 0.027 -6.104 15.777 1.00 1.71 N ATOM 2427 CZ ARG A 151 1.359 -6.046 15.862 1.00 1.97 C ATOM 2428 NH1 ARG A 151 2.081 -7.163 15.901 1.00 1.74 N ATOM 2429 NH2 ARG A 151 1.966 -4.869 15.947 1.00 2.88 N ATOM 0 H ARG A 151 -3.315 -8.330 12.876 1.00 0.33 H new ATOM 0 HA ARG A 151 -4.492 -6.193 14.288 1.00 0.35 H new ATOM 0 HB2 ARG A 151 -1.698 -6.746 13.238 1.00 0.41 H new ATOM 0 HB3 ARG A 151 -2.078 -5.302 14.155 1.00 0.41 H new ATOM 0 HG2 ARG A 151 -2.670 -6.570 16.105 1.00 1.21 H new ATOM 0 HG3 ARG A 151 -2.702 -8.075 15.208 1.00 1.21 H new ATOM 0 HD2 ARG A 151 -0.658 -7.920 16.556 1.00 1.20 H new ATOM 0 HD3 ARG A 151 -0.267 -7.954 14.848 1.00 1.20 H new ATOM 0 HE ARG A 151 -0.496 -5.229 15.817 1.00 1.71 H new ATOM 0 HH11 ARG A 151 1.618 -8.071 15.866 1.00 1.74 H new ATOM 0 HH12 ARG A 151 3.098 -7.111 15.966 1.00 1.74 H new ATOM 0 HH21 ARG A 151 1.416 -4.010 15.947 1.00 2.88 H new ATOM 0 HH22 ARG A 151 2.983 -4.823 16.012 1.00 2.88 H new ATOM 2443 N PHE A 152 -3.715 -5.561 11.149 1.00 0.28 N ATOM 2444 CA PHE A 152 -3.927 -4.575 10.089 1.00 0.27 C ATOM 2445 C PHE A 152 -5.420 -4.403 9.804 1.00 0.23 C ATOM 2446 O PHE A 152 -5.883 -3.283 9.600 1.00 0.24 O ATOM 2447 CB PHE A 152 -3.140 -4.924 8.794 1.00 0.30 C ATOM 2448 CG PHE A 152 -3.949 -5.548 7.671 1.00 0.25 C ATOM 2449 CD1 PHE A 152 -4.899 -4.808 6.978 1.00 0.21 C ATOM 2450 CD2 PHE A 152 -3.756 -6.871 7.312 1.00 0.28 C ATOM 2451 CE1 PHE A 152 -5.639 -5.378 5.966 1.00 0.19 C ATOM 2452 CE2 PHE A 152 -4.493 -7.445 6.295 1.00 0.26 C ATOM 2453 CZ PHE A 152 -5.437 -6.698 5.624 1.00 0.21 C ATOM 0 H PHE A 152 -3.321 -6.448 10.837 1.00 0.28 H new ATOM 0 HA PHE A 152 -3.533 -3.623 10.446 1.00 0.27 H new ATOM 0 HB2 PHE A 152 -2.676 -4.012 8.418 1.00 0.30 H new ATOM 0 HB3 PHE A 152 -2.332 -5.607 9.056 1.00 0.30 H new ATOM 0 HD1 PHE A 152 -5.059 -3.772 7.236 1.00 0.21 H new ATOM 0 HD2 PHE A 152 -3.019 -7.462 7.835 1.00 0.28 H new ATOM 0 HE1 PHE A 152 -6.378 -4.791 5.440 1.00 0.19 H new ATOM 0 HE2 PHE A 152 -4.330 -8.478 6.026 1.00 0.26 H new ATOM 0 HZ PHE A 152 -6.018 -7.146 4.831 1.00 0.21 H new ATOM 2463 N VAL A 153 -6.176 -5.506 9.779 1.00 0.22 N ATOM 2464 CA VAL A 153 -7.607 -5.422 9.492 1.00 0.22 C ATOM 2465 C VAL A 153 -8.297 -4.611 10.589 1.00 0.25 C ATOM 2466 O VAL A 153 -9.199 -3.825 10.312 1.00 0.28 O ATOM 2467 CB VAL A 153 -8.288 -6.820 9.348 1.00 0.23 C ATOM 2468 CG1 VAL A 153 -7.436 -7.765 8.514 1.00 0.23 C ATOM 2469 CG2 VAL A 153 -8.609 -7.453 10.695 1.00 0.28 C ATOM 0 H VAL A 153 -5.827 -6.449 9.951 1.00 0.22 H new ATOM 0 HA VAL A 153 -7.714 -4.926 8.527 1.00 0.22 H new ATOM 0 HB VAL A 153 -9.233 -6.649 8.832 1.00 0.23 H new ATOM 0 HG11 VAL A 153 -7.937 -8.730 8.432 1.00 0.23 H new ATOM 0 HG12 VAL A 153 -7.294 -7.344 7.519 1.00 0.23 H new ATOM 0 HG13 VAL A 153 -6.466 -7.899 8.993 1.00 0.23 H new ATOM 0 HG21 VAL A 153 -9.081 -8.423 10.538 1.00 0.28 