USER MOD reduce.3.24.130724 H: found=0, std=0, add=790, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 788 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 190 THR OG1 : rot 30:sc= 0.75 USER MOD Set 1.2: A 191 THR OG1 : rot 152:sc= 1.86 USER MOD Set 2.1: A 173 ASN : amide:sc= 0.684 K(o=0.86,f=-0.34) USER MOD Set 2.2: A 177 HIS : no HE2:sc= 0.179 K(o=0.86,f=-0.34) USER MOD Set 3.1: A 171 ASN : amide:sc=-0.00425 K(o=-0.0045,f=-1.2!) USER MOD Set 3.2: A 174 ASN :FLIP amide:sc=-0.000244 F(o=-2.6,f=-0.0045) USER MOD Set 4.1: A 134 MET CE :methyl 163:sc= -0.0181 (180deg=0) USER MOD Set 4.2: A 163 TYR OH : rot 180:sc= 0.385 USER MOD Set 4.3: A 217 GLN : amide:sc= -0.2 X(o=0.17,f=-0.15) USER MOD Set 5.1: A 162 TYR OH : rot 180:sc= 0.147 USER MOD Set 5.2: A 186 GLN : amide:sc= 0.494 K(o=0.64,f=-0.35) USER MOD Set 6.1: A 149 TYR OH : rot 159:sc= 0.00832 USER MOD Set 6.2: A 157 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 MET CE :methyl 160:sc= -2.21 (180deg=-4.48!) USER MOD Single : A 132 SER OG : rot -74:sc= 1.15 USER MOD Single : A 135 SER OG : rot 180:sc= 0.00329 USER MOD Single : A 138 MET CE :methyl 174:sc= -0.124 (180deg=-0.162) USER MOD Single : A 140 HIS : no HD1:sc= -0.0512 X(o=-0.051,f=0) USER MOD Single : A 143 ASN : amide:sc= -0.47 K(o=-0.47,f=-1) USER MOD Single : A 150 TYR OH : rot -165:sc= 0.948 USER MOD Single : A 153 ASN : amide:sc= 0.0823 K(o=0.082,f=-1.4) USER MOD Single : A 154 MET CE :methyl 158:sc= -1.64 (180deg=-2.75!) USER MOD Single : A 155 TYR OH : rot 180:sc= -0.0792 USER MOD Single : A 159 ASN :FLIP amide:sc= 0.16 F(o=-0.67!,f=0.16) USER MOD Single : A 160 GLN : amide:sc= 0.412 K(o=0.41,f=-0.17) USER MOD Single : A 168 GLN : amide:sc= 0.061 K(o=0.061,f=-6.8!) USER MOD Single : A 169 TYR OH : rot 75:sc= 0.752 USER MOD Single : A 170 SER OG : rot -14:sc= 0.865 USER MOD Single : A 172 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 181 ASN : amide:sc= -0.186 X(o=-0.19,f=-0.028) USER MOD Single : A 183 THR OG1 : rot 94:sc= 1.78 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 187 HIS : no HD1:sc= -0.77 K(o=-0.77,f=-2) USER MOD Single : A 188 THR OG1 : rot 180:sc= 0 USER MOD Single : A 192 THR OG1 : rot 73:sc= 1.27 USER MOD Single : A 193 THR OG1 : rot 106:sc= 1.31 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN :FLIP amide:sc= -0.0336 F(o=-0.57,f=-0.034) USER MOD Single : A 199 THR OG1 : rot 54:sc= 1.29 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 150:sc= 1.25 (180deg=-0.434) USER MOD Single : A 205 MET CE :methyl -159:sc= -0.24 (180deg=-1.76) USER MOD Single : A 206 MET CE :methyl -174:sc= -0.291 (180deg=-0.462) USER MOD Single : A 212 GLN : amide:sc= -1.15 K(o=-1.1,f=-2.1!) USER MOD Single : A 213 MET CE :methyl 179:sc= -2.77! (180deg=-2.93!) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 218 TYR OH : rot 4:sc= 0.495 USER MOD Single : A 219 GLN : amide:sc= 0.535 K(o=0.54,f=0) USER MOD Single : A 220 LYS NZ :NH3+ -170:sc= -0.0347 (180deg=-0.187) USER MOD Single : A 222 SER OG : rot 157:sc= 1.16 USER MOD Single : A 223 GLN :FLIP amide:sc= -0.118 F(o=-1,f=-0.12) USER MOD Single : A 225 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 125 -8.282 13.614 -1.243 1.00 0.00 N ATOM 66 CA LEU A 125 -7.738 12.672 -2.231 1.00 0.00 C ATOM 67 C LEU A 125 -8.623 12.291 -3.386 1.00 0.00 C ATOM 68 O LEU A 125 -8.123 11.719 -4.348 1.00 0.00 O ATOM 69 CB LEU A 125 -7.291 11.380 -1.528 1.00 0.00 C ATOM 70 CG LEU A 125 -5.986 11.478 -0.734 1.00 0.00 C ATOM 71 CD1 LEU A 125 -5.444 10.068 -0.572 1.00 0.00 C ATOM 72 CD2 LEU A 125 -4.894 12.317 -1.403 1.00 0.00 C ATOM 0 HA LEU A 125 -6.915 13.230 -2.677 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -8.084 11.062 -0.851 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -7.181 10.598 -2.279 1.00 0.00 H new ATOM 0 HG LEU A 125 -6.227 11.971 0.208 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -4.511 10.099 -0.009 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -6.171 9.458 -0.036 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -5.260 9.634 -1.555 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -4.007 12.331 -0.770 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -4.643 11.882 -2.371 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -5.254 13.336 -1.545 1.00 0.00 H new ATOM 84 N GLY A 126 -9.871 12.696 -3.378 1.00 0.00 N ATOM 85 CA GLY A 126 -10.816 12.291 -4.401 1.00 0.00 C ATOM 86 C GLY A 126 -11.794 11.209 -3.942 1.00 0.00 C ATOM 87 O GLY A 126 -12.454 10.593 -4.778 1.00 0.00 O ATOM 0 H GLY A 126 -10.262 13.313 -2.667 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -11.381 13.164 -4.727 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -10.265 11.926 -5.268 1.00 0.00 H new ATOM 91 N GLY A 127 -11.864 10.911 -2.639 1.00 0.00 N ATOM 92 CA GLY A 127 -12.753 9.869 -2.125 1.00 0.00 C ATOM 93 C GLY A 127 -12.115 8.481 -2.050 1.00 0.00 C ATOM 94 O GLY A 127 -12.826 7.489 -1.907 1.00 0.00 O ATOM 0 H GLY A 127 -11.312 11.380 -1.921 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -13.092 10.155 -1.129 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -13.637 9.816 -2.760 1.00 0.00 H new ATOM 98 N TYR A 128 -10.781 8.407 -2.094 1.00 0.00 N ATOM 99 CA TYR A 128 -9.999 7.257 -1.631 1.00 0.00 C ATOM 100 C TYR A 128 -10.279 7.035 -0.122 1.00 0.00 C ATOM 101 O TYR A 128 -11.045 7.785 0.486 1.00 0.00 O ATOM 102 CB TYR A 128 -8.500 7.545 -1.857 1.00 0.00 C ATOM 103 CG TYR A 128 -8.130 7.637 -3.323 1.00 0.00 C ATOM 104 CD1 TYR A 128 -8.450 8.787 -4.068 1.00 0.00 C ATOM 105 CD2 TYR A 128 -7.540 6.540 -3.974 1.00 0.00 C ATOM 106 CE1 TYR A 128 -8.173 8.850 -5.442 1.00 0.00 C ATOM 107 CE2 TYR A 128 -7.328 6.576 -5.360 1.00 0.00 C ATOM 108 CZ TYR A 128 -7.647 7.727 -6.109 1.00 0.00 C ATOM 109 OH TYR A 128 -7.480 7.752 -7.456 1.00 0.00 O ATOM 0 H TYR A 128 -10.202 9.162 -2.461 1.00 0.00 H new ATOM 0 HA TYR A 128 -10.278 6.360 -2.184 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -8.237 8.480 -1.362 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -7.910 6.758 -1.388 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -8.914 9.630 -3.577 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -7.250 5.668 -3.406 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -8.364 9.761 -5.989 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -6.916 5.712 -5.859 1.00 0.00 H new ATOM 0 HH TYR A 128 -7.106 6.897 -7.755 1.00 0.00 H new ATOM 119 N MET A 129 -9.587 6.086 0.507 1.00 0.00 N ATOM 120 CA MET A 129 -9.436 5.833 1.943 1.00 0.00 C ATOM 121 C MET A 129 -7.959 5.855 2.295 1.00 0.00 C ATOM 122 O MET A 129 -7.122 5.782 1.396 1.00 0.00 O ATOM 123 CB MET A 129 -10.069 4.499 2.316 1.00 0.00 C ATOM 124 CG MET A 129 -11.592 4.652 2.347 1.00 0.00 C ATOM 125 SD MET A 129 -12.444 3.089 2.140 1.00 0.00 S ATOM 126 CE MET A 129 -12.154 2.919 0.367 1.00 0.00 C ATOM 0 H MET A 129 -9.061 5.400 -0.034 1.00 0.00 H new ATOM 0 HA MET A 129 -9.948 6.610 2.510 1.00 0.00 H new ATOM 0 HB2 MET A 129 -9.784 3.734 1.594 1.00 0.00 H new ATOM 0 HB3 MET A 129 -9.705 4.170 3.290 1.00 0.00 H new ATOM 0 HG2 MET A 129 -11.889 5.101 3.294 1.00 0.00 H new ATOM 0 HG3 MET A 129 -11.901 5.338 1.558 1.00 0.00 H new ATOM 0 HE1 MET A 129 -12.277 1.876 0.077 1.00 0.00 H new ATOM 0 HE2 MET A 129 -12.869 3.534 -0.179 1.00 0.00 H new ATOM 0 HE3 MET A 129 -11.141 3.244 0.131 1.00 0.00 H new ATOM 136 N LEU A 130 -7.634 5.977 3.587 1.00 0.00 N ATOM 137 CA LEU A 130 -6.315 5.684 4.124 1.00 0.00 C ATOM 138 C LEU A 130 -6.516 4.522 5.079 1.00 0.00 C ATOM 139 O LEU A 130 -7.099 4.690 6.152 1.00 0.00 O ATOM 140 CB LEU A 130 -5.641 6.893 4.809 1.00 0.00 C ATOM 141 CG LEU A 130 -4.340 6.453 5.529 1.00 0.00 C ATOM 142 CD1 LEU A 130 -3.361 5.718 4.603 1.00 0.00 C ATOM 143 CD2 LEU A 130 -3.594 7.624 6.159 1.00 0.00 C ATOM 0 H LEU A 130 -8.298 6.288 4.296 1.00 0.00 H new ATOM 0 HA LEU A 130 -5.624 5.434 3.319 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -5.412 7.658 4.067 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -6.328 7.341 5.527 1.00 0.00 H new ATOM 0 HG LEU A 130 -4.683 5.771 6.307 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -2.471 5.436 5.165 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -3.839 4.822 4.206 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -3.078 6.373 3.779 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -2.692 7.259 6.649 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -3.322 8.341 5.384 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -4.235 8.110 6.894 1.00 0.00 H new ATOM 155 N GLY A 131 -6.038 3.353 4.669 1.00 0.00 N ATOM 156 CA GLY A 131 -6.054 2.135 5.447 1.00 0.00 C ATOM 157 C GLY A 131 -5.303 2.296 6.762 1.00 0.00 C ATOM 158 O GLY A 131 -4.582 3.273 6.976 1.00 0.00 O ATOM 0 H GLY A 131 -5.614 3.230 3.749 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -7.085 1.847 5.650 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -5.605 1.328 4.868 1.00 0.00 H new ATOM 162 N SER A 132 -5.431 1.320 7.651 1.00 0.00 N ATOM 163 CA SER A 132 -4.667 1.345 8.893 1.00 0.00 C ATOM 164 C SER A 132 -3.194 1.058 8.650 1.00 0.00 C ATOM 165 O SER A 132 -2.799 0.516 7.619 1.00 0.00 O ATOM 166 CB SER A 132 -5.296 0.378 9.912 1.00 0.00 C ATOM 167 OG SER A 132 -4.655 0.366 11.183 1.00 0.00 O ATOM 0 H SER A 132 -6.045 0.513 7.540 1.00 0.00 H new ATOM 0 HA SER A 132 -4.711 2.350 9.314 1.00 0.00 H new ATOM 0 HB2 SER A 132 -6.344 0.645 10.049 1.00 0.00 H new ATOM 0 HB3 SER A 132 -5.276 -0.630 9.499 1.00 0.00 H new ATOM 0 HG SER A 132 -3.800 -0.108 11.114 1.00 0.00 H new ATOM 173 N ALA A 133 -2.386 1.416 9.651 1.00 0.00 N ATOM 174 CA ALA A 133 -1.066 0.847 9.832 1.00 0.00 C ATOM 175 C ALA A 133 -1.277 -0.630 10.168 1.00 0.00 C ATOM 176 O ALA A 133 -2.259 -1.003 10.819 1.00 0.00 O ATOM 177 CB ALA A 133 -0.328 1.596 10.938 1.00 0.00 C ATOM 0 H ALA A 133 -2.637 2.110 10.355 1.00 0.00 H new ATOM 0 HA ALA A 133 -0.449 0.937 8.938 1.00 0.00 H new ATOM 0 HB1 ALA A 133 0.664 1.164 11.070 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -0.233 2.647 10.665 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -0.887 1.512 11.870 1.00 0.00 H new ATOM 183 N MET A 134 -0.334 -1.446 9.728 1.00 0.00 N ATOM 184 CA MET A 134 -0.221 -2.879 9.964 1.00 0.00 C ATOM 185 C MET A 134 1.262 -3.132 10.248 1.00 0.00 C ATOM 186 O MET A 134 2.088 -2.267 9.945 1.00 0.00 O ATOM 187 CB MET A 134 -0.694 -3.704 8.744 1.00 0.00 C ATOM 188 CG MET A 134 -1.218 -2.956 7.510 1.00 0.00 C ATOM 189 SD MET A 134 -3.026 -2.837 7.432 1.00 0.00 S ATOM 190 CE MET A 134 -3.302 -3.240 5.682 1.00 0.00 C ATOM 0 H MET A 134 0.433 -1.099 9.152 1.00 0.00 H new ATOM 0 HA MET A 134 -0.856 -3.188 10.794 1.00 0.00 H new ATOM 0 HB2 MET A 134 0.140 -4.328 8.423 1.00 0.00 H new ATOM 0 HB3 MET A 134 -1.483 -4.375 9.084 1.00 0.00 H new ATOM 0 HG2 MET A 134 -0.797 -1.950 7.502 1.00 0.00 H new ATOM 0 HG3 MET A 134 -0.858 -3.460 6.613 1.00 0.00 H new ATOM 0 HE1 MET A 134 -4.348 -3.507 5.531 1.00 0.00 H new ATOM 0 HE2 MET A 134 -3.055 -2.375 5.066 1.00 0.00 H new ATOM 0 HE3 MET A 134 -2.668 -4.080 5.398 1.00 0.00 H new ATOM 200 N SER A 135 1.654 -4.307 10.729 1.00 0.00 N ATOM 201 CA SER A 135 3.044 -4.753 10.607 1.00 0.00 C ATOM 202 C SER A 135 3.434 -4.763 9.121 1.00 0.00 C ATOM 203 O SER A 135 2.584 -4.974 8.254 1.00 0.00 O ATOM 204 CB SER A 135 3.178 -6.132 11.271 1.00 0.00 C ATOM 205 OG SER A 135 2.127 -7.007 10.884 1.00 0.00 O ATOM 0 H SER A 135 1.037 -4.966 11.204 1.00 0.00 H new ATOM 0 HA SER A 135 3.730 -4.076 11.117 1.00 0.00 H new ATOM 0 HB2 SER A 135 4.137 -6.574 11.001 1.00 0.00 H new ATOM 0 HB3 SER A 135 3.174 -6.016 12.355 1.00 0.00 H new ATOM 0 HG SER A 135 2.245 -7.875 11.324 1.00 0.00 H new ATOM 211 N ARG A 136 4.698 -4.492 8.773 1.00 0.00 N ATOM 212 CA ARG A 136 5.149 -4.812 7.415 1.00 0.00 C ATOM 213 C ARG A 136 5.094 -6.347 7.247 1.00 0.00 C ATOM 214 O ARG A 136 5.343 -7.068 8.221 1.00 0.00 O ATOM 215 CB ARG A 136 6.534 -4.287 7.080 1.00 0.00 C ATOM 216 CG ARG A 136 6.927 -2.920 7.579 1.00 