USER MOD reduce.3.24.130724 H: found=0, std=0, add=1092, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1092 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 139 SER OG : rot -79:sc= -0.241 USER MOD Set 1.2: A 140 SER OG : rot 180:sc= 0.149 USER MOD Set 2.1: A 122 GLN : amide:sc= -4.21! C(o=-7!,f=-8.8!) USER MOD Set 2.2: A 125 MET CE :methyl -167:sc= -2.75! (180deg=-2.9!) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0.0203 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 GLN :FLIP amide:sc= -0.391 F(o=-1.5,f=-0.39) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN :FLIP amide:sc= 0.0223 F(o=-0.57,f=0.022) USER MOD Single : A 45 MET CE :methyl -159:sc= -0.0295 (180deg=-0.293) USER MOD Single : A 54 THR OG1 : rot 84:sc= 0.627 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 180:sc= 0.00277 USER MOD Single : A 66 GLN :FLIP amide:sc= 0.763 F(o=-0.31,f=0.76) USER MOD Single : A 68 HIS : no HD1:sc= -0.27 X(o=-0.27,f=-0.66) USER MOD Single : A 70 THR OG1 : rot 66:sc= 0.436 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 GLN : amide:sc= -1.69! C(o=-1.7!,f=-4.1!) USER MOD Single : A 76 GLN : amide:sc= -4.12! C(o=-4.1!,f=-9.4!) USER MOD Single : A 79 THR OG1 : rot -56:sc= 1.59 USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 SER OG : rot -170:sc= -0.756 USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 ASN : amide:sc= 0.309 K(o=0.31,f=-4.2!) USER MOD Single : A 106 CYS SG : rot 160:sc= -0.0878 USER MOD Single : A 109 SER OG : rot -114:sc= -1.07! USER MOD Single : A 111 ASN : amide:sc=-0.00349 K(o=-0.0035,f=-0.94) USER MOD Single : A 112 LYS NZ :NH3+ 152:sc= 0.233 (180deg=0.0374) USER MOD Single : A 114 MET CE :methyl -138:sc= -0.893 (180deg=-2.73!) USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot 57:sc= 1.19 USER MOD Single : A 138 HIS : no HD1:sc= 0 X(o=0,f=-0.0011) USER MOD Single : A 147 THR OG1 : rot 81:sc= 0.118 USER MOD Single : A 150 TYR OH : rot 150:sc= -1.1 USER MOD Single : A 165 ASN :FLIP amide:sc= -2.48! C(o=-3!,f=-2.5!) USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 86 N ASP A 8 -12.105 10.600 12.063 1.00 0.00 N ATOM 87 CA ASP A 8 -11.250 9.476 12.421 1.00 0.00 C ATOM 88 C ASP A 8 -10.542 8.918 11.192 1.00 0.00 C ATOM 89 O ASP A 8 -11.129 8.172 10.408 1.00 0.00 O ATOM 90 CB ASP A 8 -12.071 8.377 13.097 1.00 0.00 C ATOM 91 CG ASP A 8 -11.369 7.801 14.313 1.00 0.00 C ATOM 92 OD1 ASP A 8 -11.241 8.526 15.321 1.00 0.00 O ATOM 93 OD2 ASP A 8 -10.946 6.628 14.256 1.00 0.00 O ATOM 0 HA ASP A 8 -10.495 9.835 13.120 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -13.038 8.781 13.396 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -12.266 7.579 12.381 1.00 0.00 H new ATOM 98 N THR A 9 -9.275 9.282 11.030 1.00 0.00 N ATOM 99 CA THR A 9 -8.488 8.816 9.897 1.00 0.00 C ATOM 100 C THR A 9 -7.973 7.402 10.133 1.00 0.00 C ATOM 101 O THR A 9 -8.047 6.554 9.248 1.00 0.00 O ATOM 102 CB THR A 9 -7.313 9.762 9.641 1.00 0.00 C ATOM 103 OG1 THR A 9 -7.561 11.034 10.212 1.00 0.00 O ATOM 104 CG2 THR A 9 -7.018 9.966 8.169 1.00 0.00 C ATOM 0 H THR A 9 -8.772 9.898 11.669 1.00 0.00 H new ATOM 0 HA THR A 9 -9.136 8.805 9.020 1.00 0.00 H new ATOM 0 HB THR A 9 -6.450 9.284 10.104 1.00 0.00 H new ATOM 0 HG1 THR A 9 -6.798 11.624 10.039 1.00 0.00 H new ATOM 0 HG21 THR A 9 -6.174 10.647 8.058 1.00 0.00 H new ATOM 0 HG22 THR A 9 -6.774 9.008 7.711 1.00 0.00 H new ATOM 0 HG23 THR A 9 -7.894 10.390 7.678 1.00 0.00 H new ATOM 112 N ARG A 10 -7.464 7.151 11.339 1.00 0.00 N ATOM 113 CA ARG A 10 -6.942 5.833 11.692 1.00 0.00 C ATOM 114 C ARG A 10 -8.000 4.753 11.496 1.00 0.00 C ATOM 115 O ARG A 10 -7.698 3.650 11.042 1.00 0.00 O ATOM 116 CB ARG A 10 -6.460 5.824 13.145 1.00 0.00 C ATOM 117 CG ARG A 10 -5.892 4.485 13.593 1.00 0.00 C ATOM 118 CD ARG A 10 -5.529 4.500 15.070 1.00 0.00 C ATOM 119 NE ARG A 10 -6.517 3.797 15.887 1.00 0.00 N ATOM 120 CZ ARG A 10 -6.647 2.474 15.920 1.00 0.00 C ATOM 121 NH1 ARG A 10 -5.850 1.705 15.189 1.00 0.00 N ATOM 122 NH2 ARG A 10 -7.576 1.917 16.684 1.00 0.00 N ATOM 0 H ARG A 10 -7.402 7.843 12.086 1.00 0.00 H new ATOM 0 HA ARG A 10 -6.102 5.619 11.032 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -5.697 6.592 13.270 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -7.292 6.092 13.796 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -6.622 3.698 13.405 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.007 4.248 13.002 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -4.551 4.038 15.207 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -5.445 5.532 15.412 1.00 0.00 H new ATOM 0 HE ARG A 10 -7.144 4.355 16.466 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -5.134 2.128 14.599 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -5.953 0.691 15.218 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -8.192 2.503 17.247 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -7.675 0.902 16.709 1.00 0.00 H new ATOM 136 N ALA A 11 -9.241 5.073 11.846 1.00 0.00 N ATOM 137 CA ALA A 11 -10.336 4.124 11.710 1.00 0.00 C ATOM 138 C ALA A 11 -10.436 3.609 10.283 1.00 0.00 C ATOM 139 O ALA A 11 -10.612 2.416 10.061 1.00 0.00 O ATOM 140 CB ALA A 11 -11.649 4.761 12.139 1.00 0.00 C ATOM 0 H ALA A 11 -9.512 5.980 12.225 1.00 0.00 H new ATOM 0 HA ALA A 11 -10.131 3.275 12.363 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -12.457 4.037 12.031 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -11.579 5.073 13.181 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -11.854 5.630 11.513 1.00 0.00 H new ATOM 146 N LEU A 12 -10.318 4.517 9.323 1.00 0.00 N ATOM 147 CA LEU A 12 -10.395 4.153 7.915 1.00 0.00 C ATOM 148 C LEU A 12 -9.155 3.385 7.478 1.00 0.00 C ATOM 149 O LEU A 12 -9.233 2.497 6.627 1.00 0.00 O ATOM 150 CB LEU A 12 -10.551 5.403 7.058 1.00 0.00 C ATOM 151 CG LEU A 12 -10.460 5.164 5.551 1.00 0.00 C ATOM 152 CD1 LEU A 12 -11.535 4.186 5.097 1.00 0.00 C ATOM 153 CD2 LEU A 12 -10.580 6.481 4.814 1.00 0.00 C ATOM 0 H LEU A 12 -10.169 5.511 9.494 1.00 0.00 H new ATOM 0 HA LEU A 12 -11.265 3.510 7.782 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -11.514 5.861 7.281 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -9.783 6.121 7.345 1.00 0.00 H new ATOM 0 HG LEU A 12 -9.490 4.723 5.320 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -11.453 4.029 4.021 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -11.403 3.235 5.613 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -12.519 4.593 5.331 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -10.514 6.304 3.740 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -11.539 6.943 5.048 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -9.773 7.145 5.122 1.00 0.00 H new ATOM 165 N VAL A 13 -8.013 3.728 8.057 1.00 0.00 N ATOM 166 CA VAL A 13 -6.769 3.060 7.712 1.00 0.00 C ATOM 167 C VAL A 13 -6.787 1.620 8.206 1.00 0.00 C ATOM 168 O VAL A 13 -6.650 0.685 7.420 1.00 0.00 O ATOM 169 CB VAL A 13 -5.544 3.790 8.298 1.00 0.00 C ATOM 170 CG1 VAL A 13 -4.257 3.231 7.714 1.00 0.00 C ATOM 171 CG2 VAL A 13 -5.636 5.287 8.043 1.00 0.00 C ATOM 0 H VAL A 13 -7.923 4.459 8.762 1.00 0.00 H new ATOM 0 HA VAL A 13 -6.685 3.075 6.625 1.00 0.00 H new ATOM 0 HB VAL A 13 -5.534 3.625 9.375 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.404 3.760 8.140 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -4.181 2.170 7.950 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -4.261 3.362 6.632 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -4.762 5.782 8.465 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -5.675 5.471 6.969 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -6.538 5.681 8.512 1.00 0.00 H new ATOM 181 N ALA A 14 -6.966 1.449 9.512 1.00 0.00 N ATOM 182 CA ALA A 14 -7.005 0.120 10.112 1.00 0.00 C ATOM 183 C ALA A 14 -8.180 -0.704 9.585 1.00 0.00 C ATOM 184 O ALA A 14 -8.113 -1.933 9.547 1.00 0.00 O ATOM 185 CB ALA A 14 -7.072 0.229 11.628 1.00 0.00 C ATOM 0 H ALA A 14 -7.086 2.214 10.175 1.00 0.00 H new ATOM 0 HA ALA A 14 -6.088 -0.398 9.831 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -7.101 -0.770 12.064 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -6.193 0.759 11.994 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -7.971 0.776 11.914 1.00 0.00 H new ATOM 191 N ASP A 15 -9.255 -0.030 9.182 1.00 0.00 N ATOM 192 CA ASP A 15 -10.434 -0.722 8.661 1.00 0.00 C ATOM 193 C ASP A 15 -10.165 -1.278 7.274 1.00 0.00 C ATOM 194 O ASP A 15 -10.264 -2.483 7.042 1.00 0.00 O ATOM 195 CB ASP A 15 -11.642 0.217 8.603 1.00 0.00 C ATOM 196 CG ASP A 15 -12.736 -0.188 9.569 1.00 0.00 C ATOM 197 OD1 ASP A 15 -12.983 -1.404 9.709 1.00 0.00 O ATOM 198 OD2 ASP A 15 -13.347 0.711 10.184 1.00 0.00 O ATOM 0 H ASP A 15 -9.335 0.987 9.205 1.00 0.00 H new ATOM 0 HA ASP A 15 -10.656 -1.545 9.341 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -11.320 1.233 8.829 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -12.042 0.228 7.589 1.00 0.00 H new ATOM 203 N PHE A 16 -9.834 -0.389 6.350 1.00 0.00 N ATOM 204 CA PHE A 16 -9.559 -0.783 4.978 1.00 0.00 C ATOM 205 C PHE A 16 -8.535 -1.917 4.925 1.00 0.00 C ATOM 206 O PHE A 16 -8.636 -2.817 4.092 1.00 0.00 O ATOM 207 CB PHE A 16 -9.058 0.416 4.174 1.00 0.00 C ATOM 208 CG PHE A 16 -8.560 0.036 2.811 1.00 0.00 C ATOM 209 CD1 PHE A 16 -9.431 -0.477 1.866 1.00 0.00 C ATOM 210 CD2 PHE A 16 -7.225 0.172 2.481 1.00 0.00 C ATOM 211 CE1 PHE A 16 -8.981 -0.843 0.615 1.00 0.00 C ATOM 212 CE2 PHE A 16 -6.768 -0.194 1.231 1.00 0.00 C ATOM 213 CZ PHE A 16 -7.650 -0.703 0.295 1.00 0.00 C ATOM 0 H PHE A 16 -9.749 0.612 6.527 1.00 0.00 H new ATOM 0 HA PHE A 16 -10.488 -1.144 4.538 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -9.865 1.141 4.072 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -8.256 0.907 4.725 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -10.476 -0.592 2.111 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.532 0.569 3.208 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.673 -1.239 -0.113 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.722 -0.083 0.984 1.00 0.00 H new ATOM 0 HZ PHE A 16 -7.295 -0.990 -0.684 1.00 0.00 H new ATOM 223 N VAL A 17 -7.550 -1.862 5.817 1.00 0.00 N ATOM 224 CA VAL A 17 -6.509 -2.882 5.871 1.00 0.00 C ATOM 225 C VAL A 17 -7.076 -4.213 6.358 1.00 0.00 C ATOM 226 O VAL A 17 -6.842 -5.258 5.750 1.00 0.00 O ATOM 227 CB VAL A 17 -5.353 -2.450 6.795 1.00 0.00 C ATOM 228 CG1 VAL A 17 -4.256 -3.506 6.828 1.00 0.00 C ATOM 229 CG2 VAL A 17 -4.791 -1.106 6.352 1.00 0.00 C ATOM 0 H VAL A 17 -7.451 -1.122 6.512 1.00 0.00 H new ATOM 0 HA VAL A 17 -6.124 -3.006 4.859 1.00 0.00 H new ATOM 0 HB VAL A 17 -5.748 -2.344 7.805 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -3.453 -3.176 7.487 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.666 -4.445 7.198 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.862 -3.653 5.822 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -3.976 -0.816 7.015 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -4.417 -1.187 5.331 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -5.577 -0.352 6.392 1.00 0.00 H new ATOM 239 N GLY A 18 -7.821 -4.164 7.456 1.00 0.00 N ATOM 240 CA GLY A 18 -8.411 -5.371 8.008 1.00 0.00 C ATOM 241 C GLY A 18 -9.320 -6.076 7.020 1.00 0.00 C ATOM 242 O GLY A 18 -9.407 -7.304 7.014 1.00 0.00 O ATOM 0 H GLY A 18 -8.028 -3.310 7.975 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -7.617 -6.052 8.316 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.979 -5.118 8.903 1.00 0.00 H new ATOM 246 N TYR A 19 -10.001 -5.298 6.187 1.00 0.00 N ATOM 247 CA TYR A 19 -10.909 -5.855 5.192 1.00 0.00 C ATOM 248 C TYR A 19 -10.135 -6.543 4.069 1.00 0.00 C ATOM 249 O TYR A 19 -10.414 -7.691 3.723 1.00 0.00 O ATOM 250 CB TYR A 19 -11.804 -4.751 4.622 1.00 0.00 C ATOM 251 CG TYR A 19 -13.284 -5.027 4.783 1.00 0.00 C ATOM 252 CD1 TYR A 19 -13.870 -6.123 4.170 1.00 0.00 C ATOM 253 CD2 TYR A 19 -14.092 -4.194 5.545 1.00 0.00 C ATOM 254 CE1 TYR A 19 -15.218 -6.386 4.306 1.00 0.00 C ATOM 255 CE2 TYR A 19 -15.443 -4.448 5.689 1.00 0.00 C ATOM 256 CZ TYR A 19 -16.002 -5.545 5.066 1.00 0.00 C ATOM 257 OH TYR A 19 -17.347 -5.803 5.206 1.00 0.00 O ATOM 0 H TYR A 19 -9.942 -4.280 6.181 1.00 0.00 H new ATOM 0 HA TYR A 19 -11.534 -6.603 5.679 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -11.563 -3.809 5.114 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -11.580 -4.624 3.563 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -13.259 -6.785 3.574 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -13.658 -3.334 6.033 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -15.656 -7.245 3.820 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -16.058 -3.791 6.286 1.00 0.00 H new ATOM 0 HH TYR A 19 -17.755 -5.116 5.774 1.00 0.00 H new ATOM 267 N LYS A 20 -9.158 -5.835 3.506 1.00 0.00 N ATOM 268 CA LYS A 20 -8.342 -6.380 2.424 1.00 0.00 C ATOM 269 C LYS A 20 -7.732 -7.721 2.820 1.00 0.00 C ATOM 270 O LYS A 20 -7.521 -8.592 1.977 1.00 0.00 O ATOM 271 CB LYS A 20 -7.233 -5.397 2.047 1.00 0.00 C ATOM 272 CG LYS A 20 -6.842 -5.451 0.578 1.00 0.00 C ATOM 273 CD LYS A 20 -7.430 -4.286 -0.200 1.00 0.00 C ATOM 274 CE LYS A 20 -8.918 -4.474 -0.449 1.00 0.00 C ATOM 275 NZ LYS A 20 -9.309 -4.055 -1.823 1.00 0.00 N ATOM 0 H LYS A 20 -8.913 -4.884 3.781 1.00 0.00 H new ATOM 0 HA LYS A 20 -8.990 -6.537 1.562 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.558 -4.385 2.290 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.353 -5.604 2.656 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -5.756 -5.437 0.489 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -7.186 -6.390 0.144 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -7.267 -3.360 0.351 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -6.911 -4.185 -1.153 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -9.181 -5.521 -0.300 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -9.484 -3.896 0.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.331 -4.199 -1.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -9.081 -3.049 -1.