H new ATOM 0 HG22 VAL A 153 -7.688 -7.585 11.264 1.00 0.28 H new ATOM 0 HG23 VAL A 153 -9.288 -6.805 11.249 1.00 0.28 H new ATOM 2479 N SER A 154 -7.843 -4.779 11.830 1.00 0.28 N ATOM 2480 CA SER A 154 -8.357 -3.997 12.944 1.00 0.33 C ATOM 2481 C SER A 154 -8.006 -2.524 12.767 1.00 0.32 C ATOM 2482 O SER A 154 -8.800 -1.646 13.103 1.00 0.35 O ATOM 2483 CB SER A 154 -7.799 -4.523 14.264 1.00 0.38 C ATOM 2484 OG SER A 154 -8.233 -5.850 14.505 1.00 1.05 O ATOM 0 H SER A 154 -7.120 -5.451 12.085 1.00 0.28 H new ATOM 0 HA SER A 154 -9.443 -4.093 12.964 1.00 0.33 H new ATOM 0 HB2 SER A 154 -6.710 -4.491 14.241 1.00 0.38 H new ATOM 0 HB3 SER A 154 -8.120 -3.877 15.082 1.00 0.38 H new ATOM 0 HG SER A 154 -7.706 -6.471 13.959 1.00 1.05 H new ATOM 2490 N PHE A 155 -6.821 -2.256 12.226 1.00 0.29 N ATOM 2491 CA PHE A 155 -6.423 -0.890 11.919 1.00 0.29 C ATOM 2492 C PHE A 155 -7.313 -0.340 10.810 1.00 0.28 C ATOM 2493 O PHE A 155 -7.692 0.824 10.833 1.00 0.30 O ATOM 2494 CB PHE A 155 -4.946 -0.821 11.507 1.00 0.29 C ATOM 2495 CG PHE A 155 -4.422 0.583 11.365 1.00 0.31 C ATOM 2496 CD1 PHE A 155 -4.096 1.328 12.488 1.00 0.41 C ATOM 2497 CD2 PHE A 155 -4.262 1.162 10.114 1.00 0.26 C ATOM 2498 CE1 PHE A 155 -3.620 2.620 12.365 1.00 0.45 C ATOM 2499 CE2 PHE A 155 -3.789 2.454 9.987 1.00 0.30 C ATOM 2500 CZ PHE A 155 -3.467 3.183 11.115 1.00 0.39 C ATOM 0 H PHE A 155 -6.125 -2.964 11.993 1.00 0.29 H new ATOM 0 HA PHE A 155 -6.543 -0.282 12.815 1.00 0.29 H new ATOM 0 HB2 PHE A 155 -4.346 -1.350 12.248 1.00 0.29 H new ATOM 0 HB3 PHE A 155 -4.817 -1.345 10.560 1.00 0.29 H new ATOM 0 HD1 PHE A 155 -4.215 0.894 13.470 1.00 0.41 H new ATOM 0 HD2 PHE A 155 -4.510 0.596 9.229 1.00 0.26 H new ATOM 0 HE1 PHE A 155 -3.368 3.189 13.248 1.00 0.45 H new ATOM 0 HE2 PHE A 155 -3.671 2.893 9.007 1.00 0.30 H new ATOM 0 HZ PHE A 155 -3.096 4.193 11.019 1.00 0.39 H new ATOM 2510 N ALA A 156 -7.656 -1.198 9.850 1.00 0.25 N ATOM 2511 CA ALA A 156 -8.561 -0.824 8.770 1.00 0.25 C ATOM 2512 C ALA A 156 -9.896 -0.327 9.325 1.00 0.28 C ATOM 2513 O ALA A 156 -10.395 0.728 8.931 1.00 0.28 O ATOM 2514 CB ALA A 156 -8.819 -2.002 7.835 1.00 0.25 C ATOM 0 H ALA A 156 -7.318 -2.159 9.800 1.00 0.25 H new ATOM 0 HA ALA A 156 -8.080 -0.022 8.210 1.00 0.25 H new ATOM 0 HB1 ALA A 156 -9.497 -1.693 7.039 1.00 0.25 H new ATOM 0 HB2 ALA A 156 -7.877 -2.334 7.400 1.00 0.25 H new ATOM 0 HB3 ALA A 156 -9.268 -2.821 8.397 1.00 0.25 H new ATOM 2520 N LYS A 157 -10.460 -1.097 10.250 1.00 0.33 N ATOM 2521 CA LYS A 157 -11.775 -0.800 10.807 1.00 0.39 C ATOM 2522 C LYS A 157 -11.729 0.409 11.740 1.00 0.41 C ATOM 2523 O LYS A 157 -12.657 1.214 11.764 1.00 0.44 O ATOM 2524 CB LYS A 157 -12.336 -2.023 11.541 1.00 0.50 C ATOM 2525 CG LYS A 157 -12.595 -3.210 10.622 1.00 0.78 C ATOM 2526 CD LYS A 157 -11.910 -4.466 11.134 1.00 0.70 C ATOM 2527 CE LYS A 157 -11.873 -5.564 