0.00 C ATOM 217 CD ARG A 136 6.337 -1.695 6.935 1.00 0.00 C ATOM 218 NE ARG A 136 4.958 -1.539 7.373 1.00 0.00 N ATOM 219 CZ ARG A 136 3.900 -1.901 6.651 1.00 0.00 C ATOM 220 NH1 ARG A 136 3.997 -2.001 5.334 1.00 0.00 N ATOM 221 NH2 ARG A 136 2.753 -2.163 7.254 1.00 0.00 N ATOM 0 H ARG A 136 5.399 -4.071 9.383 1.00 0.00 H new ATOM 0 HA ARG A 136 4.482 -4.308 6.715 1.00 0.00 H new ATOM 0 HB2 ARG A 136 7.261 -5.002 7.465 1.00 0.00 H new ATOM 0 HB3 ARG A 136 6.634 -4.285 5.995 1.00 0.00 H new ATOM 0 HG2 ARG A 136 6.685 -2.879 8.641 1.00 0.00 H new ATOM 0 HG3 ARG A 136 8.011 -2.842 7.496 1.00 0.00 H new ATOM 0 HD2 ARG A 136 6.918 -0.813 7.204 1.00 0.00 H new ATOM 0 HD3 ARG A 136 6.378 -1.785 5.850 1.00 0.00 H new ATOM 0 HE ARG A 136 4.792 -1.126 8.291 1.00 0.00 H new ATOM 0 HH11 ARG A 136 4.884 -1.800 4.871 1.00 0.00 H new ATOM 0 HH12 ARG A 136 3.185 -2.279 4.782 1.00 0.00 H new ATOM 0 HH21 ARG A 136 2.681 -2.087 8.269 1.00 0.00 H new ATOM 0 HH22 ARG A 136 1.940 -2.441 6.705 1.00 0.00 H new ATOM 235 N PRO A 137 4.799 -6.859 6.046 1.00 0.00 N ATOM 236 CA PRO A 137 4.840 -8.286 5.733 1.00 0.00 C ATOM 237 C PRO A 137 6.279 -8.762 5.501 1.00 0.00 C ATOM 238 O PRO A 137 7.223 -7.963 5.491 1.00 0.00 O ATOM 239 CB PRO A 137 3.955 -8.428 4.486 1.00 0.00 C ATOM 240 CG PRO A 137 4.007 -7.061 3.807 1.00 0.00 C ATOM 241 CD PRO A 137 4.368 -6.075 4.908 1.00 0.00 C ATOM 0 HA PRO A 137 4.476 -8.911 6.549 1.00 0.00 H new ATOM 0 HB2 PRO A 137 4.327 -9.211 3.825 1.00 0.00 H new ATOM 0 HB3 PRO A 137 2.933 -8.696 4.755 1.00 0.00 H new ATOM 0 HG2 PRO A 137 4.749 -7.047 3.009 1.00 0.00 H new ATOM 0 HG3 PRO A 137 3.047 -6.810 3.355 1.00 0.00 H new ATOM 0 HD2 PRO A 137 5.160 -5.402 4.580 1.00 0.00 H new ATOM 0 HD3 PRO A 137 3.510 -5.455 5.168 1.00 0.00 H new ATOM 249 N MET A 138 6.461 -10.059 5.247 1.00 0.00 N ATOM 250 CA MET A 138 7.613 -10.556 4.500 1.00 0.00 C ATOM 251 C MET A 138 7.182 -10.660 3.040 1.00 0.00 C ATOM 252 O MET A 138 6.034 -11.013 2.763 1.00 0.00 O ATOM 253 CB MET A 138 8.053 -11.928 5.023 1.00 0.00 C ATOM 254 CG MET A 138 8.689 -11.847 6.416 1.00 0.00 C ATOM 255 SD MET A 138 10.506 -11.914 6.497 1.00 0.00 S ATOM 256 CE MET A 138 11.004 -10.385 5.660 1.00 0.00 C ATOM 0 H MET A 138 5.817 -10.789 5.552 1.00 0.00 H new ATOM 0 HA MET A 138 8.462 -9.882 4.613 1.00 0.00 H new ATOM 0 HB2 MET A 138 7.191 -12.594 5.059 1.00 0.00 H new ATOM 0 HB3 MET A 138 8.766 -12.368 4.326 1.00 0.00 H new ATOM 0 HG2 MET A 138 8.363 -10.918 6.884 1.00 0.00 H new ATOM 0 HG3 MET A 138 8.292 -12.664 7.018 1.00 0.00 H new ATOM 0 HE1 MET A 138 12.084 -10.261 5.740 1.00 0.00 H new ATOM 0 HE2 MET A 138 10.722 -10.437 4.608 1.00 0.00 H new ATOM 0 HE3 MET A 138 10.506 -9.536 6.127 1.00 0.00 H new ATOM 266 N ILE A 139 8.088 -10.353 2.115 1.00 0.00 N ATOM 267 CA ILE A 139 7.918 -10.563 0.686 1.00 0.00 C ATOM 268 C ILE A 139 9.276 -11.083 0.189 1.00 0.00 C ATOM 269 O ILE A 139 10.311 -10.773 0.782 1.00 0.00 O ATOM 270 CB ILE A 139 7.445 -9.259 -0.010 1.00 0.00 C ATOM 271 CG1 ILE A 139 6.179 -8.650 0.648 1.00 0.00 C ATOM 272 CG2 ILE A 139 7.135 -9.550 -1.489 1.00 0.00 C ATOM 273 CD1 ILE A 139 5.751 -7.318 0.062 1.00 0.00 C ATOM 0 H ILE A 139 8.989 -9.938 2.351 1.00 0.00 H new ATOM 0 HA ILE A 139 7.138 -11.287 0.450 1.00 0.00 H new ATOM 0 HB ILE A 139 8.254 -8.536 0.090 1.00 0.00 H new ATOM 0 HG12 ILE A 139 5.356 -9.358 0.550 1.00 0.00 H new ATOM 0 HG13 ILE A 139 6.364 -8.522 1.715 1.00 0.00 H new ATOM 0 HG21 ILE A 139 6.803 -8.634 -1.978 1.00 0.00 H new ATOM 0 HG22 ILE A 139 8.033 -9.920 -1.983 1.00 0.00 H new ATOM 0 HG23 ILE A 139 6.349 -10.302 -1.555 1.00 0.00 H new ATOM 0 HD11 ILE A 139 4.859 -6.963 0.579 1.00 0.00 H new ATOM 0 HD12 ILE A 139 6.555 -6.592 0.184 1.00 0.00 H new ATOM 0 HD13 ILE A 139 5.531 -7.441 -0.999 1.00 0.00 H new ATOM 285 N HIS A 140 9.266 -11.890 -0.870 1.00 0.00 N ATOM 286 CA HIS A 140 10.357 -12.733 -1.329 1.00 0.00 C ATOM 287 C HIS A 140 10.708 -12.324 -2.759 1.00 0.00 C ATOM 288 O HIS A 140 9.935 -12.538 -3.696 1.00 0.00 O ATOM 289 CB HIS A 140 9.949 -14.213 -1.244 1.00 0.00 C ATOM 290 CG HIS A 140 9.311 -14.602 0.068 1.00 0.00 C ATOM 291 ND1 HIS A 140 9.948 -15.166 1.149 1.00 0.00 N ATOM 292 CD2 HIS A 140 7.978 -14.495 0.375 1.00 0.00 C ATOM 293 CE1 HIS A 140 9.015 -15.400 2.086 1.00 0.00 C ATOM 294 NE2 HIS A 140 7.799 -15.013 1.662 1.00 0.00 N ATOM 0 H HIS A 140 8.442 -11.975 -1.465 1.00 0.00 H new ATOM 0 HA HIS A 140 11.236 -12.605 -0.698 1.00 0.00 H new ATOM 0 HB2 HIS A 140 9.254 -14.434 -2.054 1.00 0.00 H new ATOM 0 HB3 HIS A 140 10.832 -14.832 -1.404 1.00 0.00 H new ATOM 0 HD2 HIS A 140 7.207 -14.085 -0.261 1.00 0.00 H new ATOM 0 HE1 HIS A 140 9.215 -15.840 3.052 1.00 0.00 H new ATOM 0 HE2 HIS A 140 6.921 -15.083 2.176 1.00 0.00 H new ATOM 302 N PHE A 141 11.858 -11.679 -2.922 1.00 0.00 N ATOM 303 CA PHE A 141 12.329 -11.092 -4.174 1.00 0.00 C ATOM 304 C PHE A 141 13.257 -12.048 -4.940 1.00 0.00 C ATOM 305 O PHE A 141 13.675 -11.767 -6.065 1.00 0.00 O ATOM 306 CB PHE A 141 13.018 -9.767 -3.853 1.00 0.00 C ATOM 307 CG PHE A 141 12.203 -8.683 -3.169 1.00 0.00 C ATOM 308 CD1 PHE A 141 11.821 -8.781 -1.814 1.00 0.00 C ATOM 309 CD2 PHE A 141 11.865 -7.528 -3.903 1.00 0.00 C ATOM 310 CE1 PHE A 141 11.065 -7.756 -1.220 1.00 0.00 C ATOM 311 CE2 PHE A 141 11.111 -6.508 -3.304 1.00 0.00 C ATOM 312 CZ PHE A 141 10.704 -6.625 -1.969 1.00 0.00 C ATOM 0 H PHE A 141 12.516 -11.545 -2.154 1.00 0.00 H new ATOM 0 HA PHE A 141 11.480 -10.911 -4.833 1.00 0.00 H new ATOM 0 HB2 PHE A 141 13.880 -9.984 -3.222 1.00 0.00 H new ATOM 0 HB3 PHE A 141 13.402 -9.356 -4.787 1.00 0.00 H new ATOM 0 HD1 PHE A 141 12.110 -9.644 -1.233 1.00 0.00 H new ATOM 0 HD2 PHE A 141 12.187 -7.428 -4.929 1.00 0.00 H new ATOM 0 HE1 PHE A 141 10.762 -7.838 -0.187 1.00 0.00 H new ATOM 0 HE2 PHE A 141 10.844 -5.630 -3.874 1.00 0.00 H new ATOM 0 HZ PHE A 141 10.112 -5.844 -1.515 1.00 0.00 H new ATOM 322 N GLY A 142 13.606 -13.194 -4.355 1.00 0.00 N ATOM 323 CA GLY A 142 14.517 -14.171 -4.932 1.00 0.00 C ATOM 324 C GLY A 142 15.967 -13.765 -4.702 1.00 0.00 C ATOM 325 O GLY A 142 16.777 -14.598 -4.297 1.00 0.00 O ATOM 0 H GLY A 142 13.250 -13.472 -3.440 1.00 0.00 H new ATOM 0 HA2 GLY A 142 14.335 -15.150 -4.489 1.00 0.00 H new ATOM 0 HA3 GLY A 142 14.327 -14.265 -6.001 1.00 0.00 H new ATOM 329 N ASN A 143 16.319 -12.488 -4.907 1.00 0.00 N ATOM 330 CA ASN A 143 17.641 -12.005 -4.555 1.00 0.00 C ATOM 331 C ASN A 143 17.779 -12.040 -3.047 1.00 0.00 C ATOM 332 O ASN A 143 16.825 -11.750 -2.318 1.00 0.00 O ATOM 333 CB ASN A 143 17.882 -10.567 -4.991 1.00 0.00 C ATOM 334 CG ASN A 143 17.655 -10.347 -6.464 1.00 0.00 C ATOM 335 OD1 ASN A 143 18.577 -10.461 -7.262 1.00 0.00 O ATOM 336 ND2 ASN A 143 16.418 -10.081 -6.831 1.00 0.00 N ATOM 0 H ASN A 143 15.704 -11.783 -5.313 1.00 0.00 H new ATOM 0 HA ASN A 143 18.361 -12.646 -5.063 1.00 0.00 H new ATOM 0 HB2 ASN A 143 17.223 -9.908 -4.426 1.00 0.00 H new ATOM 0 HB3 ASN A 143 18.905 -10.285 -4.742 1.00 0.00 H new ATOM 0 HD21 ASN A 143 16.194 -9.960 -7.819 1.00 0.00 H new ATOM 0 HD22 ASN A 143 15.684 -9.996 -6.127 1.00 0.00 H new ATOM 343 N ASP A 144 18.992 -12.294 -2.576 1.00 0.00 N ATOM 344 CA ASP A 144 19.286 -12.162 -1.149 1.00 0.00 C ATOM 345 C ASP A 144 19.362 -10.695 -0.768 1.00 0.00 C ATOM 346 O ASP A 144 18.931 -10.324 0.316 1.00 0.00 O ATOM 347 CB ASP A 144 20.579 -12.869 -0.733 1.00 0.00 C ATOM 348 CG ASP A 144 20.589 -13.074 0.785 1.00 0.00 C ATOM 349 OD1 ASP A 144 19.711 -13.837 1.255 1.00 0.00 O ATOM 350 OD2 ASP A 144 21.467 -12.540 1.493 1.00 0.00 O ATOM 0 H ASP A 144 19.782 -12.589 -3.150 1.00 0.00 H new ATOM 0 HA ASP A 144 18.470 -12.650 -0.616 1.00 0.00 H new ATOM 0 HB2 ASP A 144 20.659 -13.831 -1.240 1.00 0.00 H new ATOM 0 HB3 ASP A 144 21.442 -12.277 -1.036 1.00 0.00 H new ATOM 355 N TRP A 145 19.851 -9.845 -1.678 1.00 0.00 N ATOM 356 CA TRP A 145 20.140 -8.467 -1.353 1.00 0.00 C ATOM 357 C TRP A 145 18.848 -7.658 -1.325 1.00 0.00 C ATOM 358 O TRP A 145 18.755 -6.707 -0.561 1.00 0.00 O ATOM 359 CB TRP A 145 21.172 -7.914 -2.338 1.00 0.00 C ATOM 360 CG TRP A 145 20.772 -7.886 -3.781 1.00 0.00 C ATOM 361 CD1 TRP A 145 20.983 -8.865 -4.685 1.00 0.00 C ATOM 362 CD2 TRP A 145 20.035 -6.851 -4.488 1.00 0.00 C ATOM 363 NE1 TRP A 145 20.385 -8.530 -5.887 1.00 0.00 N ATOM 364 CE2 TRP A 145 19.835 -7.266 -5.837 1.00 0.00 C ATOM 365 CE3 TRP A 145 19.454 -5.632 -4.097 1.00 0.00 C ATOM 366 CZ2 TRP A 145 19.134 -6.479 -6.763 1.00 0.00 C ATOM 367 CZ3 TRP A 145 18.752 -4.832 -5.014 1.00 0.00 C ATOM 368 CH2 TRP A 145 18.600 -5.246 -6.347 1.00 0.00 C ATOM 0 H TRP A 145 20.051 -10.100 -2.645 1.00 0.00 H new ATOM 0 HA TRP A 145 20.577 -8.395 -0.357 1.00 0.00 H new ATOM 0 HB2 TRP A 145 21.423 -6.898 -2.034 1.00 0.00 H new ATOM 0 HB3 TRP A 145 22.082 -8.508 -2.248 1.00 0.00 H new ATOM 0 HD1 TRP A 145 21.536 -9.774 -4.498 1.00 0.00 H new ATOM 0 HE1 TRP A 145 20.355 -9.139 -6.705 1.00 0.00 H new ATOM 0 HE3 TRP A 145 19.549 -5.304 -3.072 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 19.006 -6.815 -7.781 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 18.327 -3.893 -4.692 1.00 0.00 H new ATOM 0 HH2 TRP A 145 18.074 -4.619 -7.052 1.00 0.00 H new ATOM 379 N GLU A 146 17.839 -8.037 -2.115 1.00 0.00 N ATOM 380 CA GLU A 146 16.538 -7.408 -2.087 1.00 0.00 C ATOM 381 C GLU A 146 15.763 -7.858 -0.858 1.00 0.00 C ATOM 382 O GLU A 146 15.213 -6.986 -0.205 1.00 0.00 O ATOM 383 CB GLU A 146 15.777 -7.726 -3.370 1.00 0.00 C ATOM 384 CG GLU A 146 16.410 -7.028 -4.569 1.00 0.00 C ATOM 385 CD GLU A 146 15.567 -7.093 -5.839 1.00 0.00 C ATOM 386 OE1 GLU A 146 14.832 -8.089 -5.997 1.00 0.00 O ATOM 387 OE2 GLU A 146 15.684 -6.183 -6.684 1.00 0.00 O ATOM 0 H GLU A 146 17.914 -8.795 -2.793 1.00 0.00 H new ATOM 0 HA GLU A 146 16.663 -6.327 -2.027 1.00 0.00 H new ATOM 0 HB2 GLU A 146 15.769 -8.803 -3.535 1.00 0.00 H new ATOM 0 HB3 GLU A 146 14.738 -7.411 -3.268 1.00 0.00 H new ATOM 0 HG2 GLU A 146 16.588 -5.983 -4.316 1.00 0.00 H new ATOM 0 HG3 GLU A 146 17.383 -7.478 -4.767 1.00 0.00 H new ATOM 394 N ASP A 147 15.760 -9.154 -0.497 1.00 0.00 N ATOM 395 CA ASP A 147 15.188 -9.617 0.782 1.00 0.00 C ATOM 396 C ASP A 147 15.796 -8.825 1.927 1.00 0.00 C ATOM 397 O ASP A 147 15.080 -8.199 2.707 1.00 0.00 O ATOM 398 CB ASP A 147 15.445 -11.111 1.042 1.00 0.00 C ATOM 399 CG ASP A 147 15.283 -11.462 2.536 1.00 0.00 C ATOM 400 OD1 ASP A 147 14.140 -11.497 3.042 1.00 0.00 O ATOM 401 OD2 ASP A 147 16.316 -11.684 3.214 1.00 0.00 O ATOM 0 H ASP A 147 16.148 -9.901 -1.074 1.00 0.00 H new ATOM 0 HA ASP A 147 14.111 -9.463 0.719 1.00 0.00 H new ATOM 0 HB2 ASP A 147 14.752 -11.709 0.450 1.00 0.00 H new ATOM 0 HB3 ASP A 147 16.451 -11.371 0.713 1.00 0.00 H new ATOM 406 N ARG A 148 17.126 -8.833 1.998 1.00 0.00 N ATOM 407 CA ARG A 148 17.879 -8.149 3.022 1.00 0.00 C ATOM 408 C ARG A 148 17.494 -6.680 3.046 1.00 0.00 C ATOM 409 O ARG A 148 17.093 -6.160 4.084 1.00 0.00 O ATOM 410 CB ARG A 148 19.376 -8.374 2.754 1.00 0.00 C ATOM 411 CG ARG A 148 20.292 -7.601 3.710 1.00 0.00 C ATOM 412 CD ARG A 148 19.916 -7.793 5.177 1.00 0.00 C ATOM 413 NE ARG A 148 19.959 -9.192 5.597 1.00 0.00 N ATOM 414 CZ ARG A 148 20.488 -9.642 6.730 1.00 0.00 C ATOM 415 NH1 ARG A 148 20.858 -8.825 7.711 1.00 0.00 N ATOM 416 NH2 ARG A 148 20.696 -10.942 6.849 1.00 0.00 N ATOM 0 H ARG A 148 17.713 -9.328 1.327 1.00 0.00 H new ATOM 0 HA ARG A 148 17.652 -8.545 4.012 1.00 0.00 H new ATOM 0 HB2 ARG A 148 19.595 -9.439 2.835 1.00 0.00 H new ATOM 0 HB3 ARG A 148 19.602 -8.079 1.729 1.00 0.00 H new ATOM 0 HG2 ARG A 148 21.322 -7.924 3.559 1.00 0.00 H new ATOM 0 HG3 ARG A 148 20.251 -6.540 3.466 1.00 0.00 H new ATOM 0 HD2 ARG A 148 20.595 -7.211 5.800 1.00 0.00 H new ATOM 0 HD3 ARG A 148 18.913 -7.399 5.344 1.00 0.00 H new ATOM 0 HE ARG A 148 19.548 -9.881 4.967 1.00 0.00 H new ATOM 0 HH11 ARG A 148 20.739 -7.817 7.608 1.00 0.00 H new ATOM 0 HH12 ARG A 148 21.261 -9.206 8.567 1.00 0.00 H new ATOM 0 HH21 ARG A 148 20.452 -11.570 6.083 1.00 0.00 H new ATOM 0 HH22 ARG A 