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -8.788 -4.624 -2.521 1.00 0.00 H new ATOM 289 N LEU A 21 -7.450 -7.878 4.109 1.00 0.00 N ATOM 290 CA LEU A 21 -6.866 -9.112 4.616 1.00 0.00 C ATOM 291 C LEU A 21 -7.930 -10.197 4.753 1.00 0.00 C ATOM 292 O LEU A 21 -7.675 -11.369 4.481 1.00 0.00 O ATOM 293 CB LEU A 21 -6.196 -8.862 5.968 1.00 0.00 C ATOM 294 CG LEU A 21 -5.785 -10.121 6.736 1.00 0.00 C ATOM 295 CD1 LEU A 21 -4.950 -11.040 5.855 1.00 0.00 C ATOM 296 CD2 LEU A 21 -5.023 -9.742 7.993 1.00 0.00 C ATOM 0 H LEU A 21 -7.617 -7.166 4.820 1.00 0.00 H new ATOM 0 HA LEU A 21 -6.114 -9.453 3.904 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -5.310 -8.248 5.808 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -6.877 -8.282 6.591 1.00 0.00 H new ATOM 0 HG LEU A 21 -6.686 -10.661 7.027 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -4.668 -11.929 6.420 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -5.532 -11.335 4.982 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -4.051 -10.516 5.532 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -4.736 -10.646 8.531 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -4.128 -9.182 7.721 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -5.657 -9.126 8.631 1.00 0.00 H new ATOM 308 N ARG A 22 -9.122 -9.795 5.178 1.00 0.00 N ATOM 309 CA ARG A 22 -10.225 -10.732 5.352 1.00 0.00 C ATOM 310 C ARG A 22 -10.759 -11.198 4.001 1.00 0.00 C ATOM 311 O ARG A 22 -11.326 -12.285 3.890 1.00 0.00 O ATOM 312 CB ARG A 22 -11.346 -10.089 6.171 1.00 0.00 C ATOM 313 CG ARG A 22 -10.916 -9.671 7.569 1.00 0.00 C ATOM 314 CD ARG A 22 -11.425 -10.639 8.626 1.00 0.00 C ATOM 315 NE ARG A 22 -10.464 -10.820 9.714 1.00 0.00 N ATOM 316 CZ ARG A 22 -10.395 -10.033 10.787 1.00 0.00 C ATOM 317 NH1 ARG A 22 -11.222 -9.003 10.922 1.00 0.00 N ATOM 318 NH2 ARG A 22 -9.494 -10.278 11.729 1.00 0.00 N ATOM 0 H ARG A 22 -9.349 -8.828 5.408 1.00 0.00 H new ATOM 0 HA ARG A 22 -9.851 -11.602 5.891 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -11.718 -9.214 5.638 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -12.176 -10.791 6.250 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -9.828 -9.620 7.615 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -11.291 -8.670 7.781 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -12.367 -10.269 9.032 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -11.634 -11.603 8.163 1.00 0.00 H new ATOM 0 HE ARG A 22 -9.806 -11.597 9.647 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -11.917 -8.809 10.201 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -11.162 -8.406 11.747 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -8.856 -11.068 11.631 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -9.439 -9.677 12.551 1.00 0.00 H new ATOM 332 N GLN A 23 -10.572 -10.374 2.974 1.00 0.00 N ATOM 333 CA GLN A 23 -11.032 -10.712 1.632 1.00 0.00 C ATOM 334 C GLN A 23 -10.075 -11.689 0.956 1.00 0.00 C ATOM 335 O GLN A 23 -10.462 -12.427 0.052 1.00 0.00 O ATOM 336 CB GLN A 23 -11.176 -9.446 0.784 1.00 0.00 C ATOM 337 CG GLN A 23 -12.553 -9.283 0.164 1.00 0.00 C ATOM 338 CD GLN A 23 -13.052 -7.854 0.241 1.00 0.00 C ATOM 339 OE1 GLN A 23 -13.036 -7.292 1.441 1.00 0.00 O flip ATOM 340 NE2 GLN A 23 -13.442 -7.262 -0.765 1.00 0.00 N flip ATOM 0 H GLN A 23 -10.106 -9.469 3.046 1.00 0.00 H new ATOM 0 HA GLN A 23 -12.006 -11.193 1.720 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -10.961 -8.576 1.405 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -10.429 -9.463 -0.010 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -12.519 -9.598 -0.879 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -13.258 -9.940 0.673 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -13.437 -7.734 -1.669 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -13.771 -6.299 -0.695 1.00 0.00 H new ATOM 349 N LYS A 24 -8.821 -11.690 1.403 1.00 0.00 N ATOM 350 CA LYS A 24 -7.810 -12.579 0.843 1.00 0.00 C ATOM 351 C LYS A 24 -7.564 -13.783 1.753 1.00 0.00 C ATOM 352 O LYS A 24 -6.707 -14.620 1.468 1.00 0.00 O ATOM 353 CB LYS A 24 -6.500 -11.819 0.618 1.00 0.00 C ATOM 354 CG LYS A 24 -6.397 -11.179 -0.757 1.00 0.00 C ATOM 355 CD LYS A 24 -6.831 -9.722 -0.727 1.00 0.00 C ATOM 356 CE LYS A 24 -7.271 -9.243 -2.101 1.00 0.00 C ATOM 357 NZ LYS A 24 -6.111 -8.897 -2.969 1.00 0.00 N ATOM 0 H LYS A 24 -8.482 -11.085 2.151 1.00 0.00 H new ATOM 0 HA LYS A 24 -8.182 -12.945 -0.114 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -6.404 -11.044 1.379 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.664 -12.505 0.754 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.370 -11.246 -1.115 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -7.018 -11.730 -1.464 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -7.650 -9.600 -0.018 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -6.007 -9.103 -0.371 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.865 -10.020 -2.583 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.915 -8.370 -1.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -6.455 -8.575 -3.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -5.558 -8.138 -2.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -5.509 -9.736 -3.095 1.00 0.00 H new ATOM 589 N GLN A 43 -14.382 4.072 -0.274 1.00 0.00 N ATOM 590 CA GLN A 43 -14.377 3.785 -1.711 1.00 0.00 C ATOM 591 C GLN A 43 -13.063 4.229 -2.346 1.00 0.00 C ATOM 592 O GLN A 43 -12.544 3.578 -3.252 1.00 0.00 O ATOM 593 CB GLN A 43 -15.547 4.496 -2.397 1.00 0.00 C ATOM 594 CG GLN A 43 -16.330 3.612 -3.351 1.00 0.00 C ATOM 595 CD GLN A 43 -17.582 3.039 -2.714 1.00 0.00 C ATOM 596 OE1 GLN A 43 -17.606 1.724 -2.534 1.00 0.00 O flip ATOM 597 NE2 GLN A 43 -18.517 3.770 -2.387 1.00 0.00 N flip ATOM 0 HA GLN A 43 -14.483 2.708 -1.843 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -16.224 4.879 -1.634 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -15.165 5.357 -2.946 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -16.606 4.190 -4.233 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -15.693 2.796 -3.691 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -18.457 4.776 -2.544 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -19.352 3.370 -1.959 1.00 0.00 H new ATOM 606 N ALA A 44 -12.537 5.345 -1.855 1.00 0.00 N ATOM 607 CA ALA A 44 -11.285 5.893 -2.356 1.00 0.00 C ATOM 608 C ALA A 44 -10.141 4.907 -2.163 1.00 0.00 C ATOM 609 O ALA A 44 -9.488 4.493 -3.123 1.00 0.00 O ATOM 610 CB ALA A 44 -10.976 7.201 -1.643 1.00 0.00 C ATOM 0 H ALA A 44 -12.963 5.890 -1.105 1.00 0.00 H new ATOM 0 HA ALA A 44 -11.392 6.080 -3.424 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -10.038 7.608 -2.020 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -11.781 7.914 -1.825 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -10.888 7.019 -0.572 1.00 0.00 H new ATOM 616 N MET A 45 -9.908 4.537 -0.911 1.00 0.00 N ATOM 617 CA MET A 45 -8.846 3.598 -0.564 1.00 0.00 C ATOM 618 C MET A 45 -8.912 2.344 -1.434 1.00 0.00 C ATOM 619 O MET A 45 -7.890 1.846 -1.899 1.00 0.00 O ATOM 620 CB MET A 45 -8.944 3.212 0.915 1.00 0.00 C ATOM 621 CG MET A 45 -8.415 4.277 1.864 1.00 0.00 C ATOM 622 SD MET A 45 -7.327 3.600 3.134 1.00 0.00 S ATOM 623 CE MET A 45 -5.784 4.414 2.730 1.00 0.00 C ATOM 0 H MET A 45 -10.444 4.875 -0.112 1.00 0.00 H new ATOM 0 HA MET A 45 -7.890 4.090 -0.745 1.00 0.00 H new ATOM 0 HB2 MET A 45 -9.986 3.007 1.159 1.00 0.00 H new ATOM 0 HB3 MET A 45 -8.391 2.287 1.077 1.00 0.00 H new ATOM 0 HG2 MET A 45 -7.874 5.031 1.292 1.00 0.00 H new ATOM 0 HG3 MET A 45 -9.255 4.781 2.342 1.00 0.00 H new ATOM 0 HE1 MET A 45 -4.953 3.850 3.153 1.00 0.00 H new ATOM 0 HE2 MET A 45 -5.673 4.466 1.647 1.00 0.00 H new ATOM 0 HE3 MET A 45 -5.786 5.423 3.143 1.00 0.00 H new ATOM 633 N ARG A 46 -10.121 1.840 -1.653 1.00 0.00 N ATOM 634 CA ARG A 46 -10.311 0.645 -2.471 1.00 0.00 C ATOM 635 C ARG A 46 -10.053 0.950 -3.941 1.00 0.00 C ATOM 636 O ARG A 46 -9.293 0.248 -4.611 1.00 0.00 O ATOM 637 CB ARG A 46 -11.733 0.105 -2.306 1.00 0.00 C ATOM 638 CG ARG A 46 -11.855 -0.994 -1.266 1.00 0.00 C ATOM 639 CD ARG A 46 -12.566 -0.496 -0.020 1.00 0.00 C ATOM 640 NE ARG A 46 -13.882 0.053 -0.337 1.00 0.00 N ATOM 641 CZ ARG A 46 -15.015 -0.645 -0.291 1.00 0.00 C ATOM 642 NH1 ARG A 46 -15.011 -1.917 0.089 1.00 0.00 N ATOM 643 NH2 ARG A 46 -16.159 -0.066 -0.629 1.00 0.00 N ATOM 0 H ARG A 46 -10.982 2.237 -1.278 1.00 0.00 H new ATOM 0 HA ARG A 46 -9.598 -0.108 -2.135 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -12.394 0.927 -2.031 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -12.080 -0.276 -3.266 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -12.402 -1.837 -1.687 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -10.863 -1.358 -1.000 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -12.674 -1.316 0.690 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -11.959 0.268 0.465 1.00 0.00 H new ATOM 0 HE ARG A 46 -13.937 1.034 -0.611 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -14.134 -2.369 0.349 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -15.885 -2.443 0.121 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -16.169 0.911 -0.923 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -17.029 -0.597 -0.595 1.00 0.00 H new ATOM 657 N ALA A 47 -10.700 2.000 -4.435 1.00 0.00 N ATOM 658 CA ALA A 47 -10.560 2.408 -5.825 1.00 0.00 C ATOM 659 C ALA A 47 -9.099 2.660 -6.185 1.00 0.00 C ATOM 660 O ALA A 47 -8.647 2.307 -7.273 1.00 0.00 O ATOM 661 CB ALA A 47 -11.393 3.651 -6.087 1.00 0.00 C ATOM 0 H ALA A 47 -11.330 2.586 -3.888 1.00 0.00 H new ATOM 0 HA ALA A 47 -10.921 1.596 -6.456 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -11.283 3.950 -7.129 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -12.441 3.437 -5.880 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -11.053 4.460 -5.440 1.00 0.00 H new ATOM 667 N ALA A 48 -8.365 3.272 -5.263 1.00 0.00 N ATOM 668 CA ALA A 48 -6.955 3.567 -5.486 1.00 0.00 C ATOM 669 C ALA A 48 -6.153 2.282 -5.654 1.00 0.00 C ATOM 670 O ALA A 48 -5.493 2.077 -6.674 1.00 0.00 O ATOM 671 CB ALA A 48 -6.400 4.388 -4.332 1.00 0.00 C ATOM 0 H ALA A 48 -8.722 3.573 -4.356 1.00 0.00 H new ATOM 0 HA ALA A 48 -6.868 4.147 -6.405 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -5.346 4.601 -4.511 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -6.952 5.325 -4.254 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -6.504 3.827 -3.403 1.00 0.00 H new ATOM 677 N GLY A 49 -6.220 1.421 -4.643 1.00 0.00 N ATOM 678 CA GLY A 49 -5.501 0.162 -4.682 1.00 0.00 C ATOM 679 C GLY A 49 -5.818 -0.643 -5.929 1.00 0.00 C ATOM 680 O GLY A 49 -4.928 -1.200 -6.568 1.00 0.00 O ATOM 0 H GLY A 49 -6.763 1.575 -3.793 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -4.429 0.357 -4.640 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -5.753 -0.425 -3.799 1.00 0.00 H new ATOM 684 N ASP A 50 -7.094 -0.707 -6.271 1.00 0.00 N ATOM 685 CA ASP A 50 -7.530 -1.450 -7.448 1.00 0.00 C ATOM 686 C ASP A 50 -7.013 -0.812 -8.739 1.00 0.00 C ATOM 687 O ASP A 50 -6.781 -1.503 -9.732 1.00 0.00 O ATOM 688 CB ASP A 50 -9.057 -1.541 -7.487 1.00 0.00 C ATOM 689 CG ASP A 50 -9.555 -2.943 -7.203 1.00 0.00 C ATOM 690 OD1 ASP A 50 -9.491 -3.370 -6.031 1.00 0.00 O ATOM 691 OD2 ASP A 50 -10.007 -3.617 -8.153 1.00 0.00 O ATOM 0 H ASP A 50 -7.847 -0.255 -5.753 1.00 0.00 H new ATOM 0 HA ASP A 50 -7.112 -2.454 -7.376 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -9.479 -0.852 -6.755 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -9.413 -1.222 -8.467 1.00 0.00 H new ATOM 696 N GLU A 51 -6.840 0.507 -8.723 1.00 0.00 N ATOM 697 CA GLU A 51 -6.356 1.228 -9.900 1.00 0.00 C ATOM 698 C GLU A 51 -4.940 0.795 -10.266 1.00 0.00 C ATOM 699 O GLU A 51 -4.653 0.500 -11.426 1.00 0.00 O ATOM 700 CB GLU A 51 -6.395 2.737 -9.654 1.00 0.00 C ATOM 701 CG GLU A 51 -7.078 3.515 -10.767 1.00 0.00 C ATOM 702 CD GLU A 51 -6.200 4.607 -11.344 1.00 0.00 C ATOM 703 OE1 GLU A 51 -5.285 4.282 -12.130 1.00 0.00 O ATOM 704 OE2 GLU A 51 -6.427 5.790 -11.011 1.00 0.00 O ATOM 0 H GLU A 51 -7.026 1.097 -7.912 1.00 0.00 H new ATOM 0 HA GLU A 51 -7.014 0.987 -10.735 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -6.913 2.931 -8.715 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -5.376 3.105 -9.537 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -7.364 2.827 -11.562 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -7.997 3.959 -10.383 1.00 0.00 H new ATOM 711 N PHE A 52 -4.058 0.759 -9.274 1.00 0.00 N ATOM 712 CA PHE A 52 -2.675 0.358 -9.504 1.00 0.00 C ATOM 713 C PHE A 52 -2.591 -1.134 -9.815 1.00 0.00 C ATOM 714 O PHE A 52 -1.897 -1.547 -10.736 1.00 0.00 O ATOM 715 CB PHE A 52 -1.812 0.695 -8.283 1.00 0.00 C ATOM 716 CG PHE A 52 -1.789 -0.379 -7.233 1.00 0.00 C ATOM 717 CD1 PHE A 52 -1.000 -1.508 -7.385 1.00 0.00 C ATOM 718 CD2 PHE A 52 -2.566 -0.256 -6.098 1.00 0.00 C ATOM 719 CE1 PHE A 52 -0.991 -2.495 -6.419 1.00 0.00 C ATOM 720 CE2 PHE A 52 -2.564 -1.241 -5.128 1.00 0.00 C ATOM 721 CZ PHE A 52 -1.774 -2.362 -5.288 1.00 0.00 C ATOM 0 H PHE A 52 -4.274 1.001 -8.307 1.00 0.00 H new ATOM 0 HA PHE A 52 -2.297 0.911 -10.364 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -0.791 0.886 -8.614 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.180 1.618 -7.835 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -0.386 -1.617 -8.267 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -3.183 0.621 -5.967 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -0.372 -3.371 -6.547 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -3.179 -1.134 -4.247 1.00 0.00 H new ATOM 0 HZ PHE A 52 -1.768 -3.133 -4.531 1.00 0.00 H new ATOM 731 N GLU A 53 -3.302 -1.938 -9.031 1.00 0.00 N ATOM 732 CA GLU A 53 -3.302 -3.386 -9.218 1.00 0.00 C ATOM 733 C GLU A 53 -3.691 -3.763 -10.646 1.00 0.00 C ATOM 734 O GLU A 53 -3.161 -4.719 -11.210 1.00 0.00 O ATOM 735 CB GLU A 53 -4.263 -4.047 -8.233 1.00 0.00 C ATOM 736 CG GLU A 53 -3.606 -4.444 -6.924 1.00 0.00 C ATOM 737 CD GLU A 53 -4.289 -5.624 -6.264 1.00 0.00 C ATOM 738 OE1 GLU A 53 -4.691 -6.558 -6.989 1.00 0.00 O ATOM 739 OE2 GLU A 53 -4.422 -5.613 -5.023 1.00 0.00 O ATOM 0 H GLU A 53 -3.885 -1.612 -8.260 1.00 0.00 H new ATOM 0 HA GLU A 53 -2.289 -3.743 -9.033 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -5.086 -3.363 -8.025 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -4.695 -4.933 -8.698 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -2.560 -4.690 -7.107 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -3.619 -3.593 -6.242 1.00 0.00 H new ATOM 746 N THR A 54 -4.620 -3.008 -11.224 1.00 0.00 N ATOM 747 CA THR A 54 -5.078 -3.270 -12.585 1.00 0.00 C ATOM 748 C THR A 54 -4.173 -2.585 -13.589 1.00 0.00 C ATOM 749 O THR A 54 -3.966 -3.077 -14.700 1.00 0.00 O ATOM 750 CB THR A 54 -6.506 -2.776 -12.771 1.00 0.00 C ATOM 751 OG1 THR A 54 -7.374 -3.390 -11.837 1.00 0.00 O ATOM 752 CG2 THR A 54 -7.046 -3.044 -14.157 1.00 0.00 C ATOM 0 H THR A 54 -5.070 -2.211 -10.773 1.00 0.00 H new ATOM 0 HA THR A 54 -5.048 -4.347 -12.751 1.00 0.00 H new ATOM 0 HB THR A 54 -6.468 -1.698 -12.616 1.00 0.00 H new ATOM 0 HG1 THR A 54 -7.343 -2.899 -10.989 1.00 0.00 H new ATOM 0 HG21 THR A 54 -8.067 -2.669 -14.228 1.00 0.00 H new ATOM 0 HG22 THR A 54 -6.422 -2.539 -14.894 1.00 0.00 H new ATOM 0 HG23 THR A 54 -7.039 -4.117 -14.349 1.00 0.00 H new ATOM 760 N ARG A 55 -3.637 -1.446 -13.186 1.00 0.00 N ATOM 761 CA ARG A 55 -2.751 -0.684 -14.033 1.00 0.00 C ATOM 762 C ARG A 55 -1.643 -1.567 -14.594 1.00 0.00 C ATOM 763 O ARG A 55 -1.405 -1.589 -15.802 1.00 0.00 O ATOM 764 CB ARG A 55 -2.171 0.471 -13.233 1.00 0.00 C ATOM 765 CG ARG A 55 -2.718 1.821 -13.657 1.00 0.00 C ATOM 766 CD ARG A 55 -2.423 2.896 -12.627 1.00 0.00 C ATOM 767 NE ARG A 55 -1.121 2.719 -11.970 1.00 0.00 N ATOM 768 CZ ARG A 55 -0.626 3.576 -11.087 1.00 0.00 C ATOM 769 NH1 ARG A 55 -1.295 4.686 -10.798 1.00 0.00 N ATOM 770 NH2 ARG A 55 0.542 3.336 -10.505 1.00 0.00 N ATOM 0 H ARG A 55 -3.805 -1.030 -12.270 1.00 0.00 H new ATOM 0 HA ARG A 55 -3.313 -0.289 -14.879 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -2.383 0.315 -12.175 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -1.087 0.474 -13.344 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -2.282 2.106 -14.615 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -3.795 1.746 -13.807 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -2.450 3.872 -13.111 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -3.209 2.893 -11.871 1.00 0.00 H new ATOM 0 HE ARG A 55 -0.569 1.894 -12.205 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -2.187 4.877 -11.255 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -0.917 5.347 -10.119 1.00 0.00 H new ATOM 0 HH21 ARG A 55 1.063 2.490 -10.736 1.00 0.00 H new ATOM 0 HH22 ARG A 55 0.919 3.998 -9.826 1.00 0.00 H new ATOM 784 N PHE A 56 -0.977 -2.305 -13.711 1.00 0.00 N ATOM 785 CA PHE A 56 0.086 -3.195 -14.123 1.00 0.00 C ATOM 786 C PHE A 56 -0.438 -4.599 -14.400 1.00 0.00 C ATOM 787 O PHE A 56 -1.559 -4.773 -14.878 1.00 0.00 O ATOM 788 CB PHE A 56 1.187 -3.244 -13.072 1.00 0.00 C ATOM 789 CG PHE A 56 1.595 -1.904 -12.544 1.00 0.00 C ATOM 790 CD1 PHE A 56 0.718 -1.115 -11.817 1.00 0.00 C ATOM 791 CD2 PHE A 56 2.863 -1.434 -12.773 1.00 0.00 C ATOM 792 CE1 PHE A 56 1.102 0.115 -11.334 1.00 0.00 C ATOM 793 CE2 PHE A 56 3.251 -0.214 -12.294 1.00 0.00 C ATOM 794 CZ PHE A 56 2.376 0.567 -11.575 1.00 0.00 C ATOM 0 H PHE A 56 -1.160 -2.299 -12.708 1.00 0.00 H new ATOM 0 HA PHE A 56 0.502 -2.800 -15.050 1.00 0.00 H new ATOM 0 HB2 PHE A 56 0.851 -3.863 -12.240 1.00 0.00 H new ATOM 0 HB3 PHE A 56 2.061 -3.734 -13.501 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -0.284 -1.471 -11.626 1.00 0.00 H new ATOM 0 HD2 PHE A 56 3.562 -2.034 -13.337 1.00 0.00 H new ATOM 0 HE1 PHE A 56 0.407 0.720 -10.770 1.00 0.00 H new ATOM 0 HE2 PHE A 56 4.254 0.140 -12.482 1.00 0.00 H new ATOM 0 HZ PHE A 56 2.690 1.531 -11.202 1.00 0.00 H new ATOM 804 N ARG A 57 0.386 -5.596 -14.086 1.00 0.00 N ATOM 805 CA ARG A 57 0.029 -6.985 -14.286 1.00 0.00 C ATOM 806 C ARG A 57 0.519 -7.829 -13.112 1.00 0.00 C ATOM 807 O ARG A 57 -0.257 -8.186 -12.228 1.00 0.00 O ATOM 808 CB ARG A 57 0.633 -7.504 -15.594 1.00 0.00 C ATOM 809 CG ARG A 57 0.302 -6.650 -16.810 1.00 0.00 C ATOM 810 CD ARG A 57 1.560 -6.160 -17.513 1.00 0.00 C ATOM 811 NE ARG A 57 1.904 -6.996 -18.661 1.00 0.00 N ATOM 812 CZ ARG A 57 1.277 -6.939 -19.835 1.00 0.00 C ATOM 813 NH1 ARG A 57 0.281 -6.081 -20.019 1.00 0.00 N ATOM 814 NH2 ARG A 57 1.650 -7.737 -20.827 1.00 0.00 N ATOM 0 H ARG A 57 1.315 -5.457 -13.688 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.057 -7.061 -14.346 1.00 0.00 H new ATOM 0 HB2 ARG A 57 1.716 -7.559 -15.485 1.00 0.00 H new ATOM 0 HB3 ARG A 57 0.278 -8.520 -15.768 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -0.303 -7.229 -17.508 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -0.299 -5.795 -16.501 1.00 0.00 H new ATOM 0 HD2 ARG A 57 1.414 -5.132 -17.844 1.00 0.00 H new ATOM 0 HD3 ARG A 57 2.391 -6.153 -16.807 1.00 0.00 H new ATOM 0 HE ARG A 57 2.669 -7.662 -18.557 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -0.006 -5.463 -19.260 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -0.197 -6.040 -20.919 1.00 0.00 H new ATOM 0 HH21 ARG A 57 2.417 -8.395 -20.691 1.00 0.00 H new ATOM 0 HH22 ARG A 57 1.169 -7.693 -21.726 1.00 0.00 H new ATOM 828 N ARG A 58 1.812 -8.137 -13.103 1.00 0.00 N ATOM 829 CA ARG A 58 2.394 -8.932 -12.030 1.00 0.00 C ATOM 830 C ARG A 58 3.646 -8.267 -11.476 1.00 0.00 C ATOM 831 O ARG A 58 4.712 -8.883 -11.416 1.00 0.00 O ATOM 832 CB ARG A 58 2.732 -10.335 -12.534 1.00 0.00 C ATOM 833 CG ARG A 58 3.216 -11.276 -11.439 1.00 0.00 C ATOM 834 CD ARG A 58 2.179 -12.339 -11.118 1.00 0.00 C ATOM 835 NE ARG A 58 1.592 -12.147 -9.792 1.00 0.00 N ATOM 836 CZ ARG A 58 0.347 -11.719 -9.576 1.00 0.00 C ATOM 837 NH1 ARG A 58 -0.450 -11.410 -10.594 1.00 0.00 N ATOM 838 NH2 ARG A 58 -0.102 -11.597 -8.335 1.00 0.00 N ATOM 0 H ARG A 58 2.474 -7.849 -13.824 1.00 0.00 H new ATOM 0 HA ARG A 58 1.659 -9.006 -11.229 1.00 0.00 H new ATOM 0 HB2 ARG A 58 1.849 -10.765 -13.007 1.00 0.00 H new ATOM 0 HB3 ARG A 58 3.501 -10.260 -13.303 1.00 0.00 H new ATOM 0 HG2 ARG A 58 4.144 -11.755 -11.753 1.00 0.00 H new ATOM 0 HG3 ARG A 58 3.442 -10.703 -10.539 1.00 0.00 H new ATOM 0 HD2 ARG A 58 1.391 -12.316 -11.871 1.00 0.00 H new ATOM 0 HD3 ARG A 58 2.641 -13.325 -11.171 1.00 0.00 H new ATOM 0 HE ARG A 58 2.173 -12.354 -8.979 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -0.111 -11.499 -11.552 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -1.400 -11.084 -10.417 1.00 0.00 H new ATOM 0 HH21 ARG A 58 0.504 -11.830 -7.548 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -1.053 -11.270 -8.167 1.00 0.00 H new ATOM 852 N THR A 59 3.520 -7.011 -11.072 1.00 0.00 N ATOM 853 CA THR A 59 4.654 -6.280 -10.530 1.00 0.00 C ATOM 854 C THR A 59 5.124 -6.897 -9.218 1.00 0.00 C ATOM 855 O THR A 59 6.310 -6.856 -8.900 1.00 0.00 O ATOM 856 CB THR A 59 4.288 -4.814 -10.313 1.00 0.00 C ATOM 857 OG1 THR A 59 3.118 -4.703 -9.525 1.00 0.00 O ATOM 858 CG2 THR A 59 4.050 -4.065 -11.605 1.00 0.00 C ATOM 0 H THR A 59 2.650 -6.481 -11.109 1.00 0.00 H new ATOM 0 HA THR A 59 5.469 -6.340 -11.252 1.00 0.00 H new ATOM 0 HB THR A 59 5.145 -4.369 -9.807 1.00 0.00 H new ATOM 0 HG1 THR A 59 2.900 -3.757 -9.395 1.00 0.00 H new ATOM 0 HG21 THR A 59 3.794 -3.029 -11.383 1.00 0.00 H new ATOM 0 HG22 THR A 59 4.954 -4.093 -12.214 1.00 0.00 H new ATOM 0 HG23 THR A 59 3.230 -4.532 -12.151 1.00 0.00 H new ATOM 866 N PHE A 60 4.187 -7.461 -8.456 1.00 0.00 N ATOM 867 CA PHE A 60 4.508 -8.068 -7.166 1.00 0.00 C ATOM 868 C PHE A 60 5.828 -8.828 -7.219 1.00 0.00 C ATOM 869 O PHE A 60 6.819 -8.383 -6.648 1.00 0.00 O ATOM 870 CB PHE A 60 3.386 -9.015 -6.733 1.00 0.00 C ATOM 871 CG PHE A 60 2.511 -8.453 -5.653 1.00 0.00 C ATOM 872 CD1 PHE A 60 1.770 -7.303 -5.873 1.00 0.00 C ATOM 873 CD2 PHE A 60 2.432 -9.070 -4.416 1.00 0.00 C ATOM 874 CE1 PHE A 60 0.966 -6.780 -4.878 1.00 0.00 C ATOM 875 CE2 PHE A 60 1.631 -8.552 -3.417 1.00 0.00 C ATOM 876 CZ PHE A 60 0.897 -7.405 -3.649 1.00 0.00 C ATOM 0 H PHE A 60 3.200 -7.510 -8.710 1.00 0.00 H new ATOM 0 HA PHE A 60 4.607 -7.263 -6.438 1.00 0.00 H new ATOM 0 HB2 PHE A 60 2.770 -9.256 -7.600 1.00 0.00 H new ATOM 0 HB3 PHE A 60 3.825 -9.950 -6.384 1.00 0.00 H new ATOM 0 HD1 PHE A 60 1.821 -6.810 -6.833 1.00 0.00 H new ATOM 0 HD2 PHE A 60 3.004 -9.967 -4.230 1.00 0.00 H new ATOM 0 HE1 PHE A 60 0.392 -5.884 -5.062 1.00 0.00 H new ATOM 0 HE2 PHE A 60 1.579 -9.043 -2.456 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.270 -6.998 -2.870 1.00 0.00 H new ATOM 886 N SER A 61 5.835 -9.967 -7.905 1.00 0.00 N ATOM 887 CA SER A 61 7.043 -10.782 -8.018 1.00 0.00 C ATOM 888 C SER A 61 8.147 -10.045 -8.774 1.00 0.00 C ATOM 889 O SER A 61 9.333 -10.250 -8.513 1.00 0.00 O ATOM 890 CB SER A 61 6.726 -12.104 -8.722 1.00 0.00 C ATOM 891 OG SER A 61 5.997 -11.886 -9.916 1.00 0.00 O ATOM 0 H SER A 61 5.022 -10.347 -8.390 1.00 0.00 H new ATOM 0 HA SER A 61 7.401 -10.985 -7.009 1.00 0.00 H new ATOM 0 HB2 SER A 61 7.654 -12.629 -8.950 1.00 0.00 H new ATOM 0 HB3 SER A 61 6.152 -12.746 -8.054 1.00 0.00 H new ATOM 0 HG SER A 61 5.809 -12.746 -10.346 1.00 0.00 H new ATOM 897 N ASP A 62 7.748 -9.184 -9.705 1.00 0.00 N ATOM 898 CA ASP A 62 8.701 -8.413 -10.495 1.00 0.00 C ATOM 899 C ASP A 62 9.578 -7.557 -9.581 1.00 0.00 C ATOM 900 O ASP A 62 10.747 -7.875 -9.354 1.00 0.00 O ATOM 901 CB ASP A 62 7.945 -7.556 -11.527 1.00 0.00 C ATOM 902 CG ASP A 62 8.547 -6.174 -11.735 1.00 0.00 C ATOM 903 OD1 ASP A 62 9.709 -6.092 -12.185 1.00 0.00 O ATOM 904 OD2 ASP A 62 7.852 -5.175 -11.450 1.00 0.00 O ATOM 0 H ASP A 62 6.770 -9.003 -9.931 1.00 0.00 H new ATOM 0 HA ASP A 62 9.360 -9.092 -11.037 1.00 0.00 H new ATOM 0 HB2 ASP A 62 7.929 -8.083 -12.481 1.00 0.00 H new ATOM 0 HB3 ASP A 62 6.909 -7.447 -11.206 1.00 0.00 H new ATOM 909 N LEU A 63 9.009 -6.478 -9.054 1.00 0.00 N ATOM 910 CA LEU A 63 9.744 -5.595 -8.162 1.00 0.00 C ATOM 911 C LEU A 63 10.149 -6.325 -6.884 1.00 0.00 C ATOM 912 O LEU A 63 11.019 -5.856 -6.149 1.00 0.00 O ATOM 913 CB LEU A 63 8.916 -4.346 -7.820 1.00 0.00 C ATOM 914 CG LEU A 63 7.449 -4.592 -7.446 1.00 0.00 C ATOM 915 CD1 LEU A 63 7.327 -5.275 -6.089 1.00 0.00 C ATOM 916 CD2 LEU A 63 6.676 -3.284 -7.446 1.00 0.00 C ATOM 0 H LEU A 63 8.045 -6.196 -9.230 1.00 0.00 H new ATOM 0 HA LEU A 63 10.649 -5.278 -8.681 1.00 0.00 H new ATOM 0 HB2 LEU A 63 9.400 -3.830 -6.991 1.00 0.00 H new ATOM 0 HB3 LEU A 63 8.944 -3.671 -8.675 1.00 0.00 H new ATOM 0 HG LEU A 63 7.022 -5.257 -8.197 1.00 0.00 H new ATOM 0 HD11 LEU A 63 6.274 -5.434 -5.855 1.00 0.00 H new ATOM 0 HD12 LEU A 63 7.842 -6.235 -6.117 1.00 0.00 H new ATOM 0 HD13 LEU A 63 7.778 -4.644 -5.322 1.00 0.00 H new ATOM 0 HD21 LEU A 63 5.637 -3.476 -7.179 1.00 0.00 H new ATOM 0 HD22 LEU A 63 7.117 -2.601 -6.720 1.00 0.00 H new ATOM 0 HD23 LEU A 63 6.719 -2.836 -8.439 1.00 0.00 H new ATOM 928 N ALA A 64 9.519 -7.473 -6.615 1.00 0.00 N ATOM 929 CA ALA A 64 9.837 -8.238 -5.420 1.00 0.00 C ATOM 930 C ALA A 64 11.297 -8.632 -5.422 1.00 0.00 C ATOM 931 O ALA A 64 12.084 -8.090 -4.657 1.00 0.00 O ATOM 932 CB ALA A 64 8.955 -9.476 -5.303 1.00 0.00 C ATOM 0 H ALA A 64 8.795 -7.884 -7.205 1.00 0.00 H new ATOM 0 HA ALA A 64 9.642 -7.604 -4.555 1.00 0.00 H new ATOM 0 HB1 ALA A 64 9.218 -10.026 -4.399 1.00 0.00 H new ATOM 0 HB2 ALA A 64 7.909 -9.174 -5.253 1.00 0.00 H new ATOM 0 HB3 ALA A 64 9.107 -10.114 -6.173 1.00 0.00 H new ATOM 938 N ALA A 65 11.652 -9.570 -6.292 1.00 0.00 N ATOM 939 CA ALA A 65 13.027 -10.040 -6.389 1.00 0.00 C ATOM 940 C ALA A 65 13.969 -8.934 -6.858 1.00 0.00 C ATOM 941 O ALA A 65 15.066 -8.776 -6.320 1.00 0.00 O ATOM 942 CB ALA A 65 13.106 -11.240 -7.319 1.00 0.00 C ATOM 0 H ALA A 65 11.006 -10.020 -6.940 1.00 0.00 H new ATOM 0 HA ALA A 65 13.349 -10.342 -5.392 1.00 0.00 H new ATOM 0 HB1 ALA A 65 14.139 -11.583 -7.384 1.00 0.00 H new ATOM 0 HB2 ALA A 65 12.481 -12.044 -6.930 1.00 0.00 H new ATOM 0 HB3 ALA A 65 12.755 -10.955 -8.311 1.00 0.00 H new ATOM 948 N GLN A 66 13.543 -8.172 -7.865 1.00 0.00 N ATOM 949 CA GLN A 66 14.363 -7.089 -8.396 1.00 0.00 C ATOM 950 C GLN A 66 14.861 -6.185 -7.267 1.00 0.00 C ATOM 951 O GLN A 66 16.067 -6.063 -7.047 1.00 0.00 O ATOM 952 CB GLN A 66 13.579 -6.278 -9.440 1.00 0.00 C ATOM 953 CG GLN A 66 14.021 -6.548 -10.870 1.00 0.00 C ATOM 954 CD GLN A 66 13.728 -7.968 -11.321 1.00 0.00 C ATOM 955 OE1 GLN A 66 14.653 -8.555 -12.076 1.00 0.00 O flip ATOM 956 NE2 GLN A 66 12.680 -8.531 -11.000 1.00 0.00 N flip ATOM 0 H GLN A 66 12.640 -8.285 -8.326 1.00 0.00 H new ATOM 0 HA GLN A 66 15.232 -7.527 -8.888 1.00 0.00 H new ATOM 0 HB2 GLN A 66 12.518 -6.508 -9.346 1.00 0.00 H new ATOM 0 HB3 GLN A 66 13.695 -5.216 -9.226 1.00 0.00 H new ATOM 0 HG2 GLN A 66 13.518 -5.849 -11.538 1.00 0.00 H new ATOM 0 HG3 GLN A 66 15.091 -6.358 -10.956 1.00 0.00 H new ATOM 0 HE21 GLN A 66 11.997 -8.045 -10.419 1.00 0.00 H new ATOM 0 HE22 GLN A 66 12.496 -9.483 -11.315 1.00 0.00 H new ATOM 965 N LEU A 67 13.927 -5.555 -6.556 1.00 0.00 N ATOM 966 CA LEU A 67 14.279 -4.671 -5.457 1.00 0.00 C ATOM 967 C LEU A 67 14.718 -5.472 -4.228 1.00 0.00 C ATOM 968 O LEU A 67 15.397 -4.943 -3.349 1.00 0.00 O ATOM 969 CB LEU A 67 13.094 -3.758 -5.114 1.00 0.00 C ATOM 970 CG LEU A 67 13.378 -2.255 -5.196 1.00 0.00 C ATOM 971 CD1 LEU A 67 13.644 -1.834 -6.635 1.00 0.00 C ATOM 972 CD2 LEU A 67 12.213 -1.468 -4.618 1.00 0.00 C ATOM 0 H LEU A 67 12.925 -5.643 -6.724 1.00 0.00 H new ATOM 0 HA LEU A 67 15.120 -4.051 -5.769 1.00 0.00 H new ATOM 0 HB2 LEU A 67 12.270 -3.992 -5.788 1.00 0.00 H new ATOM 0 HB3 LEU A 67 12.757 -3.992 -4.104 1.00 0.00 H new ATOM 0 HG LEU A 67 14.271 -2.040 -4.609 1.00 0.00 H new ATOM 0 HD11 LEU A 67 13.843 -0.763 -6.670 1.00 0.00 H new ATOM 0 HD12 LEU A 67 14.508 -2.376 -7.019 1.00 0.00 H new ATOM 0 HD13 LEU A 67 12.771 -2.061 -7.248 1.00 0.00 H new ATOM 0 HD21 LEU A 67 12.427 -0.401 -4.682 1.00 0.00 H new ATOM 0 HD22 LEU A 67 11.308 -1.691 -5.182 1.00 0.00 H new ATOM 0 HD23 LEU A 67 12.068 -1.747 -3.574 1.00 0.00 H new ATOM 984 N HIS A 68 14.335 -6.749 -4.174 1.00 0.00 N ATOM 985 CA HIS A 68 14.700 -7.612 -3.051 1.00 0.00 C ATOM 986 C HIS A 68 16.214 -7.620 -2.838 1.00 0.00 C ATOM 987 O HIS A 68 16.707 -7.025 -1.881 1.00 0.00 O ATOM 988 CB HIS A 68 14.193 -9.038 -3.279 1.00 0.00 C ATOM 989 CG HIS A 68 14.532 -9.982 -2.169 1.00 0.00 C ATOM 990 ND1 HIS A 68 14.874 -9.556 -0.906 1.00 0.00 N ATOM 991 CD2 HIS A 68 14.579 -11.338 -2.133 1.00 0.00 C ATOM 992 CE1 HIS A 68 15.121 -10.600 -0.140 1.00 0.00 C ATOM 993 NE2 HIS A 68 14.949 -11.696 -0.858 1.00 0.00 N ATOM 0 H HIS A 68 13.774 -7.207 -4.893 1.00 0.00 H new ATOM 0 HA HIS A 68 14.228 -7.212 -2.154 1.00 0.00 H new ATOM 0 HB2 HIS A 68 13.111 -9.013 -3.405 1.00 0.00 H new ATOM 0 HB3 HIS A 68 14.614 -9.419 -4.209 1.00 0.00 H new ATOM 0 HD2 HIS A 68 14.366 -12.009 -2.952 1.00 0.00 H new ATOM 0 HE1 HIS A 68 15.414 -10.565 0.899 1.00 0.00 H new ATOM 0 HE2 HIS A 68 15.071 -12.651 -0.521 1.00 0.00 H new ATOM 1001 N VAL A 69 16.946 -8.300 -3.735 1.00 0.00 N ATOM 1002 CA VAL A 69 18.417 -8.387 -3.649 1.00 0.00 C ATOM 1003 C VAL A 69 19.006 -7.136 -2.986 1.00 0.00 C ATOM 1004 O VAL A 69 19.575 -7.214 -1.896 1.00 0.00 O ATOM 1005 CB VAL A 69 19.048 -8.605 -5.058 1.00 0.00 C ATOM 1006 CG1 VAL A 69 20.456 -8.019 -5.170 1.00 0.00 C ATOM 1007 CG2 VAL A 69 19.078 -10.088 -5.397 1.00 0.00 C ATOM 0 H VAL A 69 16.545 -8.799 -4.529 1.00 0.00 H new ATOM 0 HA VAL A 69 18.661 -9.249 -3.028 1.00 0.00 H new ATOM 0 HB VAL A 69 18.418 -8.074 -5.772 1.00 0.00 H new ATOM 0 HG11 VAL A 69 20.847 -8.200 -6.171 1.00 0.00 H new ATOM 0 HG12 VAL A 69 20.419 -6.946 -4.983 1.00 0.00 H new ATOM 0 HG13 VAL A 69 21.107 -8.493 -4.436 1.00 0.00 H new ATOM 0 HG21 VAL A 69 19.521 -10.227 -6.383 1.00 0.00 H new ATOM 0 HG22 VAL A 69 19.673 -10.619 -4.654 1.00 0.00 H new ATOM 0 HG23 VAL A 69 18.062 -10.482 -5.397 1.00 0.00 H new ATOM 1017 N THR A 70 18.860 -5.983 -3.638 1.00 0.00 N ATOM 1018 CA THR A 70 19.366 -4.733 -3.098 1.00 0.00 C ATOM 1019 C THR A 70 18.914 -4.534 -1.650 1.00 0.00 C ATOM 1020 O THR A 70 17.736 -4.292 -1.387 1.00 0.00 O ATOM 1021 CB THR A 70 18.890 -3.567 -3.964 1.00 0.00 C ATOM 1022 OG1 THR A 70 17.895 -3.992 -4.884 1.00 0.00 O ATOM 1023 CG2 THR A 70 20.009 -2.931 -4.755 1.00 0.00 C ATOM 0 H THR A 70 18.394 -5.894 -4.541 1.00 0.00 H new ATOM 0 HA THR A 70 20.455 -4.770 -3.107 1.00 0.00 H new ATOM 0 HB THR A 70 18.486 -2.831 -3.269 1.00 0.00 H new ATOM 0 HG1 THR A 70 17.092 -4.265 -4.394 1.00 0.00 H new ATOM 0 HG21 THR A 70 19.612 -2.109 -5.351 1.00 0.00 H new ATOM 0 HG22 THR A 70 20.767 -2.550 -4.071 1.00 0.00 H new ATOM 0 HG23 THR A 70 20.457 -3.674 -5.415 1.00 0.00 H new ATOM 1031 N PRO A 71 19.854 -4.631 -0.691 1.00 0.00 N ATOM 1032 CA PRO A 71 19.552 -4.457 0.734 1.00 0.00 C ATOM 1033 C PRO A 71 18.748 -3.193 1.006 1.00 0.00 C ATOM 1034 O PRO A 71 19.292 -2.088 1.030 1.00 0.00 O ATOM 1035 CB PRO A 71 20.936 -4.367 1.380 1.00 0.00 C ATOM 1036 CG PRO A 71 21.830 -5.126 0.462 1.00 0.00 C ATOM 1037 CD PRO A 71 21.282 -4.912 -0.922 1.00 0.00 C ATOM 0 HA PRO A 71 18.938 -5.269 1.124 1.00 0.00 H new ATOM 0 HB2 PRO A 71 21.259 -3.331 1.481 1.00 0.00 H new ATOM 0 HB3 PRO A 71 20.935 -4.800 2.380 1.00 0.00 H new ATOM 0 HG2 PRO A 71 22.857 -4.769 0.534 1.00 0.00 H new ATOM 0 HG3 PRO A 71 21.842 -6.186 0.717 1.00 0.00 H new ATOM 0 HD2 PRO A 71 21.777 -4.082 -1.425 1.00 0.00 H new ATOM 0 HD3 PRO A 71 21.421 -5.793 -1.549 1.00 0.00 H new ATOM 1045 N GLY A 72 17.448 -3.366 1.213 1.00 0.00 N ATOM 1046 CA GLY A 72 16.583 -2.237 1.485 1.00 0.00 C ATOM 1047 C GLY A 72 15.910 -2.347 2.836 1.00 0.00 C ATOM 1048 O GLY A 72 15.792 -3.439 3.393 1.00 0.00 O ATOM 0 H GLY A 72 16.978 -4.271 1.197 1.00 0.00 H new ATOM 0 HA2 GLY A 72 17.166 -1.317 1.445 1.00 0.00 H new ATOM 0 HA3 GLY A 72 15.823 -2.167 0.707 1.00 0.00 H new ATOM 1052 N SER A 73 15.471 -1.216 3.369 1.00 0.00 N ATOM 1053 CA SER A 73 14.810 -1.199 4.666 1.00 0.00 C ATOM 1054 C SER A 73 13.381 -1.728 4.546 1.00 0.00 C ATOM 1055 O SER A 73 12.874 -1.932 3.442 1.00 0.00 O ATOM 1056 CB SER A 73 14.835 0.215 5.253 1.00 0.00 C ATOM 1057 OG SER A 73 14.956 0.185 6.662 1.00 0.00 O ATOM 0 H SER A 73 15.560 -0.302 2.926 1.00 0.00 H new ATOM 0 HA SER A 73 15.350 -1.857 5.347 1.00 0.00 H new ATOM 0 HB2 SER A 73 15.668 0.773 4.826 1.00 0.00 H new ATOM 0 HB3 SER A 73 13.922 0.742 4.975 1.00 0.00 H new ATOM 0 HG SER A 73 14.971 1.102 7.009 1.00 0.00 H new ATOM 1063 N ALA A 74 12.744 -1.966 5.685 1.00 0.00 N ATOM 1064 CA ALA A 74 11.383 -2.495 5.712 1.00 0.00 C ATOM 1065 C ALA A 74 10.346 -1.447 5.277 1.00 0.00 C ATOM 1066 O ALA A 74 10.641 -0.577 4.459 1.00 0.00 O ATOM 1067 CB ALA A 74 11.084 -3.024 7.108 1.00 0.00 C ATOM 0 H ALA A 74 13.148 -1.801 6.607 1.00 0.00 H new ATOM 0 HA ALA A 74 11.312 -3.310 4.992 1.00 0.00 H new ATOM 0 HB1 ALA A 74 10.069 -3.421 7.137 1.00 0.00 H new ATOM 0 HB2 ALA A 74 11.791 -3.816 7.356 1.00 0.00 H new ATOM 0 HB3 ALA A 74 11.178 -2.214 7.832 1.00 0.00 H new ATOM 1073 N GLN A 75 9.127 -1.547 5.823 1.00 0.00 N ATOM 1074 CA GLN A 75 8.042 -0.626 5.495 1.00 0.00 C ATOM 1075 C GLN A 75 8.523 0.818 5.402 1.00 0.00 C ATOM 1076 O GLN A 75 8.314 1.496 4.391 1.00 0.00 O ATOM 1077 CB GLN A 75 6.935 -0.722 6.543 1.00 0.00 C ATOM 1078 CG GLN A 75 6.295 -2.096 6.645 1.00 0.00 C ATOM 1079 CD GLN A 75 7.037 -3.025 7.584 1.00 0.00 C ATOM 1080 OE1 GLN A 75 7.788 -3.894 7.145 1.00 0.00 O ATOM 1081 NE2 GLN A 75 6.834 -2.847 8.884 1.00 0.00 N ATOM 0 H GLN A 75 8.871 -2.266 6.500 1.00 0.00 H new ATOM 0 HA GLN A 75 7.658 -0.918 4.517 1.00 0.00 H new ATOM 0 HB2 GLN A 75 7.346 -0.451 7.516 1.00 0.00 H new ATOM 0 HB3 GLN A 75 6.163 0.010 6.308 1.00 0.00 H new ATOM 0 HG2 GLN A 75 5.266 -1.987 6.988 1.00 0.00 H new ATOM 0 HG3 GLN A 75 6.254 -2.547 5.653 1.00 0.00 H new ATOM 0 HE21 GLN A 75 6.202 -2.114 9.206 1.00 0.00 H new ATOM 0 HE22 GLN A 75 7.310 -3.444 9.561 1.00 0.00 H new ATOM 1090 N GLN A 76 9.156 1.284 6.468 1.00 0.00 N ATOM 1091 CA GLN A 76 9.665 2.651 6.529 1.00 0.00 C ATOM 1092 C GLN A 76 10.442 3.007 5.259 1.00 0.00 C ATOM 1093 O GLN A 76 10.511 4.173 4.868 1.00 0.00 O ATOM 1094 CB GLN A 76 10.562 2.819 7.755 1.00 0.00 C ATOM 1095 CG GLN A 76 9.933 2.323 9.052 1.00 0.00 C ATOM 1096 CD GLN A 76 8.865 3.259 9.588 1.00 0.00 C ATOM 1097 OE1 GLN A 76 8.255 4.020 8.836 1.00 0.00 O ATOM 1098 NE2 GLN A 76 8.629 3.203 10.895 1.00 0.00 N ATOM 0 H GLN A 76 9.332 0.734 7.309 1.00 0.00 H new ATOM 0 HA GLN A 76 8.815 3.328 6.608 1.00 0.00 H new ATOM 0 HB2 GLN A 76 11.495 2.282 7.587 1.00 0.00 H new ATOM 0 HB3 GLN A 76 10.816 3.873 7.866 1.00 0.00 H new ATOM 0 HG2 GLN A 76 9.495 1.339 8.884 1.00 0.00 H new ATOM 0 HG3 GLN A 76 10.712 2.201 9.804 1.00 0.00 H new ATOM 0 HE21 GLN A 76 9.158 2.558 11.482 1.00 0.00 H new ATOM 0 HE22 GLN A 76 7.919 3.805 11.311 1.00 0.00 H new ATOM 1107 N ARG A 77 11.020 1.988 4.620 1.00 