USER MOD reduce.3.24.130724 H: found=0, std=0, add=807, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 805 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 172 GLN :FLIP amide:sc= 0.523 F(o=-0.22,f=0.52) USER MOD Set 1.2: A 219 GLN :FLIP amide:sc=-0.00194 X(o=0.23,f=0.52) USER MOD Set 2.1: A 187 HIS : no HE2:sc= -3.25 X(o=-5.5,f=-6!) USER MOD Set 2.2: A 188 THR OG1 : rot -150:sc= -0.0287 USER MOD Set 2.3: A 206 MET CE :methyl -163:sc= -2.27 (180deg=-0.556) USER MOD Set 3.1: A 190 THR OG1 : rot 180:sc= -0.238 USER MOD Set 3.2: A 194 LYS NZ :NH3+ -124:sc= 0.0593 (180deg=0) USER MOD Set 4.1: A 177 HIS :FLIP no HE2:sc=-0.00234 F(o=-1.3,f=-0.078) USER MOD Set 4.2: A 181 ASN : amide:sc= -0.0759 K(o=-0.078,f=-1.2!) USER MOD Set 5.1: A 171 ASN : amide:sc= 0.736 K(o=1,f=-2.9!) USER MOD Set 5.2: A 174 ASN : amide:sc= 0.276 K(o=1,f=-11!) USER MOD Set 6.1: A 162 TYR OH : rot 180:sc= 0 USER MOD Set 6.2: A 186 GLN : amide:sc= 0.295 X(o=0.29,f=-0.094) USER MOD Set 7.1: A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 7.2: A 154 MET CE :methyl -171:sc= 0 (180deg=0) USER MOD Single : A 128 TYR OH : rot 161:sc= 1.21 USER MOD Single : A 129 MET CE :methyl 164:sc= -1.44 (180deg=-2.51!) USER MOD Single : A 132 SER OG : rot 180:sc= 0.105 USER MOD Single : A 134 MET CE :methyl -164:sc= -1.04 (180deg=-1.68) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HD1:sc= -0.439 X(o=-0.44,f=-0.39) USER MOD Single : A 143 ASN : amide:sc= 0.542 K(o=0.54,f=-0.078) USER MOD Single : A 149 TYR OH : rot -132:sc= 1.32 USER MOD Single : A 150 TYR OH : rot -172:sc= 0.801 USER MOD Single : A 153 ASN : amide:sc= 1.34 K(o=1.3,f=-8.6!) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 TYR OH : rot 49:sc= 1.26 USER MOD Single : A 159 ASN : amide:sc= -0.0149 X(o=-0.015,f=0) USER MOD Single : A 160 GLN : amide:sc= 0.971 K(o=0.97,f=0) USER MOD Single : A 163 TYR OH : rot 180:sc= 0 USER MOD Single : A 168 GLN : amide:sc= -0.505 X(o=-0.5,f=-0.064) USER MOD Single : A 170 SER OG : rot 55:sc= 0.0124 USER MOD Single : A 173 ASN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 183 THR OG1 : rot 93:sc= 1.66 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 191 THR OG1 : rot -120:sc= -1.02 USER MOD Single : A 192 THR OG1 : rot 171:sc= -0.191 USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 197 ASN : amide:sc= -0.328 X(o=-0.33,f=-0.33) USER MOD Single : A 199 THR OG1 : rot 180:sc= 0 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0.028 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl -151:sc=-0.00804 (180deg=-0.974) USER MOD Single : A 212 GLN : amide:sc=-0.00274 