148 21.101 -11.317 7.707 1.00 0.00 H new ATOM 430 N TYR A 149 17.634 -5.988 1.924 1.00 0.00 N ATOM 431 CA TYR A 149 17.451 -4.554 1.912 1.00 0.00 C ATOM 432 C TYR A 149 16.006 -4.193 2.248 1.00 0.00 C ATOM 433 O TYR A 149 15.781 -3.273 3.037 1.00 0.00 O ATOM 434 CB TYR A 149 17.875 -4.008 0.552 1.00 0.00 C ATOM 435 CG TYR A 149 17.604 -2.534 0.454 1.00 0.00 C ATOM 436 CD1 TYR A 149 18.430 -1.632 1.145 1.00 0.00 C ATOM 437 CD2 TYR A 149 16.445 -2.086 -0.203 1.00 0.00 C ATOM 438 CE1 TYR A 149 18.090 -0.272 1.183 1.00 0.00 C ATOM 439 CE2 TYR A 149 16.090 -0.733 -0.155 1.00 0.00 C ATOM 440 CZ TYR A 149 16.905 0.173 0.558 1.00 0.00 C ATOM 441 OH TYR A 149 16.524 1.470 0.643 1.00 0.00 O ATOM 0 H TYR A 149 17.872 -6.397 1.020 1.00 0.00 H new ATOM 0 HA TYR A 149 18.077 -4.095 2.678 1.00 0.00 H new ATOM 0 HB2 TYR A 149 18.937 -4.197 0.396 1.00 0.00 H new ATOM 0 HB3 TYR A 149 17.338 -4.533 -0.238 1.00 0.00 H new ATOM 0 HD1 TYR A 149 19.321 -1.984 1.644 1.00 0.00 H new ATOM 0 HD2 TYR A 149 15.828 -2.787 -0.746 1.00 0.00 H new ATOM 0 HE1 TYR A 149 18.733 0.433 1.689 1.00 0.00 H new ATOM 0 HE2 TYR A 149 15.200 -0.385 -0.659 1.00 0.00 H new ATOM 0 HH TYR A 149 15.904 1.677 -0.087 1.00 0.00 H new ATOM 451 N TYR A 150 15.037 -4.928 1.696 1.00 0.00 N ATOM 452 CA TYR A 150 13.627 -4.836 2.032 1.00 0.00 C ATOM 453 C TYR A 150 13.479 -4.941 3.546 1.00 0.00 C ATOM 454 O TYR A 150 13.037 -3.994 4.194 1.00 0.00 O ATOM 455 CB TYR A 150 12.849 -5.948 1.319 1.00 0.00 C ATOM 456 CG TYR A 150 11.445 -6.156 1.830 1.00 0.00 C ATOM 457 CD1 TYR A 150 10.410 -5.322 1.382 1.00 0.00 C ATOM 458 CD2 TYR A 150 11.172 -7.205 2.727 1.00 0.00 C ATOM 459 CE1 TYR A 150 9.096 -5.548 1.810 1.00 0.00 C ATOM 460 CE2 TYR A 150 9.871 -7.390 3.219 1.00 0.00 C ATOM 461 CZ TYR A 150 8.826 -6.566 2.751 1.00 0.00 C ATOM 462 OH TYR A 150 7.563 -6.743 3.212 1.00 0.00 O ATOM 0 H TYR A 150 15.227 -5.627 0.978 1.00 0.00 H new ATOM 0 HA TYR A 150 13.219 -3.881 1.702 1.00 0.00 H new ATOM 0 HB2 TYR A 150 12.804 -5.718 0.255 1.00 0.00 H new ATOM 0 HB3 TYR A 150 13.401 -6.882 1.420 1.00 0.00 H new ATOM 0 HD1 TYR A 150 10.626 -4.507 0.708 1.00 0.00 H new ATOM 0 HD2 TYR A 150 11.965 -7.869 3.037 1.00 0.00 H new ATOM 0 HE1 TYR A 150 8.290 -4.944 1.421 1.00 0.00 H new ATOM 0 HE2 TYR A 150 9.671 -8.158 3.951 1.00 0.00 H new ATOM 0 HH TYR A 150 7.582 -7.314 4.008 1.00 0.00 H new ATOM 472 N ARG A 151 13.870 -6.074 4.132 1.00 0.00 N ATOM 473 CA ARG A 151 13.593 -6.396 5.527 1.00 0.00 C ATOM 474 C ARG A 151 14.407 -5.575 6.529 1.00 0.00 C ATOM 475 O ARG A 151 14.208 -5.725 7.737 1.00 0.00 O ATOM 476 CB ARG A 151 13.624 -7.903 5.734 1.00 0.00 C ATOM 477 CG ARG A 151 15.020 -8.499 5.786 1.00 0.00 C ATOM 478 CD ARG A 151 15.464 -8.756 7.222 1.00 0.00 C ATOM 479 NE ARG A 151 16.293 -9.940 7.209 1.00 0.00 N ATOM 480 CZ ARG A 151 17.259 -10.296 8.056 1.00 0.00 C ATOM 481 NH1 ARG A 151 17.742 -9.446 8.959 1.00 0.00 N ATOM 482 NH2 ARG A 151 17.737 -11.529 8.008 1.00 0.00 N ATOM 0 H ARG A 151 14.394 -6.800 3.643 1.00 0.00 H new ATOM 0 HA ARG A 151 12.576 -6.077 5.754 1.00 0.00 H new ATOM 0 HB2 ARG A 151 13.105 -8.141 6.663 1.00 0.00 H new ATOM 0 HB3 ARG A 151 13.068 -8.380 4.927 1.00 0.00 H new ATOM 0 HG2 ARG A 151 15.039 -9.434 5.225 1.00 0.00 H new ATOM 0 HG3 ARG A 151 15.724 -7.822 5.302 1.00 0.00 H new ATOM 0 HD2 ARG A 151 16.019 -7.902 7.611 1.00 0.00 H new ATOM 0 HD3 ARG A 151 14.601 -8.898 7.872 1.00 0.00 H new ATOM 0 HE ARG A 151 16.114 -10.593 6.446 1.00 0.00 H new ATOM 0 HH11 ARG A 151 17.373 -8.497 9.015 1.00 0.00 H new ATOM 0 HH12 ARG A 151 18.481 -9.744 9.595 1.00 0.00 H new ATOM 0 HH21 ARG A 151 17.366 -12.194 7.329 1.00 0.00 H new ATOM 0 HH22 ARG A 151 18.476 -11.815 8.650 1.00 0.00 H new ATOM 496 N GLU A 152 15.301 -4.699 6.069 1.00 0.00 N ATOM 497 CA GLU A 152 16.094 -3.800 6.912 1.00 0.00 C ATOM 498 C GLU A 152 15.787 -2.331 6.598 1.00 0.00 C ATOM 499 O GLU A 152 16.413 -1.428 7.156 1.00 0.00 O ATOM 500 CB GLU A 152 17.586 -4.206 6.892 1.00 0.00 C ATOM 501 CG GLU A 152 17.669 -5.696 7.296 1.00 0.00 C ATOM 502 CD GLU A 152 18.756 -6.149 8.263 1.00 0.00 C ATOM 503 OE1 GLU A 152 19.951 -6.176 7.889 1.00 0.00 O ATOM 504 OE2 GLU A 152 18.334 -6.635 9.347 1.00 0.00 O ATOM 0 H GLU A 152 15.500 -4.591 5.074 1.00 0.00 H new ATOM 0 HA GLU A 152 15.800 -3.908 7.956 1.00 0.00 H new ATOM 0 HB2 GLU A 152 18.011 -4.054 5.900 1.00 0.00 H new ATOM 0 HB3 GLU A 152 18.160 -3.589 7.583 1.00 0.00 H new ATOM 0 HG2 GLU A 152 16.708 -5.971 7.732 1.00 0.00 H new ATOM 0 HG3 GLU A 152 17.782 -6.277 6.381 1.00 0.00 H new ATOM 511 N ASN A 153 14.779 -2.072 5.752 1.00 0.00 N ATOM 512 CA ASN A 153 14.245 -0.737 5.467 1.00 0.00 C ATOM 513 C ASN A 153 12.716 -0.730 5.413 1.00 0.00 C ATOM 514 O ASN A 153 12.121 0.309 5.145 1.00 0.00 O ATOM 515 CB ASN A 153 14.820 -0.193 4.152 1.00 0.00 C ATOM 516 CG ASN A 153 16.306 0.065 4.292 1.00 0.00 C ATOM 517 OD1 ASN A 153 16.721 1.146 4.691 1.00 0.00 O ATOM 518 ND2 ASN A 153 17.133 -0.922 4.002 1.00 0.00 N ATOM 0 H ASN A 153 14.301 -2.809 5.233 1.00 0.00 H new ATOM 0 HA ASN A 153 14.551 -0.088 6.287 1.00 0.00 H new ATOM 0 HB2 ASN A 153 14.643 -0.907 3.347 1.00 0.00 H new ATOM 0 HB3 ASN A 153 14.308 0.730 3.878 1.00 0.00 H new ATOM 0 HD21 ASN A 153 18.139 -0.792 4.109 1.00 0.00 H new ATOM 0 HD22 ASN A 153 16.766 -1.814 3.671 1.00 0.00 H new ATOM 525 N MET A 154 12.058 -1.867 5.660 1.00 0.00 N ATOM 526 CA MET A 154 10.625 -2.085 5.467 1.00 0.00 C ATOM 527 C MET A 154 9.772 -1.009 6.140 1.00 0.00 C ATOM 528 O MET A 154 8.753 -0.618 5.587 1.00 0.00 O ATOM 529 CB MET A 154 10.239 -3.514 5.912 1.00 0.00 C ATOM 530 CG MET A 154 10.582 -3.833 7.378 1.00 0.00 C ATOM 531 SD MET A 154 10.974 -5.571 7.722 1.00 0.00 S ATOM 532 CE MET A 154 9.374 -6.340 7.408 1.00 0.00 C ATOM 0 H MET A 154 12.533 -2.696 6.016 1.00 0.00 H new ATOM 0 HA MET A 154 10.411 -1.996 4.402 1.00 0.00 H new ATOM 0 HB2 MET A 154 9.168 -3.652 5.763 1.00 0.00 H new ATOM 0 HB3 MET A 154 10.746 -4.232 5.268 1.00 0.00 H new ATOM 0 HG2 MET A 154 11.432 -3.220 7.677 1.00 0.00 H new ATOM 0 HG3 MET A 154 9.740 -3.537 8.004 1.00 0.00 H new ATOM 0 HE1 MET A 154 9.516 -7.399 7.190 1.00 0.00 H new ATOM 0 HE2 MET A 154 8.739 -6.232 8.288 1.00 0.00 H new ATOM 0 HE3 MET A 154 8.898 -5.855 6.556 1.00 0.00 H new ATOM 542 N TYR A 155 10.189 -0.538 7.314 1.00 0.00 N ATOM 543 CA TYR A 155 9.531 0.468 8.147 1.00 0.00 C ATOM 544 C TYR A 155 9.698 1.898 7.637 1.00 0.00 C ATOM 545 O TYR A 155 8.984 2.782 8.102 1.00 0.00 O ATOM 546 CB TYR A 155 10.070 0.375 9.587 1.00 0.00 C ATOM 547 CG TYR A 155 11.300 -0.499 9.760 1.00 0.00 C ATOM 548 CD1 TYR A 155 12.579 0.023 9.490 1.00 0.00 C ATOM 549 CD2 TYR A 155 11.141 -1.867 10.051 1.00 0.00 C ATOM 550 CE1 TYR A 155 13.707 -0.811 9.547 1.00 0.00 C ATOM 551 CE2 TYR A 155 12.264 -2.710 10.109 1.00 0.00 C ATOM 552 CZ TYR A 155 13.554 -2.178 9.874 1.00 0.00 C ATOM 553 OH TYR A 155 14.655 -2.973 9.940 1.00 0.00 O ATOM 0 H TYR A 155 11.055 -0.872 7.738 1.00 0.00 H new ATOM 0 HA TYR A 155 8.464 0.247 8.110 1.00 0.00 H new ATOM 0 HB2 TYR A 155 10.306 1.380 9.936 1.00 0.00 H new ATOM 0 HB3 TYR A 155 9.278 -0.008 10.231 1.00 0.00 H new ATOM 0 HD1 TYR A 155 12.693 1.067 9.238 1.00 0.00 H new ATOM 0 HD2 TYR A 155 10.155 -2.269 10.230 1.00 0.00 H new ATOM 0 HE1 TYR A 155 14.688 -0.410 9.342 1.00 0.00 H new ATOM 0 HE2 TYR A 155 12.143 -3.760 10.332 1.00 0.00 H new ATOM 0 HH TYR A 155 14.386 -3.885 10.177 1.00 0.00 H new ATOM 563 N ARG A 156 10.638 2.156 6.724 1.00 0.00 N ATOM 564 CA ARG A 156 10.763 3.476 6.115 1.00 0.00 C ATOM 565 C ARG A 156 9.620 3.693 5.127 1.00 0.00 C ATOM 566 O ARG A 156 9.220 4.832 4.911 1.00 0.00 O ATOM 567 CB ARG A 156 12.123 3.637 5.416 1.00 0.00 C ATOM 568 CG ARG A 156 13.320 3.351 6.343 1.00 0.00 C ATOM 569 CD ARG A 156 14.673 3.664 5.688 1.00 0.00 C ATOM 570 NE ARG A 156 14.922 5.118 5.647 1.00 0.00 N ATOM 571 CZ ARG A 156 14.581 5.953 4.654 1.00 0.00 C ATOM 572 NH1 ARG A 156 14.227 5.491 3.462 1.00 0.00 N ATOM 573 NH2 ARG A 156 14.593 7.265 4.841 1.00 0.00 N ATOM 0 H ARG A 156 11.318 1.471 6.394 1.00 0.00 H new ATOM 0 HA ARG A 156 10.706 4.230 6.900 1.00 0.00 H new ATOM 0 HB2 ARG A 156 12.166 2.964 4.560 1.00 0.00 H new ATOM 0 HB3 ARG A 156 12.207 4.652 5.028 1.00 0.00 H new ATOM 0 HG2 ARG A 156 13.217 3.942 7.253 1.00 0.00 H new ATOM 0 HG3 ARG A 156 13.300 2.303 6.640 1.00 0.00 H new ATOM 0 HD2 ARG A 156 15.471 3.171 6.243 1.00 0.00 H new ATOM 0 HD3 ARG A 156 14.692 3.260 4.676 1.00 0.00 H new ATOM 0 HE ARG A 156 15.399 5.527 6.450 1.00 0.00 H new ATOM 0 HH11 ARG A 156 14.211 4.486 3.289 1.00 0.00 H new ATOM 0 HH12 ARG A 156 13.971 6.141 2.719 1.00 0.00 H new ATOM 0 HH21 ARG A 156 14.863 7.649 5.747 1.00 0.00 H new ATOM 0 HH22 ARG A 156 14.332 7.891 4.079 1.00 0.00 H new ATOM 587 N TYR A 157 9.117 2.616 4.523 1.00 0.00 N ATOM 588 CA TYR A 157 7.944 2.617 3.661 1.00 0.00 C ATOM 589 C TYR A 157 6.691 2.766 4.530 1.00 0.00 C ATOM 590 O TYR A 157 6.757 2.517 5.738 1.00 0.00 O ATOM 591 CB TYR A 157 7.944 1.301 2.866 1.00 0.00 C ATOM 592 CG TYR A 157 9.275 0.981 2.214 1.00 0.00 C ATOM 593 CD1 TYR A 157 10.010 2.003 1.587 1.00 0.00 C ATOM 594 CD2 TYR A 157 9.830 -0.304 2.351 1.00 0.00 C ATOM 595 CE1 TYR A 157 11.340 1.772 1.205 1.00 0.00 C ATOM 596 CE2 TYR A 157 11.161 -0.549 1.969 1.00 0.00 C ATOM 597 CZ TYR A 157 11.932 0.510 1.425 1.00 0.00 C ATOM 598 OH TYR A 157 13.244 0.330 1.108 1.00 0.00 O ATOM 0 H TYR A 157 9.532 1.690 4.627 1.00 0.00 H new ATOM 0 HA TYR A 157 7.957 3.449 2.957 1.00 0.00 H new ATOM 0 HB2 TYR A 157 7.671 0.484 3.534 1.00 0.00 H new ATOM 0 HB3 TYR A 157 7.175 1.353 2.095 1.00 0.00 H new ATOM 0 HD1 TYR A 157 9.552 2.963 1.400 1.00 0.00 H new ATOM 0 HD2 TYR A 157 9.230 -1.108 2.752 1.00 0.00 H new ATOM 0 HE1 TYR A 157 11.912 2.562 0.741 1.00 0.00 H new ATOM 0 HE2 TYR A 157 11.591 -1.532 2.088 1.00 0.00 H new ATOM 0 HH TYR A 157 13.508 -0.590 1.317 1.00 0.00 H new ATOM 608 N PRO A 158 5.534 3.136 3.958 1.00 0.00 N ATOM 609 CA PRO A 158 4.369 3.429 4.766 1.00 0.00 C ATOM 610 C PRO A 158 3.843 2.145 5.398 1.00 0.00 C ATOM 611 O PRO A 158 3.855 1.068 4.791 1.00 0.00 O ATOM 612 CB PRO A 158 3.345 4.072 3.832 1.00 0.00 C ATOM 613 CG PRO A 158 3.784 3.672 2.424 1.00 0.00 C ATOM 614 CD PRO A 158 5.237 3.219 2.539 1.00 0.00 C ATOM 0 HA PRO A 158 4.598 4.108 5.588 1.00 0.00 H new ATOM 0 HB2 PRO A 158 2.337 3.716 4.047 1.00 0.00 H new ATOM 0 HB3 PRO A 158 3.332 5.156 3.948 1.00 0.00 H new ATOM 0 HG2 PRO A 158 3.157 2.870 2.035 1.00 0.00 H new ATOM 0 HG3 PRO A 158 3.692 4.512 1.735 1.00 0.00 H new ATOM 0 HD2 PRO A 158 5.381 2.253 2.056 1.00 0.00 H new ATOM 0 HD3 PRO A 158 5.904 3.925 2.044 1.00 0.00 H new ATOM 622 N ASN A 159 3.303 2.282 6.608 1.00 0.00 N ATOM 623 CA ASN A 159 2.595 1.199 7.269 1.00 0.00 C ATOM 624 C ASN A 159 1.187 1.013 6.730 1.00 0.00 C ATOM 625 O ASN A 159 0.555 0.020 7.070 1.00 0.00 O ATOM 626 CB ASN A 159 2.542 1.406 8.781 1.00 0.00 C ATOM 627 CG ASN A 159 3.861 0.959 9.384 1.00 0.00 C ATOM 628 OD1 ASN A 159 3.887 -0.252 9.906 1.00 0.00 O flip ATOM 629 ND2 ASN A 159 4.879 1.622 9.278 1.00 0.00 N flip ATOM 0 H ASN A 159 3.346 3.144 7.151 1.00 0.00 H new ATOM 0 HA ASN A 159 3.162 0.293 7.054 1.00 0.00 H new ATOM 0 HB2 ASN A 159 2.358 2.455 9.012 1.00 0.00 H new ATOM 0 HB3 ASN A 159 1.718 0.836 9.211 1.00 0.00 H new ATOM 0 HD21 ASN A 159 4.839 2.557 8.872 1.00 0.00 H new ATOM 0 HD22 ASN A 159 5.771 1.242 9.596 1.00 0.00 H new ATOM 636 N GLN A 160 0.691 1.973 5.953 1.00 0.00 N ATOM 637 CA GLN A 160 -0.695 2.134 5.548 1.00 0.00 C ATOM 638 C GLN A 160 -0.750 2.141 4.011 1.00 0.00 C ATOM 639 O GLN A 160 0.293 2.272 3.366 1.00 0.00 O ATOM 640 CB GLN A 160 -1.257 3.419 6.170 1.00 0.00 C ATOM 641 CG GLN A 160 -0.874 3.748 7.615 1.00 0.00 C ATOM 642 CD GLN A 160 -1.578 5.005 8.121 1.00 0.00 C ATOM 643 OE1 GLN A 160 -0.990 6.078 8.193 1.00 0.00 O ATOM 644 NE2 GLN A 160 -2.853 4.926 8.449 1.00 0.00 N ATOM 0 H GLN A 160 1.289 2.704 5.567 1.00 0.00 H new ATOM 0 HA GLN A 160 -1.316 1.311 5.903 1.00 0.00 H new ATOM 0 HB2 GLN A 