10.078 1.00 0.55 C ATOM 2528 NZ LYS A 157 -13.107 -6.393 10.079 1.00 0.75 N ATOM 0 H LYS A 157 -10.024 -1.936 10.632 1.00 0.33 H new ATOM 0 HA LYS A 157 -12.438 -0.554 9.978 1.00 0.39 H new ATOM 0 HB2 LYS A 157 -11.636 -2.322 12.321 1.00 0.50 H new ATOM 0 HB3 LYS A 157 -13.267 -1.746 12.036 1.00 0.50 H new ATOM 0 HG2 LYS A 157 -13.668 -3.385 10.544 1.00 0.78 H new ATOM 0 HG3 LYS A 157 -12.236 -2.981 9.619 1.00 0.78 H new ATOM 0 HD2 LYS A 157 -10.893 -4.225 11.442 1.00 0.70 H new ATOM 0 HD3 LYS A 157 -12.433 -4.830 12.018 1.00 0.70 H new ATOM 0 HE2 LYS A 157 -11.742 -5.114 9.094 1.00 0.55 H new ATOM 0 HE3 LYS A 157 -11.008 -6.204 10.253 1.00 0.55 H new ATOM 0 HZ1 LYS A 157 -12.987 -7.196 9.429 1.00 0.75 H new ATOM 0 HZ2 LYS A 157 -13.285 -6.749 11.040 1.00 0.75 H new ATOM 0 HZ3 LYS A 157 -13.914 -5.815 9.769 1.00 0.75 H new ATOM 2542 N SER A 158 -10.644 0.546 12.494 1.00 0.48 N ATOM 2543 CA SER A 158 -10.496 1.677 13.404 1.00 0.58 C ATOM 2544 C SER A 158 -10.141 2.952 12.636 1.00 0.49 C ATOM 2545 O SER A 158 -10.343 4.067 13.126 1.00 0.55 O ATOM 2546 CB SER A 158 -9.436 1.372 14.465 1.00 0.81 C ATOM 2547 OG SER A 158 -8.251 0.868 13.879 1.00 1.39 O ATOM 0 H SER A 158 -9.860 -0.106 12.494 1.00 0.48 H new ATOM 0 HA SER A 158 -11.450 1.841 13.905 1.00 0.58 H new ATOM 0 HB2 SER A 158 -9.209 2.278 15.026 1.00 0.81 H new ATOM 0 HB3 SER A 158 -9.829 0.646 15.177 1.00 0.81 H new ATOM 0 HG SER A 158 -8.288 -0.111 13.856 1.00 1.39 H new ATOM 2553 N LEU A 159 -9.613 2.776 11.429 1.00 0.43 N ATOM 2554 CA LEU A 159 -9.286 3.892 10.552 1.00 0.46 C ATOM 2555 C LEU A 159 -10.555 4.386 9.843 1.00 0.38 C ATOM 2556 O LEU A 159 -10.570 5.467 9.257 1.00 0.55 O ATOM 2557 CB LEU A 159 -8.210 3.449 9.546 1.00 0.61 C ATOM 2558 CG LEU A 159 -7.582 4.541 8.669 1.00 0.30 C ATOM 2559 CD1 LEU A 159 -6.878 5.602 9.520 1.00 0.34 C ATOM 2560 CD2 LEU A 159 -6.603 3.906 7.688 1.00 0.76 C ATOM 0 H LEU A 159 -9.401 1.860 11.034 1.00 0.43 H new ATOM 0 HA LEU A 159 -8.887 4.723 11.135 1.00 0.46 H new ATOM 0 HB2 LEU A 159 -7.410 2.958 10.100 1.00 0.61 H new ATOM 0 HB3 LEU A 159 -8.649 2.698 8.889 1.00 0.61 H new ATOM 0 HG LEU A 159 -8.377 5.040 8.114 1.00 0.30 H new ATOM 0 HD11 LEU A 159 -6.444 6.361 8.869 1.00 0.34 H new ATOM 0 HD12 LEU A 159 -7.600 6.069 10.190 1.00 0.34 H new ATOM 0 HD13 LEU A 159 -6.089 5.133 10.107 1.00 0.34 H new ATOM 0 HD21 LEU A 159 -6.157 4.682 7.065 1.00 0.76 H new ATOM 0 HD22 LEU A 159 -5.819 3.389 8.240 1.00 0.76 H new ATOM 0 HD23 LEU A 159 -7.132 3.193 7.056 1.00 0.76 H new ATOM 2572 N GLY A 160 -11.623 3.592 9.921 1.00 0.31 N ATOM 2573 CA GLY A 160 -12.908 4.019 9.390 1.00 0.41 C ATOM 2574 C GLY A 160 -13.542 3.007 8.452 1.00 0.35 C ATOM 2575 O GLY A 160 -14.727 3.105 8.124 1.00 0.42 O ATOM 0 H GLY A 160 -11.621 2.663 10.342 1.00 0.31 H new ATOM 0 HA2 GLY A 160 -13.589 4.211 10.219 1.00 0.41 H new ATOM 0 HA3 GLY