0.00 N ATOM 1108 CA ARG A 77 11.793 2.177 3.390 1.00 0.00 C ATOM 1109 C ARG A 77 10.904 2.568 2.230 1.00 0.00 C ATOM 1110 O ARG A 77 11.204 3.508 1.494 1.00 0.00 O ATOM 1111 CB ARG A 77 12.515 0.893 2.995 1.00 0.00 C ATOM 1112 CG ARG A 77 13.668 1.114 2.024 1.00 0.00 C ATOM 1113 CD ARG A 77 14.691 2.106 2.560 1.00 0.00 C ATOM 1114 NE ARG A 77 16.034 1.827 2.048 1.00 0.00 N ATOM 1115 CZ ARG A 77 17.166 2.082 2.707 1.00 0.00 C ATOM 1116 NH1 ARG A 77 17.140 2.578 3.938 1.00 0.00 N ATOM 1117 NH2 ARG A 77 18.334 1.823 2.134 1.00 0.00 N ATOM 0 H ARG A 77 10.967 1.019 4.935 1.00 0.00 H new ATOM 0 HA ARG A 77 12.509 2.972 3.598 1.00 0.00 H new ATOM 0 HB2 ARG A 77 12.896 0.409 3.894 1.00 0.00 H new ATOM 0 HB3 ARG A 77 11.798 0.207 2.544 1.00 0.00 H new ATOM 0 HG2 ARG A 77 14.159 0.162 1.823 1.00 0.00 H new ATOM 0 HG3 ARG A 77 13.276 1.477 1.074 1.00 0.00 H new ATOM 0 HD2 ARG A 77 14.398 3.118 2.281 1.00 0.00 H new ATOM 0 HD3 ARG A 77 14.701 2.066 3.649 1.00 0.00 H new ATOM 0 HE ARG A 77 16.110 1.408 1.121 1.00 0.00 H new ATOM 0 HH11 ARG A 77 16.247 2.769 4.392 1.00 0.00 H new ATOM 0 HH12 ARG A 77 18.013 2.768 4.430 1.00 0.00 H new ATOM 0 HH21 ARG A 77 18.365 1.430 1.193 1.00 0.00 H new ATOM 0 HH22 ARG A 77 19.202 2.016 2.634 1.00 0.00 H new ATOM 1131 N PHE A 78 9.815 1.830 2.065 1.00 0.00 N ATOM 1132 CA PHE A 78 8.880 2.080 0.984 1.00 0.00 C ATOM 1133 C PHE A 78 8.387 3.518 1.034 1.00 0.00 C ATOM 1134 O PHE A 78 8.388 4.221 0.023 1.00 0.00 O ATOM 1135 CB PHE A 78 7.710 1.106 1.081 1.00 0.00 C ATOM 1136 CG PHE A 78 7.596 0.154 -0.078 1.00 0.00 C ATOM 1137 CD1 PHE A 78 6.940 0.534 -1.235 1.00 0.00 C ATOM 1138 CD2 PHE A 78 8.111 -1.129 0.003 1.00 0.00 C ATOM 1139 CE1 PHE A 78 6.798 -0.340 -2.290 1.00 0.00 C ATOM 1140 CE2 PHE A 78 7.979 -2.009 -1.056 1.00 0.00 C ATOM 1141 CZ PHE A 78 7.318 -1.613 -2.204 1.00 0.00 C ATOM 0 H PHE A 78 9.559 1.050 2.671 1.00 0.00 H new ATOM 0 HA PHE A 78 9.386 1.927 0.031 1.00 0.00 H new ATOM 0 HB2 PHE A 78 7.808 0.529 2.001 1.00 0.00 H new ATOM 0 HB3 PHE A 78 6.784 1.676 1.160 1.00 0.00 H new ATOM 0 HD1 PHE A 78 6.533 1.531 -1.312 1.00 0.00 H new ATOM 0 HD2 PHE A 78 8.620 -1.445 0.901 1.00 0.00 H new ATOM 0 HE1 PHE A 78 6.279 -0.028 -3.184 1.00 0.00 H new ATOM 0 HE2 PHE A 78 8.392 -3.005 -0.986 1.00 0.00 H new ATOM 0 HZ PHE A 78 7.210 -2.299 -3.031 1.00 0.00 H new ATOM 1151 N THR A 79 7.973 3.956 2.218 1.00 0.00 N ATOM 1152 CA THR A 79 7.486 5.322 2.386 1.00 0.00 C ATOM 1153 C THR A 79 8.571 6.317 2.004 1.00 0.00 C ATOM 1154 O THR A 79 8.389 7.149 1.114 1.00 0.00 O ATOM 1155 CB THR A 79 7.038 5.592 3.830 1.00 0.00 C ATOM 1156 OG1 THR A 79 6.843 4.388 4.561 1.00 0.00 O ATOM 1157 CG2 THR A 79 5.759 6.400 3.911 1.00 0.00 C ATOM 0 H THR A 79 7.964 3.392 3.068 1.00 0.00 H new ATOM 0 HA THR A 79 6.624 5.443 1.731 1.00 0.00 H new ATOM 0 HB THR A 79 7.852 6.169 4.270 1.00 0.00 H new ATOM 0 HG1 THR A 79 6.197 3.821 4.090 1.00 0.00 H new ATOM 0 HG21 THR A 79 5.494 6.558 4.956 1.00 0.00 H new ATOM 0 HG22 THR A 79 5.906 7.364 3.424 1.00 0.00 H new ATOM 0 HG23 THR A 79 4.955 5.860 3.411 1.00 0.00 H new ATOM 1165 N GLN A 80 9.702 6.221 2.693 1.00 0.00 N ATOM 1166 CA GLN A 80 10.838 7.106 2.447 1.00 0.00 C ATOM 1167 C GLN A 80 11.052 7.334 0.954 1.00 0.00 C ATOM 1168 O GLN A 80 11.382 8.438 0.524 1.00 0.00 O ATOM 1169 CB GLN A 80 12.107 6.521 3.070 1.00 0.00 C ATOM 1170 CG GLN A 80 13.241 7.527 3.186 1.00 0.00 C ATOM 1171 CD GLN A 80 14.482 6.939 3.830 1.00 0.00 C ATOM 1172 OE1 GLN A 80 14.560 6.809 5.052 1.00 0.00 O ATOM 1173 NE2 GLN A 80 15.462 6.584 3.007 1.00 0.00 N ATOM 0 H GLN A 80 9.859 5.535 3.431 1.00 0.00 H new ATOM 0 HA GLN A 80 10.618 8.068 2.909 1.00 0.00 H new ATOM 0 HB2 GLN A 80 11.871 6.134 4.061 1.00 0.00 H new ATOM 0 HB3 GLN A 80 12.441 5.675 2.469 1.00 0.00 H new ATOM 0 HG2 GLN A 80 13.494 7.899 2.193 1.00 0.00 H new ATOM 0 HG3 GLN A 80 12.904 8.383 3.771 1.00 0.00 H new ATOM 0 HE21 GLN A 80 15.354 6.710 2.001 1.00 0.00 H new ATOM 0 HE22 GLN A 80 16.323 6.185 3.381 1.00 0.00 H new ATOM 1182 N VAL A 81 10.856 6.284 0.167 1.00 0.00 N ATOM 1183 CA VAL A 81 11.025 6.378 -1.278 1.00 0.00 C ATOM 1184 C VAL A 81 9.943 7.257 -1.895 1.00 0.00 C ATOM 1185 O VAL A 81 10.221 8.099 -2.749 1.00 0.00 O ATOM 1186 CB VAL A 81 10.985 4.989 -1.947 1.00 0.00 C ATOM 1187 CG1 VAL A 81 11.524 5.067 -3.368 1.00 0.00 C ATOM 1188 CG2 VAL A 81 11.769 3.970 -1.129 1.00 0.00 C ATOM 0 H VAL A 81 10.581 5.361 0.503 1.00 0.00 H new ATOM 0 HA VAL A 81 12.004 6.825 -1.453 1.00 0.00 H new ATOM 0 HB VAL A 81 9.947 4.660 -1.990 1.00 0.00 H new ATOM 0 HG11 VAL A 81 11.489 4.078 -3.825 1.00 0.00 H new ATOM 0 HG12 VAL A 81 10.915 5.758 -3.951 1.00 0.00 H new ATOM 0 HG13 VAL A 81 12.555 5.420 -3.347 1.00 0.00 H new ATOM 0 HG21 VAL A 81 11.726 2.998 -1.621 1.00 0.00 H new ATOM 0 HG22 VAL A 81 12.808 4.290 -1.048 1.00 0.00 H new ATOM 0 HG23 VAL A 81 11.335 3.892 -0.132 1.00 0.00 H new ATOM 1198 N SER A 82 8.704 7.055 -1.454 1.00 0.00 N ATOM 1199 CA SER A 82 7.569 7.822 -1.955 1.00 0.00 C ATOM 1200 C SER A 82 7.797 9.322 -1.786 1.00 0.00 C ATOM 1201 O SER A 82 7.809 10.071 -2.762 1.00 0.00 O ATOM 1202 CB SER A 82 6.288 7.405 -1.230 1.00 0.00 C ATOM 1203 OG SER A 82 6.160 8.080 0.009 1.00 0.00 O ATOM 0 H SER A 82 8.461 6.362 -0.746 1.00 0.00 H new ATOM 0 HA SER A 82 7.466 7.611 -3.019 1.00 0.00 H new ATOM 0 HB2 SER A 82 5.424 7.623 -1.857 1.00 0.00 H new ATOM 0 HB3 SER A 82 6.296 6.328 -1.062 1.00 0.00 H new ATOM 0 HG SER A 82 5.422 7.687 0.521 1.00 0.00 H new ATOM 1209 N ASP A 83 7.982 9.750 -0.543 1.00 0.00 N ATOM 1210 CA ASP A 83 8.214 11.160 -0.243 1.00 0.00 C ATOM 1211 C ASP A 83 9.437 11.683 -0.992 1.00 0.00 C ATOM 1212 O ASP A 83 9.503 12.859 -1.363 1.00 0.00 O ATOM 1213 CB ASP A 83 8.410 11.354 1.263 1.00 0.00 C ATOM 1214 CG ASP A 83 7.363 10.624 2.083 1.00 0.00 C ATOM 1215 OD1 ASP A 83 6.409 10.086 1.484 1.00 0.00 O ATOM 1216 OD2 ASP A 83 7.500 10.589 3.324 1.00 0.00 O ATOM 0 H ASP A 83 7.976 9.141 0.275 1.00 0.00 H new ATOM 0 HA ASP A 83 7.340 11.723 -0.569 1.00 0.00 H new ATOM 0 HB2 ASP A 83 9.401 10.999 1.546 1.00 0.00 H new ATOM 0 HB3 ASP A 83 8.373 12.418 1.497 1.00 0.00 H new ATOM 1221 N GLU A 84 10.399 10.797 -1.221 1.00 0.00 N ATOM 1222 CA GLU A 84 11.620 11.159 -1.931 1.00 0.00 C ATOM 1223 C GLU A 84 11.299 11.774 -3.287 1.00 0.00 C ATOM 1224 O GLU A 84 11.709 12.896 -3.585 1.00 0.00 O ATOM 1225 CB GLU A 84 12.516 9.933 -2.113 1.00 0.00 C ATOM 1226 CG GLU A 84 13.999 10.243 -1.986 1.00 0.00 C ATOM 1227 CD GLU A 84 14.812 9.041 -1.551 1.00 0.00 C ATOM 1228 OE1 GLU A 84 14.222 8.096 -0.988 1.00 0.00 O ATOM 1229 OE2 GLU A 84 16.041 9.045 -1.774 1.00 0.00 O ATOM 0 H GLU A 84 10.357 9.822 -0.925 1.00 0.00 H new ATOM 0 HA GLU A 84 12.150 11.900 -1.332 1.00 0.00 H new ATOM 0 HB2 GLU A 84 12.245 9.181 -1.372 1.00 0.00 H new ATOM 0 HB3 GLU A 84 12.327 9.496 -3.094 1.00 0.00 H new ATOM 0 HG2 GLU A 84 14.374 10.603 -2.944 1.00 0.00 H new ATOM 0 HG3 GLU A 84 14.137 11.050 -1.266 1.00 0.00 H new ATOM 1236 N LEU A 85 10.564 11.035 -4.106 1.00 0.00 N ATOM 1237 CA LEU A 85 10.194 11.517 -5.429 1.00 0.00 C ATOM 1238 C LEU A 85 9.173 12.646 -5.338 1.00 0.00 C ATOM 1239 O LEU A 85 9.330 13.690 -5.974 1.00 0.00 O ATOM 1240 CB LEU A 85 9.633 10.378 -6.275 1.00 0.00 C ATOM 1241 CG LEU A 85 9.542 10.679 -7.772 1.00 0.00 C ATOM 1242 CD1 LEU A 85 9.372 9.394 -8.567 1.00 0.00 C ATOM 1243 CD2 LEU A 85 8.398 11.643 -8.048 1.00 0.00 C ATOM 0 H LEU A 85 10.214 10.104 -3.879 1.00 0.00 H new ATOM 0 HA LEU A 85 11.095 11.905 -5.905 1.00 0.00 H new ATOM 0 HB2 LEU A 85 10.258 9.496 -6.133 1.00 0.00 H new ATOM 0 HB3 LEU A 85 8.638 10.127 -5.908 1.00 0.00 H new ATOM 0 HG LEU A 85 10.472 11.151 -8.089 1.00 0.00 H new ATOM 0 HD11 LEU A 85 9.309 9.629 -9.629 1.00 0.00 H new ATOM 0 HD12 LEU A 85 10.226 8.741 -8.390 1.00 0.00 H new ATOM 0 HD13 LEU A 85 8.458 8.890 -8.252 1.00 0.00 H new ATOM 0 HD21 LEU A 85 8.345 11.848 -9.117 1.00 0.00 H new ATOM 0 HD22 LEU A 85 7.460 11.198 -7.717 1.00 0.00 H new ATOM 0 HD23 LEU A 85 8.569 12.574 -7.508 1.00 0.00 H new ATOM 1255 N PHE A 86 8.125 12.432 -4.542 1.00 0.00 N ATOM 1256 CA PHE A 86 7.076 13.431 -4.363 1.00 0.00 C ATOM 1257 C PHE A 86 7.631 14.749 -3.857 1.00 0.00 C ATOM 1258 O PHE A 86 6.921 15.748 -3.837 1.00 0.00 O ATOM 1259 CB PHE A 86 6.039 12.930 -3.373 1.00 0.00 C ATOM 1260 CG PHE A 86 4.812 13.792 -3.275 1.00 0.00 C ATOM 1261 CD1 PHE A 86 4.755 14.834 -2.374 1.00 0.00 C ATOM 1262 CD2 PHE A 86 3.708 13.544 -4.070 1.00 0.00 C ATOM 1263 CE1 PHE A 86 3.624 15.616 -2.272 1.00 0.00 C ATOM 1264 CE2 PHE A 86 2.570 14.318 -3.972 1.00 0.00 C ATOM 1265 CZ PHE A 86 2.527 15.357 -3.071 1.00 0.00 C ATOM 0 H PHE A 86 7.982 11.573 -4.011 1.00 0.00 H new ATOM 0 HA PHE A 86 6.621 13.596 -5.340 1.00 0.00 H new ATOM 0 HB2 PHE A 86 5.739 11.922 -3.658 1.00 0.00 H new ATOM 0 HB3 PHE A 86 6.499 12.859 -2.387 1.00 0.00 H new ATOM 0 HD1 PHE A 86 5.606 15.040 -1.741 1.00 0.00 H new ATOM 0 HD2 PHE A 86 3.737 12.731 -4.780 1.00 0.00 H new ATOM 0 HE1 PHE A 86 3.596 16.433 -1.566 1.00 0.00 H new ATOM 0 HE2 PHE A 86 1.716 14.109 -4.600 1.00 0.00 H new ATOM 0 HZ PHE A 86 1.640 15.967 -2.989 1.00 0.00 H new ATOM 1275 N GLN A 87 8.893 14.742 -3.445 1.00 0.00 N ATOM 1276 CA GLN A 87 9.545 15.940 -2.939 1.00 0.00 C ATOM 1277 C GLN A 87 9.274 17.145 -3.844 1.00 0.00 C ATOM 1278 O GLN A 87 10.096 17.496 -4.691 1.00 0.00 O ATOM 1279 CB GLN A 87 11.045 15.696 -2.816 1.00 0.00 C ATOM 1280 CG GLN A 87 11.749 16.674 -1.894 1.00 0.00 C ATOM 1281 CD GLN A 87 12.667 15.981 -0.908 1.00 0.00 C ATOM 1282 OE1 GLN A 87 12.374 15.903 0.285 1.00 0.00 O ATOM 1283 NE2 GLN A 87 13.787 15.470 -1.406 1.00 0.00 N ATOM 0 H GLN A 87 9.487 13.913 -3.452 1.00 0.00 H new ATOM 0 HA GLN A 87 9.134 16.165 -1.955 1.00 0.00 H new ATOM 0 HB2 GLN A 87 11.210 14.683 -2.450 1.00 0.00 H new ATOM 0 HB3 GLN A 87 11.496 15.755 -3.807 1.00 0.00 H new ATOM 0 HG2 GLN A 87 12.327 17.379 -2.491 1.00 0.00 H new ATOM 0 HG3 GLN A 87 11.005 17.254 -1.348 1.00 0.00 H new ATOM 0 HE21 GLN A 87 13.989 15.558 -2.402 1.00 0.00 H new ATOM 0 HE22 GLN A 87 14.445 14.989 -0.793 1.00 0.00 H new ATOM 1292 N GLY A 88 8.110 17.763 -3.665 1.00 0.00 N ATOM 1293 CA GLY A 88 7.735 18.909 -4.474 1.00 0.00 C ATOM 1294 C GLY A 88 6.953 18.520 -5.717 1.00 0.00 C ATOM 1295 O GLY A 88 6.940 19.252 -6.708 1.00 0.00 O ATOM 0 H GLY A 88 7.416 17.488 -2.970 1.00 0.00 H new ATOM 0 HA2 GLY A 88 7.136 19.593 -3.872 1.00 0.00 H new ATOM 0 HA3 GLY A 88 8.634 19.449 -4.770 1.00 0.00 H new ATOM 1299 N GLY A 89 6.299 17.365 -5.661 1.00 0.00 N ATOM 1300 CA GLY A 89 5.517 16.892 -6.786 1.00 0.00 C ATOM 1301 C GLY A 89 4.108 16.512 -6.377 1.00 0.00 C ATOM 1302 O GLY A 89 3.825 15.335 -6.155 1.00 0.00 O ATOM 0 H GLY A 89 6.297 16.745 -4.851 1.00 0.00 H new ATOM 0 HA2 GLY A 89 5.476 17.667 -7.551 1.00 0.00 H new ATOM 0 HA3 GLY A 89 6.010 16.029 -7.233 1.00 0.00 H new ATOM 1306 N PRO A 90 3.194 17.491 -6.271 1.00 0.00 N ATOM 1307 CA PRO A 90 1.803 17.234 -5.881 1.00 0.00 C ATOM 1308 C PRO A 90 1.014 16.516 -6.972 1.00 0.00 C ATOM 1309 O PRO A 90 -0.127 16.875 -7.265 1.00 0.00 O ATOM 1310 CB PRO A 90 1.237 18.635 -5.646 1.00 0.00 C ATOM 1311 CG PRO A 90 2.069 19.531 -6.498 1.00 0.00 C ATOM 1312 CD PRO A 90 3.445 18.921 -6.523 1.00 0.00 C ATOM 0 HA PRO A 90 1.739 16.581 -5.011 1.00 0.00 H new ATOM 0 HB2 PRO A 90 0.185 18.688 -5.926 1.00 0.00 H new ATOM 0 HB3 PRO A 90 1.302 18.916 -4.595 1.00 0.00 H new ATOM 0 HG2 PRO A 90 1.657 19.605 -7.504 1.00 0.00 H new ATOM 0 HG3 PRO A 90 2.098 20.541 -6.090 1.00 0.00 H new ATOM 0 HD2 PRO A 90 3.936 19.079 -7.483 1.00 0.00 H new ATOM 0 HD3 PRO A 90 4.090 19.356 -5.760 1.00 0.00 H new ATOM 1320 N ASN A 91 1.625 15.498 -7.565 1.00 0.00 N ATOM 1321 CA ASN A 91 0.970 14.732 -8.618 1.00 0.00 C ATOM 1322 C ASN A 91 0.214 13.547 -8.039 1.00 0.00 C ATOM 1323 O ASN A 91 0.471 13.114 -6.916 1.00 0.00 O ATOM 1324 CB ASN A 91 1.985 14.244 -9.657 1.00 0.00 C ATOM 1325 CG ASN A 91 1.329 13.851 -10.962 1.00 0.00 C ATOM 1326 OD1 ASN A 91 1.122 12.667 -11.230 1.00 0.00 O ATOM 1327 ND2 ASN A 91 0.999 14.840 -11.784 1.00 0.00 N ATOM 0 H ASN A 91 2.568 15.185 -7.336 1.00 0.00 H new ATOM 0 HA ASN A 91 0.258 15.395 -9.110 1.00 0.00 H new ATOM 0 HB2 ASN A 91 2.717 15.030 -9.843 1.00 0.00 H new ATOM 0 HB3 ASN A 91 2.530 13.390 -9.255 1.00 0.00 H new ATOM 0 HD21 ASN A 91 0.555 14.633 -12.679 1.00 0.00 H new ATOM 0 HD22 ASN A 91 1.189 15.807 -11.521 1.00 0.00 H new ATOM 1334 N TRP A 92 -0.712 13.025 -8.823 1.00 0.00 N ATOM 1335 CA TRP A 92 -1.511 11.876 -8.409 1.00 0.00 C ATOM 1336 C TRP A 92 -0.667 10.594 -8.434 1.00 0.00 C ATOM 1337 O TRP A 92 -0.963 9.619 -7.739 1.00 0.00 O ATOM 1338 CB TRP A 92 -2.740 11.726 -9.314 1.00 0.00 C ATOM 1339 CG TRP A 92 -2.938 12.879 -10.258 1.00 0.00 C ATOM 1340 CD1 TRP A 92 -3.346 14.145 -9.939 1.00 0.00 C ATOM 1341 CD2 TRP A 92 -2.735 12.868 -11.675 1.00 0.00 C ATOM 1342 NE1 TRP A 92 -3.406 14.920 -11.074 1.00 0.00 N ATOM 1343 CE2 TRP A 92 -3.037 14.158 -12.152 1.00 0.00 C ATOM 1344 CE3 TRP A 92 -2.326 11.891 -12.586 1.00 0.00 C ATOM 1345 CZ2 TRP A 92 -2.943 14.493 -13.502 1.00 0.00 C ATOM 1346 CZ3 TRP A 92 -2.234 12.225 -13.924 1.00 0.00 C ATOM 1347 CH2 TRP A 92 -2.540 13.516 -14.371 1.00 0.00 C ATOM 0 H TRP A 92 -0.933 13.377 -9.754 1.00 0.00 H new ATOM 0 HA TRP A 92 -1.851 12.043 -7.387 1.00 0.00 H new ATOM 0 HB2 TRP A 92 -2.645 10.807 -9.892 1.00 0.00 H new ATOM 0 HB3 TRP A 92 -3.628 11.621 -8.691 1.00 0.00 H new ATOM 0 HD1 TRP A 92 -3.586 14.486 -8.943 1.00 0.00 H new ATOM 0 HE1 TRP A 92 -3.680 15.902 -11.108 1.00 0.00 H new ATOM 0 HE3 TRP A 92 -2.086 10.893 -12.251 1.00 0.00 H new ATOM 0 HZ2 TRP A 92 -3.180 15.488 -13.849 1.00 0.00 H new ATOM 0 HZ3 TRP A 92 -1.921 11.477 -14.637 1.00 0.00 H new ATOM 0 HH2 TRP A 92 -2.456 13.745 -15.423 1.00 0.00 H new ATOM 1358 N GLY A 93 0.382 10.606 -9.248 1.00 0.00 N ATOM 1359 CA GLY A 93 1.253 9.450 -9.358 1.00 0.00 C ATOM 1360 C GLY A 93 1.688 8.921 -8.004 1.00 0.00 C ATOM 1361 O GLY A 93 1.557 7.729 -7.722 1.00 0.00 O ATOM 0 H GLY A 93 0.646 11.397 -9.835 1.00 0.00 H new ATOM 0 HA2 GLY A 93 0.737 8.661 -9.904 1.00 0.00 H new ATOM 0 HA3 GLY A 93 2.135 9.717 -9.941 1.00 0.00 H new ATOM 1365 N ARG A 94 2.206 9.816 -7.167 1.00 0.00 N ATOM 1366 CA ARG A 94 2.667 9.446 -5.832 1.00 0.00 C ATOM 1367 C ARG A 94 1.518 8.962 -4.957 1.00 0.00 C ATOM 1368 O ARG A 94 1.743 8.358 -3.908 1.00 0.00 O ATOM 1369 CB ARG A 94 3.344 10.626 -5.144 1.00 0.00 C ATOM 1370 CG ARG A 94 4.046 10.240 -3.852 1.00 0.00 C ATOM 1371 CD ARG A 94 3.174 10.533 -2.644 1.00 0.00 C ATOM 1372 NE ARG A 94 3.914 11.177 -1.557 1.00 0.00 N ATOM 1373 CZ ARG A 94 3.385 11.440 -0.363 1.00 0.00 C ATOM 1374 NH1 ARG A 94 2.112 11.158 -0.120 1.00 0.00 N ATOM 1375 NH2 ARG A 94 4.127 11.993 0.588 1.00 0.00 N ATOM 0 H ARG A 94 2.317 10.805 -7.391 1.00 0.00 H new ATOM 0 HA ARG A 94 3.383 8.634 -5.959 1.00 0.00 H new ATOM 0 HB2 ARG A 94 4.069 11.069 -5.826 1.00 0.00 H new ATOM 0 HB3 ARG A 94 2.598 11.391 -4.931 1.00 0.00 H new ATOM 0 HG2 ARG A 94 4.297 9.179 -3.874 1.00 0.00 H new ATOM 0 HG3 ARG A 94 4.985 10.788 -3.768 1.00 0.00 H new ATOM 0 HD2 ARG A 94 2.347 11.175 -2.945 1.00 0.00 H new ATOM 0 HD3 ARG A 94 2.739 9.602 -2.280 1.00 0.00 H new ATOM 0 HE ARG A 94 4.886 11.438 -1.723 1.00 0.00 H new ATOM 0 HH11 ARG A 94 1.535 10.738 -0.849 1.00 0.00 H new ATOM 0 HH12 ARG A 94 1.710 11.361 0.795 1.00 0.00 H new ATOM 0 HH21 ARG A 94 5.105 12.218 0.406 1.00 0.00 H new ATOM 0 HH22 ARG A 94 3.719 12.193 1.501 1.00 0.00 H new ATOM 1389 N LEU A 95 0.291 9.237 -5.381 1.00 0.00 N ATOM 1390 CA LEU A 95 -0.876 8.827 -4.620 1.00 0.00 C ATOM 1391 C LEU A 95 -1.106 7.326 -4.768 1.00 0.00 C ATOM 1392 O LEU A 95 -1.155 6.594 -3.777 1.00 0.00 O ATOM 1393 CB LEU A 95 -2.118 9.603 -5.080 1.00 0.00 C ATOM 1394 CG LEU A 95 -2.525 10.773 -4.186 1.00 0.00 C ATOM 1395 CD1 LEU A 95 -1.915 12.071 -4.695 1.00 0.00 C ATOM 1396 CD2 LEU A 95 -4.043 10.885 -4.123 1.00 0.00 C ATOM 0 H LEU A 95 0.081 9.740 -6.243 1.00 0.00 H new ATOM 0 HA LEU A 95 -0.697 9.051 -3.568 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -1.938 9.982 -6.086 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -2.956 8.909 -5.146 1.00 0.00 H new ATOM 0 HG LEU A 95 -2.148 10.589 -3.180 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -2.216 12.893 -4.046 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -0.828 11.987 -4.695 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -2.264 