160 -0.947 4.256 5.544 1.00 0.00 H new ATOM 0 HB3 GLN A 160 -2.344 3.367 6.117 1.00 0.00 H new ATOM 0 HG2 GLN A 160 -1.129 2.906 8.258 1.00 0.00 H new ATOM 0 HG3 GLN A 160 0.205 3.885 7.682 1.00 0.00 H new ATOM 0 HE21 GLN A 160 -3.341 4.032 8.388 1.00 0.00 H new ATOM 0 HE22 GLN A 160 -3.351 5.759 8.763 1.00 0.00 H new ATOM 653 N VAL A 161 -1.940 2.042 3.410 1.00 0.00 N ATOM 654 CA VAL A 161 -2.137 2.183 1.962 1.00 0.00 C ATOM 655 C VAL A 161 -3.336 3.092 1.719 1.00 0.00 C ATOM 656 O VAL A 161 -4.210 3.183 2.583 1.00 0.00 O ATOM 657 CB VAL A 161 -2.303 0.814 1.257 1.00 0.00 C ATOM 658 CG1 VAL A 161 -1.123 -0.112 1.551 1.00 0.00 C ATOM 659 CG2 VAL A 161 -3.583 0.051 1.637 1.00 0.00 C ATOM 0 H VAL A 161 -2.804 1.860 3.920 1.00 0.00 H new ATOM 0 HA VAL A 161 -1.245 2.633 1.526 1.00 0.00 H new ATOM 0 HB VAL A 161 -2.358 1.072 0.199 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -1.272 -1.064 1.041 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -0.201 0.349 1.197 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -1.053 -0.283 2.625 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -3.616 -0.895 1.097 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -3.586 -0.143 2.710 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -4.455 0.650 1.374 1.00 0.00 H new ATOM 669 N TYR A 162 -3.413 3.723 0.553 1.00 0.00 N ATOM 670 CA TYR A 162 -4.528 4.567 0.151 1.00 0.00 C ATOM 671 C TYR A 162 -5.211 3.895 -1.037 1.00 0.00 C ATOM 672 O TYR A 162 -4.494 3.461 -1.933 1.00 0.00 O ATOM 673 CB TYR A 162 -3.998 5.948 -0.248 1.00 0.00 C ATOM 674 CG TYR A 162 -3.343 6.770 0.843 1.00 0.00 C ATOM 675 CD1 TYR A 162 -1.979 6.599 1.146 1.00 0.00 C ATOM 676 CD2 TYR A 162 -4.086 7.771 1.491 1.00 0.00 C ATOM 677 CE1 TYR A 162 -1.345 7.441 2.077 1.00 0.00 C ATOM 678 CE2 TYR A 162 -3.456 8.637 2.404 1.00 0.00 C ATOM 679 CZ TYR A 162 -2.080 8.475 2.697 1.00 0.00 C ATOM 680 OH TYR A 162 -1.457 9.359 3.525 1.00 0.00 O ATOM 0 H TYR A 162 -2.682 3.659 -0.156 1.00 0.00 H new ATOM 0 HA TYR A 162 -5.239 4.694 0.967 1.00 0.00 H new ATOM 0 HB2 TYR A 162 -3.275 5.815 -1.053 1.00 0.00 H new ATOM 0 HB3 TYR A 162 -4.828 6.525 -0.656 1.00 0.00 H new ATOM 0 HD1 TYR A 162 -1.416 5.816 0.660 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -5.142 7.876 1.288 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -0.302 7.298 2.316 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -4.021 9.424 2.881 1.00 0.00 H new ATOM 0 HH TYR A 162 -2.111 10.005 3.865 1.00 0.00 H new ATOM 690 N TYR A 163 -6.545 3.781 -1.039 1.00 0.00 N ATOM 691 CA TYR A 163 -7.282 2.965 -2.016 1.00 0.00 C ATOM 692 C TYR A 163 -8.700 3.493 -2.273 1.00 0.00 C ATOM 693 O TYR A 163 -9.211 4.238 -1.439 1.00 0.00 O ATOM 694 CB TYR A 163 -7.368 1.538 -1.448 1.00 0.00 C ATOM 695 CG TYR A 163 -8.021 1.393 -0.069 1.00 0.00 C ATOM 696 CD1 TYR A 163 -7.278 1.598 1.117 1.00 0.00 C ATOM 697 CD2 TYR A 163 -9.370 0.999 0.040 1.00 0.00 C ATOM 698 CE1 TYR A 163 -7.865 1.400 2.376 1.00 0.00 C ATOM 699 CE2 TYR A 163 -9.956 0.787 1.300 1.00 0.00 C ATOM 700 CZ TYR A 163 -9.205 0.985 2.473 1.00 0.00 C ATOM 701 OH TYR A 163 -9.731 0.746 3.701 1.00 0.00 O ATOM 0 H TYR A 163 -7.146 4.252 -0.363 1.00 0.00 H new ATOM 0 HA TYR A 163 -6.755 2.997 -2.970 1.00 0.00 H new ATOM 0 HB2 TYR A 163 -7.922 0.921 -2.155 1.00 0.00 H new ATOM 0 HB3 TYR A 163 -6.359 1.131 -1.393 1.00 0.00 H new ATOM 0 HD1 TYR A 163 -6.246 1.911 1.053 1.00 0.00 H new ATOM 0 HD2 TYR A 163 -9.960 0.859 -0.854 1.00 0.00 H new ATOM 0 HE1 TYR A 163 -7.286 1.567 3.273 1.00 0.00 H new ATOM 0 HE2 TYR A 163 -10.986 0.471 1.368 1.00 0.00 H new ATOM 0 HH TYR A 163 -10.666 0.468 3.608 1.00 0.00 H new ATOM 711 N ARG A 164 -9.363 3.134 -3.383 1.00 0.00 N ATOM 712 CA ARG A 164 -10.752 3.556 -3.666 1.00 0.00 C ATOM 713 C ARG A 164 -11.778 2.536 -3.175 1.00 0.00 C ATOM 714 O ARG A 164 -11.483 1.346 -3.244 1.00 0.00 O ATOM 715 CB ARG A 164 -10.964 3.732 -5.176 1.00 0.00 C ATOM 716 CG ARG A 164 -10.187 4.923 -5.717 1.00 0.00 C ATOM 717 CD ARG A 164 -10.775 6.306 -5.426 1.00 0.00 C ATOM 718 NE ARG A 164 -12.077 6.534 -6.079 1.00 0.00 N ATOM 719 CZ ARG A 164 -12.257 6.930 -7.348 1.00 0.00 C ATOM 720 NH1 ARG A 164 -11.273 6.905 -8.246 1.00 0.00 N ATOM 721 NH2 ARG A 164 -13.463 7.324 -7.735 1.00 0.00 N ATOM 0 H ARG A 164 -8.957 2.545 -4.110 1.00 0.00 H new ATOM 0 HA ARG A 164 -10.897 4.498 -3.137 1.00 0.00 H new ATOM 0 HB2 ARG A 164 -10.651 2.826 -5.696 1.00 0.00 H new ATOM 0 HB3 ARG A 164 -12.026 3.866 -5.381 1.00 0.00 H new ATOM 0 HG2 ARG A 164 -9.178 4.887 -5.307 1.00 0.00 H new ATOM 0 HG3 ARG A 164 -10.097 4.810 -6.797 1.00 0.00 H new ATOM 0 HD2 ARG A 164 -10.891 6.425 -4.349 1.00 0.00 H new ATOM 0 HD3 ARG A 164 -10.071 7.070 -5.757 1.00 0.00 H new ATOM 0 HE ARG A 164 -12.914 6.377 -5.517 1.00 0.00 H new ATOM 0 HH11 ARG A 164 -10.345 6.577 -7.977 1.00 0.00 H new ATOM 0 HH12 ARG A 164 -11.447 7.214 -9.202 1.00 0.00 H new ATOM 0 HH21 ARG A 164 -14.237 7.323 -7.071 1.00 0.00 H new ATOM 0 HH22 ARG A 164 -13.616 7.628 -8.697 1.00 0.00 H new ATOM 735 N PRO A 165 -12.998 2.976 -2.804 1.00 0.00 N ATOM 736 CA PRO A 165 -14.049 2.106 -2.292 1.00 0.00 C ATOM 737 C PRO A 165 -14.572 1.161 -3.364 1.00 0.00 C ATOM 738 O PRO A 165 -15.025 1.610 -4.425 1.00 0.00 O ATOM 739 CB PRO A 165 -15.148 3.019 -1.743 1.00 0.00 C ATOM 740 CG PRO A 165 -14.953 4.315 -2.519 1.00 0.00 C ATOM 741 CD PRO A 165 -13.446 4.362 -2.759 1.00 0.00 C ATOM 0 HA PRO A 165 -13.664 1.459 -1.504 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -16.140 2.598 -1.908 1.00 0.00 H new ATOM 0 HB3 PRO A 165 -15.042 3.174 -0.669 1.00 0.00 H new ATOM 0 HG2 PRO A 165 -15.509 4.309 -3.457 1.00 0.00 H new ATOM 0 HG3 PRO A 165 -15.296 5.179 -1.950 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -13.216 4.876 -3.692 1.00 0.00 H new ATOM 0 HD3 PRO A 165 -12.942 4.908 -1.962 1.00 0.00 H new ATOM 749 N VAL A 166 -14.541 -0.135 -3.054 1.00 0.00 N ATOM 750 CA VAL A 166 -15.042 -1.239 -3.860 1.00 0.00 C ATOM 751 C VAL A 166 -16.511 -1.044 -4.237 1.00 0.00 C ATOM 752 O VAL A 166 -16.877 -1.473 -5.329 1.00 0.00 O ATOM 753 CB VAL A 166 -14.736 -2.574 -3.119 1.00 0.00 C ATOM 754 CG1 VAL A 166 -15.717 -3.715 -3.397 1.00 0.00 C ATOM 755 CG2 VAL A 166 -13.302 -3.010 -3.442 1.00 0.00 C ATOM 0 H VAL A 166 -14.138 -0.459 -2.175 1.00 0.00 H new ATOM 0 HA VAL A 166 -14.527 -1.274 -4.820 1.00 0.00 H new ATOM 0 HB VAL A 166 -14.856 -2.363 -2.056 1.00 0.00 H new ATOM 0 HG11 VAL A 166 -15.416 -4.599 -2.834 1.00 0.00 H new ATOM 0 HG12 VAL A 166 -16.720 -3.415 -3.093 1.00 0.00 H new ATOM 0 HG13 VAL A 166 -15.715 -3.945 -4.462 1.00 0.00 H new ATOM 0 HG21 VAL A 166 -13.081 -3.944 -2.926 1.00 0.00 H new ATOM 0 HG22 VAL A 166 -13.200 -3.156 -4.517 1.00 0.00 H new ATOM 0 HG23 VAL A 166 -12.605 -2.240 -3.112 1.00 0.00 H new ATOM 765 N ASP A 167 -17.322 -0.345 -3.441 1.00 0.00 N ATOM 766 CA ASP A 167 -18.744 -0.132 -3.729 1.00 0.00 C ATOM 767 C ASP A 167 -18.985 0.453 -5.117 1.00 0.00 C ATOM 768 O ASP A 167 -19.941 0.084 -5.801 1.00 0.00 O ATOM 769 CB ASP A 167 -19.348 0.789 -2.682 1.00 0.00 C ATOM 770 CG ASP A 167 -20.848 0.956 -2.895 1.00 0.00 C ATOM 771 OD1 ASP A 167 -21.623 0.023 -2.577 1.00 0.00 O ATOM 772 OD2 ASP A 167 -21.233 2.044 -3.379 1.00 0.00 O ATOM 0 H ASP A 167 -17.011 0.092 -2.574 1.00 0.00 H new ATOM 0 HA ASP A 167 -19.224 -1.110 -3.701 1.00 0.00 H new ATOM 0 HB2 ASP A 167 -19.162 0.384 -1.687 1.00 0.00 H new ATOM 0 HB3 ASP A 167 -18.861 1.763 -2.726 1.00 0.00 H new ATOM 777 N GLN A 168 -18.085 1.325 -5.567 1.00 0.00 N ATOM 778 CA GLN A 168 -18.161 1.920 -6.893 1.00 0.00 C ATOM 779 C GLN A 168 -17.933 0.885 -8.015 1.00 0.00 C ATOM 780 O GLN A 168 -18.479 1.071 -9.106 1.00 0.00 O ATOM 781 CB GLN A 168 -17.090 3.009 -7.035 1.00 0.00 C ATOM 782 CG GLN A 168 -17.079 4.175 -6.041 1.00 0.00 C ATOM 783 CD GLN A 168 -15.763 4.937 -6.218 1.00 0.00 C ATOM 784 OE1 GLN A 168 -15.713 6.053 -6.718 1.00 0.00 O ATOM 785 NE2 GLN A 168 -14.640 4.316 -5.882 1.00 0.00 N ATOM 0 H GLN A 168 -17.283 1.637 -5.019 1.00 0.00 H new ATOM 0 HA GLN A 168 -19.165 2.333 -6.995 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -16.116 2.522 -6.981 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -17.181 3.431 -8.036 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -17.928 4.835 -6.219 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -17.171 3.806 -5.020 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -14.677 3.386 -5.465 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -13.740 4.769 -6.041 1.00 0.00 H new ATOM 794 N TYR A 169 -17.084 -0.139 -7.801 1.00 0.00 N ATOM 795 CA TYR A 169 -16.437 -0.865 -8.901 1.00 0.00 C ATOM 796 C TYR A 169 -15.980 -2.310 -8.638 1.00 0.00 C ATOM 797 O TYR A 169 -16.023 -3.127 -9.556 1.00 0.00 O ATOM 798 CB TYR A 169 -15.238 -0.046 -9.413 1.00 0.00 C ATOM 799 CG TYR A 169 -13.986 -0.056 -8.543 1.00 0.00 C ATOM 800 CD1 TYR A 169 -13.961 0.565 -7.279 1.00 0.00 C ATOM 801 CD2 TYR A 169 -12.816 -0.665 -9.022 1.00 0.00 C ATOM 802 CE1 TYR A 169 -12.766 0.673 -6.550 1.00 0.00 C ATOM 803 CE2 TYR A 169 -11.637 -0.648 -8.261 1.00 0.00 C ATOM 804 CZ TYR A 169 -11.595 0.079 -7.050 1.00 0.00 C ATOM 805 OH TYR A 169 -10.425 0.246 -6.389 1.00 0.00 O ATOM 0 H TYR A 169 -16.833 -0.479 -6.873 1.00 0.00 H new ATOM 0 HA TYR A 169 -17.233 -0.974 -9.638 1.00 0.00 H new ATOM 0 HB2 TYR A 169 -14.969 -0.417 -10.402 1.00 0.00 H new ATOM 0 HB3 TYR A 169 -15.559 0.988 -9.537 1.00 0.00 H new ATOM 0 HD1 TYR A 169 -14.875 0.964 -6.864 1.00 0.00 H new ATOM 0 HD2 TYR A 169 -12.823 -1.152 -9.986 1.00 0.00 H new ATOM 0 HE1 TYR A 169 -12.747 1.208 -5.612 1.00 0.00 H new ATOM 0 HE2 TYR A 169 -10.765 -1.188 -8.600 1.00 0.00 H new ATOM 0 HH TYR A 169 -10.424 -0.309 -5.581 1.00 0.00 H new ATOM 815 N SER A 170 -15.525 -2.671 -7.440 1.00 0.00 N ATOM 816 CA SER A 170 -15.094 -4.010 -7.015 1.00 0.00 C ATOM 817 C SER A 170 -13.969 -4.715 -7.798 1.00 0.00 C ATOM 818 O SER A 170 -13.717 -5.898 -7.532 1.00 0.00 O ATOM 819 CB SER A 170 -16.330 -4.908 -6.818 1.00 0.00 C ATOM 820 OG SER A 170 -16.960 -5.225 -8.044 1.00 0.00 O ATOM 0 H SER A 170 -15.440 -1.991 -6.684 1.00 0.00 H new ATOM 0 HA SER A 170 -14.579 -3.828 -6.072 1.00 0.00 H new ATOM 0 HB2 SER A 170 -16.032 -5.828 -6.316 1.00 0.00 H new ATOM 0 HB3 SER A 170 -17.043 -4.405 -6.165 1.00 0.00 H new ATOM 0 HG SER A 170 -16.626 -4.630 -8.747 1.00 0.00 H new ATOM 826 N ASN A 171 -13.272 -4.054 -8.734 1.00 0.00 N ATOM 827 CA ASN A 171 -12.172 -4.710 -9.447 1.00 0.00 C ATOM 828 C ASN A 171 -11.061 -5.049 -8.473 1.00 0.00 C ATOM 829 O ASN A 171 -10.771 -4.236 -7.603 1.00 0.00 O ATOM 830 CB ASN A 171 -11.513 -3.803 -10.481 1.00 0.00 C ATOM 831 CG ASN A 171 -12.318 -3.535 -11.732 1.00 0.00 C ATOM 832 OD1 ASN A 171 -13.213 -2.708 -11.747 1.00 0.00 O ATOM 833 ND2 ASN A 171 -11.948 -4.131 -12.845 1.00 0.00 N ATOM 0 H ASN A 171 -13.446 -3.087 -9.009 1.00 0.00 H new ATOM 0 HA ASN A 171 -12.614 -5.583 -9.928 1.00 0.00 H new ATOM 0 HB2 ASN A 171 -11.286 -2.848 -10.007 1.00 0.00 H new ATOM 0 HB3 ASN A 171 -10.562 -4.248 -10.773 1.00 0.00 H new ATOM 0 HD21 ASN A 171 -12.411 -3.901 -13.725 1.00 0.00 H new ATOM 0 HD22 ASN A 171 -11.198 -4.823 -12.828 1.00 0.00 H new ATOM 840 N GLN A 172 -10.325 -6.135 -8.714 1.00 0.00 N ATOM 841 CA GLN A 172 -9.029 -6.302 -8.074 1.00 0.00 C ATOM 842 C GLN A 172 -8.006 -5.461 -8.828 1.00 0.00 C ATOM 843 O GLN A 172 -7.276 -4.698 -8.206 1.00 0.00 O ATOM 844 CB GLN A 172 -8.598 -7.773 -8.001 1.00 0.00 C ATOM 845 CG GLN A 172 -7.262 -7.846 -7.241 1.00 0.00 C ATOM 846 CD GLN A 172 -6.880 -9.255 -6.814 1.00 0.00 C ATOM 847 OE1 GLN A 172 -7.702 -10.012 -6.310 1.00 0.00 O ATOM 848 NE2 GLN A 172 -5.631 -9.661 -6.988 1.00 0.00 N ATOM 0 H GLN A 172 -10.601 -6.895 -9.335 1.00 0.00 H new ATOM 0 HA GLN A 172 -9.101 -5.962 -7.041 1.00 0.00 H new ATOM 0 HB2 GLN A 172 -9.357 -8.367 -7.492 1.00 0.00 H new ATOM 0 HB3 GLN A 172 -8.488 -8.187 -9.003 1.00 0.00 H new ATOM 0 HG2 GLN A 172 -6.472 -7.440 -7.873 1.00 0.00 H new ATOM 0 HG3 GLN A 172 -7.321 -7.211 -6.357 1.00 0.00 H new ATOM 0 HE21 GLN A 172 -4.945 -9.034 -7.407 1.00 0.00 H new ATOM 0 HE22 GLN A 172 -5.356 -10.601 -6.703 1.00 0.00 H new ATOM 857 N ASN A 173 -7.939 -5.599 -10.158 1.00 0.00 N ATOM 858 CA ASN A 173 -6.875 -4.975 -10.944 1.00 0.00 C ATOM 859 C ASN A 173 -6.874 -3.471 -10.748 1.00 0.00 C ATOM 860 O ASN A 173 -5.877 -2.908 -10.308 1.00 0.00 O ATOM 861 CB ASN A 173 -6.981 -5.328 -12.434 1.00 0.00 C ATOM 862 CG ASN A 173 -6.049 -6.479 -12.756 1.00 0.00 C ATOM 863 OD1 ASN A 173 -6.489 -7.621 -12.867 1.00 0.00 O ATOM 864 ND2 ASN A 173 -4.757 -6.205 -12.824 1.00 0.00 N ATOM 0 H ASN A 173 -8.609 -6.136 -10.708 1.00 0.00 H new ATOM 0 HA ASN A 173 -5.927 -5.374 -10.582 1.00 0.00 H new ATOM 0 HB2 ASN A 173 -8.007 -5.599 -12.681 1.00 0.00 H new ATOM 0 HB3 ASN A 173 -6.726 -4.460 -13.042 1.00 0.00 H new ATOM 0 HD21 ASN A 173 -4.084 -6.956 -12.974 1.00 0.00 H new ATOM 0 HD22 ASN A 173 -4.434 -5.242 -12.727 1.00 0.00 H new ATOM 871 N ASN A 174 -8.003 -2.818 -11.033 1.00 0.00 N ATOM 872 CA ASN A 174 -8.098 -1.370 -10.885 1.00 0.00 C ATOM 873 C ASN A 174 -7.816 -0.929 -9.449 1.00 0.00 C ATOM 874 O ASN A 174 -7.254 0.146 -9.288 1.00 0.00 O ATOM 875 CB ASN A 174 -9.424 -0.819 -11.430 1.00 0.00 C ATOM 876 CG ASN A 174 -9.429 -0.846 -12.953 1.00 0.00 C ATOM 877 OD1 ASN A 174 -10.130 -1.776 -13.580 1.00 0.00 O flip ATOM 878 ND2 ASN A 174 -8.744 -0.073 -13.607 1.00 0.00 N flip ATOM 0 H ASN A 174 -8.856 -3.268 -11.365 1.00 0.00 H new ATOM 0 HA ASN A 174 -7.315 -0.929 -11.502 1.00 0.00 H new ATOM 0 HB2 ASN A 174 -10.255 -1.412 -11.047 1.00 0.00 H new ATOM 0 HB3 ASN A 174 -9.572 0.202 -11.078 1.00 0.00 H new ATOM 0 HD21 ASN A 174 -8.199 0.649 -13.136 1.00 0.00 H new ATOM 0 HD22 ASN A 174 -8.718 -0.150 -14.624 1.00 0.00 H new ATOM 885 N PHE A 175 -8.130 -1.747 -8.436 1.00 0.00 N ATOM 886 CA PHE A 175 -7.852 -1.448 -7.036 1.00 0.00 C ATOM 887 C PHE A 175 -6.354 -1.518 -6.766 1.00 0.00 C ATOM 888 O PHE A 175 -5.778 -0.526 -6.340 1.00 0.00 O ATOM 889 CB PHE A 175 -8.676 -2.380 -6.127 1.00 0.00 C ATOM 890 CG PHE A 175 -8.713 -2.050 -4.643 1.00 0.00 C ATOM 891 CD1 PHE A 175 -7.553 -2.155 -3.861 1.00 0.00 C ATOM 892 CD2 PHE A 175 -9.927 -1.706 -4.016 1.00 0.00 C ATOM 893 CE1 PHE A 175 -7.608 -1.939 -2.474 1.00 0.00 C ATOM 894 CE2 PHE A 175 -9.978 -1.493 -2.627 1.00 0.00 C ATOM 895 CZ PHE A 175 -8.822 -1.635 -1.846 1.00 0.00 C ATOM 0 H PHE A 175 -8.591 -2.646 -8.574 1.00 0.00 H new ATOM 0 HA PHE A 175 -8.159 -0.428 -6.806 1.00 0.00 H new ATOM 0 HB2 PHE A 175 -9.702 -2.391 -6.496 1.00 0.00 H new ATOM 0 HB3 PHE A 175 -8.286 -3.392 -6.238 1.00 0.00 H new ATOM 0 HD1 PHE A 175 -6.612 -2.404 -4.328 1.00 0.00 H new ATOM 0 HD2 PHE A 175 -10.825 -1.605 -4.607 1.00 0.00 H new ATOM 0 HE1 PHE A 175 -6.705 -2.008 -1.886 1.00 0.00 H new ATOM 0 HE2 PHE A 175 -10.912 -1.219 -2.159 1.00 0.00 H new ATOM 0 HZ PHE A 175 -8.867 -1.511 -0.774 1.00 0.00 H new ATOM 905 N VAL A 176 -5.687 -2.651 -7.005 1.00 0.00 N ATOM 906 CA VAL A 176 -4.262 -2.806 -6.703 1.00 0.00 C ATOM 907 C VAL A 176 -3.423 -1.793 -7.516 1.00 0.00 C ATOM 908 O VAL A 176 -2.457 -1.220 -6.998 1.00 0.00 O ATOM 909 CB VAL A 176 -3.829 -4.279 -6.873 1.00 0.00 C ATOM 910 CG1 VAL A 176 -2.341 -4.442 -6.532 1.00 0.00 C ATOM 911 CG2 VAL A 176 -4.630 -5.213 -5.934 1.00 0.00 C ATOM 0 H VAL A 176 -6.117 -3.482 -7.411 1.00 0.00 H new ATOM 0 HA VAL A 176 -4.076 -2.566 -5.656 1.00 0.00 H new ATOM 0 HB VAL A 176 -4.019 -4.549 -7.912 1.00 0.00 H new ATOM 0 HG11 VAL A 176 -2.051 -5.485 -6.657 1.00 0.00 H new ATOM 0 HG12 VAL A 176 -1.745 -3.818 -7.198 1.00 0.00 H new ATOM 0 HG13 VAL A 176 -2.169 -4.139 -5.499 1.00 0.00 H new ATOM 0 HG21 VAL A 176 -4.302 -6.242 -6.078 1.00 0.00 H new ATOM 0 HG22 VAL A 176 -4.461 -4.920 -4.898 1.00 0.00 H new ATOM 0 HG23 VAL A 176 -5.693 -5.136 -6.164 1.00 0.00 H new ATOM 921 N HIS A 177 -3.827 -1.510 -8.760 1.00 0.00 N ATOM 922 CA HIS A 177 -3.176 -0.537 -9.632 1.00 0.00 C ATOM 923 C HIS A 177 -3.418 0.915 -9.176 1.00 0.00 C ATOM 924 O HIS A 177 -2.745 1.822 -9.668 1.00 0.00 O ATOM 925 CB HIS A 177 -3.647 -0.734 -11.083 1.00 0.00 C ATOM 926 CG HIS A 177 -3.160 -1.992 -11.779 1.00 0.00 C ATOM 927 ND1 HIS A 177 -2.737 -2.066 -13.091 1.00 0.00 N ATOM 928 CD2 HIS A 177 -3.126 -3.268 -11.278 1.00 0.00 C ATOM 929 CE1 HIS A 177 -2.485 -3.350 -13.385 1.00 0.00 C ATOM 930 NE2 HIS A 177 -2.703 -4.114 -12.305 1.00 0.00 N ATOM 0 H HIS A 177 -4.632 -1.962 -9.193 1.00 0.00 H new ATOM 0 HA HIS A 177 -2.102 -0.711 -9.573 1.00 0.00 H new ATOM 0 HB2 HIS A 177 -4.737 -0.737 -11.092 1.00 0.00 H new ATOM 0 HB3 HIS A 177 -3.326 0.128 -11.668 1.00 0.00 H new ATOM 0 HD1 HIS A 177 -2.634 -1.277 -13.729 1.00 0.00 H new ATOM 0 HD2 HIS A 177 -3.380 -3.565 -10.271 1.00 0.00 H new ATOM 0 HE1 HIS A 177 -2.156 -3.714 -14.347 1.00 0.00 H new ATOM 938 N ASP A 178 -4.346 1.160 -8.248 1.00 0.00 N ATOM 939 CA ASP A 178 -4.515 2.437 -7.549 1.00 0.00 C ATOM 940 C ASP A 178 -3.776 2.392 -6.223 1.00 0.00 C ATOM 941 O ASP A 178 -2.857 3.187 -6.067 1.00 0.00 O ATOM 942 CB ASP A 178 -5.998 2.867 -7.485 1.00 0.00 C ATOM 943 CG ASP A 178 -6.737 2.927 -6.137 1.00 0.00 C ATOM 944 OD1 ASP A 178 -6.208 3.501 -5.170 1.00 0.00 O ATOM 945 OD2 ASP A 178 -7.935 2.552 -6.126 1.00 0.00 O ATOM 0 H ASP A 178 -5.021 0.454 -7.953 1.00 0.00 H new ATOM 0 HA ASP A 178 -4.051 3.244 -8.116 1.00 0.00 H new ATOM 0 HB2 ASP A 178 -6.065 3.859 -7.933 1.00 0.00 H new ATOM 0 HB3 ASP A 178 -6.558 2.188 -8.129 1.00 0.00 H new ATOM 950 N CYS A 179 -4.024 1.391 -5.376 1.00 0.00 N ATOM 951 CA CYS A 179 -3.372 1.139 -4.096 1.00 0.00 C ATOM 952 C CYS A 179 -1.903 1.534 -4.114 1.00 0.00 C ATOM 953 O CYS A 179 -1.442 2.311 -3.276 1.00 0.00 O ATOM 954 CB CYS A 179 -3.395 -0.354 -3.840 1.00 0.00 C ATOM 955 SG CYS A 179 -4.483 -0.889 -2.547 1.00 0.00 S ATOM 0 H CYS A 179 -4.735 0.689 -5.583 1.00 0.00 H new ATOM 0 HA CYS A 179 -3.900 1.720 -3.340 1.00 0.00 H new ATOM 0 HB2 CYS A 179 -3.680 -0.859 -4.763 1.00 0.00 H new ATOM 0 HB3 CYS A 179 -2.383 -0.679 -3.598 1.00 0.00 H new ATOM 960 N VAL A 180 -1.159 0.932 -5.050 1.00 0.00 N ATOM 961 CA VAL A 180 0.266 1.149 -5.172 1.00 0.00 C ATOM 962 C VAL A 180 0.434 2.582 -5.654 1.00 0.00 C ATOM 963 O VAL A 180 0.809 3.426 -4.852 1.00 0.00 O ATOM 964 CB VAL A 180 0.929 0.061 -6.034 1.00 0.00 C ATOM 965 CG1 VAL A 180 2.418 0.338 -6.230 1.00 0.00 C ATOM 966 CG2 VAL A 180 0.821 -1.331 -5.397 1.00 0.00 C ATOM 0 H VAL A 180 -1.539 0.283 -5.739 1.00 0.00 H new ATOM 0 HA VAL A 180 0.796 1.048 -4.225 1.00 0.00 H new ATOM 0 HB VAL A 180 0.397 0.082 -6.985 1.00 0.00 H new ATOM 0 HG11 VAL A 180 2.857 -0.449 -6.843 1.00 0.00 H new ATOM 0 HG12 VAL A 180 2.547 1.300 -6.727 1.00 0.00 H new ATOM 0 HG13 VAL A 180 2.915 0.361 -5.260 1.00 0.00 H new ATOM 0 HG21 VAL A 180 1.303 -2.065 -6.043 1.00 0.00 H new ATOM 0 HG22 VAL A 180 1.312 -1.325 -4.424 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -0.230 -1.593 -5.271 1.00 0.00 H new ATOM 976 N ASN A 181 0.099 2.890 -6.907 1.00 0.00 N ATOM 977 CA ASN A 181 0.373 4.187 -7.536 1.00 0.00 C ATOM 978 C ASN A 181 -0.037 5.399 -6.678 1.00 0.00 C ATOM 979 O ASN A 181 0.575 6.466 -6.752 1.00 0.00 O ATOM 980 CB ASN A 181 -0.379 4.227 -8.881 1.00 0.00 C ATOM 981 CG ASN A 181 0.151 5.250 -9.885 1.00 0.00 C ATOM 982 OD1 ASN A 181 0.403 4.914 -11.038 1.00 0.00 O ATOM 983 ND2 ASN A 181 0.312 6.505 -9.511 1.00 0.00 N ATOM 0 H ASN A 181 -0.379 2.235 -7.526 1.00 0.00 H new ATOM 0 HA ASN A 181 1.452 4.269 -7.666 1.00 0.00 H new ATOM 0 HB2 ASN A 181 -0.334 3.237 -9.335 1.00 0.00 H new ATOM 0 HB3 ASN A 181 -1.430 4.441 -8.687 1.00 0.00 H new ATOM 0 HD21 ASN A 181 0.646 7.198 -10.181 1.00 0.00 H new ATOM 0 HD22 ASN A 181 0.102 6.782 -8.552 1.00 0.00 H new ATOM 990 N ILE A 182 -1.103 5.272 -5.901 1.00 0.00 N ATOM 991 CA ILE A 182 -1.635 6.301 -5.033 1.00 0.00 C ATOM 992 C ILE A 182 -0.791 6.387 -3.776 1.00 0.00 C ATOM 993 O ILE A 182 -0.460 7.503 -3.391 1.00 0.00 O ATOM 994 CB ILE A 182 -3.118 6.024 -4.732 1.00 0.00 C ATOM 995 CG1 ILE A 182 -3.929 6.089 -6.047 1.00 0.00 C ATOM 996 CG2 ILE A 182 -3.674 7.006 -3.684 1.00 0.00 C ATOM 997 CD1 ILE A 182 -4.356 7.489 -6.477 1.00 0.00 C ATOM 0 H ILE A 182 -1.642 4.407 -5.860 1.00 0.00 H new ATOM 0 HA ILE A 182 -1.589 7.271 -5.527 1.00 0.00 H new ATOM 0 HB ILE A 182 -3.209 5.024 -4.307 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -3.333 5.647 -6.845 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -4.821 5.472 -5.936 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -4.724 6.781 -3.496 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -3.110 6.907 -2.757 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -3.583 8.026 -4.057 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -4.918 7.428 -7.409 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -4.983 7.932 -5.703 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -3.472 8.109 -6.627 1.00 0.00 H new ATOM 1009 N THR A 183 -0.425 5.279 -3.135 1.00 0.00 N ATOM 1010 CA THR A 183 0.459 5.306 -1.976 1.00 0.00 C ATOM 1011 C THR A 183 1.864 5.771 -2.395 1.00 0.00 C ATOM 1012 O THR A 183 2.386 6.693 -1.773 1.00 0.00 O ATOM 1013 CB THR A 183 0.445 3.936 -1.287 1.00 0.00 C ATOM 1014 OG1 THR A 183 -0.890 3.555 -1.006 1.00 0.00 O ATOM 1015 CG2 THR A 183 1.227 3.920 0.028 1.00 0.00 C ATOM 0 H THR A 183 -0.731 4.344 -3.403 1.00 0.00 H new ATOM 0 HA THR A 183 0.105 6.030 -1.242 1.00 0.00 H new ATOM 0 HB THR A 183 0.923 3.240 -1.976 1.00 0.00 H new ATOM 0 HG1 THR A 183 -1.233 3.000 -1.737 1.00 0.00 H new ATOM 0 HG21 THR A 183 1.180 2.924 0.467 1.00 0.00 H new ATOM 0 HG22 THR A 183 2.267 4.183 -0.164 1.00 0.00 H new ATOM 0 HG23 THR A 183 0.792 4.642 0.719 1.00 0.00 H new ATOM 1023 N ILE A 184 2.421 5.247 -3.496 1.00 0.00 N ATOM 1024 CA ILE A 184 3.682 5.672 -4.121 1.00 0.00 C ATOM 1025 C ILE A 184 3.597 7.138 -4.621 1.00 0.00 C ATOM 1026 O ILE A 184 4.583 7.689 -5.108 1.00 0.00 O ATOM 1027 CB ILE A 184 4.093 4.668 -5.250 1.00 0.00 C ATOM 1028 CG1 ILE A 184 4.021 3.163 -4.880 1.00 0.00 C ATOM 1029 CG2 ILE A 184 5.531 4.893 -5.760 1.00 0.00 C ATOM 1030 CD1 ILE A 184 4.784 2.731 -3.640 1.00 0.00 C ATOM 0 H ILE A 184 1.982 4.476 -4.000 1.00 0.00 H new ATOM 0 HA ILE A 184 4.472 5.654 -3.370 1.00 0.00 H new ATOM 0 HB ILE A 184 3.341 4.888 -6.008 1.00 0.00 H new ATOM 0 HG12 ILE A 184 2.973 2.895 -4.746 1.00 0.00 H new ATOM 0 HG13 ILE A 184 4.392 2.586 -5.727 1.00 0.00 H new ATOM 0 HG21 ILE A 184 5.758 4.167 -6.541 1.00 0.00 H new ATOM 0 HG22 ILE A 184 5.620 5.901 -6.165 1.00 0.00 H new ATOM 0 HG23 ILE A 184 6.233 4.770 -4.935 1.00 0.00 H new ATOM 0 HD11 ILE A 184 4.655 1.659 -3.489 1.00 0.00 H new ATOM 0 HD12 ILE A 184 5.843 2.955 -3.768 1.00 0.00 H new ATOM 0 HD13 ILE A 184 4.402 3.269 -2.772 1.00 0.00 H new ATOM 1042 N LYS A 185 2.447 7.814 -4.499 1.00 0.00 N ATOM 1043 CA LYS A 185 2.321 9.255 -4.655 1.00 0.00 C ATOM 1044 C LYS A 185 2.144 9.894 -3.289 1.00 0.00 C ATOM 1045 O LYS A 185 2.956 10.728 -2.931 1.00 0.00 O ATOM 1046 CB LYS A 185 1.175 9.575 -5.631 1.00 0.00 C ATOM 1047 CG LYS A 185 0.905 11.091 -5.733 1.00 0.00 C ATOM 1048 CD LYS A 185 -0.573 11.491 -5.811 1.00 0.00 C ATOM 1049 CE LYS A 185 -1.476 10.889 -4.723 1.00 0.00 C ATOM 1050 NZ LYS A 185 -2.860 11.391 -4.842 1.00 0.00 N ATOM 0 H LYS A 185 1.562 7.356 -4.284 1.00 0.00 H new ATOM 0 HA LYS A 185 3.226 9.678 -5.091 1.00 0.00 H new ATOM 0 HB2 LYS A 185 1.421 9.184 -6.618 1.00 0.00 H new ATOM 0 HB3 LYS A 185 0.268 9.067 -5.303 1.00 0.00 H new ATOM 0 HG2 LYS A 185 1.352 11.582 -4.868 1.00 0.00 H new ATOM 0 HG3 LYS A 185 1.415 11.475 -6.616 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -0.641 12.577 -5.756 1.00 0.00 H new ATOM 0 HD3 LYS A 185 -0.961 11.196 -6.786 1.00 0.00 H new ATOM 0 HE2 LYS A 185 -1.472 9.802 -4.803 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -1.079 11.137 -3.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 -3.448 10.969 -4.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 -2.864 12.426 -4.