K(o=-0.0027,f=-0.69) USER MOD Single : A 213 MET CE :methyl -133:sc= -0.0921 (180deg=-0.748) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 217 GLN : amide:sc= -0.669 K(o=-0.67,f=-3.9!) USER MOD Single : A 218 TYR OH : rot 180:sc= -0.0262 USER MOD Single : A 220 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 SER OG : rot 93:sc= 1.22 USER MOD Single : A 223 GLN :FLIP amide:sc= 0.488 F(o=-1.1,f=0.49) USER MOD ----------------------------------------------------------------- ATOM 65 N LEU A 125 8.627 -14.153 -2.647 1.00 0.00 N ATOM 66 CA LEU A 125 8.821 -12.737 -2.964 1.00 0.00 C ATOM 67 C LEU A 125 10.313 -12.595 -3.234 1.00 0.00 C ATOM 68 O LEU A 125 11.100 -13.146 -2.464 1.00 0.00 O ATOM 69 CB LEU A 125 8.400 -11.831 -1.795 1.00 0.00 C ATOM 70 CG LEU A 125 6.893 -11.845 -1.485 1.00 0.00 C ATOM 71 CD1 LEU A 125 6.674 -11.440 -0.026 1.00 0.00 C ATOM 72 CD2 LEU A 125 6.145 -10.849 -2.377 1.00 0.00 C ATOM 0 HA LEU A 125 8.211 -12.434 -3.815 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.944 -12.136 -0.901 1.00 0.00 H new ATOM 0 HB3 LEU A 125 8.702 -10.808 -2.018 1.00 0.00 H new ATOM 0 HG LEU A 125 6.514 -12.850 -1.670 1.00 0.00 H new ATOM 0 HD11 LEU A 125 5.607 -11.449 0.198 1.00 0.00 H new ATOM 0 HD12 LEU A 125 7.188 -12.144 0.628 1.00 0.00 H new ATOM 0 HD13 LEU A 125 7.071 -10.438 0.137 1.00 0.00 H new ATOM 0 HD21 LEU A 125 5.081 -10.876 -2.140 1.00 0.00 H new ATOM 0 HD22 LEU A 125 6.530 -9.844 -2.203 1.00 0.00 H new ATOM 0 HD23 LEU A 125 6.291 -11.117 -3.423 1.00 0.00 H new ATOM 84 N GLY A 126 10.714 -11.866 -4.276 1.00 0.00 N ATOM 85 CA GLY A 126 12.077 -11.783 -4.807 1.00 0.00 C ATOM 86 C GLY A 126 13.076 -11.014 -3.940 1.00 0.00 C ATOM 87 O GLY A 126 13.866 -10.225 -4.452 1.00 0.00 O ATOM 0 H GLY A 126 10.061 -11.285 -4.802 1.00 0.00 H new ATOM 0 HA2 GLY A 126 12.453 -12.795 -4.953 1.00 0.00 H new ATOM 0 HA3 GLY A 126 12.038 -11.312 -5.789 1.00 0.00 H new ATOM 91 N GLY A 127 13.056 -11.222 -2.626 1.00 0.00 N ATOM 92 CA GLY A 127 13.880 -10.489 -1.681 1.00 0.00 C ATOM 93 C GLY A 127 13.356 -9.066 -1.521 1.00 0.00 C ATOM 94 O GLY A 127 14.146 -8.117 -1.519 1.00 0.00 O ATOM 0 H GLY A 127 12.455 -11.918 -2.185 1.00 0.00 H new ATOM 0 HA2 GLY A 127 13.878 -10.996 -0.716 1.00 0.00 H new ATOM 0 HA3 GLY A 127 14.913 -10.467 -2.028 1.00 0.00 H new ATOM 98 N TYR A 128 12.032 -8.933 -1.404 1.00 0.00 N ATOM 99 CA TYR A 128 11.345 -7.724 -0.968 1.00 0.00 C ATOM 100 C TYR A 128 11.616 -7.487 0.521 1.00 0.00 C ATOM 101 O TYR A 128 12.108 -8.366 1.231 1.00 0.00 O ATOM 102 CB TYR A 128 9.831 -7.879 -1.208 1.00 0.00 C ATOM 103 CG TYR