A 160 -12.778 4.962 8.860 1.00 0.41 H new ATOM 2579 N LEU A 161 -12.772 2.023 8.026 1.00 0.38 N ATOM 2580 CA LEU A 161 -13.248 1.067 7.039 1.00 0.35 C ATOM 2581 C LEU A 161 -13.844 -0.176 7.689 1.00 0.37 C ATOM 2582 O LEU A 161 -14.037 -0.233 8.899 1.00 0.58 O ATOM 2583 CB LEU A 161 -12.112 0.686 6.096 1.00 0.32 C ATOM 2584 CG LEU A 161 -12.280 1.189 4.666 1.00 0.33 C ATOM 2585 CD1 LEU A 161 -10.960 1.730 4.144 1.00 0.39 C ATOM 2586 CD2 LEU A 161 -12.790 0.060 3.779 1.00 0.35 C ATOM 0 H LEU A 161 -11.817 1.863 8.346 1.00 0.38 H new ATOM 0 HA LEU A 161 -14.045 1.545 6.469 1.00 0.35 H new ATOM 0 HB2 LEU A 161 -11.177 1.077 6.498 1.00 0.32 H new ATOM 0 HB3 LEU A 161 -12.021 -0.400 6.077 1.00 0.32 H new ATOM 0 HG LEU A 161 -13.010 1.998 4.653 1.00 0.33 H new ATOM 0 HD11 LEU A 161 -11.091 2.086 3.122 1.00 0.39 H new ATOM 0 HD12 LEU A 161 -10.629 2.554 4.776 1.00 0.39 H new ATOM 0 HD13 LEU A 161 -10.211 0.938 4.159 1.00 0.39 H new ATOM 0 HD21 LEU A 161 -12.908 0.424 2.759 1.00 0.35 H new ATOM 0 HD22 LEU A 161 -12.075 -0.763 3.790 1.00 0.35 H new ATOM 0 HD23 LEU A 161 -13.752 -0.290 4.153 1.00 0.35 H new ATOM 2598 N LYS A 162 -14.164 -1.153 6.854 1.00 0.40 N ATOM 2599 CA LYS A 162 -14.877 -2.350 7.282 1.00 0.42 C ATOM 2600 C LYS A 162 -14.434 -3.544 6.457 1.00 0.36 C ATOM 2601 O LYS A 162 -14.046 -3.403 5.295 1.00 0.35 O ATOM 2602 CB LYS A 162 -16.404 -2.146 7.177 1.00 0.52 C ATOM 2603 CG LYS A 162 -16.943 -1.855 5.769 1.00 0.86 C ATOM 2604 CD LYS A 162 -16.352 -0.592 5.147 1.00 0.93 C ATOM 2605 CE LYS A 162 -16.913 0.711 5.722 1.00 0.77 C ATOM 2606 NZ LYS A 162 -16.949 0.746 7.213 1.00 1.46 N ATOM 0 H LYS A 162 -13.937 -1.140 5.860 1.00 0.40 H new ATOM 0 HA LYS A 162 -14.637 -2.542 8.328 1.00 0.42 H new ATOM 0 HB2 LYS A 162 -16.898 -3.040 7.557 1.00 0.52 H new ATOM 0 HB3 LYS A 162 -16.688 -1.322 7.832 1.00 0.52 H new ATOM 0 HG2 LYS A 162 -16.728 -2.705 5.122 1.00 0.86 H new ATOM 0 HG3 LYS A 162 -18.027 -1.756 5.816 1.00 0.86 H new ATOM 0 HD2 LYS A 162 -15.271 -0.603 5.288 1.00 0.93 H new ATOM 0 HD3 LYS A 162 -16.534 -0.610 4.072 1.00 0.93 H new ATOM 0 HE2 LYS A 162 -16.310 1.545 5.363 1.00 0.77 H new ATOM 0 HE3 LYS A 162 -17.923 0.860 5.340 1.00 0.77 H new ATOM 0 HZ1 LYS A 162 -16.923 1.734 7.538 1.00 1.46 H new ATOM 0 HZ2 LYS A 162 -17.823 0.294 7.550 1.00 1.46 H new ATOM 0 HZ3 LYS A 162 -16.127 0.235 7.592 1.00 1.46 H new ATOM 2620 N ASP A 163 -14.483 -4.709 7.107 1.00 0.40 N ATOM 2621 CA ASP A 163 -14.010 -5.984 6.559 1.00 0.41 C ATOM 2622 C ASP A 163 -14.522 -6.243 5.156 1.00 0.39 C ATOM 2623 O ASP A 163 -13.873 -6.937 4.376 1.00 0.42 O ATOM 2624 CB ASP A 163 -14.463 -7.124 7.463 1.00 0.52 C ATOM 2625 CG ASP A 163 -13.725 -8.413 7.192 1.00 0.81 C ATOM 2626 OD1 ASP A 163 -12.655 -8.638 7.799 1.00 0.91 O ATOM 2627 OD2 ASP A 163 -14.214 -9.202 6.360 1.00 1.81 O ATOM 0 H ASP A 163 -14.861 -4.795 8.050 