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 -3.244 11.132 -5.773 1.00 0.00 H new ATOM 1064 N GLN A 186 1.106 9.566 -2.521 1.00 0.00 N ATOM 1065 CA GLN A 186 0.778 10.195 -1.249 1.00 0.00 C ATOM 1066 C GLN A 186 1.988 10.165 -0.329 1.00 0.00 C ATOM 1067 O GLN A 186 2.413 11.215 0.134 1.00 0.00 O ATOM 1068 CB GLN A 186 -0.411 9.479 -0.581 1.00 0.00 C ATOM 1069 CG GLN A 186 -1.733 10.243 -0.685 1.00 0.00 C ATOM 1070 CD GLN A 186 -1.687 11.536 0.127 1.00 0.00 C ATOM 1071 OE1 GLN A 186 -1.539 12.631 -0.404 1.00 0.00 O ATOM 1072 NE2 GLN A 186 -1.834 11.453 1.436 1.00 0.00 N ATOM 0 H GLN A 186 0.450 8.829 -2.779 1.00 0.00 H new ATOM 0 HA GLN A 186 0.496 11.231 -1.436 1.00 0.00 H new ATOM 0 HB2 GLN A 186 -0.534 8.497 -1.037 1.00 0.00 H new ATOM 0 HB3 GLN A 186 -0.179 9.315 0.471 1.00 0.00 H new ATOM 0 HG2 GLN A 186 -1.942 10.473 -1.730 1.00 0.00 H new ATOM 0 HG3 GLN A 186 -2.549 9.615 -0.328 1.00 0.00 H new ATOM 0 HE21 GLN A 186 -1.957 10.542 1.879 1.00 0.00 H new ATOM 0 HE22 GLN A 186 -1.824 12.300 2.005 1.00 0.00 H new ATOM 1081 N HIS A 187 2.574 8.988 -0.112 1.00 0.00 N ATOM 1082 CA HIS A 187 3.731 8.812 0.751 1.00 0.00 C ATOM 1083 C HIS A 187 4.996 9.404 0.115 1.00 0.00 C ATOM 1084 O HIS A 187 6.014 9.540 0.787 1.00 0.00 O ATOM 1085 CB HIS A 187 3.884 7.322 1.056 1.00 0.00 C ATOM 1086 CG HIS A 187 4.985 7.009 2.027 1.00 0.00 C ATOM 1087 ND1 HIS A 187 4.946 7.148 3.399 1.00 0.00 N ATOM 1088 CD2 HIS A 187 6.205 6.500 1.683 1.00 0.00 C ATOM 1089 CE1 HIS A 187 6.110 6.676 3.874 1.00 0.00 C ATOM 1090 NE2 HIS A 187 6.902 6.265 2.872 1.00 0.00 N ATOM 0 H HIS A 187 2.250 8.120 -0.539 1.00 0.00 H new ATOM 0 HA HIS A 187 3.582 9.353 1.686 1.00 0.00 H new ATOM 0 HB2 HIS A 187 2.943 6.945 1.455 1.00 0.00 H new ATOM 0 HB3 HIS A 187 4.072 6.788 0.124 1.00 0.00 H new ATOM 0 HD2 HIS A 187 6.564 6.314 0.681 1.00 0.00 H new ATOM 0 HE1 HIS A 187 6.373 6.633 4.921 1.00 0.00 H new ATOM 0 HE2 HIS A 187 7.834 5.859 2.961 1.00 0.00 H new ATOM 1098 N THR A 188 4.916 9.845 -1.134 1.00 0.00 N ATOM 1099 CA THR A 188 5.951 10.558 -1.860 1.00 0.00 C ATOM 1100 C THR A 188 5.596 12.051 -2.016 1.00 0.00 C ATOM 1101 O THR A 188 6.358 12.815 -2.592 1.00 0.00 O ATOM 1102 CB THR A 188 6.237 9.732 -3.129 1.00 0.00 C ATOM 1103 OG1 THR A 188 6.918 8.560 -2.711 1.00 0.00 O ATOM 1104 CG2 THR A 188 7.080 10.398 -4.205 1.00 0.00 C ATOM 0 H THR A 188 4.077 9.705 -1.697 1.00 0.00 H new ATOM 0 HA THR A 188 6.900 10.632 -1.328 1.00 0.00 H new ATOM 0 HB THR A 188 5.268 9.563 -3.598 1.00 0.00 H new ATOM 0 HG1 THR A 188 7.119 8.002 -3.491 1.00 0.00 H new ATOM 0 HG21 THR A 188 7.208 9.713 -5.043 1.00 0.00 H new ATOM 0 HG22 THR A 188 6.581 11.304 -4.549 1.00 0.00 H new ATOM 0 HG23 THR A 188 8.057 10.655 -3.795 1.00 0.00 H new ATOM 1112 N VAL A 189 4.514 12.527 -1.388 1.00 0.00 N ATOM 1113 CA VAL A 189 4.087 13.923 -1.379 1.00 0.00 C ATOM 1114 C VAL A 189 4.081 14.418 0.069 1.00 0.00 C ATOM 1115 O VAL A 189 4.772 15.391 0.375 1.00 0.00 O ATOM 1116 CB VAL A 189 2.735 14.045 -2.122 1.00 0.00 C ATOM 1117 CG1 VAL A 189 2.035 15.391 -1.917 1.00 0.00 C ATOM 1118 CG2 VAL A 189 2.936 13.890 -3.636 1.00 0.00 C ATOM 0 H VAL A 189 3.891 11.923 -0.853 1.00 0.00 H new ATOM 0 HA VAL A 189 4.774 14.574 -1.919 1.00 0.00 H new ATOM 0 HB VAL A 189 2.115 13.253 -1.701 1.00 0.00 H new ATOM 0 HG11 VAL A 189 1.095 15.400 -2.469 1.00 0.00 H new ATOM 0 HG12 VAL A 189 1.835 15.539 -0.856 1.00 0.00 H new ATOM 0 HG13 VAL A 189 2.676 16.194 -2.280 1.00 0.00 H new ATOM 0 HG21 VAL A 189 1.974 13.979 -4.142 1.00 0.00 H new ATOM 0 HG22 VAL A 189 3.608 14.669 -3.995 1.00 0.00 H new ATOM 0 HG23 VAL A 189 3.368 12.912 -3.847 1.00 0.00 H new ATOM 1128 N THR A 190 3.428 13.710 1.001 1.00 0.00 N ATOM 1129 CA THR A 190 3.333 14.039 2.431 1.00 0.00 C ATOM 1130 C THR A 190 4.692 14.053 3.159 1.00 0.00 C ATOM 1131 O THR A 190 4.765 14.273 4.373 1.00 0.00 O ATOM 1132 CB THR A 190 2.377 13.034 3.112 1.00 0.00 C ATOM 1133 OG1 THR A 190 2.779 11.678 2.955 1.00 0.00 O ATOM 1134 CG2 THR A 190 0.939 13.166 2.596 1.00 0.00 C ATOM 0 H THR A 190 2.928 12.852 0.768 1.00 0.00 H new ATOM 0 HA THR A 190 2.948 15.056 2.501 1.00 0.00 H new ATOM 0 HB THR A 190 2.421 13.292 4.170 1.00 0.00 H new ATOM 0 HG1 THR A 190 3.755 11.633 2.880 1.00 0.00 H new ATOM 0 HG21 THR A 190 0.303 12.440 3.102 1.00 0.00 H new ATOM 0 HG22 THR A 190 0.572 14.173 2.796 1.00 0.00 H new ATOM 0 HG23 THR A 190 0.919 12.979 1.522 1.00 0.00 H new ATOM 1142 N THR A 191 5.761 13.738 2.436 1.00 0.00 N ATOM 1143 CA THR A 191 6.990 13.194 2.967 1.00 0.00 C ATOM 1144 C THR A 191 8.141 13.823 2.192 1.00 0.00 C ATOM 1145 O THR A 191 9.057 14.359 2.807 1.00 0.00 O ATOM 1146 CB THR A 191 6.940 11.651 2.875 1.00 0.00 C ATOM 1147 OG1 THR A 191 5.607 11.164 2.796 1.00 0.00 O ATOM 1148 CG2 THR A 191 7.577 10.943 4.066 1.00 0.00 C ATOM 0 H THR A 191 5.789 13.862 1.424 1.00 0.00 H new ATOM 0 HA THR A 191 7.133 13.429 4.022 1.00 0.00 H new ATOM 0 HB THR A 191 7.503 11.431 1.968 1.00 0.00 H new ATOM 0 HG1 THR A 191 5.598 10.311 2.313 1.00 0.00 H new ATOM 0 HG21 THR A 191 7.504 9.864 3.930 1.00 0.00 H new ATOM 0 HG22 THR A 191 8.626 11.229 4.141 1.00 0.00 H new ATOM 0 HG23 THR A 191 7.057 11.229 4.980 1.00 0.00 H new ATOM 1156 N THR A 192 8.063 13.901 0.859 1.00 0.00 N ATOM 1157 CA THR A 192 9.030 14.695 0.099 1.00 0.00 C ATOM 1158 C THR A 192 8.940 16.186 0.483 1.00 0.00 C ATOM 1159 O THR A 192 9.962 16.871 0.528 1.00 0.00 O ATOM 1160 CB THR A 192 8.919 14.393 -1.407 1.00 0.00 C ATOM 1161 OG1 THR A 192 10.166 14.557 -2.052 1.00 0.00 O ATOM 1162 CG2 THR A 192 7.912 15.279 -2.141 1.00 0.00 C ATOM 0 H THR A 192 7.354 13.433 0.294 1.00 0.00 H new ATOM 0 HA THR A 192 10.045 14.402 0.368 1.00 0.00 H new ATOM 0 HB THR A 192 8.576 13.359 -1.455 1.00 0.00 H new ATOM 0 HG1 THR A 192 10.759 13.815 -1.811 1.00 0.00 H new ATOM 0 HG21 THR A 192 7.890 15.007 -3.196 1.00 0.00 H new ATOM 0 HG22 THR A 192 6.921 15.139 -1.709 1.00 0.00 H new ATOM 0 HG23 THR A 192 8.206 16.324 -2.042 1.00 0.00 H new ATOM 1170 N THR A 193 7.760 16.643 0.928 1.00 0.00 N ATOM 1171 CA THR A 193 7.534 17.918 1.614 1.00 0.00 C ATOM 1172 C THR A 193 8.500 18.148 2.789 1.00 0.00 C ATOM 1173 O THR A 193 8.723 19.283 3.213 1.00 0.00 O ATOM 1174 CB THR A 193 6.069 17.911 2.089 1.00 0.00 C ATOM 1175 OG1 THR A 193 5.200 17.949 0.973 1.00 0.00 O ATOM 1176 CG2 THR A 193 5.683 19.071 3.001 1.00 0.00 C ATOM 0 H THR A 193 6.900 16.107 0.813 1.00 0.00 H new ATOM 0 HA THR A 193 7.726 18.742 0.927 1.00 0.00 H new ATOM 0 HB THR A 193 5.972 16.993 2.668 1.00 0.00 H new ATOM 0 HG1 THR A 193 4.793 17.067 0.845 1.00 0.00 H new ATOM 0 HG21 THR A 193 4.634 18.979 3.282 1.00 0.00 H new ATOM 0 HG22 THR A 193 6.302 19.050 3.898 1.00 0.00 H new ATOM 0 HG23 THR A 193 5.837 20.014 2.476 1.00 0.00 H new ATOM 1184 N LYS A 194 9.060 17.078 3.346 1.00 0.00 N ATOM 1185 CA LYS A 194 9.769 17.079 4.606 1.00 0.00 C ATOM 1186 C LYS A 194 11.168 16.501 4.508 1.00 0.00 C ATOM 1187 O LYS A 194 11.928 16.705 5.455 1.00 0.00 O ATOM 1188 CB LYS A 194 8.952 16.294 5.629 1.00 0.00 C ATOM 1189 CG LYS A 194 7.658 17.020 6.037 1.00 0.00 C ATOM 1190 CD LYS A 194 6.859 16.263 7.105 1.00 0.00 C ATOM 1191 CE LYS A 194 7.727 15.549 8.152 1.00 0.00 C ATOM 1192 NZ LYS A 194 8.329 16.457 9.150 1.00 0.00 N ATOM 0 H LYS A 194 9.027 16.156 2.910 1.00 0.00 H new ATOM 0 HA LYS A 194 9.889 18.118 4.914 1.00 0.00 H new ATOM 0 HB2 LYS A 194 8.701 15.317 5.215 1.00 0.00 H new ATOM 0 HB3 LYS A 194 9.560 16.118 6.516 1.00 0.00 H new ATOM 0 HG2 LYS A 194 7.907 18.012 6.413 1.00 0.00 H new ATOM 0 HG3 LYS A 194 7.033 17.161 5.155 1.00 0.00 H new ATOM 0 HD2 LYS A 194 6.199 16.965 7.614 1.00 0.00 H new ATOM 0 HD3 LYS A 194 6.223 15.527 6.613 1.00 0.00 H new ATOM 0 HE2 LYS A 194 7.118 14.808 8.670 1.00 0.00 H new ATOM 0 HE3 LYS A 194 8.523 15.007 7.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 8.899 15.905 9.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 8.936 17.150 8.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 7.575 16.956 9.664 1.00 0.00 H new ATOM 1206 N GLY A 195 11.527 15.811 3.424 1.00 0.00 N ATOM 1207 CA GLY A 195 12.860 15.254 3.278 1.00 0.00 C ATOM 1208 C GLY A 195 12.970 14.022 2.404 1.00 0.00 C ATOM 1209 O GLY A 195 14.066 13.674 1.962 1.00 0.00 O ATOM 0 H GLY A 195 10.906 15.628 2.636 1.00 0.00 H new ATOM 0 HA2 GLY A 195 13.512 16.025 2.869 1.00 0.00 H new ATOM 0 HA3 GLY A 195 13.240 15.008 4.269 1.00 0.00 H new ATOM 1213 N GLU A 196 11.853 13.359 2.169 1.00 0.00 N ATOM 1214 CA GLU A 196 11.821 12.068 1.508 1.00 0.00 C ATOM 1215 C GLU A 196 12.061 12.197 0.000 1.00 0.00 C ATOM 1216 O GLU A 196 11.874 13.269 -0.579 1.00 0.00 O ATOM 1217 CB GLU A 196 10.440 11.479 1.799 1.00 0.00 C ATOM 1218 CG GLU A 196 10.467 10.019 2.248 1.00 0.00 C ATOM 1219 CD GLU A 196 10.834 9.879 3.739 1.00 0.00 C ATOM 1220 OE1 GLU A 196 11.575 10.737 4.271 1.00 0.00 O ATOM 1221 OE2 GLU A 196 10.293 8.988 4.433 1.00 0.00 O ATOM 0 H GLU A 196 10.932 13.706 2.435 1.00 0.00 H new ATOM 0 HA GLU A 196 12.616 11.421 1.879 1.00 0.00 H new ATOM 0 HB2 GLU A 196 9.957 12.077 2.572 1.00 0.00 H new ATOM 0 HB3 GLU A 196 9.826 11.561 0.902 1.00 0.00 H new ATOM 0 HG2 GLU A 196 9.491 9.567 2.071 1.00 0.00 H new ATOM 0 HG3 GLU A 196 11.188 9.467 1.644 1.00 0.00 H new ATOM 1228 N ASN A 197 12.397 11.090 -0.661 1.00 0.00 N ATOM 1229 CA ASN A 197 12.441 10.986 -2.119 1.00 0.00 C ATOM 1230 C ASN A 197 12.070 9.579 -2.551 1.00 0.00 C ATOM 1231 O ASN A 197 11.140 9.415 -3.341 1.00 0.00 O ATOM 1232 CB ASN A 197 13.837 11.323 -2.652 1.00 0.00 C ATOM 1233 CG ASN A 197 13.887 11.517 -4.166 1.00 0.00 C ATOM 1234 OD1 ASN A 197 13.600 10.527 -4.997 1.00 0.00 O flip ATOM 1235 ND2 ASN A 197 14.246 12.597 -4.618 1.00 0.00 N flip ATOM 0 H ASN A 197 12.651 10.223 -0.188 1.00 0.00 H new ATOM 0 HA ASN A 197 11.726 11.700 -2.528 1.00 0.00 H new ATOM 0 HB2 ASN A 197 14.192 12.232 -2.166 1.00 0.00 H new ATOM 0 HB3 ASN A 197 14.525 10.524 -2.374 1.00 0.00 H new ATOM 0 HD21 ASN A 197 14.469 13.366 -3.986 1.00 0.00 H new ATOM 0 HD22 ASN A 197 14.322 12.728 -5.627 1.00 0.00 H new ATOM 1242 N PHE A 198 12.794 8.589 -2.013 1.00 0.00 N ATOM 1243 CA PHE A 198 12.846 7.192 -2.429 1.00 0.00 C ATOM 1244 C PHE A 198 13.359 7.040 -3.866 1.00 0.00 C ATOM 1245 O PHE A 198 12.792 7.611 -4.796 1.00 0.00 O ATOM 1246 CB PHE A 198 11.484 6.509 -2.210 1.00 0.00 C ATOM 1247 CG PHE A 198 11.032 6.452 -0.763 1.00 0.00 C ATOM 1248 CD1 PHE A 198 11.737 5.683 0.185 1.00 0.00 C ATOM 1249 CD2 PHE A 198 9.883 7.155 -0.364 1.00 0.00 C ATOM 1250 CE1 PHE A 198 11.268 5.586 1.507 1.00 0.00 C ATOM 1251 CE2 PHE A 198 9.443 7.099 0.966 1.00 0.00 C ATOM 1252 CZ PHE A 198 10.130 6.309 1.900 1.00 0.00 C ATOM 0 H PHE A 198 13.404 8.763 -1.214 1.00 0.00 H new ATOM 0 HA PHE A 198 13.571 6.678 -1.798 1.00 0.00 H new ATOM 0 HB2 PHE A 198 10.729 7.038 -2.792 1.00 0.00 H new ATOM 0 HB3 PHE A 198 11.535 5.493 -2.602 1.00 0.00 H new ATOM 0 HD1 PHE A 198 12.640 5.167 -0.105 1.00 0.00 H new ATOM 0 HD2 PHE A 198 9.335 7.742 -1.086 1.00 0.00 H new ATOM 0 HE1 PHE A 198 11.782 4.957 2.219 1.00 0.00 H new ATOM 0 HE2 PHE A 198 8.575 7.664 1.272 1.00 0.00 H new ATOM 0 HZ PHE A 198 9.784 6.257 2.922 1.00 0.00 H new ATOM 1262 N THR A 199 14.442 6.286 -4.055 1.00 0.00 N ATOM 1263 CA THR A 199 14.926 5.907 -5.379 1.00 0.00 C ATOM 1264 C THR A 199 14.196 4.657 -5.892 1.00 0.00 C ATOM 1265 O THR A 199 13.411 4.052 -5.169 1.00 0.00 O ATOM 1266 CB THR A 199 16.458 5.719 -5.357 1.00 0.00 C ATOM 1267 OG1 THR A 199 17.043 5.439 -4.088 1.00 0.00 O ATOM 1268 CG2 THR A 199 17.112 7.017 -5.819 1.00 0.00 C ATOM 0 H THR A 199 15.009 5.920 -3.290 1.00 0.00 H new ATOM 0 HA THR A 199 14.705 6.713 -6.079 1.00 0.00 H new ATOM 0 HB THR A 199 16.629 4.853 -5.996 1.00 0.00 H new ATOM 0 HG1 THR A 199 16.592 4.669 -3.683 1.00 0.00 H new ATOM 0 HG21 THR A 199 18.196 6.902 -5.809 1.00 0.00 H new ATOM 0 HG22 THR A 199 16.781 7.251 -6.831 1.00 0.00 H new ATOM 0 HG23 THR A 199 16.827 7.827 -5.147 1.00 0.00 H new ATOM 1276 N GLU A 200 14.480 4.221 -7.121 1.00 0.00 N ATOM 1277 CA GLU A 200 13.912 3.041 -7.748 1.00 0.00 C ATOM 