A 128 9.375 -7.682 -2.640 1.00 0.00 C ATOM 104 CD1 TYR A 128 9.491 -8.751 -3.538 1.00 0.00 C ATOM 105 CD2 TYR A 128 8.777 -6.479 -3.065 1.00 0.00 C ATOM 106 CE1 TYR A 128 8.951 -8.665 -4.826 1.00 0.00 C ATOM 107 CE2 TYR A 128 8.280 -6.363 -4.378 1.00 0.00 C ATOM 108 CZ TYR A 128 8.369 -7.460 -5.268 1.00 0.00 C ATOM 109 OH TYR A 128 7.909 -7.401 -6.549 1.00 0.00 O ATOM 0 H TYR A 128 11.389 -9.695 -1.619 1.00 0.00 H new ATOM 0 HA TYR A 128 11.713 -6.870 -1.537 1.00 0.00 H new ATOM 0 HB2 TYR A 128 9.529 -8.874 -0.882 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.305 -7.164 -0.576 1.00 0.00 H new ATOM 0 HD1 TYR A 128 10.003 -9.652 -3.233 1.00 0.00 H new ATOM 0 HD2 TYR A 128 8.700 -5.645 -2.383 1.00 0.00 H new ATOM 0 HE1 TYR A 128 8.980 -9.523 -5.482 1.00 0.00 H new ATOM 0 HE2 TYR A 128 7.831 -5.437 -4.706 1.00 0.00 H new ATOM 0 HH TYR A 128 7.277 -6.657 -6.636 1.00 0.00 H new ATOM 119 N MET A 129 11.232 -6.308 0.986 1.00 0.00 N ATOM 120 CA MET A 129 11.292 -5.802 2.342 1.00 0.00 C ATOM 121 C MET A 129 9.854 -5.466 2.710 1.00 0.00 C ATOM 122 O MET A 129 9.198 -4.813 1.911 1.00 0.00 O ATOM 123 CB MET A 129 12.135 -4.507 2.343 1.00 0.00 C ATOM 124 CG MET A 129 13.529 -4.560 1.688 1.00 0.00 C ATOM 125 SD MET A 129 14.925 -5.051 2.734 1.00 0.00 S ATOM 126 CE MET A 129 14.227 -6.560 3.426 1.00 0.00 C ATOM 0 H MET A 129 10.830 -5.614 0.355 1.00 0.00 H new ATOM 0 HA MET A 129 11.734 -6.514 3.038 1.00 0.00 H new ATOM 0 HB2 MET A 129 11.558 -3.731 1.841 1.00 0.00 H new ATOM 0 HB3 MET A 129 12.263 -4.190 3.378 1.00 0.00 H new ATOM 0 HG2 MET A 129 13.479 -5.251 0.847 1.00 0.00 H new ATOM 0 HG3 MET A 129 13.746 -3.574 1.278 1.00 0.00 H new ATOM 0 HE1 MET A 129 15.022 -7.159 3.870 1.00 0.00 H new ATOM 0 HE2 MET A 129 13.495 -6.304 4.192 1.00 0.00 H new ATOM 0 HE3 MET A 129 13.741 -7.132 2.636 1.00 0.00 H new ATOM 136 N LEU A 130 9.335 -5.892 3.860 1.00 0.00 N ATOM 137 CA LEU A 130 8.042 -5.427 4.365 1.00 0.00 C ATOM 138 C LEU A 130 8.288 -4.312 5.378 1.00 0.00 C ATOM 139 O LEU A 130 9.176 -4.434 6.224 1.00 0.00 O ATOM 140 CB LEU A 130 7.264 -6.608 4.970 1.00 0.00 C ATOM 141 CG LEU A 130 5.915 -6.216 5.609 1.00 0.00 C ATOM 142 CD1 LEU A 130 4.860 -5.879 4.552 1.00 0.00 C ATOM 143 CD2 LEU A 130 5.392 -7.369 6.459 1.00 0.00 C ATOM 0 H LEU A 130 9.797 -6.568 4.468 1.00 0.00 H new ATOM 0 HA LEU A 130 7.431 -5.024 3.557 1.00 0.00 H new ATOM 0 HB2 LEU A 130 7.082 -7.347 4.189 1.00 0.00 H new ATOM 0 HB3 LEU A 130 7.885 -7.089 5.726 1.00 0.00 H new ATOM 0 HG LEU A 130 6.092 -5.332 6.221 1.00 0.00 H new ATOM 0 HD11 LEU A 130 3.926 -5.608 5.044 1.00 0.00 H new ATOM 0 