1.00 0.40 H new ATOM 0 HA ASP A 163 -12.922 -5.928 6.512 1.00 0.41 H new ATOM 0 HB2 ASP A 163 -14.314 -6.837 8.504 1.00 0.52 H new ATOM 0 HB3 ASP A 163 -15.532 -7.287 7.327 1.00 0.52 H new ATOM 2632 N ASN A 164 -15.672 -5.666 4.833 1.00 0.39 N ATOM 2633 CA ASN A 164 -16.297 -5.883 3.526 1.00 0.43 C ATOM 2634 C ASN A 164 -15.469 -5.275 2.397 1.00 0.38 C ATOM 2635 O ASN A 164 -15.766 -5.471 1.221 1.00 0.47 O ATOM 2636 CB ASN A 164 -17.726 -5.337 3.497 1.00 0.52 C ATOM 2637 CG ASN A 164 -18.737 -6.355 3.990 1.00 1.34 C ATOM 2638 OD1 ASN A 164 -19.266 -7.145 3.211 1.00 2.34 O ATOM 2639 ND2 ASN A 164 -19.018 -6.345 5.282 1.00 1.68 N ATOM 0 H ASN A 164 -16.193 -5.045 5.453 1.00 0.39 H new ATOM 0 HA ASN A 164 -16.339 -6.960 3.367 1.00 0.43 H new ATOM 0 HB2 ASN A 164 -17.784 -4.441 4.115 1.00 0.52 H new ATOM 0 HB3 ASN A 164 -17.979 -5.039 2.479 1.00 0.52 H new ATOM 0 HD21 ASN A 164 -19.694 -7.008 5.662 1.00 1.68 H new ATOM 0 HD22 ASN A 164 -18.559 -5.675 5.899 1.00 1.68 H new ATOM 2646 N ASN A 165 -14.433 -4.532 2.765 1.00 0.32 N ATOM 2647 CA ASN A 165 -13.459 -4.040 1.801 1.00 0.31 C ATOM 2648 C ASN A 165 -12.046 -4.312 2.308 1.00 0.26 C ATOM 2649 O ASN A 165 -11.131 -3.527 2.086 1.00 0.27 O ATOM 2650 CB ASN A 165 -13.648 -2.541 1.533 1.00 0.35 C ATOM 2651 CG ASN A 165 -14.844 -2.246 0.647 1.00 0.53 C ATOM 2652 OD1 ASN A 165 -15.171 -3.011 -0.262 1.00 1.40 O ATOM 2653 ND2 ASN A 165 -15.514 -1.136 0.905 1.00 0.61 N ATOM 0 H ASN A 165 -14.246 -4.256 3.729 1.00 0.32 H new ATOM 0 HA ASN A 165 -13.613 -4.569 0.860 1.00 0.31 H new ATOM 0 HB2 ASN A 165 -13.768 -2.020 2.483 1.00 0.35 H new ATOM 0 HB3 ASN A 165 -12.748 -2.145 1.063 1.00 0.35 H new ATOM 0 HD21 ASN A 165 -16.329 -0.890 0.344 1.00 0.61 H new ATOM 0 HD22 ASN A 165 -15.216 -0.525 1.665 1.00 0.61 H new ATOM 2660 N ILE A 166 -11.883 -5.421 3.017 1.00 0.25 N ATOM 2661 CA ILE A 166 -10.575 -5.822 3.527 1.00 0.22 C ATOM 2662 C ILE A 166 -10.248 -7.242 3.088 1.00 0.24 C ATOM 2663 O ILE A 166 -10.742 -8.204 3.669 1.00 0.33 O ATOM 2664 CB ILE A 166 -10.519 -5.766 5.076 1.00 0.23 C ATOM 2665 CG1 ILE A 166 -10.938 -4.386 5.583 1.00 0.25 C ATOM 2666 CG2 ILE A 166 -9.127 -6.135 5.594 1.00 0.24 C ATOM 2667 CD1 ILE A 166 -10.931 -4.264 7.091 1.00 0.26 C ATOM 0 H ILE A 166 -12.641 -6.061 3.253 1.00 0.25 H new ATOM 0 HA ILE A 166 -9.847 -5.120 3.120 1.00 0.22 H new ATOM 0 HB ILE A 166 -11.224 -6.502 5.463 1.00 0.23 H new ATOM 0 HG12 ILE A 166 -10.268 -3.636 5.164 1.00 0.25 H new ATOM 0 HG13 ILE A 166 -11.939 -4.162 5.214 1.00 0.25 H new ATOM 0 HG21 ILE A 166 -9.119 -6.087 6.683 1.00 0.24 H new ATOM 0 HG22 ILE A 166 -8.876 -7.146 5.274 1.00 0.24 H new ATOM 0 HG23 ILE A 166 -8.393 -5.435 5.195 1.00 0.24 H new ATOM 0 HD11 ILE A 166 -11.239 -3.258 7.376 1.00 0.26 H new ATOM 0 HD12 ILE A 166 -11.623 -4.990 7.518 1.00 0.26 H new ATOM 0 HD13 ILE A 166 -9.926 -4.456 7.467 1.00 