1278 C GLU A 200 14.066 1.806 -6.863 1.00 0.00 C ATOM 1279 O GLU A 200 13.102 1.055 -6.718 1.00 0.00 O ATOM 1280 CB GLU A 200 14.591 2.866 -9.112 1.00 0.00 C ATOM 1281 CG GLU A 200 14.305 1.516 -9.773 1.00 0.00 C ATOM 1282 CD GLU A 200 14.687 1.466 -11.258 1.00 0.00 C ATOM 1283 OE1 GLU A 200 15.537 2.264 -11.726 1.00 0.00 O ATOM 1284 OE2 GLU A 200 14.064 0.662 -11.991 1.00 0.00 O ATOM 0 H GLU A 200 15.141 4.707 -7.727 1.00 0.00 H new ATOM 0 HA GLU A 200 12.838 3.167 -7.888 1.00 0.00 H new ATOM 0 HB2 GLU A 200 14.261 3.664 -9.777 1.00 0.00 H new ATOM 0 HB3 GLU A 200 15.668 2.979 -8.989 1.00 0.00 H new ATOM 0 HG2 GLU A 200 14.850 0.737 -9.240 1.00 0.00 H new ATOM 0 HG3 GLU A 200 13.244 1.289 -9.672 1.00 0.00 H new ATOM 1291 N THR A 201 15.239 1.589 -6.256 1.00 0.00 N ATOM 1292 CA THR A 201 15.414 0.402 -5.430 1.00 0.00 C ATOM 1293 C THR A 201 14.524 0.467 -4.177 1.00 0.00 C ATOM 1294 O THR A 201 14.045 -0.565 -3.716 1.00 0.00 O ATOM 1295 CB THR A 201 16.892 0.170 -5.070 1.00 0.00 C ATOM 1296 OG1 THR A 201 17.703 0.213 -6.227 1.00 0.00 O ATOM 1297 CG2 THR A 201 17.149 -1.195 -4.420 1.00 0.00 C ATOM 0 H THR A 201 16.053 2.201 -6.320 1.00 0.00 H new ATOM 0 HA THR A 201 15.095 -0.459 -6.017 1.00 0.00 H new ATOM 0 HB THR A 201 17.138 0.965 -4.365 1.00 0.00 H new ATOM 0 HG1 THR A 201 18.639 0.065 -5.976 1.00 0.00 H new ATOM 0 HG21 THR A 201 18.210 -1.295 -4.191 1.00 0.00 H new ATOM 0 HG22 THR A 201 16.570 -1.275 -3.500 1.00 0.00 H new ATOM 0 HG23 THR A 201 16.850 -1.987 -5.106 1.00 0.00 H new ATOM 1305 N ASP A 202 14.268 1.663 -3.637 1.00 0.00 N ATOM 1306 CA ASP A 202 13.378 1.864 -2.495 1.00 0.00 C ATOM 1307 C ASP A 202 11.954 1.589 -2.943 1.00 0.00 C ATOM 1308 O ASP A 202 11.242 0.809 -2.320 1.00 0.00 O ATOM 1309 CB ASP A 202 13.405 3.303 -1.972 1.00 0.00 C ATOM 1310 CG ASP A 202 14.766 3.799 -1.534 1.00 0.00 C ATOM 1311 OD1 ASP A 202 15.584 4.108 -2.435 1.00 0.00 O ATOM 1312 OD2 ASP A 202 15.017 3.845 -0.315 1.00 0.00 O ATOM 0 H ASP A 202 14.680 2.528 -3.987 1.00 0.00 H new ATOM 0 HA ASP A 202 13.714 1.195 -1.703 1.00 0.00 H new ATOM 0 HB2 ASP A 202 13.028 3.964 -2.752 1.00 0.00 H new ATOM 0 HB3 ASP A 202 12.718 3.380 -1.129 1.00 0.00 H new ATOM 1317 N VAL A 203 11.549 2.226 -4.041 1.00 0.00 N ATOM 1318 CA VAL A 203 10.244 2.092 -4.653 1.00 0.00 C ATOM 1319 C VAL A 203 9.940 0.630 -4.948 1.00 0.00 C ATOM 1320 O VAL A 203 8.833 0.209 -4.647 1.00 0.00 O ATOM 1321 CB VAL A 203 10.171 3.004 -5.894 1.00 0.00 C ATOM 1322 CG1 VAL A 203 9.025 2.652 -6.851 1.00 0.00 C ATOM 1323 CG2 VAL A 203 10.028 4.470 -5.459 1.00 0.00 C ATOM 0 H VAL A 203 12.154 2.876 -4.544 1.00 0.00 H new ATOM 0 HA VAL A 203 9.464 2.421 -3.967 1.00 0.00 H new ATOM 0 HB VAL A 203 11.102 2.847 -6.439 1.00 0.00 H new ATOM 0 HG11 VAL A 203 9.037 3.336 -7.700 1.00 0.00 H new ATOM 0 HG12 VAL A 203 9.149 1.629 -7.207 1.00 0.00 H new ATOM 0 HG13 VAL A 203 8.073 2.741 -6.327 1.00 0.00 H new ATOM 0 HG21 VAL A 203 9.977 5.108 -6.341 1.00 0.00 H new ATOM 0 HG22 VAL A 203 9.117 4.588 -4.873 1.00 0.00 H new ATOM 0 HG23 VAL A 203 10.888 4.756 -4.854 1.00 0.00 H new ATOM 1333 N LYS A 204 10.884 -0.166 -5.456 1.00 0.00 N ATOM 1334 CA LYS A 204 10.672 -1.596 -5.669 1.00 0.00 C ATOM 1335 C LYS A 204 10.192 -2.256 -4.377 1.00 0.00 C ATOM 1336 O LYS A 204 9.250 -3.047 -4.407 1.00 0.00 O ATOM 1337 CB LYS A 204 11.984 -2.222 -6.188 1.00 0.00 C ATOM 1338 CG LYS A 204 11.918 -3.751 -6.349 1.00 0.00 C ATOM 1339 CD LYS A 204 13.260 -4.379 -6.769 1.00 0.00 C ATOM 1340 CE LYS A 204 13.575 -4.043 -8.237 1.00 0.00 C ATOM 1341 NZ LYS A 204 14.891 -4.557 -8.663 1.00 0.00 N ATOM 0 H LYS A 204 11.810 0.162 -5.729 1.00 0.00 H new ATOM 0 HA LYS A 204 9.895 -1.757 -6.416 1.00 0.00 H new ATOM 0 HB2 LYS A 204 12.234 -1.775 -7.150 1.00 0.00 H new ATOM 0 HB3 LYS A 204 12.792 -1.972 -5.501 1.00 0.00 H new ATOM 0 HG2 LYS A 204 11.596 -4.195 -5.407 1.00 0.00 H new ATOM 0 HG3 LYS A 204 11.161 -3.998 -7.093 1.00 0.00 H new ATOM 0 HD2 LYS A 204 14.059 -4.010 -6.126 1.00 0.00 H new ATOM 0 HD3 LYS A 204 13.219 -5.460 -6.638 1.00 0.00 H new ATOM 0 HE2 LYS A 204 12.799 -4.463 -8.877 1.00 0.00 H new ATOM 0 HE3 LYS A 204 13.549 -2.962 -8.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 14.866 -4.775 -9.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 15.620 -3.838 -8.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 15.116 -5.421 -8.129 1.00 0.00 H new ATOM 1355 N MET A 205 10.825 -1.942 -3.248 1.00 0.00 N ATOM 1356 CA MET A 205 10.429 -2.482 -1.960 1.00 0.00 C ATOM 1357 C MET A 205 9.072 -1.938 -1.545 1.00 0.00 C ATOM 1358 O MET A 205 8.233 -2.701 -1.068 1.00 0.00 O ATOM 1359 CB MET A 205 11.473 -2.137 -0.894 1.00 0.00 C ATOM 1360 CG MET A 205 12.889 -2.603 -1.234 1.00 0.00 C ATOM 1361 SD MET A 205 12.938 -4.242 -1.983 1.00 0.00 S ATOM 1362 CE MET A 205 14.627 -4.364 -2.572 1.00 0.00 C ATOM 0 H MET A 205 11.623 -1.308 -3.206 1.00 0.00 H new ATOM 0 HA MET A 205 10.359 -3.566 -2.053 1.00 0.00 H new ATOM 0 HB2 MET A 205 11.483 -1.057 -0.746 1.00 0.00 H new ATOM 0 HB3 MET A 205 11.172 -2.585 0.053 1.00 0.00 H new ATOM 0 HG2 MET A 205 13.347 -1.886 -1.915 1.00 0.00 H new ATOM 0 HG3 MET A 205 13.491 -2.608 -0.325 1.00 0.00 H new ATOM 0 HE1 MET A 205 14.687 -5.124 -3.351 1.00 0.00 H new ATOM 0 HE2 MET A 205 14.941 -3.403 -2.978 1.00 0.00 H new ATOM 0 HE3 MET A 205 15.282 -4.640 -1.745 1.00 0.00 H new ATOM 1372 N MET A 206 8.863 -0.630 -1.699 1.00 0.00 N ATOM 1373 CA MET A 206 7.641 0.044 -1.302 1.00 0.00 C ATOM 1374 C MET A 206 6.463 -0.540 -2.068 1.00 0.00 C ATOM 1375 O MET A 206 5.452 -0.840 -1.446 1.00 0.00 O ATOM 1376 CB MET A 206 7.740 1.551 -1.594 1.00 0.00 C ATOM 1377 CG MET A 206 6.918 2.376 -0.598 1.00 0.00 C ATOM 1378 SD MET A 206 6.477 4.070 -1.080 1.00 0.00 S ATOM 1379 CE MET A 206 8.061 4.705 -1.691 1.00 0.00 C ATOM 0 H MET A 206 9.555 -0.004 -2.111 1.00 0.00 H new ATOM 0 HA MET A 206 7.494 -0.101 -0.232 1.00 0.00 H new ATOM 0 HB2 MET A 206 8.784 1.862 -1.551 1.00 0.00 H new ATOM 0 HB3 MET A 206 7.390 1.749 -2.607 1.00 0.00 H new ATOM 0 HG2 MET A 206 5.995 1.833 -0.392 1.00 0.00 H new ATOM 0 HG3 MET A 206 7.474 2.426 0.338 1.00 0.00 H new ATOM 0 HE1 MET A 206 7.964 5.766 -1.920 1.00 0.00 H new ATOM 0 HE2 MET A 206 8.827 4.567 -0.928 1.00 0.00 H new ATOM 0 HE3 MET A 206 8.346 4.164 -2.593 1.00 0.00 H new ATOM 1389 N GLU A 207 6.587 -0.724 -3.386 1.00 0.00 N ATOM 1390 CA GLU A 207 5.514 -1.203 -4.233 1.00 0.00 C ATOM 1391 C GLU A 207 5.034 -2.542 -3.702 1.00 0.00 C ATOM 1392 O GLU A 207 3.838 -2.735 -3.523 1.00 0.00 O ATOM 1393 CB GLU A 207 5.931 -1.377 -5.706 1.00 0.00 C ATOM 1394 CG GLU A 207 6.260 -0.086 -6.473 1.00 0.00 C ATOM 1395 CD GLU A 207 5.587 -0.018 -7.849 1.00 0.00 C ATOM 1396 OE1 GLU A 207 5.783 -0.954 -8.661 1.00 0.00 O ATOM 1397 OE2 GLU A 207 4.835 0.940 -8.147 1.00 0.00 O ATOM 0 H GLU A 207 7.453 -0.539 -3.893 1.00 0.00 H new ATOM 0 HA GLU A 207 4.726 -0.450 -4.209 1.00 0.00 H new ATOM 0 HB2 GLU A 207 6.804 -2.029 -5.741 1.00 0.00 H new ATOM 0 HB3 GLU A 207 5.127 -1.893 -6.231 1.00 0.00 H new ATOM 0 HG2 GLU A 207 5.947 0.773 -5.879 1.00 0.00 H new ATOM 0 HG3 GLU A 207 7.340 -0.010 -6.599 1.00 0.00 H new ATOM 1404 N ARG A 208 5.970 -3.447 -3.403 1.00 0.00 N ATOM 1405 CA ARG A 208 5.672 -4.764 -2.870 1.00 0.00 C ATOM 1406 C ARG A 208 5.002 -4.632 -1.511 1.00 0.00 C ATOM 1407 O ARG A 208 3.947 -5.220 -1.297 1.00 0.00 O ATOM 1408 CB ARG A 208 6.973 -5.572 -2.783 1.00 0.00 C ATOM 1409 CG ARG A 208 7.635 -5.941 -4.131 1.00 0.00 C ATOM 1410 CD ARG A 208 6.817 -6.911 -5.003 1.00 0.00 C ATOM 1411 NE ARG A 208 5.714 -6.262 -5.744 1.00 0.00 N ATOM 1412 CZ ARG A 208 5.753 -5.393 -6.763 1.00 0.00 C ATOM 1413 NH1 ARG A 208 6.901 -4.978 -7.295 1.00 0.00 N ATOM 1414 NH2 ARG A 208 4.598 -4.938 -7.228 1.00 0.00 N ATOM 0 H ARG A 208 6.968 -3.276 -3.529 1.00 0.00 H new ATOM 0 HA ARG A 208 4.981 -5.291 -3.528 1.00 0.00 H new ATOM 0 HB2 ARG A 208 7.691 -5.004 -2.192 1.00 0.00 H new ATOM 0 HB3 ARG A 208 6.769 -6.493 -2.237 1.00 0.00 H new ATOM 0 HG2 ARG A 208 7.812 -5.026 -4.696 1.00 0.00 H new ATOM 0 HG3 ARG A 208 8.610 -6.386 -3.932 1.00 0.00 H new ATOM 0 HD2 ARG A 208 7.485 -7.396 -5.715 1.00 0.00 H new ATOM 0 HD3 ARG A 208 6.404 -7.695 -4.368 1.00 0.00 H new ATOM 0 HE ARG A 208 4.777 -6.516 -5.430 1.00 0.00 H new ATOM 0 HH11 ARG A 208 7.788 -5.323 -6.927 1.00 0.00 H new ATOM 0 HH12 ARG A 208 6.894 -4.315 -8.070 1.00 0.00 H new ATOM 0 HH21 ARG A 208 3.721 -5.251 -6.811 1.00 0.00 H new ATOM 0 HH22 ARG A 208 4.586 -4.275 -8.003 1.00 0.00 H new ATOM 1428 N VAL A 209 5.597 -3.888 -0.577 1.00 0.00 N ATOM 1429 CA VAL A 209 5.072 -3.727 0.775 1.00 0.00 C ATOM 1430 C VAL A 209 3.635 -3.196 0.740 1.00 0.00 C ATOM 1431 O VAL A 209 2.776 -3.684 1.475 1.00 0.00 O ATOM 1432 CB VAL A 209 6.073 -2.884 1.605 1.00 0.00 C ATOM 1433 CG1 VAL A 209 5.664 -1.465 1.984 1.00 0.00 C ATOM 1434 CG2 VAL A 209 6.437 -3.562 2.913 1.00 0.00 C ATOM 0 H VAL A 209 6.464 -3.377 -0.742 1.00 0.00 H new ATOM 0 HA VAL A 209 4.988 -4.687 1.284 1.00 0.00 H new ATOM 0 HB VAL A 209 6.901 -2.810 0.899 1.00 0.00 H new ATOM 0 HG11 VAL A 209 6.462 -0.998 2.562 1.00 0.00 H new ATOM 0 HG12 VAL A 209 5.484 -0.884 1.079 1.00 0.00 H new ATOM 0 HG13 VAL A 209 4.753 -1.496 2.582 1.00 0.00 H new ATOM 0 HG21 VAL A 209 7.141 -2.937 3.463 1.00 0.00 H new ATOM 0 HG22 VAL A 209 5.537 -3.707 3.510 1.00 0.00 H new ATOM 0 HG23 VAL A 209 6.895 -4.529 2.706 1.00 0.00 H new ATOM 1444 N VAL A 210 3.372 -2.208 -0.111 1.00 0.00 N ATOM 1445 CA VAL A 210 2.074 -1.597 -0.312 1.00 0.00 C ATOM 1446 C VAL A 210 1.146 -2.605 -0.991 1.00 0.00 C ATOM 1447 O VAL A 210 0.003 -2.731 -0.569 1.00 0.00 O ATOM 1448 CB VAL A 210 2.293 -0.291 -1.104 1.00 0.00 C ATOM 1449 CG1 VAL A 210 1.018 0.348 -1.652 1.00 0.00 C ATOM 1450 CG2 VAL A 210 2.994 0.759 -0.217 1.00 0.00 C ATOM 0 H VAL A 210 4.094 -1.798 -0.703 1.00 0.00 H new ATOM 0 HA VAL A 210 1.582 -1.329 0.623 1.00 0.00 H new ATOM 0 HB VAL A 210 2.904 -0.586 -1.957 1.00 0.00 H new ATOM 0 HG11 VAL A 210 1.271 1.260 -2.193 1.00 0.00 H new ATOM 0 HG12 VAL A 210 0.523 -0.349 -2.328 1.00 0.00 H new ATOM 0 HG13 VAL A 210 0.349 0.590 -0.827 1.00 0.00 H new ATOM 0 HG21 VAL A 210 3.143 1.676 -0.787 1.00 0.00 H new ATOM 0 HG22 VAL A 210 2.375 0.970 0.655 1.00 0.00 H new ATOM 0 HG23 VAL A 210 3.960 0.373 0.109 1.00 0.00 H new ATOM 1460 N GLU A 211 1.602 -3.358 -1.990 1.00 0.00 N ATOM 1461 CA GLU A 211 0.803 -4.355 -2.685 1.00 0.00 C ATOM 1462 C GLU A 211 0.377 -5.460 -1.717 1.00 0.00 C ATOM 1463 O GLU A 211 -0.799 -5.805 -1.678 1.00 0.00 O ATOM 1464 CB GLU A 211 1.592 -4.936 -3.863 1.00 0.00 C ATOM 1465 CG GLU A 211 0.729 -5.821 -4.774 1.00 0.00 C ATOM 1466 CD GLU A 211 1.552 -6.642 -5.768 1.00 0.00 C ATOM 1467 OE1 GLU A 211 2.796 -6.496 -5.813 1.00 0.00 O ATOM 1468 OE2 GLU A 211 0.966 -7.523 -6.441 1.00 0.00 O ATOM 0 H GLU A 211 2.556 -3.288 -2.343 1.00 0.00 H new ATOM 0 HA GLU A 211 -0.096 -3.879 -3.076 1.00 0.00 H new ATOM 0 HB2 GLU A 211 2.015 -4.120 -4.450 1.00 0.00 H new ATOM 0 HB3 GLU A 211 2.429 -5.521 -3.482 1.00 0.00 H new ATOM 0 HG2 GLU A 211 0.135 -6.496 -4.158 1.00 0.00 H new ATOM 0 HG3 GLU A 211 0.028 -5.192 -5.324 1.00 0.00 H new ATOM 1475 N GLN A 212 1.285 -6.023 -0.913 1.00 0.00 N ATOM 1476 CA GLN A 212 0.942 -7.141 -0.043 1.00 0.00 C ATOM 1477 C GLN A 212 -0.058 -6.733 1.049 1.00 0.00 C ATOM 1478 O GLN A 212 -0.834 -7.559 1.538 1.00 0.00 O ATOM 1479 CB GLN A 212 2.245 -7.680 0.559 1.00 0.00 C ATOM 1480 CG GLN A 212 2.185 -9.141 1.027 1.00 0.00 C ATOM 1481 CD GLN A 212 2.230 -10.066 -0.184 1.00 0.00 C ATOM 1482 OE1 GLN A 212 1.278 -10.125 -0.958 1.00 0.00 O ATOM 1483 NE2 GLN A 212 3.338 -10.740 -0.435 1.00 0.00 N ATOM 0 H GLN A 212 2.257 -5.721 -0.850 1.00 0.00 H new ATOM 0 HA GLN A 212 0.446 -7.920 -0.622 1.00 0.00 H new ATOM 0 HB2 GLN A 212 3.038 -7.584 -0.183 1.00 0.00 H new ATOM 0 HB3 GLN A 212 2.523 -7.053 1.406 1.00 0.00 H new ATOM 0 HG2 GLN A 212 3.021 -9.355 1.693 1.00 0.00 H new ATOM 0 HG3 GLN A 212 1.272 -9.314 1.596 1.00 0.00 H new ATOM 0 HE21 GLN A 212 4.125 -10.687 