HD12 LEU A 130 5.207 -5.042 3.946 1.00 0.00 H new ATOM 0 HD13 LEU A 130 4.696 -6.746 3.913 1.00 0.00 H new ATOM 0 HD21 LEU A 130 4.440 -7.087 6.908 1.00 0.00 H new ATOM 0 HD22 LEU A 130 5.251 -8.249 5.831 1.00 0.00 H new ATOM 0 HD23 LEU A 130 6.111 -7.596 7.246 1.00 0.00 H new ATOM 155 N GLY A 131 7.508 -3.240 5.277 1.00 0.00 N ATOM 156 CA GLY A 131 7.556 -2.039 6.092 1.00 0.00 C ATOM 157 C GLY A 131 6.853 -2.175 7.434 1.00 0.00 C ATOM 158 O GLY A 131 6.214 -3.187 7.717 1.00 0.00 O ATOM 0 H GLY A 131 6.774 -3.188 4.571 1.00 0.00 H new ATOM 0 HA2 GLY A 131 8.598 -1.771 6.265 1.00 0.00 H new ATOM 0 HA3 GLY A 131 7.103 -1.217 5.537 1.00 0.00 H new ATOM 162 N SER A 132 6.956 -1.127 8.246 1.00 0.00 N ATOM 163 CA SER A 132 6.331 -1.011 9.561 1.00 0.00 C ATOM 164 C SER A 132 4.846 -0.654 9.426 1.00 0.00 C ATOM 165 O SER A 132 4.388 -0.215 8.369 1.00 0.00 O ATOM 166 CB SER A 132 7.077 0.035 10.414 1.00 0.00 C ATOM 167 OG SER A 132 7.940 0.867 9.650 1.00 0.00 O ATOM 0 H SER A 132 7.500 -0.301 7.996 1.00 0.00 H new ATOM 0 HA SER A 132 6.397 -1.975 10.065 1.00 0.00 H new ATOM 0 HB2 SER A 132 6.348 0.658 10.933 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.660 -0.478 11.179 1.00 0.00 H new ATOM 0 HG SER A 132 8.383 1.510 10.242 1.00 0.00 H new ATOM 173 N ALA A 133 4.071 -0.858 10.497 1.00 0.00 N ATOM 174 CA ALA A 133 2.639 -0.577 10.528 1.00 0.00 C ATOM 175 C ALA A 133 2.375 0.930 10.434 1.00 0.00 C ATOM 176 O ALA A 133 2.480 1.650 11.430 1.00 0.00 O ATOM 177 CB ALA A 133 2.023 -1.182 11.794 1.00 0.00 C ATOM 0 H ALA A 133 4.430 -1.228 11.377 1.00 0.00 H new ATOM 0 HA ALA A 133 2.165 -1.038 9.662 1.00 0.00 H new ATOM 0 HB1 ALA A 133 0.954 -0.971 11.815 1.00 0.00 H new ATOM 0 HB2 ALA A 133 2.180 -2.261 11.795 1.00 0.00 H new ATOM 0 HB3 ALA A 133 2.496 -0.745 12.673 1.00 0.00 H new ATOM 183 N MET A 134 2.036 1.415 9.241 1.00 0.00 N ATOM 184 CA MET A 134 1.683 2.807 8.984 1.00 0.00 C ATOM 185 C MET A 134 0.214 3.074 9.322 1.00 0.00 C ATOM 186 O MET A 134 -0.364 2.330 10.115 1.00 0.00 O ATOM 187 CB MET A 134 2.140 3.218 7.576 1.00 0.00 C ATOM 188 CG MET A 134 3.641 2.930 7.400 1.00 0.00 C ATOM 189 SD MET A 134 4.546 4.102 6.361 1.00 0.00 S ATOM 190 CE MET A 134 3.840 3.657 4.763 1.00 0.00 C ATOM 0 H MET A 134 1.999 0.833 8.404 1.00 0.00 H new ATOM 0 HA MET A 134 2.227 3.470 9.657 1.00 0.00 H new ATOM 0 HB2 MET A 134 1.567 2.673 6.826 1.00 0.00 H new ATOM 0 HB3 MET A 134 1.945 4.279 7.417 1.00 0.00 H new ATOM 0 HG2 MET A 134 4.107 2.911 8.385 1.00 0.00 H new ATOM 0 HG3 MET A 134 3.754 1.933 6.975 1.00 0.00 H new ATOM 0 HE1 MET A 134 4.463 4.061 3.965 1.00 