12.263 -5.710 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -4.320 11.723 -3.483 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -4.438 11.049 -5.126 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.459 9.964 -3.715 1.00 0.00 H new ATOM 1408 N VAL A 96 -1.232 6.873 -6.011 1.00 0.00 N ATOM 1409 CA VAL A 96 -1.444 5.462 -6.288 1.00 0.00 C ATOM 1410 C VAL A 96 -0.267 4.632 -5.783 1.00 0.00 C ATOM 1411 O VAL A 96 -0.448 3.515 -5.305 1.00 0.00 O ATOM 1412 CB VAL A 96 -1.645 5.213 -7.799 1.00 0.00 C ATOM 1413 CG1 VAL A 96 -1.942 3.746 -8.072 1.00 0.00 C ATOM 1414 CG2 VAL A 96 -2.764 6.089 -8.343 1.00 0.00 C ATOM 0 H VAL A 96 -1.191 7.465 -6.841 1.00 0.00 H new ATOM 0 HA VAL A 96 -2.349 5.156 -5.763 1.00 0.00 H new ATOM 0 HB VAL A 96 -0.719 5.476 -8.310 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -2.080 3.596 -9.143 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -1.109 3.135 -7.724 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -2.851 3.455 -7.545 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -2.890 5.899 -9.409 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.693 5.859 -7.821 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -2.512 7.138 -8.189 1.00 0.00 H new ATOM 1424 N ALA A 97 0.941 5.197 -5.882 1.00 0.00 N ATOM 1425 CA ALA A 97 2.154 4.517 -5.428 1.00 0.00 C ATOM 1426 C ALA A 97 2.162 4.364 -3.921 1.00 0.00 C ATOM 1427 O ALA A 97 2.030 3.262 -3.389 1.00 0.00 O ATOM 1428 CB ALA A 97 3.394 5.292 -5.856 1.00 0.00 C ATOM 0 H ALA A 97 1.103 6.125 -6.273 1.00 0.00 H new ATOM 0 HA ALA A 97 2.165 3.528 -5.886 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.286 4.771 -5.509 1.00 0.00 H new ATOM 0 HB2 ALA A 97 3.418 5.369 -6.943 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.366 6.292 -5.422 1.00 0.00 H new ATOM 1434 N PHE A 98 2.337 5.492 -3.246 1.00 0.00 N ATOM 1435 CA PHE A 98 2.390 5.528 -1.795 1.00 0.00 C ATOM 1436 C PHE A 98 1.365 4.583 -1.183 1.00 0.00 C ATOM 1437 O PHE A 98 1.595 3.984 -0.136 1.00 0.00 O ATOM 1438 CB PHE A 98 2.152 6.952 -1.310 1.00 0.00 C ATOM 1439 CG PHE A 98 2.425 7.114 0.148 1.00 0.00 C ATOM 1440 CD1 PHE A 98 1.628 6.486 1.084 1.00 0.00 C ATOM 1441 CD2 PHE A 98 3.491 7.880 0.582 1.00 0.00 C ATOM 1442 CE1 PHE A 98 1.892 6.620 2.427 1.00 0.00 C ATOM 1443 CE2 PHE A 98 3.758 8.019 1.927 1.00 0.00 C ATOM 1444 CZ PHE A 98 2.959 7.388 2.848 1.00 0.00 C ATOM 0 H PHE A 98 2.446 6.404 -3.689 1.00 0.00 H new ATOM 0 HA PHE A 98 3.379 5.197 -1.477 1.00 0.00 H new ATOM 0 HB2 PHE A 98 2.788 7.635 -1.873 1.00 0.00 H new ATOM 0 HB3 PHE A 98 1.120 7.235 -1.516 1.00 0.00 H new ATOM 0 HD1 PHE A 98 0.791 5.885 0.759 1.00 0.00 H new ATOM 0 HD2 PHE A 98 4.122 8.375 -0.141 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.264 6.124 3.153 1.00 0.00 H new ATOM 0 HE2 PHE A 98 4.592 8.622 2.255 1.00 0.00 H new ATOM 0 HZ PHE A 98 3.165 7.493 3.903 1.00 0.00 H new ATOM 1454 N PHE A 99 0.236 4.454 -1.850 1.00 0.00 N ATOM 1455 CA PHE A 99 -0.823 3.579 -1.387 1.00 0.00 C ATOM 1456 C PHE A 99 -0.397 2.116 -1.466 1.00 0.00 C ATOM 1457 O PHE A 99 -0.458 1.387 -0.477 1.00 0.00 O ATOM 1458 CB PHE A 99 -2.066 3.800 -2.236 1.00 0.00 C ATOM 1459 CG PHE A 99 -3.245 3.002 -1.782 1.00 0.00 C ATOM 1460 CD1 PHE A 99 -3.294 1.631 -1.989 1.00 0.00 C ATOM 1461 CD2 PHE A 99 -4.308 3.621 -1.147 1.00 0.00 C ATOM 1462 CE1 PHE A 99 -4.384 0.899 -1.571 1.00 0.00 C ATOM 1463 CE2 PHE A 99 -5.396 2.890 -0.728 1.00 0.00 C ATOM 1464 CZ PHE A 99 -5.433 1.530 -0.941 1.00 0.00 C ATOM 0 H PHE A 99 0.027 4.946 -2.719 1.00 0.00 H new ATOM 0 HA PHE A 99 -1.039 3.814 -0.345 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -2.325 4.859 -2.219 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -1.840 3.544 -3.271 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -2.472 1.134 -2.482 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -4.283 4.688 -0.979 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -4.415 -0.168 -1.737 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -6.220 3.382 -0.233 1.00 0.00 H new ATOM 0 HZ PHE A 99 -6.287 0.957 -0.613 1.00 0.00 H new ATOM 1474 N VAL A 100 0.031 1.693 -2.650 1.00 0.00 N ATOM 1475 CA VAL A 100 0.462 0.311 -2.862 1.00 0.00 C ATOM 1476 C VAL A 100 1.420 -0.139 -1.774 1.00 0.00 C ATOM 1477 O VAL A 100 1.383 -1.286 -1.334 1.00 0.00 O ATOM 1478 CB VAL A 100 1.157 0.136 -4.221 1.00 0.00 C ATOM 1479 CG1 VAL A 100 1.433 -1.334 -4.494 1.00 0.00 C ATOM 1480 CG2 VAL A 100 0.321 0.752 -5.328 1.00 0.00 C ATOM 0 H VAL A 100 0.090 2.285 -3.479 1.00 0.00 H new ATOM 0 HA VAL A 100 -0.440 -0.300 -2.836 1.00 0.00 H new ATOM 0 HB VAL A 100 2.114 0.657 -4.193 1.00 0.00 H new ATOM 0 HG11 VAL A 100 1.925 -1.438 -5.461 1.00 0.00 H new ATOM 0 HG12 VAL A 100 2.079 -1.734 -3.713 1.00 0.00 H new ATOM 0 HG13 VAL A 100 0.493 -1.885 -4.505 1.00 0.00 H new ATOM 0 HG21 VAL A 100 0.828 0.619 -6.284 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -0.653 0.264 -5.363 1.00 0.00 H new ATOM 0 HG23 VAL A 100 0.187 1.816 -5.133 1.00 0.00 H new ATOM 1490 N PHE A 101 2.280 0.769 -1.345 1.00 0.00 N ATOM 1491 CA PHE A 101 3.243 0.460 -0.307 1.00 0.00 C ATOM 1492 C PHE A 101 2.532 0.179 1.015 1.00 0.00 C ATOM 1493 O PHE A 101 2.582 -0.935 1.531 1.00 0.00 O ATOM 1494 CB PHE A 101 4.247 1.607 -0.157 1.00 0.00 C ATOM 1495 CG PHE A 101 4.268 2.233 1.207 1.00 0.00 C ATOM 1496 CD1 PHE A 101 4.709 1.512 2.303 1.00 0.00 C ATOM 1497 CD2 PHE A 101 3.819 3.521 1.398 1.00 0.00 C ATOM 1498 CE1 PHE A 101 4.707 2.067 3.566 1.00 0.00 C ATOM 1499 CE2 PHE A 101 3.809 4.076 2.655 1.00 0.00 C ATOM 1500 CZ PHE A 101 4.254 3.354 3.740 1.00 0.00 C ATOM 0 H PHE A 101 2.330 1.724 -1.700 1.00 0.00 H new ATOM 0 HA PHE A 101 3.791 -0.438 -0.593 1.00 0.00 H new ATOM 0 HB2 PHE A 101 5.245 1.234 -0.388 1.00 0.00 H new ATOM 0 HB3 PHE A 101 4.015 2.376 -0.894 1.00 0.00 H new ATOM 0 HD1 PHE A 101 5.060 0.500 2.167 1.00 0.00 H new ATOM 0 HD2 PHE A 101 3.472 4.099 0.554 1.00 0.00 H new ATOM 0 HE1 PHE A 101 5.059 1.495 4.412 1.00 0.00 H new ATOM 0 HE2 PHE A 101 3.450 5.085 2.793 1.00 0.00 H new ATOM 0 HZ PHE A 101 4.247 3.797 4.725 1.00 0.00 H new ATOM 1510 N GLY A 102 1.885 1.209 1.570 1.00 0.00 N ATOM 1511 CA GLY A 102 1.191 1.055 2.834 1.00 0.00 C ATOM 1512 C GLY A 102 0.372 -0.219 2.897 1.00 0.00 C ATOM 1513 O GLY A 102 0.477 -0.978 3.856 1.00 0.00 O ATOM 0 H GLY A 102 1.832 2.143 1.164 1.00 0.00 H new ATOM 0 HA2 GLY A 102 1.918 1.056 3.646 1.00 0.00 H new ATOM 0 HA3 GLY A 102 0.536 1.912 2.992 1.00 0.00 H new ATOM 1517 N ALA A 103 -0.445 -0.448 1.872 1.00 0.00 N ATOM 1518 CA ALA A 103 -1.295 -1.632 1.806 1.00 0.00 C ATOM 1519 C ALA A 103 -0.469 -2.911 1.765 1.00 0.00 C ATOM 1520 O ALA A 103 -0.608 -3.780 2.628 1.00 0.00 O ATOM 1521 CB ALA A 103 -2.203 -1.544 0.589 1.00 0.00 C ATOM 0 H ALA A 103 -0.536 0.176 1.071 1.00 0.00 H new ATOM 0 HA ALA A 103 -1.905 -1.666 2.709 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -2.836 -2.430 0.543 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -2.828 -0.654 0.665 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.596 -1.485 -0.314 1.00 0.00 H new ATOM 1527 N ALA A 104 0.388 -3.030 0.752 1.00 0.00 N ATOM 1528 CA ALA A 104 1.229 -4.217 0.603 1.00 0.00 C ATOM 1529 C ALA A 104 1.975 -4.522 1.890 1.00 0.00 C ATOM 1530 O ALA A 104 1.845 -5.608 2.457 1.00 0.00 O ATOM 1531 CB ALA A 104 2.218 -4.047 -0.544 1.00 0.00 C ATOM 0 H ALA A 104 0.518 -2.325 0.027 1.00 0.00 H new ATOM 0 HA ALA A 104 0.572 -5.056 0.374 1.00 0.00 H new ATOM 0 HB1 ALA A 104 2.831 -4.944 -0.632 1.00 0.00 H new ATOM 0 HB2 ALA A 104 1.673 -3.887 -1.474 1.00 0.00 H new ATOM 0 HB3 ALA A 104 2.859 -3.188 -0.347 1.00 0.00 H new ATOM 1537 N LEU A 105 2.749 -3.553 2.357 1.00 0.00 N ATOM 1538 CA LEU A 105 3.505 -3.713 3.583 1.00 0.00 C ATOM 1539 C LEU A 105 2.568 -3.833 4.782 1.00 0.00 C ATOM 1540 O LEU A 105 2.986 -4.238 5.866 1.00 0.00 O ATOM 1541 CB LEU A 105 4.464 -2.541 3.755 1.00 0.00 C ATOM 1542 CG LEU A 105 5.752 -2.663 2.941 1.00 0.00 C ATOM 1543 CD1 LEU A 105 6.427 -1.313 2.789 1.00 0.00 C ATOM 1544 CD2 LEU A 105 6.691 -3.672 3.584 1.00 0.00 C ATOM 0 H LEU A 105 2.868 -2.648 1.902 1.00 0.00 H new ATOM 0 HA LEU A 105 4.087 -4.633 3.523 1.00 0.00 H new ATOM 0 HB2 LEU A 105 3.952 -1.622 3.469 1.00 0.00 H new ATOM 0 HB3 LEU A 105 4.721 -2.448 4.810 1.00 0.00 H new ATOM 0 HG LEU A 105 5.496 -3.020 1.944 1.00 0.00 H new ATOM 0 HD11 LEU A 105 7.341 -1.427 2.206 1.00 0.00 H new ATOM 0 HD12 LEU A 105 5.754 -0.625 2.278 1.00 0.00 H new ATOM 0 HD13 LEU A 105 6.672 -0.916 3.774 1.00 0.00 H new ATOM 0 HD21 LEU A 105 7.604 -3.748 2.993 1.00 0.00 H new ATOM 0 HD22 LEU A 105 6.939 -3.346 4.594 1.00 0.00 H new ATOM 0 HD23 LEU A 105 6.204 -4.646 3.626 1.00 0.00 H new ATOM 1556 N CYS A 106 1.294 -3.498 4.577 1.00 0.00 N ATOM 1557 CA CYS A 106 0.312 -3.596 5.641 1.00 0.00 C ATOM 1558 C CYS A 106 -0.092 -5.046 5.857 1.00 0.00 C ATOM 1559 O CYS A 106 0.233 -5.638 6.881 1.00 0.00 O ATOM 1560 CB CYS A 106 -0.927 -2.751 5.327 1.00 0.00 C ATOM 1561 SG CYS A 106 -1.186 -1.379 6.477 1.00 0.00 S ATOM 0 H CYS A 106 0.926 -3.159 3.688 1.00 0.00 H new ATOM 0 HA CYS A 106 0.768 -3.212 6.554 1.00 0.00 H new ATOM 0 HB2 CYS A 106 -0.837 -2.353 4.316 1.00 0.00 H new ATOM 0 HB3 CYS A 106 -1.807 -3.394 5.340 1.00 0.00 H new ATOM 0 HG CYS A 106 -1.959 -0.491 5.926 1.00 0.00 H new ATOM 1567 N ALA A 107 -0.799 -5.619 4.883 1.00 0.00 N ATOM 1568 CA ALA A 107 -1.249 -7.004 4.980 1.00 0.00 C ATOM 1569 C ALA A 107 -0.103 -7.933 5.369 1.00 0.00 C ATOM 1570 O ALA A 107 -0.302 -8.905 6.097 1.00 0.00 O ATOM 1571 CB ALA A 107 -1.874 -7.457 3.668 1.00 0.00 C ATOM 0 H ALA A 107 -1.071 -5.146 4.021 1.00 0.00 H new ATOM 0 HA ALA A 107 -2.005 -7.053 5.764 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -2.203 -8.492 3.760 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -2.730 -6.823 3.435 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -1.137 -7.380 2.868 1.00 0.00 H new ATOM 1577 N GLU A 108 1.094 -7.626 4.884 1.00 0.00 N ATOM 1578 CA GLU A 108 2.265 -8.437 5.188 1.00 0.00 C ATOM 1579 C GLU A 108 2.616 -8.347 6.668 1.00 0.00 C ATOM 1580 O GLU A 108 2.631 -9.354 7.376 1.00 0.00 O ATOM 1581 CB GLU A 108 3.456 -7.989 4.342 1.00 0.00 C ATOM 1582 CG GLU A 108 4.158 -9.134 3.634 1.00 0.00 C ATOM 1583 CD GLU A 108 5.220 -8.656 2.664 1.00 0.00 C ATOM 1584 OE1 GLU A 108 5.762 -7.550 2.874 1.00 0.00 O ATOM 1585 OE2 GLU A 108 5.509 -9.387 1.693 1.00 0.00 O ATOM 0 H GLU A 108 1.278 -6.824 4.281 1.00 0.00 H new ATOM 0 HA GLU A 108 2.030 -9.474 4.950 1.00 0.00 H new ATOM 0 HB2 GLU A 108 3.114 -7.268 3.600 1.00 0.00 H new ATOM 0 HB3 GLU A 108 4.173 -7.473 4.981 1.00 0.00 H new ATOM 0 HG2 GLU A 108 4.616 -9.788 4.376 1.00 0.00 H new ATOM 0 HG3 GLU A 108 3.421 -9.730 3.095 1.00 0.00 H new ATOM 1592 N SER A 109 2.896 -7.132 7.129 1.00 0.00 N ATOM 1593 CA SER A 109 3.247 -6.904 8.527 1.00 0.00 C ATOM 1594 C SER A 109 2.212 -7.528 9.462 1.00 0.00 C ATOM 1595 O SER A 109 2.518 -7.849 10.609 1.00 0.00 O ATOM 1596 CB SER A 109 3.376 -5.404 8.808 1.00 0.00 C ATOM 1597 OG SER A 109 2.362 -4.667 8.145 1.00 0.00 O ATOM 0 H SER A 109 2.887 -6.289 6.554 1.00 0.00 H new ATOM 0 HA SER A 109 4.208 -7.382 8.715 1.00 0.00 H new ATOM 0 HB2 SER A 109 3.315 -5.226 9.882 1.00 0.00 H new ATOM 0 HB3 SER A 109 4.355 -5.054 8.482 1.00 0.00 H new ATOM 0 HG SER A 109 2.768 -4.093 7.462 1.00 0.00 H new ATOM 1603 N VAL A 110 0.989 -7.705 8.963 1.00 0.00 N ATOM 1604 CA VAL A 110 -0.077 -8.300 9.761 1.00 0.00 C ATOM 1605 C VAL A 110 0.155 -9.794 9.955 1.00 0.00 C ATOM 1606 O VAL A 110 0.314 -10.261 11.082 1.00 0.00 O ATOM 1607 CB VAL A 110 -1.463 -8.080 9.119 1.00 0.00 C ATOM 1608 CG1 VAL A 110 -2.561 -8.633 10.012 1.00 0.00 C ATOM 1609 CG2 VAL A 110 -1.699 -6.603 8.835 1.00 0.00 C ATOM 0 H VAL A 110 0.715 -7.446 8.015 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.060 -7.802 10.730 1.00 0.00 H new ATOM 0 HB VAL A 110 -1.487 -8.618 8.171 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -3.530 -8.468 9.542 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.406 -9.702 10.159 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -2.535 -8.126 10.977 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.682 -6.472 8.383 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.651 -6.041 9.768 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -0.933 -6.237 8.151 1.00 0.00 H new ATOM 1619 N ASN A 111 0.161 -10.540 8.851 1.00 0.00 N ATOM 1620 CA ASN A 111 0.362 -11.988 8.898 1.00 0.00 C ATOM 1621 C ASN A 111 1.509 -12.359 9.833 1.00 0.00 C ATOM 1622 O ASN A 111 1.329 -13.125 10.780 1.00 0.00 O ATOM 1623 CB ASN A 111 0.643 -12.533 7.497 1.00 0.00 C ATOM 1624 CG ASN A 111 -0.543 -12.381 6.564 1.00 0.00 C ATOM 1625 OD1 ASN A 111 -1.681 -12.231 7.008 1.00 0.00 O ATOM 1626 ND2 ASN A 111 -0.282 -12.423 5.262 1.00 0.00 N ATOM 0 H ASN A 111 0.029 -10.165 7.912 1.00 0.00 H new ATOM 0 HA ASN A 111 -0.554 -12.436 9.283 1.00 0.00 H new ATOM 0 HB2 ASN A 111 1.502 -12.013 7.074 1.00 0.00 H new ATOM 0 HB3 ASN A 111 0.912 -13.587 7.568 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -1.041 -12.329 4.587 1.00 0.00 H new ATOM 0 HD22 ASN A 111 0.677 -12.549 4.938 1.00 0.00 H new ATOM 1633 N LYS A 112 2.688 -11.803 9.563 1.00 0.00 N ATOM 1634 CA LYS A 112 3.867 -12.066 10.382 1.00 0.00 C ATOM 1635 C LYS A 112 3.674 -11.565 11.816 1.00 0.00 C ATOM 1636 O LYS A 112 4.523 -11.793 12.679 1.00 0.00 O ATOM 1637 CB LYS A 112 5.100 -11.408 9.757 1.00 0.00 C ATOM 1638 CG LYS A 112 6.367 -12.243 9.874 1.00 0.00 C ATOM 1639 CD LYS A 112 7.403 -11.566 10.757 1.00 0.00 C ATOM 1640 CE LYS A 112 7.978 -10.326 10.090 1.00 0.00 C ATOM 1641 NZ LYS A 112 9.294 -9.942 10.669 1.00 0.00 N ATOM 0 H LYS A 112 2.851 -11.167 8.782 1.00 0.00 H new ATOM 0 HA LYS A 112 4.015 -13.145 10.420 1.00 0.00 H new ATOM 0 HB2 LYS A 112 4.901 -11.212 8.703 1.00 0.00 H new ATOM 0 HB3 LYS A 112 5.267 -10.443 10.235 1.00 0.00 H new ATOM 0 HG2 LYS A 112 6.122 -13.222 10.285 1.00 0.00 H new ATOM 0 HG3 LYS A 112 6.787 -12.410 8.882 1.00 0.00 H new ATOM 0 HD2 LYS A 112 6.948 -11.291 11.708 1.00 0.00 H new ATOM 0 HD3 LYS A 112 8.207 -12.267 10.979 1.00 0.00 H new ATOM 0 HE2 LYS A 112 8.091 -10.509 9.021 1.00 0.00 H new ATOM 0 HE3 LYS A 112 7.278 -9.498 10.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 9.859 -9.447 9.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 9.145 -9.314 11.