0.26 H new ATOM 2679 N VAL A 167 -9.416 -7.369 2.072 1.00 0.25 N ATOM 2680 CA VAL A 167 -9.032 -8.676 1.565 1.00 0.26 C ATOM 2681 C VAL A 167 -7.669 -9.084 2.105 1.00 0.26 C ATOM 2682 O VAL A 167 -6.988 -8.320 2.787 1.00 0.31 O ATOM 2683 CB VAL A 167 -8.960 -8.714 0.020 1.00 0.28 C ATOM 2684 CG1 VAL A 167 -10.328 -8.546 -0.623 1.00 0.57 C ATOM 2685 CG2 VAL A 167 -7.980 -7.676 -0.502 1.00 0.72 C ATOM 0 H VAL A 167 -8.992 -6.583 1.580 1.00 0.25 H new ATOM 0 HA VAL A 167 -9.805 -9.367 1.901 1.00 0.26 H new ATOM 0 HB VAL A 167 -8.596 -9.702 -0.261 1.00 0.28 H new ATOM 0 HG11 VAL A 167 -10.227 -8.579 -1.708 1.00 0.57 H new ATOM 0 HG12 VAL A 167 -10.986 -9.351 -0.295 1.00 0.57 H new ATOM 0 HG13 VAL A 167 -10.754 -7.587 -0.328 1.00 0.57 H new ATOM 0 HG21 VAL A 167 -7.947 -7.722 -1.591 1.00 0.72 H new ATOM 0 HG22 VAL A 167 -8.302 -6.682 -0.190 1.00 0.72 H new ATOM 0 HG23 VAL A 167 -6.987 -7.878 -0.100 1.00 0.72 H new ATOM 2695 N PHE A 168 -7.285 -10.298 1.781 1.00 0.26 N ATOM 2696 CA PHE A 168 -5.967 -10.801 2.099 1.00 0.28 C ATOM 2697 C PHE A 168 -5.295 -11.172 0.793 1.00 0.30 C ATOM 2698 O PHE A 168 -5.941 -11.713 -0.107 1.00 0.42 O ATOM 2699 CB PHE A 168 -6.052 -12.006 3.042 1.00 0.33 C ATOM 2700 CG PHE A 168 -6.698 -11.689 4.366 1.00 0.34 C ATOM 2701 CD1 PHE A 168 -6.056 -10.883 5.296 1.00 0.33 C ATOM 2702 CD2 PHE A 168 -7.950 -12.194 4.678 1.00 0.41 C ATOM 2703 CE1 PHE A 168 -6.653 -10.589 6.510 1.00 0.35 C ATOM 2704 CE2 PHE A 168 -8.549 -11.905 5.890 1.00 0.45 C ATOM 2705 CZ PHE A 168 -7.901 -11.102 6.806 1.00 0.40 C ATOM 0 H PHE A 168 -7.878 -10.966 1.289 1.00 0.26 H new ATOM 0 HA PHE A 168 -5.384 -10.040 2.619 1.00 0.28 H new ATOM 0 HB2 PHE A 168 -6.615 -12.801 2.553 1.00 0.33 H new ATOM 0 HB3 PHE A 168 -5.047 -12.390 3.220 1.00 0.33 H new ATOM 0 HD1 PHE A 168 -5.080 -10.481 5.070 1.00 0.33 H new ATOM 0 HD2 PHE A 168 -8.465 -12.821 3.965 1.00 0.41 H new ATOM 0 HE1 PHE A 168 -6.144 -9.959 7.225 1.00 0.35 H new ATOM 0 HE2 PHE A 168 -9.524 -12.308 6.120 1.00 0.45 H new ATOM 0 HZ PHE A 168 -8.369 -10.875 7.753 1.00 0.40 H new ATOM 2715 N SER A 169 -4.021 -10.854 0.672 1.00 0.48 N ATOM 2716 CA SER A 169 -3.336 -10.983 -0.597 1.00 0.63 C ATOM 2717 C SER A 169 -3.187 -12.445 -1.003 1.00 0.50 C ATOM 2718 O SER A 169 -2.614 -13.256 -0.278 1.00 0.66 O ATOM 2719 CB SER A 169 -1.975 -10.304 -0.520 1.00 1.01 C ATOM 2720 OG SER A 169 -1.210 -10.840 0.533 1.00 1.75 O ATOM 0 H SER A 169 -3.441 -10.505 1.435 1.00 0.48 H new ATOM 0 HA SER A 169 -3.937 -10.492 -1.363 1.00 0.63 H new ATOM 0 HB2 SER A 169 -1.445 -10.433 -1.464 1.00 1.01 H new ATOM 0 HB3 SER A 169 -2.106 -9.232 -0.372 1.00 1.01 H new ATOM 0 HG SER A 169 -1.370 -11.805 0.595 1.00 1.75 H new ATOM 2726 N VAL A 170 -3.730 -12.772 -2.162 1.00 0.46 N ATOM 2727 CA VAL A 170 -3.634 -14.116 -2.700 1.00 0.41 C ATOM 2728 C VAL A 170 -2.345 -14.285 -3.482 1.00 0.41 C