0.00 H new ATOM 0 HE2 MET A 134 3.795 2.572 4.674 1.00 0.00 H new ATOM 0 HE3 MET A 134 2.834 4.069 4.682 1.00 0.00 H new ATOM 200 N SER A 135 -0.384 4.167 8.845 1.00 0.00 N ATOM 201 CA SER A 135 -1.779 4.508 9.113 1.00 0.00 C ATOM 202 C SER A 135 -2.476 4.944 7.825 1.00 0.00 C ATOM 203 O SER A 135 -1.838 5.176 6.789 1.00 0.00 O ATOM 204 CB SER A 135 -1.854 5.549 10.242 1.00 0.00 C ATOM 205 OG SER A 135 -3.107 5.522 10.903 1.00 0.00 O ATOM 0 H SER A 135 0.094 4.848 8.255 1.00 0.00 H new ATOM 0 HA SER A 135 -2.321 3.630 9.465 1.00 0.00 H new ATOM 0 HB2 SER A 135 -1.059 5.360 10.963 1.00 0.00 H new ATOM 0 HB3 SER A 135 -1.682 6.544 9.831 1.00 0.00 H new ATOM 0 HG SER A 135 -3.116 6.196 11.615 1.00 0.00 H new ATOM 211 N ARG A 136 -3.808 4.980 7.861 1.00 0.00 N ATOM 212 CA ARG A 136 -4.620 5.015 6.658 1.00 0.00 C ATOM 213 C ARG A 136 -4.555 6.428 6.094 1.00 0.00 C ATOM 214 O ARG A 136 -4.756 7.385 6.844 1.00 0.00 O ATOM 215 CB ARG A 136 -6.050 4.502 6.905 1.00 0.00 C ATOM 216 CG ARG A 136 -6.975 5.398 7.750 1.00 0.00 C ATOM 217 CD ARG A 136 -7.643 4.661 8.915 1.00 0.00 C ATOM 218 NE ARG A 136 -6.770 4.613 10.102 1.00 0.00 N ATOM 219 CZ ARG A 136 -6.988 5.203 11.286 1.00 0.00 C ATOM 220 NH1 ARG A 136 -8.090 5.925 11.494 1.00 0.00 N ATOM 221 NH2 ARG A 136 -6.100 5.074 12.267 1.00 0.00 N ATOM 0 H ARG A 136 -4.348 4.986 8.726 1.00 0.00 H new ATOM 0 HA ARG A 136 -4.225 4.326 5.911 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -6.525 4.341 5.937 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -5.982 3.529 7.392 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -6.397 6.234 8.143 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -7.747 5.819 7.106 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -8.579 5.158 9.171 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -7.895 3.646 8.607 1.00 0.00 H new ATOM 0 HE ARG A 136 -5.909 4.074 10.013 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -8.777 6.033 10.748 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -8.245 6.369 12.399 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -5.253 4.526 12.119 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -6.266 5.523 13.168 1.00 0.00 H new ATOM 235 N PRO A 137 -4.220 6.596 4.814 1.00 0.00 N ATOM 236 CA PRO A 137 -4.163 7.915 4.223 1.00 0.00 C ATOM 237 C PRO A 137 -5.583 8.489 4.116 1.00 0.00 C ATOM 238 O PRO A 137 -6.558 7.731 4.091 1.00 0.00 O ATOM 239 CB PRO A 137 -3.478 7.704 2.861 1.00 0.00 C ATOM 240 CG PRO A 137 -3.832 6.260 2.507 1.00 0.00 C ATOM 241 CD PRO A 137 -3.882 5.563 3.860 1.00 0.00 C ATOM 0 HA PRO A 137 -3.604 8.642 