0.212 1.00 0.00 H new ATOM 0 HE22 GLN A 212 3.407 -11.314 -1.276 1.00 0.00 H new ATOM 1492 N MET A 213 -0.057 -5.454 1.425 1.00 0.00 N ATOM 1493 CA MET A 213 -1.079 -4.859 2.271 1.00 0.00 C ATOM 1494 C MET A 213 -2.360 -4.611 1.478 1.00 0.00 C ATOM 1495 O MET A 213 -3.451 -4.889 1.972 1.00 0.00 O ATOM 1496 CB MET A 213 -0.540 -3.543 2.825 1.00 0.00 C ATOM 1497 CG MET A 213 0.506 -3.804 3.905 1.00 0.00 C ATOM 1498 SD MET A 213 0.879 -2.314 4.846 1.00 0.00 S ATOM 1499 CE MET A 213 1.605 -1.249 3.584 1.00 0.00 C ATOM 0 H MET A 213 0.669 -4.795 1.143 1.00 0.00 H new ATOM 0 HA MET A 213 -1.319 -5.540 3.088 1.00 0.00 H new ATOM 0 HB2 MET A 213 -0.100 -2.956 2.019 1.00 0.00 H new ATOM 0 HB3 MET A 213 -1.358 -2.954 3.238 1.00 0.00 H new ATOM 0 HG2 MET A 213 0.146 -4.580 4.580 1.00 0.00 H new ATOM 0 HG3 MET A 213 1.419 -4.181 3.444 1.00 0.00 H new ATOM 0 HE1 MET A 213 1.865 -0.287 4.026 1.00 0.00 H new ATOM 0 HE2 MET A 213 2.503 -1.719 3.183 1.00 0.00 H new ATOM 0 HE3 MET A 213 0.886 -1.096 2.779 1.00 0.00 H new ATOM 1509 N CYS A 214 -2.246 -4.108 0.251 1.00 0.00 N ATOM 1510 CA CYS A 214 -3.364 -3.823 -0.626 1.00 0.00 C ATOM 1511 C CYS A 214 -4.196 -5.072 -0.870 1.00 0.00 C ATOM 1512 O CYS A 214 -5.414 -5.024 -0.744 1.00 0.00 O ATOM 1513 CB CYS A 214 -2.881 -3.292 -1.970 1.00 0.00 C ATOM 1514 SG CYS A 214 -4.300 -2.846 -2.958 1.00 0.00 S ATOM 0 H CYS A 214 -1.343 -3.883 -0.167 1.00 0.00 H new ATOM 0 HA CYS A 214 -3.975 -3.067 -0.132 1.00 0.00 H new ATOM 0 HB2 CYS A 214 -2.236 -2.426 -1.823 1.00 0.00 H new ATOM 0 HB3 CYS A 214 -2.287 -4.048 -2.483 1.00 0.00 H new ATOM 1519 N VAL A 215 -3.548 -6.192 -1.187 1.00 0.00 N ATOM 1520 CA VAL A 215 -4.200 -7.467 -1.427 1.00 0.00 C ATOM 1521 C VAL A 215 -5.064 -7.836 -0.222 1.00 0.00 C ATOM 1522 O VAL A 215 -6.153 -8.365 -0.395 1.00 0.00 O ATOM 1523 CB VAL A 215 -3.123 -8.518 -1.767 1.00 0.00 C ATOM 1524 CG1 VAL A 215 -3.669 -9.946 -1.801 1.00 0.00 C ATOM 1525 CG2 VAL A 215 -2.540 -8.237 -3.154 1.00 0.00 C ATOM 0 H VAL A 215 -2.534 -6.233 -1.285 1.00 0.00 H new ATOM 0 HA VAL A 215 -4.876 -7.415 -2.280 1.00 0.00 H new ATOM 0 HB VAL A 215 -2.373 -8.441 -0.980 1.00 0.00 H new ATOM 0 HG11 VAL A 215 -2.863 -10.638 -2.046 1.00 0.00 H new ATOM 0 HG12 VAL A 215 -4.082 -10.201 -0.825 1.00 0.00 H new ATOM 0 HG13 VAL A 215 -4.451 -10.019 -2.557 1.00 0.00 H new ATOM 0 HG21 VAL A 215 -1.780 -8.983 -3.387 1.00 0.00 H new ATOM 0 HG22 VAL A 215 -3.335 -8.283 -3.899 1.00 0.00 H new ATOM 0 HG23 VAL A 215 -2.089 -7.245 -3.165 1.00 0.00 H new ATOM 1535 N THR A 216 -4.631 -7.548 1.004 1.00 0.00 N ATOM 1536 CA THR A 216 -5.484 -7.706 2.170 1.00 0.00 C ATOM 1537 C THR A 216 -6.626 -6.684 2.163 1.00 0.00 C ATOM 1538 O THR A 216 -7.775 -7.059 2.384 1.00 0.00 O ATOM 1539 CB THR A 216 -4.579 -7.596 3.412 1.00 0.00 C ATOM 1540 OG1 THR A 216 -3.908 -8.829 3.582 1.00 0.00 O ATOM 1541 CG2 THR A 216 -5.318 -7.182 4.683 1.00 0.00 C ATOM 0 H THR A 216 -3.693 -7.204 1.211 1.00 0.00 H new ATOM 0 HA THR A 216 -5.977 -8.678 2.171 1.00 0.00 H new ATOM 0 HB THR A 216 -3.865 -6.791 3.237 1.00 0.00 H new ATOM 0 HG1 THR A 216 -3.325 -8.778 4.368 1.00 0.00 H new ATOM 0 HG21 THR A 216 -4.613 -7.127 5.512 1.00 0.00 H new ATOM 0 HG22 THR A 216 -5.780 -6.206 4.534 1.00 0.00 H new ATOM 0 HG23 THR A 216 -6.090 -7.917 4.911 1.00 0.00 H new ATOM 1549 N GLN A 217 -6.333 -5.405 1.958 1.00 0.00 N ATOM 1550 CA GLN A 217 -7.308 -4.332 2.085 1.00 0.00 C ATOM 1551 C GLN A 217 -8.463 -4.509 1.097 1.00 0.00 C ATOM 1552 O GLN A 217 -9.621 -4.431 1.500 1.00 0.00 O ATOM 1553 CB GLN A 217 -6.572 -2.989 1.906 1.00 0.00 C ATOM 1554 CG GLN A 217 -6.706 -1.942 3.023 1.00 0.00 C ATOM 1555 CD GLN A 217 -7.363 -2.373 4.332 1.00 0.00 C ATOM 1556 OE1 GLN A 217 -6.838 -3.215 5.058 1.00 0.00 O ATOM 1557 NE2 GLN A 217 -8.487 -1.786 4.696 1.00 0.00 N ATOM 0 H GLN A 217 -5.402 -5.082 1.696 1.00 0.00 H new ATOM 0 HA GLN A 217 -7.765 -4.353 3.074 1.00 0.00 H new ATOM 0 HB2 GLN A 217 -5.512 -3.204 1.774 1.00 0.00 H new ATOM 0 HB3 GLN A 217 -6.923 -2.536 0.979 1.00 0.00 H new ATOM 0 HG2 GLN A 217 -5.707 -1.572 3.256 1.00 0.00 H new ATOM 0 HG3 GLN A 217 -7.273 -1.100 2.626 1.00 0.00 H new ATOM 0 HE21 GLN A 217 -8.918 -1.088 4.089 1.00 0.00 H new ATOM 0 HE22 GLN A 217 -8.925 -2.030 5.584 1.00 0.00 H new ATOM 1566 N TYR A 218 -8.146 -4.823 -0.160 1.00 0.00 N ATOM 1567 CA TYR A 218 -9.108 -5.159 -1.195 1.00 0.00 C ATOM 1568 C TYR A 218 -9.970 -6.334 -0.770 1.00 0.00 C ATOM 1569 O TYR A 218 -11.183 -6.256 -0.951 1.00 0.00 O ATOM 1570 CB TYR A 218 -8.372 -5.509 -2.499 1.00 0.00 C ATOM 1571 CG TYR A 218 -9.269 -6.137 -3.551 1.00 0.00 C ATOM 1572 CD1 TYR A 218 -10.291 -5.377 -4.147 1.00 0.00 C ATOM 1573 CD2 TYR A 218 -9.130 -7.500 -3.879 1.00 0.00 C ATOM 1574 CE1 TYR A 218 -11.165 -5.969 -5.074 1.00 0.00 C ATOM 1575 CE2 TYR A 218 -10.004 -8.099 -4.804 1.00 0.00 C ATOM 1576 CZ TYR A 218 -11.023 -7.332 -5.410 1.00 0.00 C ATOM 1577 OH TYR A 218 -11.851 -7.907 -6.327 1.00 0.00 O ATOM 0 H TYR A 218 -7.181 -4.850 -0.490 1.00 0.00 H new ATOM 0 HA TYR A 218 -9.751 -4.294 -1.357 1.00 0.00 H new ATOM 0 HB2 TYR A 218 -7.924 -4.603 -2.908 1.00 0.00 H new ATOM 0 HB3 TYR A 218 -7.555 -6.195 -2.273 1.00 0.00 H new ATOM 0 HD1 TYR A 218 -10.405 -4.334 -3.891 1.00 0.00 H new ATOM 0 HD2 TYR A 218 -8.349 -8.087 -3.418 1.00 0.00 H new ATOM 0 HE1 TYR A 218 -11.947 -5.380 -5.530 1.00 0.00 H new ATOM 0 HE2 TYR A 218 -9.896 -9.145 -5.051 1.00 0.00 H new ATOM 0 HH TYR A 218 -12.448 -7.226 -6.701 1.00 0.00 H new ATOM 1587 N GLN A 219 -9.372 -7.400 -0.216 1.00 0.00 N ATOM 1588 CA GLN A 219 -10.134 -8.533 0.292 1.00 0.00 C ATOM 1589 C GLN A 219 -11.150 -8.045 1.309 1.00 0.00 C ATOM 1590 O GLN A 219 -12.331 -8.259 1.081 1.00 0.00 O ATOM 1591 CB GLN A 219 -9.243 -9.631 0.912 1.00 0.00 C ATOM 1592 CG GLN A 219 -8.481 -10.461 -0.117 1.00 0.00 C ATOM 1593 CD GLN A 219 -7.502 -11.431 0.534 1.00 0.00 C ATOM 1594 OE1 GLN A 219 -7.884 -12.469 1.072 1.00 0.00 O ATOM 1595 NE2 GLN A 219 -6.224 -11.101 0.533 1.00 0.00 N ATOM 0 H GLN A 219 -8.362 -7.494 -0.112 1.00 0.00 H new ATOM 0 HA GLN A 219 -10.641 -8.989 -0.558 1.00 0.00 H new ATOM 0 HB2 GLN A 219 -8.528 -9.165 1.590 1.00 0.00 H new ATOM 0 HB3 GLN A 219 -9.865 -10.295 1.512 1.00 0.00 H new ATOM 0 HG2 GLN A 219 -9.190 -11.019 -0.728 1.00 0.00 H new ATOM 0 HG3 GLN A 219 -7.938 -9.795 -0.788 1.00 0.00 H new ATOM 0 HE21 GLN A 219 -5.921 -10.237 0.083 1.00 0.00 H new ATOM 0 HE22 GLN A 219 -5.540 -11.710 0.982 1.00 0.00 H new ATOM 1604 N LYS A 220 -10.712 -7.390 2.390 1.00 0.00 N ATOM 1605 CA LYS A 220 -11.594 -6.917 3.458 1.00 0.00 C ATOM 1606 C LYS A 220 -12.757 -6.132 2.883 1.00 0.00 C ATOM 1607 O LYS A 220 -13.889 -6.501 3.181 1.00 0.00 O ATOM 1608 CB LYS A 220 -10.830 -6.037 4.459 1.00 0.00 C ATOM 1609 CG LYS A 220 -9.724 -6.792 5.194 1.00 0.00 C ATOM 1610 CD LYS A 220 -9.082 -5.888 6.251 1.00 0.00 C ATOM 1611 CE LYS A 220 -7.979 -6.602 7.041 1.00 0.00 C ATOM 1612 NZ LYS A 220 -8.442 -7.861 7.662 1.00 0.00 N ATOM 0 H LYS A 220 -9.728 -7.173 2.548 1.00 0.00 H new ATOM 0 HA LYS A 220 -11.975 -7.794 3.981 1.00 0.00 H new ATOM 0 HB2 LYS A 220 -10.394 -5.189 3.930 1.00 0.00 H new ATOM 0 HB3 LYS A 220 -11.532 -5.632 5.188 1.00 0.00 H new ATOM 0 HG2 LYS A 220 -10.135 -7.684 5.668 1.00 0.00 H new ATOM 0 HG3 LYS A 220 -8.968 -7.128 4.484 1.00 0.00 H new ATOM 0 HD2 LYS A 220 -8.664 -5.006 5.765 1.00 0.00 H new ATOM 0 HD3 LYS A 220 -9.850 -5.538 6.941 1.00 0.00 H new ATOM 0 HE2 LYS A 220 -7.143 -6.817 6.376 1.00 0.00 H new ATOM 0 HE3 LYS A 220 -7.605 -5.935 7.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 -7.715 -8.213 8.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 -9.324 -7.686 8.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 -8.613 -8.571 6.921 1.00 0.00 H new ATOM 1626 N GLU A 221 -12.470 -5.111 2.065 1.00 0.00 N ATOM 1627 CA GLU A 221 -13.493 -4.305 1.423 1.00 0.00 C ATOM 1628 C GLU A 221 -14.457 -5.217 0.672 1.00 0.00 C ATOM 1629 O GLU A 221 -15.596 -5.360 1.089 1.00 0.00 O ATOM 1630 CB GLU A 221 -12.891 -3.239 0.493 1.00 0.00 C ATOM 1631 CG GLU A 221 -12.728 -1.858 1.155 1.00 0.00 C ATOM 1632 CD GLU A 221 -13.338 -0.749 0.293 1.00 0.00 C ATOM 1633 OE1 GLU A 221 -12.907 -0.625 -0.869 1.00 0.00 O ATOM 1634 OE2 GLU A 221 -14.252 -0.029 0.761 1.00 0.00 O ATOM 0 H GLU A 221 -11.517 -4.828 1.835 1.00 0.00 H new ATOM 0 HA GLU A 221 -14.040 -3.763 2.195 1.00 0.00 H new ATOM 0 HB2 GLU A 221 -11.917 -3.582 0.145 1.00 0.00 H new ATOM 0 HB3 GLU A 221 -13.526 -3.137 -0.387 1.00 0.00 H new ATOM 0 HG2 GLU A 221 -13.206 -1.864 2.135 1.00 0.00 H new ATOM 0 HG3 GLU A 221 -11.670 -1.654 1.318 1.00 0.00 H new ATOM 1641 N SER A 222 -14.002 -5.861 -0.403 1.00 0.00 N ATOM 1642 CA SER A 222 -14.784 -6.748 -1.255 1.00 0.00 C ATOM 1643 C SER A 222 -15.621 -7.726 -0.435 1.00 0.00 C ATOM 1644 O SER A 222 -16.844 -7.655 -0.448 1.00 0.00 O ATOM 1645 CB SER A 222 -13.802 -7.455 -2.195 1.00 0.00 C ATOM 1646 OG SER A 222 -13.425 -6.611 -3.258 1.00 0.00 O ATOM 0 H SER A 222 -13.035 -5.773 -0.715 1.00 0.00 H new ATOM 0 HA SER A 222 -15.508 -6.180 -1.840 1.00 0.00 H new ATOM 0 HB2 SER A 222 -12.917 -7.762 -1.638 1.00 0.00 H new ATOM 0 HB3 SER A 222 -14.260 -8.362 -2.590 1.00 0.00 H new ATOM 0 HG SER A 222 -12.561 -6.902 -3.616 1.00 0.00 H new ATOM 1652 N GLN A 223 -14.962 -8.638 0.266 1.00 0.00 N ATOM 1653 CA GLN A 223 -15.507 -9.636 1.159 1.00 0.00 C ATOM 1654 C GLN A 223 -16.645 -9.079 2.004 1.00 0.00 C ATOM 1655 O GLN A 223 -17.747 -9.637 1.978 1.00 0.00 O ATOM 1656 CB GLN A 223 -14.348 -10.179 2.014 1.00 0.00 C ATOM 1657 CG GLN A 223 -14.731 -11.276 3.002 1.00 0.00 C ATOM 1658 CD GLN A 223 -14.976 -10.712 4.399 1.00 0.00 C ATOM 1659 OE1 GLN A 223 -16.207 -10.360 4.692 1.00 0.00 O flip ATOM 1660 NE2 GLN A 223 -14.061 -10.561 5.206 1.00 0.00 N flip ATOM 0 H GLN A 223 -13.945 -8.699 0.216 1.00 0.00 H new ATOM 0 HA GLN A 223 -15.951 -10.451 0.588 1.00 0.00 H new ATOM 0 HB2 GLN A 223 -13.576 -10.565 1.348 1.00 0.00 H new ATOM 0 HB3 GLN A 223 -13.907 -9.351 2.568 1.00 0.00 H new ATOM 0 HG2 GLN A 223 -15.629 -11.785 2.652 1.00 0.00 H new ATOM 0 HG3 GLN A 223 -13.938 -12.022 3.044 1.00 0.00 H new ATOM 0 HE21 GLN A 223 -13.112 -10.841 4.959 1.00 0.00 H new ATOM 0 HE22 GLN A 223 -14.251 -10.156 6.123 1.00 0.00 H new ATOM 1669 N ALA A 224 -16.387 -8.036 2.793 1.00 0.00 N ATOM 1670 CA ALA A 224 -17.379 -7.412 3.638 1.00 0.00 C ATOM 1671 C ALA A 224 -18.508 -6.930 2.744 1.00 0.00 C ATOM 1672 O ALA A 224 -19.645 -7.338 2.952 1.00 0.00 O ATOM 1673 CB ALA A 224 -16.759 -6.277 4.456 1.00 0.00 C ATOM 0 H ALA A 224 -15.466 -7.602 2.857 1.00 0.00 H new ATOM 0 HA ALA A 224 -17.774 -8.124 4.363 1.00 0.00 H new ATOM 0 HB1 ALA A 224 -17.524 -5.822 5.085 1.00 0.00 H new ATOM 0 HB2 ALA A 224 -15.962 -6.675 5.085 1.00 0.00 H new ATOM 0 HB3 ALA A 224 -16.348 -5.525 3.782 1.00 0.00 H new ATOM 1679 N TYR A 225 -18.206 -6.194 1.680 1.00 0.00 N ATOM 1680 CA TYR A 225 -19.187 -5.637 0.776 1.00 0.00 C ATOM 1681 C TYR A 225 -19.999 -6.673 0.006 1.00 0.00 C ATOM 1682 O TYR A 225 -20.936 -6.287 -0.698 1.00 0.00 O ATOM 1683 CB TYR A 225 -18.497 -4.721 -0.242 1.00 0.00 C ATOM 1684 CG TYR A 225 -18.868 -3.279 -0.051 1.00 0.00 C ATOM 1685 CD1 TYR A 225 -20.229 -2.930 -0.030 1.00 0.00 C ATOM 1686 CD2 TYR A 225 -17.868 -2.317 0.157 1.00 0.00 C ATOM 1687 CE1 TYR A 225 -20.596 -1.608 0.302 1.00 0.00 C ATOM 1688 CE2 TYR A 225 -18.225 -0.988 0.416 1.00 0.00 C ATOM 1689 CZ TYR A 225 -19.589 -0.636 0.541 1.00 0.00 C ATOM 1690 OH TYR A 225 -19.885 0.649 0.881 1.00 0.00 O ATOM 0 H TYR A 225 -17.246 -5.967 1.422 1.00 0.00 H new ATOM 0 HA TYR A 225 -19.884 -5.091 1.411 1.00 0.00 H new ATOM 0 HB2 TYR A 225 -17.416 -4.831 -0.153 1.00 0.00 H new ATOM 0 HB3 TYR A 225 -18.767 -5.033 -1.251 1.00 0.00 H new ATOM 0 HD1 TYR A 225 -20.985 -3.664 -0.265 1.00 0.00 H new ATOM 0 HD2 TYR A 225 -16.827 -2.601 0.117 1.00 0.00 H new ATOM 0 HE1 TYR A 225 -21.639 -1.337 0.374 1.00 0.00 H new ATOM 0 HE2 TYR A 225 -17.460 -0.233 0.520 1.00 0.00 H new ATOM 0 HH TYR A 225 -19.054 1.155 1.002 1.00 0.00 H new