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 9.800 -10.796 10.978 1.00 0.00 H new ATOM 1655 N GLU A 113 2.555 -10.889 12.067 1.00 0.00 N ATOM 1656 CA GLU A 113 2.252 -10.366 13.389 1.00 0.00 C ATOM 1657 C GLU A 113 3.250 -9.287 13.788 1.00 0.00 C ATOM 1658 O GLU A 113 3.665 -9.205 14.943 1.00 0.00 O ATOM 1659 CB GLU A 113 2.240 -11.496 14.422 1.00 0.00 C ATOM 1660 CG GLU A 113 0.838 -11.933 14.819 1.00 0.00 C ATOM 1661 CD GLU A 113 0.499 -11.588 16.256 1.00 0.00 C ATOM 1662 OE1 GLU A 113 1.230 -10.776 16.863 1.00 0.00 O ATOM 1663 OE2 GLU A 113 -0.500 -12.128 16.776 1.00 0.00 O ATOM 0 H GLU A 113 1.842 -10.692 11.365 1.00 0.00 H new ATOM 0 HA GLU A 113 1.260 -9.915 13.357 1.00 0.00 H new ATOM 0 HB2 GLU A 113 2.780 -12.353 14.019 1.00 0.00 H new ATOM 0 HB3 GLU A 113 2.778 -11.171 15.313 1.00 0.00 H new ATOM 0 HG2 GLU A 113 0.114 -11.460 14.156 1.00 0.00 H new ATOM 0 HG3 GLU A 113 0.744 -13.010 14.677 1.00 0.00 H new ATOM 1670 N MET A 114 3.632 -8.463 12.818 1.00 0.00 N ATOM 1671 CA MET A 114 4.578 -7.382 13.056 1.00 0.00 C ATOM 1672 C MET A 114 3.848 -6.051 13.203 1.00 0.00 C ATOM 1673 O MET A 114 4.312 -5.019 12.722 1.00 0.00 O ATOM 1674 CB MET A 114 5.597 -7.305 11.914 1.00 0.00 C ATOM 1675 CG MET A 114 6.941 -6.742 12.339 1.00 0.00 C ATOM 1676 SD MET A 114 7.936 -7.935 13.254 1.00 0.00 S ATOM 1677 CE MET A 114 7.516 -7.513 14.942 1.00 0.00 C ATOM 0 H MET A 114 3.299 -8.525 11.856 1.00 0.00 H new ATOM 0 HA MET A 114 5.108 -7.589 13.986 1.00 0.00 H new ATOM 0 HB2 MET A 114 5.744 -8.303 11.501 1.00 0.00 H new ATOM 0 HB3 MET A 114 5.189 -6.686 11.115 1.00 0.00 H new ATOM 0 HG2 MET A 114 7.491 -6.418 11.455 1.00 0.00 H new ATOM 0 HG3 MET A 114 6.781 -5.858 12.957 1.00 0.00 H new ATOM 0 HE1 MET A 114 8.416 -7.529 15.556 1.00 0.00 H new ATOM 0 HE2 MET A 114 7.076 -6.516 14.969 1.00 0.00 H new ATOM 0 HE3 MET A 114 6.799 -8.236 15.330 1.00 0.00 H new ATOM 1687 N GLU A 115 2.703 -6.084 13.878 1.00 0.00 N ATOM 1688 CA GLU A 115 1.909 -4.881 14.099 1.00 0.00 C ATOM 1689 C GLU A 115 2.752 -3.795 14.767 1.00 0.00 C ATOM 1690 O GLU A 115 2.525 -2.600 14.568 1.00 0.00 O ATOM 1691 CB GLU A 115 0.692 -5.210 14.968 1.00 0.00 C ATOM 1692 CG GLU A 115 -0.070 -6.448 14.511 1.00 0.00 C ATOM 1693 CD GLU A 115 -0.435 -7.369 15.660 1.00 0.00 C ATOM 1694 OE1 GLU A 115 -1.134 -6.911 16.589 1.00 0.00 O ATOM 1695 OE2 GLU A 115 -0.023 -8.547 15.632 1.00 0.00 O ATOM 0 H GLU A 115 2.304 -6.932 14.282 1.00 0.00 H new ATOM 0 HA GLU A 115 1.568 -4.508 13.133 1.00 0.00 H new ATOM 0 HB2 GLU A 115 1.020 -5.355 15.997 1.00 0.00 H new ATOM 0 HB3 GLU A 115 0.014 -4.356 14.967 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -0.979 -6.140 13.995 1.00 0.00 H new ATOM 0 HG3 GLU A 115 0.536 -6.996 13.790 1.00 0.00 H new ATOM 1702 N VAL A 116 3.733 -4.227 15.555 1.00 0.00 N ATOM 1703 CA VAL A 116 4.624 -3.304 16.256 1.00 0.00 C ATOM 1704 C VAL A 116 5.155 -2.226 15.313 1.00 0.00 C ATOM 1705 O VAL A 116 5.121 -1.037 15.632 1.00 0.00 O ATOM 1706 CB VAL A 116 5.818 -4.039 16.899 1.00 0.00 C ATOM 1707 CG1 VAL A 116 6.597 -3.100 17.808 1.00 0.00 C ATOM 1708 CG2 VAL A 116 5.351 -5.269 17.668 1.00 0.00 C ATOM 0 H VAL A 116 3.932 -5.213 15.725 1.00 0.00 H new ATOM 0 HA VAL A 116 4.031 -2.838 17.043 1.00 0.00 H new ATOM 0 HB VAL A 116 6.481 -4.373 16.100 1.00 0.00 H new ATOM 0 HG11 VAL A 116 7.435 -3.636 18.253 1.00 0.00 H new ATOM 0 HG12 VAL A 116 6.972 -2.258 17.226 1.00 0.00 H new ATOM 0 HG13 VAL A 116 5.942 -2.732 18.598 1.00 0.00 H new ATOM 0 HG21 VAL A 116 6.212 -5.769 18.112 1.00 0.00 H new ATOM 0 HG22 VAL A 116 4.662 -4.965 18.456 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.845 -5.953 16.987 1.00 0.00 H new ATOM 1718 N LEU A 117 5.645 -2.646 14.151 1.00 0.00 N ATOM 1719 CA LEU A 117 6.184 -1.713 13.167 1.00 0.00 C ATOM 1720 C LEU A 117 5.063 -0.993 12.417 1.00 0.00 C ATOM 1721 O LEU A 117 5.163 0.202 12.135 1.00 0.00 O ATOM 1722 CB LEU A 117 7.086 -2.446 12.171 1.00 0.00 C ATOM 1723 CG LEU A 117 8.144 -3.359 12.795 1.00 0.00 C ATOM 1724 CD1 LEU A 117 8.825 -4.191 11.720 1.00 0.00 C ATOM 1725 CD2 LEU A 117 9.169 -2.542 13.570 1.00 0.00 C ATOM 0 H LEU A 117 5.680 -3.625 13.868 1.00 0.00 H new ATOM 0 HA LEU A 117 6.774 -0.969 13.703 1.00 0.00 H new ATOM 0 HB2 LEU A 117 6.459 -3.044 11.510 1.00 0.00 H new ATOM 0 HB3 LEU A 117 7.590 -1.706 11.549 1.00 0.00 H new ATOM 0 HG LEU A 117 7.649 -4.034 13.493 1.00 0.00 H new ATOM 0 HD11 LEU A 117 9.575 -4.835 12.179 1.00 0.00 H new ATOM 0 HD12 LEU A 117 8.082 -4.805 11.210 1.00 0.00 H new ATOM 0 HD13 LEU A 117 9.307 -3.530 10.999 1.00 0.00 H new ATOM 0 HD21 LEU A 117 9.912 -3.210 14.006 1.00 0.00 H new ATOM 0 HD22 LEU A 117 9.661 -1.842 12.895 1.00 0.00 H new ATOM 0 HD23 LEU A 117 8.668 -1.989 14.364 1.00 0.00 H new ATOM 1737 N VAL A 118 3.998 -1.725 12.099 1.00 0.00 N ATOM 1738 CA VAL A 118 2.856 -1.159 11.382 1.00 0.00 C ATOM 1739 C VAL A 118 2.446 0.185 11.975 1.00 0.00 C ATOM 1740 O VAL A 118 2.489 1.215 11.302 1.00 0.00 O ATOM 1741 CB VAL A 118 1.645 -2.120 11.419 1.00 0.00 C ATOM 1742 CG1 VAL A 118 0.402 -1.461 10.831 1.00 0.00 C ATOM 1743 CG2 VAL A 118 1.970 -3.414 10.689 1.00 0.00 C ATOM 0 H VAL A 118 3.901 -2.714 12.327 1.00 0.00 H new ATOM 0 HA VAL A 118 3.167 -1.013 10.347 1.00 0.00 H new ATOM 0 HB VAL A 118 1.432 -2.358 12.461 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.433 -2.160 10.870 1.00 0.00 H new ATOM 0 HG12 VAL A 118 0.156 -0.569 11.407 1.00 0.00 H new ATOM 0 HG13 VAL A 118 0.594 -1.182 9.795 1.00 0.00 H new ATOM 0 HG21 VAL A 118 1.107 -4.079 10.725 1.00 0.00 H new ATOM 0 HG22 VAL A 118 2.216 -3.194 9.650 1.00 0.00 H new ATOM 0 HG23 VAL A 118 2.821 -3.898 11.168 1.00 0.00 H new ATOM 1753 N GLY A 119 2.050 0.164 13.242 1.00 0.00 N ATOM 1754 CA GLY A 119 1.639 1.382 13.911 1.00 0.00 C ATOM 1755 C GLY A 119 2.669 2.487 13.788 1.00 0.00 C ATOM 1756 O GLY A 119 2.328 3.670 13.822 1.00 0.00 O ATOM 0 H GLY A 119 2.006 -0.677 13.818 1.00 0.00 H new ATOM 0 HA2 GLY A 119 0.693 1.723 13.490 1.00 0.00 H new ATOM 0 HA3 GLY A 119 1.461 1.171 14.966 1.00 0.00 H new ATOM 1760 N GLN A 120 3.934 2.102 13.644 1.00 0.00 N ATOM 1761 CA GLN A 120 5.013 3.072 13.515 1.00 0.00 C ATOM 1762 C GLN A 120 5.029 3.679 12.115 1.00 0.00 C ATOM 1763 O GLN A 120 5.217 4.885 11.951 1.00 0.00 O ATOM 1764 CB GLN A 120 6.363 2.417 13.819 1.00 0.00 C ATOM 1765 CG GLN A 120 6.507 1.965 15.264 1.00 0.00 C ATOM 1766 CD GLN A 120 7.870 2.291 15.842 1.00 0.00 C ATOM 1767 OE1 GLN A 120 7.978 2.977 16.858 1.00 0.00 O ATOM 1768 NE2 GLN A 120 8.920 1.798 15.195 1.00 0.00 N ATOM 0 H GLN A 120 4.235 1.128 13.614 1.00 0.00 H new ATOM 0 HA GLN A 120 4.839 3.870 14.237 1.00 0.00 H new ATOM 0 HB2 GLN A 120 6.496 1.557 13.163 1.00 0.00 H new ATOM 0 HB3 GLN A 120 7.161 3.122 13.586 1.00 0.00 H new ATOM 0 HG2 GLN A 120 5.736 2.442 15.869 1.00 0.00 H new ATOM 0 HG3 GLN A 120 6.339 0.890 15.323 1.00 0.00 H new ATOM 0 HE21 GLN A 120 8.783 1.234 14.356 1.00 0.00 H new ATOM 0 HE22 GLN A 120 9.863 1.983 15.537 1.00 0.00 H new ATOM 1777 N VAL A 121 4.827 2.834 11.107 1.00 0.00 N ATOM 1778 CA VAL A 121 4.811 3.283 9.720 1.00 0.00 C ATOM 1779 C VAL A 121 3.676 4.270 9.483 1.00 0.00 C ATOM 1780 O VAL A 121 3.793 5.181 8.663 1.00 0.00 O ATOM 1781 CB VAL A 121 4.664 2.092 8.755 1.00 0.00 C ATOM 1782 CG1 VAL A 121 4.517 2.568 7.313 1.00 0.00 C ATOM 1783 CG2 VAL A 121 5.850 1.157 8.897 1.00 0.00 C ATOM 0 H VAL A 121 4.672 1.833 11.227 1.00 0.00 H new ATOM 0 HA VAL A 121 5.762 3.779 9.526 1.00 0.00 H new ATOM 0 HB VAL A 121 3.757 1.547 9.016 1.00 0.00 H new ATOM 0 HG11 VAL A 121 4.415 1.706 6.654 1.00 0.00 H new ATOM 0 HG12 VAL A 121 3.632 3.198 7.226 1.00 0.00 H new ATOM 0 HG13 VAL A 121 5.399 3.141 7.027 1.00 0.00 H new ATOM 0 HG21 VAL A 121 5.736 0.318 8.210 1.00 0.00 H new ATOM 0 HG22 VAL A 121 6.768 1.696 8.663 1.00 0.00 H new ATOM 0 HG23 VAL A 121 5.899 0.784 9.920 1.00 0.00 H new ATOM 1793 N GLN A 122 2.578 4.081 10.202 1.00 0.00 N ATOM 1794 CA GLN A 122 1.426 4.958 10.064 1.00 0.00 C ATOM 1795 C GLN A 122 1.721 6.332 10.660 1.00 0.00 C ATOM 1796 O GLN A 122 1.619 7.348 9.972 1.00 0.00 O ATOM 1797 CB GLN A 122 0.196 4.333 10.729 1.00 0.00 C ATOM 1798 CG GLN A 122 -0.740 3.654 9.744 1.00 0.00 C ATOM 1799 CD GLN A 122 -1.410 4.639 8.808 1.00 0.00 C ATOM 1800 OE1 GLN A 122 -1.104 4.688 7.618 1.00 0.00 O ATOM 1801 NE2 GLN A 122 -2.331 5.432 9.342 1.00 0.00 N ATOM 0 H GLN A 122 2.462 3.331 10.884 1.00 0.00 H new ATOM 0 HA GLN A 122 1.216 5.086 9.002 1.00 0.00 H new ATOM 0 HB2 GLN A 122 0.523 3.604 11.470 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -0.352 5.108 11.265 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -0.180 2.925 9.159 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -1.503 3.103 10.294 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -2.554 5.358 10.334 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -2.815 6.115 8.760 1.00 0.00 H new ATOM 1810 N GLU A 123 2.090 6.359 11.940 1.00 0.00 N ATOM 1811 CA GLU A 123 2.400 7.611 12.625 1.00 0.00 C ATOM 1812 C GLU A 123 3.316 8.495 11.778 1.00 0.00 C ATOM 1813 O GLU A 123 3.126 9.709 11.701 1.00 0.00 O ATOM 1814 CB GLU A 123 3.060 7.319 13.975 1.00 0.00 C ATOM 1815 CG GLU A 123 2.144 6.610 14.959 1.00 0.00 C ATOM 1816 CD GLU A 123 0.994 7.483 15.419 1.00 0.00 C ATOM 1817 OE1 GLU A 123 0.020 7.636 14.651 1.00 0.00 O ATOM 1818 OE2 GLU A 123 1.068 8.016 16.545 1.00 0.00 O ATOM 0 H GLU A 123 2.181 5.527 12.523 1.00 0.00 H new ATOM 0 HA GLU A 123 1.465 8.148 12.786 1.00 0.00 H new ATOM 0 HB2 GLU A 123 3.947 6.707 13.812 1.00 0.00 H new ATOM 0 HB3 GLU A 123 3.397 8.257 14.416 1.00 0.00 H new ATOM 0 HG2 GLU A 123 1.747 5.708 14.494 1.00 0.00 H new ATOM 0 HG3 GLU A 123 2.724 6.293 15.826 1.00 0.00 H new ATOM 1825 N TRP A 124 4.307 7.879 11.144 1.00 0.00 N ATOM 1826 CA TRP A 124 5.247 8.612 10.304 1.00 0.00 C ATOM 1827 C TRP A 124 4.550 9.148 9.061 1.00 0.00 C ATOM 1828 O TRP A 124 4.776 10.287 8.650 1.00 0.00 O ATOM 1829 CB TRP A 124 6.414 7.710 9.902 1.00 0.00 C ATOM 1830 CG TRP A 124 7.396 7.483 11.009 1.00 0.00 C ATOM 1831 CD1 TRP A 124 7.247 7.830 12.322 1.00 0.00 C ATOM 1832 CD2 TRP A 124 8.679 6.858 10.902 1.00 0.00 C ATOM 1833 NE1 TRP A 124 8.360 7.460 13.037 1.00 0.00 N ATOM 1834 CE2 TRP A 124 9.253 6.861 12.187 1.00 0.00 C ATOM 1835 CE3 TRP A 124 9.398 6.296 9.844 1.00 0.00 C ATOM 1836 CZ2 TRP A 124 10.513 6.323 12.442 1.00 0.00 C ATOM 1837 CZ3 TRP A 124 10.648 5.763 10.097 1.00 0.00 C ATOM 1838 CH2 TRP A 124 11.194 5.780 11.387 1.00 0.00 C ATOM 0 H TRP A 124 4.480 6.875 11.195 1.00 0.00 H new ATOM 0 HA TRP A 124 5.633 9.455 10.877 1.00 0.00 H new ATOM 0 HB2 TRP A 124 6.023 6.748 9.570 1.00 0.00 H new ATOM 0 HB3 TRP A 124 6.932 8.155 9.052 1.00 0.00 H new ATOM 0 HD1 TRP A 124 6.381 8.323 12.737 1.00 0.00 H new ATOM 0 HE1 TRP A 124 8.499 7.607 14.037 1.00 0.00 H new ATOM 0 HE3 TRP A 124 8.985 6.278 8.846 1.00 0.00 H new ATOM 0 HZ2 TRP A 124 10.936 6.334 13.436 1.00 0.00 H new ATOM 0 HZ3 TRP A 124 11.213 5.326 9.287 1.00 0.00 H new ATOM 0 HH2 TRP A 124 12.173 5.355 11.552 1.00 0.00 H new ATOM 1849 N MET A 125 3.697 8.319 8.470 1.00 0.00 N ATOM 1850 CA MET A 125 2.954 8.703 7.275 1.00 0.00 C ATOM 1851 C MET A 125 2.177 9.993 7.514 1.00 0.00 C ATOM 1852 O MET A 125 2.436 11.015 6.880 1.00 0.00 O ATOM 1853 CB MET A 125 1.987 7.585 6.874 1.00 0.00 C ATOM 1854 CG MET A 125 1.256 7.846 5.569 1.00 0.00 C ATOM 1855 SD MET A 125 -0.218 6.825 5.370 1.00 0.00 S ATOM 1856 CE MET A 125 0.504 5.191 5.207 1.00 0.00 C ATOM 0 H MET A 125 3.502 7.374 8.800 1.00 0.00 H new ATOM 0 HA MET A 125 3.668 8.869 6.468 1.00 0.00 H new ATOM 0 HB2 MET A 125 2.542 6.651 6.788 1.00 0.00 H new ATOM 0 HB3 MET A 125 1.254 7.449 7.669 1.00 0.00 H new ATOM 0 HG2 MET A 125 0.972 8.897 5.522 1.00 0.00 H new ATOM 0 HG3 MET A 125 1.934 7.661 4.736 1.00 0.00 H new ATOM 0 HE1 MET A 125 -0.253 4.493 4.850 1.00 0.00 H new ATOM 0 HE2 MET A 125 1.329 5.227 4.495 1.00 0.00 H new ATOM 0 HE3 MET A 125 0.876 4.859 6.176 1.00 0.00 H new ATOM 1866 N VAL A 126 1.223 9.934 8.438 1.00 0.00 N ATOM 1867 CA VAL A 126 0.403 11.091 8.770 1.00 0.00 C ATOM 1868 C VAL A 126 1.259 12.256 9.262 1.00 0.00 C ATOM 1869 O VAL A 126 0.858 13.415 9.165 1.00 0.00 O ATOM 1870 CB VAL A 126 -0.635 10.741 9.848 1.00 0.00 C ATOM 1871 CG1 VAL A 126 -1.604 11.896 10.056 1.00 0.00 C ATOM 1872 CG2 VAL A 126 -1.380 9.468 9.475 1.00 0.00 C ATOM 0 H VAL A 126 0.999 9.094 8.971 1.00 0.00 H new ATOM 0 HA VAL A 126 -0.112 11.389 7.856 1.00 0.00 H new ATOM 0 HB VAL A 126 -0.112 10.567 10.788 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -2.331 11.628 10.823 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -1.052 12.781 10.372 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -2.124 12.107 9.122 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -2.111 9.234 10.249 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -1.892 9.612 8.523 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -0.671 8.645 9.385 1.00 0.00 H new ATOM 1882 N ALA A 127 2.441 11.940 9.789 1.00 0.00 N ATOM 1883 CA ALA A 127 3.348 12.964 10.291 1.00 0.00 C ATOM 1884 C ALA A 127 3.771 13.908 9.174 1.00 0.00 C ATOM 1885 O ALA A 127 3.531 15.113 9.242 1.00 0.00 O ATOM 1886 CB ALA A 127 4.569 12.322 10.935 1.00 0.00 C ATOM 0 H ALA A 127 2.790 10.986 9.878 1.00 0.00 H new ATOM 0 HA ALA A 127 2.820 13.546 11.047 1.00 0.00 H new ATOM 0 HB1 ALA A 127 5.237 13.100 11.305 1.00 0.00 H new ATOM 0 HB2 ALA A 127 4.253 11.690 11.765 1.00 0.00 H new ATOM 0 HB3 ALA A 127 5.093 11.715 10.197 1.00 0.00 H new ATOM 1892 N TYR A 128 4.396 13.351 8.142 1.00 0.00 N ATOM 1893 CA TYR A 128 4.843 14.149 7.009 1.00 0.00 C ATOM 1894 C TYR A 128 3.657 14.797 6.318 1.00 0.00 C ATOM 1895 O TYR A 128 3.755 15.912 5.808 1.00 0.00 O ATOM 1896 CB TYR A 128 5.610 13.288 6.008 1.00 0.00 C ATOM 1897 CG TYR A 128 6.420 14.092 5.014 1.00 0.00 C ATOM 1898 CD1 TYR A 128 5.865 14.503 3.808 1.00 0.00 C ATOM 1899 CD2 TYR A 128 7.739 14.434 5.280 1.00 0.00 C ATOM 1900 CE1 TYR A 128 6.606 15.232 2.894 1.00 0.00 C ATOM 1901 CE2 TYR A 128 8.484 15.165 4.372 1.00 0.00 C ATOM 1902 CZ TYR A 128 7.914 15.560 3.182 1.00 0.00 C ATOM 1903 OH TYR A 128 8.655 16.285 2.275 1.00 0.00 O ATOM 0 H TYR A 128 4.603 12.355 8.068 1.00 0.00 H new ATOM 0 HA TYR A 128 5.508 14.926 7.386 1.00 0.00 H new ATOM 0 HB2 TYR A 128 6.277 12.620 6.552 1.00 0.00 H new ATOM 0 HB3 TYR A 128 4.904 12.660 5.465 1.00 0.00 H new ATOM 0 HD1 TYR A 128 4.840 14.250 3.581 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.191 14.124 6.211 1.00 0.00 H new ATOM 0 HE1 TYR A 128 6.162 15.542 1.960 1.00 0.00 H new ATOM 0 HE2 TYR A 128 9.508 15.425 4.595 1.00 0.00 H new ATOM 0 HH TYR A 128 9.556 16.432 2.632 1.00 0.00 H new ATOM 1913 N LEU A 129 2.530 14.089 6.296 1.00 0.00 N ATOM 1914 CA LEU A 129 1.335 14.609 5.656 1.00 0.00 C ATOM 1915 C LEU A 129 0.981 15.991 6.210 1.00 0.00 C ATOM 1916 O LEU A 129 0.842 16.958 5.461 1.00 0.00 O ATOM 1917 CB LEU A 129 0.158 13.642 5.821 1.00 0.00 C ATOM 1918 CG LEU A 129 -0.139 12.796 4.577 1.00 0.00 C ATOM 1919 CD1 LEU A 129 0.903 11.701 4.417 1.00 0.00 C ATOM 1920 CD2 LEU A 129 -1.538 12.198 4.645 1.00 0.00 C ATOM 0 H LEU A 129 2.424 13.163 6.711 1.00 0.00 H new ATOM 0 HA LEU A 129 1.541 14.710 4.591 1.00 0.00 H new ATOM 0 HB2 LEU A 129 0.364 12.976 6.659 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.734 14.213 6.080 1.00 0.00 H new ATOM 0 HG LEU A 129 -0.093 13.448 3.705 1.00 0.00 H new ATOM 0 HD11 LEU A 129 0.677 11.110 3.529 1.00 0.00 H new ATOM 0 HD12 LEU A 129 1.890 12.151 4.312 1.00 0.00 H new ATOM 0 HD13 LEU A 129 0.890 11.055 5.295 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.723 11.603 3.751 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -1.620 11.563 5.527 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -2.274 13.000 4.706 1.00 0.00 H new ATOM 1932 N GLU A 130 0.823 16.072 7.524 1.00 0.00 N ATOM 1933 CA GLU A 130 0.468 17.329 8.182 1.00 0.00 C ATOM 1934 C GLU A 130 1.663 18.277 8.278 1.00 0.00 C ATOM 1935 O GLU A 130 1.500 19.464 8.567 1.00 0.00 O ATOM 1936 CB GLU A 130 -0.101 17.046 9.570 1.00 0.00 C ATOM 1937 CG GLU A 130 -1.397 16.253 9.533 1.00 0.00 C ATOM 1938 CD GLU A 130 -2.457 16.818 10.458 1.00 0.00 C ATOM 1939 OE1 GLU A 130 -2.094 17.566 11.388 1.00 0.00 O ATOM 1940 OE2 GLU A 130 -3.650 16.510 10.251 1.00 0.00 O ATOM 0 H GLU A 130 0.935 15.282 8.160 1.00 0.00 H new ATOM 0 HA GLU A 130 -0.290 17.823 7.575 1.00 0.00 H new ATOM 0 HB2 GLU A 130 0.638 16.497 10.154 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -0.275 17.991 10.084 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -1.781 16.240 8.513 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -1.193 15.219 9.810 1.00 0.00 H new ATOM 1947 N THR A 131 2.860 17.741 8.058 1.00 0.00 N ATOM 1948 CA THR A 131 4.087 18.530 8.129 1.00 0.00 C ATOM 1949 C THR A 131 4.295 19.355 6.856 1.00 0.00 C ATOM 1950 O THR A 131 4.129 20.572 6.857 1.00 0.00 O ATOM 1951 CB THR A 131 5.289 17.603 8.344 1.00 0.00 C ATOM 1952 OG1 THR A 131 5.199 16.951 9.602 1.00 0.00 O ATOM 1953 CG2 THR A 131 6.623 18.319 8.283 1.00 0.00 C ATOM 0 H THR A 131 3.007 16.758 7.828 1.00 0.00 H new ATOM 0 HA THR A 131 3.996 19.218 8.969 1.00 0.00 H new ATOM 0 HB THR A 131 5.251 16.885 7.525 1.00 0.00 H new ATOM 0 HG1 THR A 131 4.354 16.457 9.655 1.00 0.00 H new ATOM 0 HG21 THR A 131 7.428 17.602 8.444 1.00 0.00 H new ATOM 0 HG22 THR A 131 6.741 18.785 7.305 1.00 0.00 H new ATOM 0 HG23 THR A 131 6.660 19.086 9.057 1.00 0.00 H new ATOM 1961 N ARG A 132 4.680 18.683 5.778 1.00 0.00 N ATOM 1962 CA ARG A 132 4.939 19.361 4.505 1.00 0.00 C ATOM 1963 C ARG A 132 3.891 19.025 3.449 1.00 0.00 C ATOM 1964 O ARG A 132 3.798 19.693 2.414 1.00 0.00 O ATOM 1965 CB ARG A 132 6.329 19.000 3.981 1.00 0.00 C ATOM 1966 CG ARG A 132 7.194 20.214 3.680 1.00 0.00 C ATOM 1967 CD ARG A 132 7.598 20.946 4.953 1.00 0.00 C ATOM 1968 NE ARG A 132 9.018 21.297 4.957 1.00 0.00 N ATOM 1969 CZ ARG A 132 9.890 20.892 5.881 1.00 0.00 C ATOM 1970 NH1 ARG A 132 9.503 20.131 6.899 1.00 0.00 N ATOM 1971 NH2 ARG A 132 11.162 21.254 5.783 1.00 0.00 N ATOM 0 H ARG A 132 4.821 17.673 5.755 1.00 0.00 H new ATOM 0 HA ARG A 132 4.886 20.432 4.699 1.00 0.00 H new ATOM 0 HB2 ARG A 132 6.836 18.375 4.717 1.00 0.00 H new ATOM 0 HB3 ARG A 132 6.224 18.404 3.075 1.00 0.00 H new ATOM 0 HG2 ARG A 132 8.088 19.900 3.141 1.00 0.00 H new ATOM 0 HG3 ARG A 132 6.650 20.895 3.025 1.00 0.00 H new ATOM 0 