4.811 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -3.849 8.404 2.112 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -2.400 7.849 2.927 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -4.788 6.197 1.988 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -3.084 5.812 1.853 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -4.626 4.766 3.864 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -2.923 5.105 4.101 1.00 0.00 H new ATOM 249 N MET A 138 -5.717 9.811 4.017 1.00 0.00 N ATOM 250 CA MET A 138 -6.922 10.410 3.456 1.00 0.00 C ATOM 251 C MET A 138 -6.769 10.350 1.938 1.00 0.00 C ATOM 252 O MET A 138 -5.676 10.632 1.443 1.00 0.00 O ATOM 253 CB MET A 138 -7.102 11.860 3.927 1.00 0.00 C ATOM 254 CG MET A 138 -7.748 11.976 5.315 1.00 0.00 C ATOM 255 SD MET A 138 -9.563 11.843 5.348 1.00 0.00 S ATOM 256 CE MET A 138 -9.808 10.241 6.158 1.00 0.00 C ATOM 0 H MET A 138 -5.010 10.482 4.317 1.00 0.00 H new ATOM 0 HA MET A 138 -7.808 9.869 3.787 1.00 0.00 H new ATOM 0 HB2 MET A 138 -6.129 12.351 3.945 1.00 0.00 H new ATOM 0 HB3 MET A 138 -7.716 12.396 3.203 1.00 0.00 H new ATOM 0 HG2 MET A 138 -7.332 11.199 5.956 1.00 0.00 H new ATOM 0 HG3 MET A 138 -7.463 12.934 5.750 1.00 0.00 H new ATOM 0 HE1 MET A 138 -10.875 10.035 6.242 1.00 0.00 H new ATOM 0 HE2 MET A 138 -9.333 9.458 5.567 1.00 0.00 H new ATOM 0 HE3 MET A 138 -9.363 10.265 7.153 1.00 0.00 H new ATOM 266 N ILE A 139 -7.833 9.975 1.220 1.00 0.00 N ATOM 267 CA ILE A 139 -7.896 9.922 -0.240 1.00 0.00 C ATOM 268 C ILE A 139 -9.276 10.442 -0.603 1.00 0.00 C ATOM 269 O ILE A 139 -10.284 9.783 -0.348 1.00 0.00 O ATOM 270 CB ILE A 139 -7.655 8.505 -0.817 1.00 0.00 C ATOM 271 CG1 ILE A 139 -6.433 7.855 -0.145 1.00 0.00 C ATOM 272 CG2 ILE A 139 -7.509 8.559 -2.361 1.00 0.00 C ATOM 273 CD1 ILE A 139 -5.995 6.592 -0.863 1.00 0.00 C ATOM 0 H ILE A 139 -8.708 9.689 1.660 1.00 0.00 H new ATOM 0 HA ILE A 139 -7.098 10.524 -0.675 1.00 0.00 H new ATOM 0 HB ILE A 139 -8.522 7.881 -0.597 1.00 0.00 H new ATOM 0 HG12 ILE A 139 -5.608 8.567 -0.127 1.00 0.00 H new ATOM 0 HG13 ILE A 139 -6.672 7.618 0.892 1.00 0.00 H new ATOM 0 HG21 ILE A 139 -7.340 7.553 -2.746 1.00 0.00 H new ATOM 0 HG22 ILE A 139 -8.420 8.967 -2.799 1.00 0.00 H new ATOM 0 HG23 ILE A 139 -6.664 9.195 -2.625 1.00 0.00 H new ATOM 0 HD11 ILE A 139 -5.130 6.166 -0.355 1.00 0.00 H new ATOM 0 HD12 ILE A 139 -6.811 5.869 -0.858 1.00 0.00 H new ATOM 0 HD13 ILE A 139 -5.729 6.832 -1.893 1.00 0.00 H new ATOM 285 N HIS A 140 -9.329 11.657 -1.132 1.00 0.00 N ATOM 286 CA HIS A 140 -10.602 12.339 -1.390 1.00 0.00 C ATOM 287 C HIS A 140 -11.290 