ATOM 2729 O VAL A 170 -2.042 -13.484 -4.364 1.00 0.43 O ATOM 2730 CB VAL A 170 -4.837 -14.427 -3.609 1.00 0.47 C ATOM 2731 CG1 VAL A 170 -4.691 -15.778 -4.290 1.00 0.55 C ATOM 2732 CG2 VAL A 170 -6.115 -14.362 -2.805 1.00 0.57 C ATOM 0 H VAL A 170 -4.246 -12.119 -2.752 1.00 0.46 H new ATOM 0 HA VAL A 170 -3.636 -14.814 -1.863 1.00 0.41 H new ATOM 0 HB VAL A 170 -4.874 -13.675 -4.397 1.00 0.47 H new ATOM 0 HG11 VAL A 170 -5.559 -15.962 -4.923 1.00 0.55 H new ATOM 0 HG12 VAL A 170 -3.789 -15.782 -4.902 1.00 0.55 H new ATOM 0 HG13 VAL A 170 -4.620 -16.561 -3.535 1.00 0.55 H new ATOM 0 HG21 VAL A 170 -6.964 -14.583 -3.452 1.00 0.57 H new ATOM 0 HG22 VAL A 170 -6.075 -15.093 -1.998 1.00 0.57 H new ATOM 0 HG23 VAL A 170 -6.230 -13.363 -2.384 1.00 0.57 H new ATOM 2742 N PRO A 171 -1.553 -15.300 -3.131 1.00 0.47 N ATOM 2743 CA PRO A 171 -0.340 -15.649 -3.867 1.00 0.54 C ATOM 2744 C PRO A 171 -0.661 -16.030 -5.306 1.00 0.54 C ATOM 2745 O PRO A 171 -0.973 -17.185 -5.596 1.00 0.62 O ATOM 2746 CB PRO A 171 0.224 -16.853 -3.105 1.00 0.66 C ATOM 2747 CG PRO A 171 -0.433 -16.816 -1.767 1.00 0.83 C ATOM 2748 CD PRO A 171 -1.776 -16.183 -1.976 1.00 0.57 C ATOM 0 HA PRO A 171 0.362 -14.817 -3.925 1.00 0.54 H new ATOM 0 HB2 PRO A 171 0.004 -17.785 -3.625 1.00 0.66 H new ATOM 0 HB3 PRO A 171 1.308 -16.787 -3.013 1.00 0.66 H new ATOM 0 HG2 PRO A 171 -0.536 -17.820 -1.356 1.00 0.83 H new ATOM 0 HG3 PRO A 171 0.162 -16.241 -1.057 1.00 0.83 H new ATOM 0 HD2 PRO A 171 -2.545 -16.928 -2.181 1.00 0.57 H new ATOM 0 HD3 PRO A 171 -2.099 -15.624 -1.098 1.00 0.57 H new ATOM 2756 N THR A 172 -0.614 -15.048 -6.195 1.00 0.65 N ATOM 2757 CA THR A 172 -0.902 -15.284 -7.595 1.00 0.78 C ATOM 2758 C THR A 172 0.189 -16.140 -8.213 1.00 0.73 C ATOM 2759 O THR A 172 1.339 -16.126 -7.761 1.00 0.72 O ATOM 2760 CB THR A 172 -1.044 -13.963 -8.385 1.00 1.07 C ATOM 2761 OG1 THR A 172 -1.477 -14.229 -9.727 1.00 1.78 O ATOM 2762 CG2 THR A 172 0.268 -13.188 -8.421 1.00 0.81 C ATOM 0 H THR A 172 -0.379 -14.082 -5.968 1.00 0.65 H new ATOM 0 HA THR A 172 -1.856 -15.808 -7.651 1.00 0.78 H new ATOM 0 HB THR A 172 -1.789 -13.355 -7.872 1.00 1.07 H new ATOM 0 HG1 THR A 172 -2.133 -13.554 -9.999 1.00 1.78 H new ATOM 0 HG21 THR A 172 0.130 -12.265 -8.985 1.00 0.81 H new ATOM 0 HG22 THR A 172 0.577 -12.949 -7.404 1.00 0.81 H new ATOM 0 HG23 THR A 172 1.036 -13.795 -8.901 1.00 0.81 H new ATOM 2770 N ASP A 173 -0.169 -16.892 -9.229 1.00 0.75 N ATOM 2771 CA ASP A 173 0.770 -17.760 -9.882 1.00 0.80 C ATOM 2772 C ASP A 173 1.418 -17.043 -11.051 1.00 0.77 C ATOM 2773 O ASP A 173 1.000 -17.159 -12.202 1.00 0.86 O ATOM 2774 CB ASP A 173 0.076 -19.047 -10.324 1.00 0.99 C ATOM 2775 CG ASP A 173 -1.197 -18.824 -11.126 1.00 1.34 C ATOM 2776 OD1 ASP A 173 -2.125 -18.169 -10.602 1.00 1.94 O ATOM 2777 OD2 ASP A 173 -1.264 -19.268 -12.295 1.00 1.55 O ATOM 0 H ASP A 173 -1.111 -16.916 -9.619 1.00 0.75 H new ATOM 0 HA ASP A 173 1.559 -18.032 -9.181 1.00 0.80 H new ATOM 0 HB2 ASP A 173 0.772 -19.634 -10.923 1.00 0.99 H new ATOM 0 HB3 ASP A 173 -0.163 -19.640 -9.441 1.00 0.99 H new ATOM 2782 N GLN A 174 2.464 -16.310 -10.724 1.00 0.78 N ATOM 2783 CA GLN A 174 3.236 -15.557 -11.698 1.00 0.94 C ATOM 2784 C GLN A 174 4.639 -15.310 -11.171 1.00 0.89 C ATOM 2785 O GLN A 174 4.996 -15.760 -10.082 1.00 1.21 O ATOM 2786 CB GLN A 174 2.575 -14.210 -12.035 1.00 1.17 C ATOM 2787 CG GLN A 174 1.566 -14.271 -13.167 1.00 1.69 C ATOM 2788 CD GLN A 174 2.039 -15.090 -14.353 1.00 2.98 C ATOM 2789 OE1 GLN A 174 3.235 -15.169 -14.635 1.00 3.60 O ATOM 2790 NE2 GLN A 174 1.103 -15.707 -15.055 1.00 3.76 N ATOM 0 H GLN A 174 2.806 -16.218 -9.768 1.00 0.78 H new ATOM 0 HA GLN A 174 3.279 -16.152 -12.610 1.00 0.94 H new ATOM 0 HB2 GLN A 174 2.078 -13.830 -11.142 1.00 1.17 H new ATOM 0 HB3 GLN A 174 3.353 -13.493 -12.297 1.00 1.17 H new ATOM 0 HG2 GLN A 174 0.635 -14.694 -12.791 1.00 1.69 H new ATOM 0 HG3 GLN A 174 1.344 -13.257 -13.501 1.00 1.69 H new ATOM 0 HE21 GLN A 174 0.123 -15.616 -14.789 1.00 3.76 H new ATOM 0 HE22 GLN A 174 1.362 -16.274 -15.863 1.00 3.76 H new ATOM 2799 N CYS A 175 5.414 -14.566 -11.942 1.00 0.79 N ATOM 2800 CA CYS A 175 6.811 -14.286 -11.626 1.00 0.85 C ATOM 2801 C CYS A 175 6.942 -13.215 -10.542 1.00 1.02 C ATOM 2802 O CYS A 175 7.818 -12.354 -10.612 1.00 2.06 O ATOM 2803 CB CYS A 175 7.507 -13.821 -12.902 1.00 0.90 C ATOM 2804 SG CYS A 175 6.834 -14.599 -14.408 1.00 1.07 S ATOM 0 H CYS A 175 5.094 -14.136 -12.809 1.00 0.79 H new ATOM 0 HA CYS A 175 7.275 -15.194 -11.242 1.00 0.85 H new ATOM 0 HB2 CYS A 175 7.413 -12.738 -12.986 1.00 0.90 H new ATOM 0 HB3 CYS A 175 8.572 -14.044 -12.830 1.00 0.90 H new ATOM 2809 N ILE A 176 6.074 -13.282 -9.535 1.00 0.60 N ATOM 2810 CA ILE A 176 6.031 -12.275 -8.479 1.00 0.56 C ATOM 2811 C ILE A 176 7.310 -12.306 -7.642 1.00 0.80 C ATOM 2812 O ILE A 176 7.750 -11.284 -7.109 1.00 1.52 O ATOM 2813 CB ILE A 176 4.795 -12.470 -7.560 1.00 0.51 C ATOM 2814 CG1 ILE A 176 4.745 -11.364 -6.501 1.00 0.46 C ATOM 2815 CG2 ILE A 176 4.811 -13.847 -6.904 1.00 0.81 C ATOM 2816 CD1 ILE A 176 3.560 -11.452 -5.552 1.00 0.65 C ATOM 0 H ILE A 176 5.387 -14.028 -9.429 1.00 0.60 H new ATOM 0 HA ILE A 176 5.950 -11.302 -8.963 1.00 0.56 H new ATOM 0 HB ILE A 176 3.897 -12.406 -8.174 1.00 0.51 H new ATOM 0 HG12 ILE A 176 5.665 -11.396 -5.917 1.00 0.46 H new ATOM 0 HG13 ILE A 176 4.720 -10.397 -7.004 1.00 0.46 H new ATOM 0 HG21 ILE A 176 3.934 -13.956 -6.266 1.00 0.81 H new ATOM 0 HG22 ILE A 176 4.797 -14.617 -7.675 1.00 0.81 H new ATOM 0 HG23 ILE A 176 5.713 -13.953 -6.302 1.00 0.81 H new ATOM 0 HD11 ILE A 176 3.605 -10.631 -4.837 1.00 0.65 H new ATOM 0 HD12 ILE A 176 2.633 -11.387 -6.121 1.00 0.65 H new ATOM 0 HD13 ILE A 176 3.592 -12.401 -5.017 1.00 0.65 H new