HD2 ARG A 132 7.001 21.852 5.055 1.00 0.00 H new ATOM 0 HD3 ARG A 132 7.377 20.319 5.817 1.00 0.00 H new ATOM 0 HE ARG A 132 9.364 21.891 4.203 1.00 0.00 H new ATOM 0 HH11 ARG A 132 8.527 19.848 6.982 1.00 0.00 H new ATOM 0 HH12 ARG A 132 10.182 19.830 7.598 1.00 0.00 H new ATOM 0 HH21 ARG A 132 11.467 21.838 5.005 1.00 0.00 H new ATOM 0 HH22 ARG A 132 11.835 20.948 6.486 1.00 0.00 H new ATOM 1985 N LEU A 133 3.099 17.998 3.714 1.00 0.00 N ATOM 1986 CA LEU A 133 2.051 17.584 2.795 1.00 0.00 C ATOM 1987 C LEU A 133 0.748 18.314 3.108 1.00 0.00 C ATOM 1988 O LEU A 133 -0.258 18.105 2.438 1.00 0.00 O ATOM 1989 CB LEU A 133 1.828 16.076 2.911 1.00 0.00 C ATOM 1990 CG LEU A 133 1.438 15.356 1.627 1.00 0.00 C ATOM 1991 CD1 LEU A 133 1.950 13.925 1.644 1.00 0.00 C ATOM 1992 CD2 LEU A 133 -0.069 15.384 1.448 1.00 0.00 C ATOM 0 H LEU A 133 3.163 17.434 4.562 1.00 0.00 H new ATOM 0 HA LEU A 133 2.361 17.832 1.780 1.00 0.00 H new ATOM 0 HB2 LEU A 133 2.742 15.623 3.295 1.00 0.00 H new ATOM 0 HB3 LEU A 133 1.049 15.900 3.653 1.00 0.00 H new ATOM 0 HG LEU A 133 1.896 15.872 0.783 1.00 0.00 H new ATOM 0 HD11 LEU A 133 1.663 13.425 0.719 1.00 0.00 H new ATOM 0 HD12 LEU A 133 3.036 13.928 1.732 1.00 0.00 H new ATOM 0 HD13 LEU A 133 1.519 13.394 2.493 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -0.336 14.866 0.527 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -0.545 14.888 2.294 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -0.410 16.418 1.395 1.00 0.00 H new ATOM 2004 N ALA A 134 0.770 19.150 4.147 1.00 0.00 N ATOM 2005 CA ALA A 134 -0.418 19.891 4.562 1.00 0.00 C ATOM 2006 C ALA A 134 -0.810 20.923 3.519 1.00 0.00 C ATOM 2007 O ALA A 134 -1.979 21.289 3.403 1.00 0.00 O ATOM 2008 CB ALA A 134 -0.198 20.559 5.916 1.00 0.00 C ATOM 0 H ALA A 134 1.598 19.330 4.715 1.00 0.00 H new ATOM 0 HA ALA A 134 -1.236 19.178 4.660 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -1.097 21.105 6.203 1.00 0.00 H new ATOM 0 HB2 ALA A 134 0.020 19.798 6.666 1.00 0.00 H new ATOM 0 HB3 ALA A 134 0.641 21.252 5.848 1.00 0.00 H new ATOM 2014 N ASP A 135 0.171 21.385 2.750 1.00 0.00 N ATOM 2015 CA ASP A 135 -0.083 22.370 1.711 1.00 0.00 C ATOM 2016 C ASP A 135 -0.721 21.711 0.496 1.00 0.00 C ATOM 2017 O ASP A 135 -1.847 22.033 0.123 1.00 0.00 O ATOM 2018 CB ASP A 135 1.221 23.057 1.307 1.00 0.00 C ATOM 2019 CG ASP A 135 1.021 24.520 0.963 1.00 0.00 C ATOM 2020 OD1 ASP A 135 1.084 25.361 1.883 1.00 0.00 O ATOM 2021 OD2 ASP A 135 0.802 24.823 -0.229 1.00 0.00 O ATOM 0 H ASP A 135 1.145 21.093 2.828 1.00 0.00 H new ATOM 0 HA ASP A 135 -0.772 23.118 2.105 1.00 0.00 H new ATOM 0 HB2 ASP A 135 1.940 22.973 2.122 1.00 0.00 H new ATOM 0 HB3 ASP A 135 1.650 22.540 0.449 1.00 0.00 H new ATOM 2026 N TRP A 136 0.005 20.784 -0.120 1.00 0.00 N ATOM 2027 CA TRP A 136 -0.492 20.088 -1.306 1.00 0.00 C ATOM 2028 C TRP A 136 -1.907 19.543 -1.089 1.00 0.00 C ATOM 2029 O TRP A 136 -2.668 19.371 -2.043 1.00 0.00 O ATOM 2030 CB TRP A 136 0.459 18.951 -1.688 1.00 0.00 C ATOM 2031 CG TRP A 136 1.805 19.421 -2.165 1.00 0.00 C ATOM 2032 CD1 TRP A 136 3.016 18.866 -1.863 1.00 0.00 C ATOM 2033 CD2 TRP A 136 2.083 20.539 -3.026 1.00 0.00 C ATOM 2034 NE1 TRP A 136 4.025 19.558 -2.486 1.00 0.00 N ATOM 2035 CE2 TRP A 136 3.479 20.588 -3.204 1.00 0.00 C ATOM 2036 CE3 TRP A 136 1.290 21.500 -3.668 1.00 0.00 C ATOM 2037 CZ2 TRP A 136 4.097 21.555 -3.993 1.00 0.00 C ATOM 2038 CZ3 TRP A 136 1.907 22.458 -4.449 1.00 0.00 C ATOM 2039 CH2 TRP A 136 3.297 22.479 -4.606 1.00 0.00 C ATOM 0 H TRP A 136 0.937 20.496 0.179 1.00 0.00 H new ATOM 0 HA TRP A 136 -0.535 20.810 -2.121 1.00 0.00 H new ATOM 0 HB2 TRP A 136 0.597 18.300 -0.825 1.00 0.00 H new ATOM 0 HB3 TRP A 136 -0.004 18.350 -2.471 1.00 0.00 H new ATOM 0 HD1 TRP A 136 3.159 18.006 -1.226 1.00 0.00 H new ATOM 0 HE1 TRP A 136 5.020 19.340 -2.424 1.00 0.00 H new ATOM 0 HE3 TRP A 136 0.216 21.492 -3.554 1.00 0.00 H new ATOM 0 HZ2 TRP A 136 5.170 21.574 -4.116 1.00 0.00 H new ATOM 0 HZ3 TRP A 136 1.306 23.204 -4.947 1.00 0.00 H new ATOM 0 HH2 TRP A 136 3.748 23.241 -5.224 1.00 0.00 H new ATOM 2050 N ILE A 137 -2.256 19.288 0.168 1.00 0.00 N ATOM 2051 CA ILE A 137 -3.583 18.782 0.513 1.00 0.00 C ATOM 2052 C ILE A 137 -4.597 19.918 0.549 1.00 0.00 C ATOM 2053 O ILE A 137 -5.721 19.775 0.073 1.00 0.00 O ATOM 2054 CB ILE A 137 -3.570 18.053 1.877 1.00 0.00 C ATOM 2055 CG1 ILE A 137 -2.624 16.853 1.810 1.00 0.00 C ATOM 2056 CG2 ILE A 137 -4.976 17.625 2.288 1.00 0.00 C ATOM 2057 CD1 ILE A 137 -3.163 15.685 1.010 1.00 0.00 C ATOM 0 H ILE A 137 -1.637 19.423 0.968 1.00 0.00 H new ATOM 0 HA ILE A 137 -3.872 18.067 -0.258 1.00 0.00 H new ATOM 0 HB ILE A 137 -3.208 18.743 2.640 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -1.678 17.173 1.373 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -2.409 16.517 2.824 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -4.934 17.115 3.251 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -5.615 18.505 2.370 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -5.385 16.949 1.537 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -2.433 14.876 1.011 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -4.093 15.335 1.458 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -3.351 16.002 -0.016 1.00 0.00 H new ATOM 2069 N HIS A 138 -4.189 21.044 1.120 1.00 0.00 N ATOM 2070 CA HIS A 138 -5.061 22.206 1.217 1.00 0.00 C ATOM 2071 C HIS A 138 -5.521 22.664 -0.164 1.00 0.00 C ATOM 2072 O HIS A 138 -6.690 22.997 -0.358 1.00 0.00 O ATOM 2073 CB HIS A 138 -4.347 23.353 1.933 1.00 0.00 C ATOM 2074 CG HIS A 138 -5.258 24.173 2.790 1.00 0.00 C ATOM 2075 ND1 HIS A 138 -5.766 23.726 3.991 1.00 0.00 N ATOM 2076 CD2 HIS A 138 -5.761 25.417 2.613 1.00 0.00 C ATOM 2077 CE1 HIS A 138 -6.541 24.656 4.516 1.00 0.00 C ATOM 2078 NE2 HIS A 138 -6.555 25.693 3.700 1.00 0.00 N ATOM 0 H HIS A 138 -3.261 21.177 1.522 1.00 0.00 H new ATOM 0 HA HIS A 138 -5.939 21.916 1.795 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -3.548 22.945 2.551 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -3.878 23.999 1.191 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -5.573 26.071 1.774 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -7.073 24.581 5.453 1.00 0.00 H new ATOM 0 HE2 HIS A 138 -7.072 26.559 3.852 1.00 0.00 H new ATOM 2086 N SER A 139 -4.598 22.685 -1.123 1.00 0.00 N ATOM 2087 CA SER A 139 -4.920 23.109 -2.482 1.00 0.00 C ATOM 2088 C SER A 139 -6.071 22.286 -3.059 1.00 0.00 C ATOM 2089 O SER A 139 -7.144 22.817 -3.350 1.00 0.00 O ATOM 2090 CB SER A 139 -3.687 22.989 -3.379 1.00 0.00 C ATOM 2091 OG SER A 139 -3.530 21.667 -3.865 1.00 0.00 O ATOM 0 H SER A 139 -3.624 22.414 -0.984 1.00 0.00 H new ATOM 0 HA SER A 139 -5.234 24.152 -2.444 1.00 0.00 H new ATOM 0 HB2 SER A 139 -3.777 23.679 -4.218 1.00 0.00 H new ATOM 0 HB3 SER A 139 -2.798 23.281 -2.820 1.00 0.00 H new ATOM 0 HG SER A 139 -3.128 21.108 -3.168 1.00 0.00 H new ATOM 2097 N SER A 140 -5.842 20.990 -3.217 1.00 0.00 N ATOM 2098 CA SER A 140 -6.853 20.087 -3.754 1.00 0.00 C ATOM 2099 C SER A 140 -7.905 19.754 -2.695 1.00 0.00 C ATOM 2100 O SER A 140 -8.974 19.232 -3.009 1.00 0.00 O ATOM 2101 CB SER A 140 -6.182 18.806 -4.260 1.00 0.00 C ATOM 2102 OG SER A 140 -4.861 18.698 -3.760 1.00 0.00 O ATOM 0 H SER A 140 -4.959 20.537 -2.980 1.00 0.00 H new ATOM 0 HA SER A 140 -7.357 20.581 -4.585 1.00 0.00 H new ATOM 0 HB2 SER A 140 -6.765 17.938 -3.950 1.00 0.00 H new ATOM 0 HB3 SER A 140 -6.164 18.806 -5.350 1.00 0.00 H new ATOM 0 HG SER A 140 -4.451 17.873 -4.094 1.00 0.00 H new ATOM 2108 N GLY A 141 -7.592 20.053 -1.437 1.00 0.00 N ATOM 2109 CA GLY A 141 -8.513 19.774 -0.351 1.00 0.00 C ATOM 2110 C GLY A 141 -8.345 18.373 0.199 1.00 0.00 C ATOM 2111 O GLY A 141 -8.541 18.139 1.394 1.00 0.00 O ATOM 0 H GLY A 141 -6.713 20.485 -1.151 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -8.357 20.497 0.449 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -9.536 19.904 -0.703 1.00 0.00 H new ATOM 2115 N GLY A 142 -7.979 17.437 -0.671 1.00 0.00 N ATOM 2116 CA GLY A 142 -7.788 16.077 -0.257 1.00 0.00 C ATOM 2117 C GLY A 142 -8.111 15.108 -1.375 1.00 0.00 C ATOM 2118 O GLY A 142 -7.721 15.308 -2.524 1.00 0.00 O ATOM 0 H GLY A 142 -7.812 17.608 -1.663 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -6.756 15.934 0.063 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -8.421 15.865 0.604 1.00 0.00 H new ATOM 2122 N TRP A 143 -8.823 14.061 -1.031 1.00 0.00 N ATOM 2123 CA TRP A 143 -9.214 13.037 -1.995 1.00 0.00 C ATOM 2124 C TRP A 143 -10.129 13.611 -3.075 1.00 0.00 C ATOM 2125 O TRP A 143 -10.283 13.022 -4.141 1.00 0.00 O ATOM 2126 CB TRP A 143 -9.908 11.882 -1.275 1.00 0.00 C ATOM 2127 CG TRP A 143 -9.060 11.244 -0.211 1.00 0.00 C ATOM 2128 CD1 TRP A 143 -9.030 11.563 1.117 1.00 0.00 C ATOM 2129 CD2 TRP A 143 -8.119 10.176 -0.386 1.00 0.00 C ATOM 2130 NE1 TRP A 143 -8.134 10.756 1.778 1.00 0.00 N ATOM 2131 CE2 TRP A 143 -7.562 9.898 0.877 1.00 0.00 C ATOM 2132 CE3 TRP A 143 -7.694 9.428 -1.487 1.00 0.00 C ATOM 2133 CZ2 TRP A 143 -6.606 8.903 1.068 1.00 0.00 C ATOM 2134 CZ3 TRP A 143 -6.746 8.441 -1.296 1.00 0.00 C ATOM 2135 CH2 TRP A 143 -6.211 8.185 -0.027 1.00 0.00 C ATOM 0 H TRP A 143 -9.151 13.887 -0.081 1.00 0.00 H new ATOM 0 HA TRP A 143 -8.312 12.668 -2.483 1.00 0.00 H new ATOM 0 HB2 TRP A 143 -10.830 12.247 -0.823 1.00 0.00 H new ATOM 0 HB3 TRP A 143 -10.190 11.125 -2.007 1.00 0.00 H new ATOM 0 HD1 TRP A 143 -9.624 12.337 1.581 1.00 0.00 H new ATOM 0 HE1 TRP A 143 -7.929 10.791 2.777 1.00 0.00 H new ATOM 0 HE3 TRP A 143 -8.099 9.618 -2.470 1.00 0.00 H new ATOM 0 HZ2 TRP A 143 -6.192 8.706 2.046 1.00 0.00 H new ATOM 0 HZ3 TRP A 143 -6.412 7.856 -2.140 1.00 0.00 H new ATOM 0 HH2 TRP A 143 -5.472 7.406 0.089 1.00 0.00 H new ATOM 2146 N ALA A 144 -10.742 14.760 -2.787 1.00 0.00 N ATOM 2147 CA ALA A 144 -11.656 15.408 -3.732 1.00 0.00 C ATOM 2148 C ALA A 144 -11.144 15.306 -5.167 1.00 0.00 C ATOM 2149 O ALA A 144 -11.781 14.692 -6.026 1.00 0.00 O ATOM 2150 CB ALA A 144 -11.853 16.867 -3.354 1.00 0.00 C ATOM 0 H ALA A 144 -10.623 15.262 -1.907 1.00 0.00 H new ATOM 0 HA ALA A 144 -12.612 14.888 -3.679 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -12.534 17.338 -4.063 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -12.274 16.929 -2.351 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -10.892 17.382 -3.377 1.00 0.00 H new ATOM 2156 N GLU A 145 -9.988 15.903 -5.420 1.00 0.00 N ATOM 2157 CA GLU A 145 -9.390 15.870 -6.746 1.00 0.00 C ATOM 2158 C GLU A 145 -9.168 14.433 -7.194 1.00 0.00 C ATOM 2159 O GLU A 145 -9.355 14.100 -8.364 1.00 0.00 O ATOM 2160 CB GLU A 145 -8.066 16.631 -6.752 1.00 0.00 C ATOM 2161 CG GLU A 145 -8.234 18.131 -6.924 1.00 0.00 C ATOM 2162 CD GLU A 145 -8.324 18.542 -8.378 1.00 0.00 C ATOM 2163 OE1 GLU A 145 -8.875 17.762 -9.183 1.00 0.00 O ATOM 2164 OE2 GLU A 145 -7.842 19.643 -8.714 1.00 0.00 O ATOM 0 H GLU A 145 -9.446 16.416 -4.724 1.00 0.00 H new ATOM 0 HA GLU A 145 -10.075 16.352 -7.444 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -7.539 16.436 -5.818 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -7.439 16.248 -7.557 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -9.135 18.455 -6.402 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -7.393 18.643 -6.456 1.00 0.00 H new ATOM 2171 N PHE A 146 -8.785 13.581 -6.249 1.00 0.00 N ATOM 2172 CA PHE A 146 -8.549 12.176 -6.544 1.00 0.00 C ATOM 2173 C PHE A 146 -9.833 11.509 -7.021 1.00 0.00 C ATOM 2174 O PHE A 146 -9.803 10.642 -7.887 1.00 0.00 O ATOM 2175 CB PHE A 146 -7.992 11.453 -5.308 1.00 0.00 C ATOM 2176 CG PHE A 146 -8.397 10.005 -5.213 1.00 0.00 C ATOM 2177 CD1 PHE A 146 -7.674 9.019 -5.867 1.00 0.00 C ATOM 2178 CD2 PHE A 146 -9.507 9.634 -4.475 1.00 0.00 C ATOM 2179 CE1 PHE A 146 -8.052 7.690 -5.781 1.00 0.00 C ATOM 2180 CE2 PHE A 146 -9.885 8.311 -4.384 1.00 0.00 C ATOM 2181 CZ PHE A 146 -9.158 7.337 -5.034 1.00 0.00 C ATOM 0 H PHE A 146 -8.632 13.840 -5.274 1.00 0.00 H new ATOM 0 HA PHE A 146 -7.810 12.110 -7.342 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -6.904 11.515 -5.322 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -8.329 11.974 -4.412 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -6.806 9.291 -6.450 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -10.085 10.390 -3.964 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -7.483 6.931 -6.297 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -10.753 8.037 -3.802 1.00 0.00 H new ATOM 0 HZ PHE A 146 -9.453 6.301 -4.959 1.00 0.00 H new ATOM 2191 N THR A 147 -10.959 11.919 -6.452 1.00 0.00 N ATOM 2192 CA THR A 147 -12.249 11.351 -6.826 1.00 0.00 C ATOM 2193 C THR A 147 -12.584 11.656 -8.281 1.00 0.00 C ATOM 2194 O THR A 147 -13.045 10.787 -9.017 1.00 0.00 O ATOM 2195 CB THR A 147 -13.357 11.874 -5.907 1.00 0.00 C ATOM 2196 OG1 THR A 147 -12.882 12.025 -4.580 1.00 0.00 O ATOM 2197 CG2 THR A 147 -14.568 10.968 -5.858 1.00 0.00 C ATOM 0 H THR A 147 -11.006 12.640 -5.732 1.00 0.00 H new ATOM 0 HA THR A 147 -12.181 10.269 -6.712 1.00 0.00 H new ATOM 0 HB THR A 147 -13.654 12.833 -6.331 1.00 0.00 H new ATOM 0 HG1 THR A 147 -12.393 12.871 -4.502 1.00 0.00 H new ATOM 0 HG21 THR A 147 -15.315 11.396 -5.190 1.00 0.00 H new ATOM 0 HG22 THR A 147 -14.990 10.870 -6.858 1.00 0.00 H new ATOM 0 HG23 THR A 147 -14.273 9.985 -5.491 1.00 0.00 H new ATOM 2205 N ALA A 148 -12.344 12.889 -8.684 1.00 0.00 N ATOM 2206 CA ALA A 148 -12.617 13.313 -10.059 1.00 0.00 C ATOM 2207 C ALA A 148 -11.416 13.072 -10.974 1.00 0.00 C ATOM 2208 O ALA A 148 -11.460 13.373 -12.169 1.00 0.00 O ATOM 2209 CB ALA A 148 -13.009 14.780 -10.083 1.00 0.00 C ATOM 0 H ALA A 148 -11.961 13.620 -8.085 1.00 0.00 H new ATOM 0 HA ALA A 148 -13.444 12.712 -10.435 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -13.210 15.086 -11.110 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -13.904 14.927 -9.479 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -12.195 15.381 -9.678 1.00 0.00 H new ATOM 2215 N LEU A 149 -10.340 12.538 -10.404 1.00 0.00 N ATOM 2216 CA LEU A 149 -9.127 12.275 -11.165 1.00 0.00 C ATOM 2217 C LEU A 149 -9.185 10.933 -11.880 1.00 0.00 C ATOM 2218 O LEU A 149 -9.060 10.869 -13.101 1.00 0.00 O ATOM 2219 CB LEU A 149 -7.911 12.322 -10.248 1.00 0.00 C ATOM 2220 CG LEU A 149 -6.881 13.374 -10.633 1.00 0.00 C ATOM 2221 CD1 LEU A 149 -6.333 14.064 -9.393 1.00 0.00 C ATOM 2222 CD2 LEU A 149 -5.769 12.736 -11.447 1.00 0.00 C ATOM 0 H LEU A 149 -10.285 12.280 -9.419 1.00 0.00 H new ATOM 0 HA LEU A 149 -9.042 13.053 -11.924 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -8.246 12.513 -9.228 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -7.432 11.343 -10.248 1.00 0.00 H new ATOM 0 HG LEU A 149 -7.362 14.135 -11.248 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -5.598 14.813 -9.688 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -7.148 14.548 -8.856 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -5.859 13.326 -8.745 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -5.036 13.495 -11.719 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -5.285 11.959 -10.855 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -6.187 12.295 -12.352 1.00 0.00 H new ATOM 2234 N TYR A 150 -9.368 9.860 -11.117 1.00 0.00 N ATOM 2235 CA TYR A 150 -9.428 8.524 -11.695 1.00 0.00 C ATOM 2236 C TYR A 150 -10.860 8.158 -12.072 1.00 0.00 C ATOM 2237 O TYR A 150 -11.235 6.986 -12.047 1.00 0.00 O ATOM 2238 CB TYR A 150 -8.854 7.494 -10.714 1.00 0.00 C ATOM 2239 CG TYR A 150 -9.795 7.140 -9.588 1.00 0.00 C ATOM 2240 CD1 TYR A 150 -9.926 7.971 -8.490 1.00 0.00 C ATOM 2241 CD2 TYR A 150 -10.562 5.985 -9.633 1.00 0.00 C ATOM 2242 CE1 TYR A 150 -10.793 7.667 -7.463 1.00 0.00 C ATOM 2243 CE2 TYR A 150 -11.430 5.670 -8.610 1.00 0.00 C ATOM 2244 CZ TYR A 150 -11.544 6.514 -7.527 1.00 0.00 C ATOM 2245 OH TYR A 150 -12.410 6.205 -6.505 1.00 0.00 O ATOM 0 H TYR A 150 -9.477 9.890 -10.103 1.00 0.00 H new ATOM 0 HA TYR A 150 -8.826 8.518 -12.603 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -8.599 6.587 -11.261 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -7.927 7.883 -10.293 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -9.338 8.875 -8.437 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -10.478 5.323 -10.482 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -10.883 8.328 -6.614 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -12.018 4.766 -8.657 1.00 0.00 H new ATOM 0 HH TYR A 150 -13.167 5.694 -6.861 1.00 0.00 H new ATOM 2255 N GLY A 151 -11.664 9.161 -12.422 1.00 0.00 N ATOM 2256 CA GLY A 151 -13.038 8.904 -12.795 1.00 0.00 C ATOM 2257 C GLY A 151 -13.180 8.559 -14.263 1.00 0.00 C ATOM 2258 O GLY A 151 -14.033 7.756 -14.638 1.00 0.00 O ATOM 0 H GLY A 151 -11.386 10.142 -12.453 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -13.429 8.084 -12.192 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -13.644 9.782 -12.570 1.00 0.00 H new ATOM 2262 N ASP A 152 -12.340 9.166 -15.096 1.00 0.00 N ATOM 2263 CA ASP A 152 -12.374 8.915 -16.532 1.00 0.00 C ATOM 2264 C ASP A 152 -10.983 9.051 -17.145 1.00 0.00 C ATOM 2265 O ASP A 152 -10.422 10.145 -17.196 1.00 0.00 O ATOM 2266 CB ASP A 152 -13.345 9.880 -17.217 1.00 0.00 C ATOM 2267 CG ASP A 152 -13.430 9.648 -18.714 1.00 0.00 C ATOM 2268 OD1 ASP A 152 -12.787 8.696 -19.205 1.00 0.00 O ATOM 2269 OD2 ASP A 152 -14.139 10.417 -19.394 1.00 0.00 O ATOM 0 H ASP A 152 -11.628 9.834 -14.801 1.00 0.00 H new ATOM 0 HA ASP A 152 -12.718 7.893 -16.688 1.00 0.00 H new ATOM 0 HB2 ASP A 152 -14.336 9.767 -16.778 1.00 0.00 H new ATOM 0 HB3 ASP A 152 -13.028 10.906 -17.028 1.00 0.00 H new ATOM 2274 N GLY A 153 -10.436 7.932 -17.611 1.00 0.00 N ATOM 2275 CA GLY A 153 -9.118 7.947 -18.220 1.00 0.00 C ATOM 2276 C GLY A 153 -8.403 6.616 -18.090 1.00 0.00 C ATOM 2277 O GLY A 153 -8.435 5.985 -17.030 1.00 0.00 O ATOM 0 H GLY A 153 -10.882 7.015 -17.578 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -9.212 8.204 -19.275 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -8.515 8.727 -17.755 1.00 0.00 H new ATOM 2281 N ALA A 154 -7.758 6.183 -19.171 1.00 0.00 N ATOM 2282 CA ALA A 154 -7.036 4.919 -19.179 1.00 0.00 C ATOM 2283 C ALA A 154 -6.086 4.820 -17.987 1.00 0.00 C ATOM 2284 O ALA A 154 -5.358 5.761 -17.675 1.00 0.00 O ATOM 2285 CB ALA A 154 -6.272 4.755 -20.485 1.00 0.00 C ATOM 0 H ALA A 154 -7.722 6.693 -20.054 1.00 0.00 H new ATOM 0 HA ALA A 154 -7.764 4.112 -19.095 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -5.737 3.805 -20.477 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -6.972 4.770 -21.320 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -5.559 5.572 -20.595 1.00 0.00 H new ATOM 2291 N LEU A 155 -6.107 3.673 -17.328 1.00 0.00 N ATOM 2292 CA LEU A 155 -5.256 3.437 -16.164 1.00 0.00 C ATOM 2293 C LEU A 155 -3.802 3.249 -16.577 1.00 0.00 C ATOM 2294 O LEU A 155 -2.890 3.748 -15.916 1.00 0.00 O ATOM 2295 CB LEU A 155 -5.733 2.209 -15.385 1.00 0.00 C ATOM 2296 CG LEU A 155 -7.236 1.922 -15.458 1.00 0.00 C ATOM 2297 CD1 LEU A 155 -7.597 0.757 -14.549 1.00 0.00 C ATOM 2298 CD2 LEU A 155 -8.038 3.163 -15.085 1.00 0.00 C ATOM 0 H LEU A 155 -6.705 2.885 -17.577 1.00 0.00 H new ATOM 0 HA LEU A 155 -5.325 4.315 -15.522 1.00 0.00 H new ATOM 0 HB2 LEU A 155 -5.196 1.335 -15.755 1.00 0.00 H new ATOM 0 HB3 LEU A 155 -5.456 2.335 -14.338 1.00 0.00 H new ATOM 0 HG LEU A 155 -7.487 1.650 -16.483 1.00 0.00 H new ATOM 0 HD11 LEU A 155 -8.668 0.565 -14.612 1.00 0.00 H new ATOM 0 HD12 LEU A 155 -7.050 -0.132 -14.863 1.00 0.00 H new ATOM 0 HD13 LEU A 155 -7.332 1.002 -13.521 1.00 0.00 H new ATOM 0 HD21 LEU A 155 -9.103 2.939 -15.143 1.00 0.00 H new ATOM 0 HD22 LEU A 155 -7.786 3.467 -14.069 1.00 0.00 H new ATOM 0 HD23 LEU A 155 -7.799 3.972 -15.776 1.00 0.00 H new ATOM 2310 N GLU A 156 -3.589 2.532 -17.677 1.00 0.00 N ATOM 2311 CA GLU A 156 -2.242 2.279 -18.185 1.00 0.00 C ATOM 2312 C GLU A 156 -1.391 3.552 -18.152 1.00 0.00 C ATOM 2313 O GLU A 156 -0.166 3.490 -18.047 1.00 0.00 O ATOM 2314 CB GLU A 156 -2.312 1.723 -19.611 1.00 0.00 C ATOM 2315 CG GLU A 156 -2.016 0.233 -19.699 1.00 0.00 C ATOM 2316 CD GLU A 156 -1.370 -0.161 -21.014 1.00 0.00 C ATOM 2317 OE1 GLU A 156 -0.255 0.325 -21.298 1.00 0.00 O ATOM 2318 OE2 GLU A 156 -1.979 -0.958 -21.759 1.00 0.00 O ATOM 0 H GLU A 156 -4.333 2.115 -18.236 1.00 0.00 H new ATOM 0 HA GLU A 156 -1.768 1.541 -17.538 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -3.306 1.912 -20.017 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -1.603 2.263 -20.238 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -1.359 -0.052 -18.877 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -2.944 -0.325 -19.573 1.00 0.00 H new ATOM 2325 N GLU A 157 -2.056 4.703 -18.235 1.00 0.00 N ATOM 2326 CA GLU A 157 -1.373 5.989 -18.209 1.00 0.00 C ATOM 2327 C GLU A 157 -0.727 6.246 -16.848 1.00 0.00 C ATOM 2328 O GLU A 157 0.494 6.372 -16.740 1.00 0.00 O ATOM 2329 CB GLU A 157 -2.364 7.110 -18.536 1.00 0.00 C ATOM 2330 CG GLU A 157 -1.839 8.114 -19.549 1.00 0.00 C ATOM 2331 CD GLU A 157 -0.876 9.110 -18.934 1.00 0.00 C ATOM 2332 OE1 GLU A 157 -1.338 9.997 -18.186 1.00 0.00 O ATOM 2333 OE2 GLU A 157 0.339 9.005 -19.201 1.00 0.00 O ATOM 0 H GLU A 157 -3.070 4.768 -18.321 1.00 0.00 H new ATOM 0 HA GLU A 157 -0.583 5.970 -18.960 1.00 0.00 H new ATOM 0 HB2 GLU A 157 -3.284 6.669 -18.918 1.00 0.00 H new ATOM 0 HB3 GLU A 157 -2.621 7.636 -17.616 1.00 0.00 H new ATOM 0 HG2 GLU A 157 -1.338 7.581 -20.358 1.00 0.00 H new ATOM 0 HG3 GLU A 157 -2.678 8.651 -19.992 1.00 0.00 H new ATOM 2340 N ALA A 158 -1.552 6.329 -15.808 1.00 0.00 N ATOM 2341 CA ALA A 158 -1.055 6.579 -14.457 1.00 0.00 C ATOM 2342 C ALA A 158 0.053 5.591 -14.090 1.00 0.00 C ATOM 2343 O ALA A 158 1.079 5.976 -13.528 1.00 0.00 O ATOM 2344 CB ALA A 158 -2.194 6.509 -13.450 1.00 0.00 C ATOM 0 H ALA A 158 -2.565 6.227 -15.874 1.00 0.00 H new ATOM 0 HA ALA A 158 -0.632 7.583 -14.430 1.00 0.00 H new ATOM 0 HB1 ALA A 158 -1.807 6.697 -12.449 1.00 0.00 H new ATOM 0 HB2 ALA A 158 -2.944 7.261 -13.696 1.00 0.00 H new ATOM 0 HB3 ALA A 158 -2.648 5.519 -13.483 1.00 0.00 H new ATOM 2350 N ARG A 159 -0.162 4.316 -14.421 1.00 0.00 N ATOM 2351 CA ARG A 159 0.817 3.260 -14.140 1.00 0.00 C ATOM 2352 C ARG A 159 2.186 3.621 -14.695 1.00 0.00 C ATOM 2353 O ARG A 159 3.106 3.941 -13.945 1.00 0.00 O ATOM 2354 CB ARG A 159 0.362 1.930 -14.747 1.00 0.00 C ATOM 2355 CG ARG A 159 1.339 0.783 -14.529 1.00 0.00 C ATOM 2356 CD ARG A 159 1.895 0.248 -15.842 1.00 0.00 C ATOM 2357 NE ARG A 159 1.731 -1.198 -15.971 1.00 0.00 N ATOM 2358 CZ ARG A 159 2.727 -2.084 -15.884 1.00 0.00 C ATOM 2359 NH1 ARG A 159 3.974 -1.682 -15.661 1.00 0.00 N ATOM 2360 NH2 ARG A 159 2.473 -3.381 -16.018 1.00 0.00 N ATOM 0 H ARG A 159 -1.008 3.987 -14.886 1.00 0.00 H new ATOM 0 HA ARG A 159 0.890 3.159 -13.057 1.00 0.00 H new ATOM 0 HB2 ARG A 159 -0.603 1.658 -14.319 1.00 0.00 H new ATOM 0 HB3 ARG A 159 0.209 2.065 -15.818 1.00 0.00 H new ATOM 0 HG2 ARG A 159 2.161 1.122 -13.899 1.00 0.00 H new ATOM 0 HG3 ARG A 159 0.838 -0.023 -13.993 1.00 0.00 H new ATOM 0 HD2 ARG A 159 1.394 0.743 -16.674 1.00 0.00 H new ATOM 0 HD3 ARG A 159 2.953 0.498 -15.913 1.00 0.00 H new ATOM 0 HE ARG A 159 0.791 -1.556 -16.139 1.00 0.00 H new ATOM 0 HH11 ARG A 159 4.178 -0.688 -15.554 1.00 0.00 H new ATOM 0 HH12 ARG A 159 4.727 -2.367 -15.596 1.00 0.00 H new ATOM 0 HH21 ARG A 159 1.519 -3.699 -16.187 1.00 0.00 H new ATOM 0 HH22 ARG A 159 3.232 -4.059 -15.952 1.00 0.00 H new ATOM 2374 N ARG A 160 2.311 3.542 -16.019 1.00 0.00 N ATOM 2375 CA ARG A 160 3.565 3.837 -16.706 1.00 0.00 C ATOM 2376 C ARG A 160 4.264 5.033 -16.076 1.00 0.00 C ATOM 2377 O ARG A 160 5.492 5.101 -16.028 1.00 0.00 O ATOM 2378 CB ARG A 160 3.290 4.102 -18.185 1.00 0.00 C ATOM 2379 CG ARG A 160 2.386 5.298 -18.428 1.00 0.00 C ATOM 2380 CD ARG A 160 2.940 6.211 -19.507 1.00 0.00 C ATOM 2381 NE ARG A 160 3.459 5.457 -20.645 1.00 0.00 N ATOM 2382 CZ ARG A 160 2.689 4.896 -21.572 1.00 0.00 C ATOM 2383 NH1 ARG A 160 1.368 5.016 -21.508 1.00 0.00 N ATOM 2384 NH2 ARG A 160 3.240 4.213 -22.566 1.00 0.00 N ATOM 0 H ARG A 160 1.549 3.273 -16.642 1.00 0.00 H new ATOM 0 HA ARG A 160 4.225 2.975 -16.611 1.00 0.00 H new ATOM 0 HB2 ARG A 160 4.237 4.262 -18.700 1.00 0.00 H new ATOM 0 HB3 ARG A 160 2.833 3.216 -18.626 1.00 0.00 H new ATOM 0 HG2 ARG A 160 1.394 4.951 -18.719 1.00 0.00 H new ATOM 0 HG3 ARG A 160 2.269 5.860 -17.501 1.00 0.00 H new ATOM 0 HD2 ARG A 160 2.156 6.888 -19.847 1.00 0.00 H new ATOM 0 HD3 ARG A 160 3.735 6.828 -19.088 1.00 0.00 H new ATOM 0 HE ARG A 160 4.470 5.355 -20.734 1.00 0.00 H new ATOM 0 HH11 ARG A 160 0.940 5.541 -20.745 1.00 0.00 H new ATOM 0 HH12 ARG A 160 0.781 4.584 -22.222 1.00 0.00 H new ATOM 0 HH21 ARG A 160 4.254 4.118 -22.619 1.00 0.00 H new ATOM 0 HH22 ARG A 160 2.650 3.782 -23.278 1.00 0.00 H new ATOM 2398 N LEU A 161 3.470 5.965 -15.581 1.00 0.00 N ATOM 2399 CA LEU A 161 4.002 7.156 -14.939 1.00 0.00 C ATOM 2400 C LEU A 161 4.507 6.831 -13.539 1.00 0.00 C ATOM 2401 O LEU A 161 5.610 7.223 -13.158 1.00 0.00 O ATOM 2402 CB LEU A 161 2.929 8.241 -14.873 1.00 0.00 C ATOM 2403 CG LEU A 161 3.417 9.644 -15.225 1.00 0.00 C ATOM 2404 CD1 LEU A 161 2.312 10.443 -15.899 1.00 0.00 C ATOM 2405 CD2 LEU A 161 3.916 10.355 -13.978 1.00 0.00 C ATOM 0 H LEU A 161 2.451 5.921 -15.611 1.00 0.00 H new ATOM 0 HA LEU A 161 4.840 7.523 -15.531 1.00 0.00 H new ATOM 0 HB2 LEU A 161 2.118 7.973 -15.550 1.00 0.00 H new ATOM 0 HB3 LEU A 161 2.511 8.258 -13.867 1.00 0.00 H new ATOM 0 HG LEU A 161 4.246 9.558 -15.927 1.00 0.00 H new ATOM 0 HD11 LEU A 161 2.680 11.440 -16.142 1.00 0.00 H new ATOM 0 HD12 LEU A 161 2.004 9.937 -16.814 1.00 0.00 H new ATOM 0 HD13 LEU A 161 1.459 10.525 -15.225 1.00 0.00 H new ATOM 0 HD21 LEU A 161 4.261 11.354 -14.243 1.00 0.00 H new ATOM 0 HD22 LEU A 161 3.105 10.431 -13.254 1.00 0.00 H new ATOM 0 HD23 LEU A 161 4.740 9.790 -13.542 1.00 0.00 H new ATOM 2417 N ARG A 162 3.695 6.108 -12.779 1.00 0.00 N ATOM 2418 CA ARG A 162 4.064 5.725 -11.423 1.00 0.00 C ATOM 2419 C ARG A 162 5.331 4.865 -11.441 1.00 0.00 C ATOM 2420 O ARG A 162 6.380 5.280 -10.945 1.00 0.00 O ATOM 2421 CB ARG A 162 2.899 4.980 -10.749 1.00 0.00 C ATOM 2422 CG ARG A 162 3.328 3.884 -9.783 1.00 0.00 C ATOM 2423 CD ARG A 162 2.580 3.958 -8.463 1.00 0.00 C ATOM 2424 NE ARG A 162 2.371 2.633 -7.879 1.00 0.00 N ATOM 2425 CZ ARG A 162 3.358 1.789 -7.584 1.00 0.00 C ATOM 2426 NH1 ARG A 162 4.622 2.148 -7.760 1.00 0.00 N ATOM 2427 NH2 ARG A 162 3.077 0.583 -7.110 1.00 0.00 N ATOM 0 H ARG A 162 2.778 5.776 -13.078 1.00 0.00 H new ATOM 0 HA ARG A 162 4.274 6.624 -10.844 1.00 0.00 H new ATOM 0 HB2 ARG A 162 2.285 5.702 -10.211 1.00 0.00 H new ATOM 0 HB3 ARG A 162 2.269 4.540 -11.522 1.00 0.00 H new ATOM 0 HG2 ARG A 162 3.157 2.910 -10.242 1.00 0.00 H new ATOM 0 HG3 ARG A 162 4.399 3.965 -9.597 1.00 0.00 H new ATOM 0 HD2 ARG A 162 3.139 4.579 -7.763 1.00 0.00 H new ATOM 0 HD3 ARG A 162 1.616 4.442 -8.619 1.00 0.00 H new ATOM 0 HE ARG A 162 1.414 2.338 -7.687 1.00 0.00 H new ATOM 0 HH11 ARG A 162 4.843 3.075 -8.123 1.00 0.00 H new ATOM 0 HH12 ARG A 162 5.374 1.497 -7.532 1.00 0.00 H new ATOM 0 HH21 ARG A 162 2.106 0.303 -6.972 1.00 0.00 H new ATOM 0 HH22 ARG A 162 3.832 -0.065 -6.884 1.00 0.00 H new ATOM 2441 N GLU A 163 5.224 3.669 -12.021 1.00 0.00 N ATOM 2442 CA GLU A 163 6.359 2.754 -12.114 1.00 0.00 C ATOM 2443 C GLU A 163 7.451 3.324 -13.001 1.00 0.00 C ATOM 2444 O GLU A 163 8.600 2.902 -12.927 1.00 0.00 O ATOM 2445 CB GLU A 163 5.914 1.411 -12.674 1.00 0.00 C ATOM 2446 CG GLU A 163 6.482 0.213 -11.920 1.00 0.00 C ATOM 2447 CD GLU A 163 7.112 -0.803 -12.852 1.00 0.00 C ATOM 2448 OE1 GLU A 163 8.197 -0.512 -13.398 1.00 0.00 O ATOM 2449 OE2 GLU A 163 6.518 -1.886 -13.045 1.00 0.00 O ATOM 0 H GLU A 163 4.362 3.312 -12.433 1.00 0.00 H new ATOM 0 HA GLU A 163 6.755 2.619 -11.108 1.00 0.00 H new ATOM 0 HB2 GLU A 163 4.825 1.361 -12.651 1.00 0.00 H new ATOM 0 HB3 GLU A 163 6.214 1.346 -13.720 1.00 0.00 H new ATOM 0 HG2 GLU A 163 7.227 0.557 -11.203 1.00 0.00 H new ATOM 0 HG3 GLU A 163 5.686 -0.265 -11.348 1.00 0.00 H new ATOM 2456 N GLY A 164 7.092 4.281 -13.841 1.00 0.00 N ATOM 2457 CA GLY A 164 8.074 4.875 -14.720 1.00 0.00 C ATOM 2458 C GLY A 164 9.127 5.646 -13.952 1.00 0.00 C ATOM 2459 O GLY A 164 10.315 5.329 -14.023 1.00 0.00 O ATOM 0 H GLY A 164 6.147 4.654 -13.930 1.00 0.00 H new ATOM 0 HA2 GLY A 164 8.554 4.093 -15.309 1.00 0.00 H new ATOM 0 HA3 GLY A 164 7.575 5.543 -15.423 1.00 0.00 H new ATOM 2463 N ASN A 165 8.688 6.658 -13.213 1.00 0.00 N ATOM 2464 CA ASN A 165 9.600 7.479 -12.425 1.00 0.00 C ATOM 2465 C ASN A 165 10.139 6.711 -11.219 1.00 0.00 C ATOM 2466 O ASN A 165 11.337 6.748 -10.936 1.00 0.00 O ATOM 2467 CB ASN A 165 8.905 8.760 -11.951 1.00 0.00 C ATOM 2468 CG ASN A 165 7.866 9.270 -12.934 1.00 0.00 C ATOM 2469 OD1 ASN A 165 6.894 10.017 -12.428 1.00 0.00 O flip ATOM 2470 ND2 ASN A 165 7.936 8.994 -14.131 1.00 0.00 N flip ATOM 0 H ASN A 165 7.707 6.930 -13.143 1.00 0.00 H new ATOM 0 HA ASN A 165 10.438 7.744 -13.069 1.00 0.00 H new ATOM 0 HB2 ASN A 165 8.427 8.573 -10.990 1.00 0.00 H new ATOM 0 HB3 ASN A 165 9.654 9.535 -11.789 1.00 0.00 H new ATOM 0 HD21 ASN A 165 8.702 8.416 -14.477 1.00 0.00 H new ATOM 0 HD22 ASN A 165 7.228 9.344 -14.777 1.00 0.00 H new ATOM 2477 N TRP A 166 9.254 6.020 -10.504 1.00 0.00 N ATOM 2478 CA TRP A 166 9.664 5.256 -9.334 1.00 0.00 C ATOM 2479 C TRP A 166 10.680 4.185 -9.712 1.00 0.00 C ATOM 2480 O TRP A 166 11.828 4.223 -9.268 1.00 0.00 O ATOM 2481 CB TRP A 166 8.450 4.616 -8.660 1.00 0.00 C ATOM 2482 CG TRP A 166 7.769 5.529 -7.688 1.00 0.00 C ATOM 2483 CD1 TRP A 166 7.539 6.866 -7.838 1.00 0.00 C ATOM 2484 CD2 TRP A 166 7.237 5.171 -6.410 1.00 0.00 C ATOM 2485 NE1 TRP A 166 6.897 7.362 -6.730 1.00 0.00 N ATOM 2486 CE2 TRP A 166 6.700 6.340 -5.840 1.00 0.00 C ATOM 2487 CE3 TRP A 166 7.162 3.974 -5.693 1.00 0.00 C ATOM 2488 CZ2 TRP A 166 6.097 6.346 -4.585 1.00 0.00 C ATOM 2489 CZ3 TRP A 166 6.564 3.981 -4.448 1.00 0.00 C ATOM 2490 CH2 TRP A 166 6.037 5.159 -3.905 1.00 0.00 C ATOM 0 H TRP A 166 8.257 5.975 -10.714 1.00 0.00 H new ATOM 0 HA TRP A 166 10.135 5.943 -8.631 1.00 0.00 H new ATOM 0 HB2 TRP A 166 7.736 4.311 -9.425 1.00 0.00 H new ATOM 0 HB3 TRP A 166 8.765 3.711 -8.140 1.00 0.00 H new ATOM 0 HD1 TRP A 166 7.821 7.449 -8.702 1.00 0.00 H new ATOM 0 HE1 TRP A 166 6.613 8.332 -6.593 1.00 0.00 H new ATOM 0 HE3 TRP A 166 7.564 3.060 -6.105 1.00 0.00 H new ATOM 0 HZ2 TRP A 166 5.691 7.254 -4.163 1.00 0.00 H new ATOM 0 HZ3 TRP A 166 6.502 3.062 -3.884 1.00 0.00 H new ATOM 0 HH2 TRP A 166 5.574 5.131 -2.930 1.00 0.00 H new ATOM 2501 N ALA A 167 10.255 3.231 -10.538 1.00 0.00 N ATOM 2502 CA ALA A 167 11.138 2.155 -10.974 1.00 0.00 C ATOM 2503 C ALA A 167 12.282 2.687 -11.830 1.00 0.00 C ATOM 2504 O ALA A 167 13.274 1.990 -12.049 1.00 0.00 O ATOM 2505 CB ALA A 167 10.358 1.088 -11.729 1.00 0.00 C ATOM 0 H ALA A 167 9.309 3.182 -10.916 1.00 0.00 H new ATOM 0 HA ALA A 167 11.570 1.702 -10.082 1.00 0.00 H new ATOM 0 HB1 ALA A 167 11.037 0.296 -12.044 1.00 0.00 H new ATOM 0 HB2 ALA A 167 9.590 0.670 -11.078 1.00 0.00 H new ATOM 0 HB3 ALA A 167 9.888 1.533 -12.606 1.00 0.00 H new ATOM 2511 N SER A 168 12.152 3.927 -12.312 1.00 0.00 N ATOM 2512 CA SER A 168 13.190 4.543 -13.137 1.00 0.00 C ATOM 2513 C SER A 168 14.577 4.313 -12.539 1.00 0.00 C ATOM 2514 O SER A 168 15.574 4.274 -13.259 1.00 0.00 O ATOM 2515 CB SER A 168 12.933 6.044 -13.287 1.00 0.00 C ATOM 2516 OG SER A 168 13.077 6.453 -14.634 1.00 0.00 O ATOM 0 H SER A 168 11.340 4.521 -12.144 1.00 0.00 H new ATOM 0 HA SER A 168 13.156 4.074 -14.120 1.00 0.00 H new ATOM 0 HB2 SER A 168 11.928 6.281 -12.937 1.00 0.00 H new ATOM 0 HB3 SER A 168 13.629 6.600 -12.658 1.00 0.00 H new ATOM 0 HG SER A 168 12.906 7.415 -14.704 1.00 0.00 H new ATOM 2522 N VAL A 169 14.631 4.161 -11.218 1.00 0.00 N ATOM 2523 CA VAL A 169 15.891 3.934 -10.526 1.00 0.00 C ATOM 2524 C VAL A 169 16.348 2.487 -10.686 1.00 0.00 C ATOM 2525 O VAL A 169 16.363 1.720 -9.723 1.00 0.00 O ATOM 2526 CB VAL A 169 15.778 4.262 -9.025 1.00 0.00 C ATOM 2527 CG1 VAL A 169 17.151 4.249 -8.368 1.00 0.00 C ATOM 2528 CG2 VAL A 169 15.093 5.605 -8.814 1.00 0.00 C ATOM 0 H VAL A 169 13.814 4.191 -10.607 1.00 0.00 H new ATOM 0 HA VAL A 169 16.626 4.600 -10.979 1.00 0.00 H new ATOM 0 HB VAL A 169 15.166 3.492 -8.554 1.00 0.00 H new ATOM 0 HG11 VAL A 169 17.049 4.483 -7.308 1.00 0.00 H new ATOM 0 HG12 VAL A 169 17.599 3.262 -8.480 1.00 0.00 H new ATOM 0 HG13 VAL A 169 17.789 4.993 -8.844 1.00 0.00 H new ATOM 0 HG21 VAL A 169 15.025 5.815 -7.747 1.00 0.00 H new ATOM 0 HG22 VAL A 169 15.672 6.389 -9.302 1.00 0.00 H new ATOM 0 HG23 VAL A 169 14.091 5.574 -9.242 1.00 0.00 H new