11.849 -2.655 1.00 0.00 C ATOM 288 O HIS A 140 -12.500 12.044 -2.795 1.00 0.00 O ATOM 289 CB HIS A 140 -10.427 13.864 -1.461 1.00 0.00 C ATOM 290 CG HIS A 140 -9.107 14.354 -1.994 1.00 0.00 C ATOM 291 ND1 HIS A 140 -8.746 14.634 -3.295 1.00 0.00 N ATOM 292 CD2 HIS A 140 -8.052 14.672 -1.194 1.00 0.00 C ATOM 293 CE1 HIS A 140 -7.494 15.135 -3.257 1.00 0.00 C ATOM 294 NE2 HIS A 140 -7.032 15.177 -1.996 1.00 0.00 N ATOM 0 H HIS A 140 -8.504 12.197 -1.394 1.00 0.00 H new ATOM 0 HA HIS A 140 -11.241 12.091 -0.542 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -11.222 14.272 -2.085 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -10.566 14.272 -0.460 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -8.013 14.553 -0.121 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -6.938 15.459 -4.124 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -6.119 15.511 -1.688 1.00 0.00 H new ATOM 302 N PHE A 141 -10.532 11.228 -3.560 1.00 0.00 N ATOM 303 CA PHE A 141 -10.911 10.867 -4.916 1.00 0.00 C ATOM 304 C PHE A 141 -11.412 12.095 -5.663 1.00 0.00 C ATOM 305 O PHE A 141 -10.640 12.776 -6.336 1.00 0.00 O ATOM 306 CB PHE A 141 -11.908 9.697 -4.918 1.00 0.00 C ATOM 307 CG PHE A 141 -11.276 8.393 -4.502 1.00 0.00 C ATOM 308 CD1 PHE A 141 -11.093 8.103 -3.139 1.00 0.00 C ATOM 309 CD2 PHE A 141 -10.835 7.491 -5.486 1.00 0.00 C ATOM 310 CE1 PHE A 141 -10.422 6.928 -2.764 1.00 0.00 C ATOM 311 CE2 PHE A 141 -10.169 6.315 -5.105 1.00 0.00 C ATOM 312 CZ PHE A 141 -9.938 6.045 -3.745 1.00 0.00 C ATOM 0 H PHE A 141 -9.575 10.948 -3.345 1.00 0.00 H new ATOM 0 HA PHE A 141 -10.034 10.508 -5.455 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -12.733 9.927 -4.244 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -12.332 9.588 -5.916 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -11.466 8.780 -2.385 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -11.008 7.702 -6.531 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -10.277 6.702 -1.718 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -9.834 5.617 -5.858 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.390 5.161 -3.454 1.00 0.00 H new ATOM 322 N GLY A 142 -12.697 12.386 -5.528 1.00 0.00 N ATOM 323 CA GLY A 142 -13.396 13.518 -6.094 1.00 0.00 C ATOM 324 C GLY A 142 -14.873 13.340 -5.790 1.00 0.00 C ATOM 325 O GLY A 142 -15.503 14.255 -5.260 1.00 0.00 O ATOM 0 H GLY A 142 -13.318 11.791 -4.980 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -13.026 14.450 -5.667 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -13.230 13.573 -7.170 1.00 0.00 H new ATOM 329 N ASN A 143 -15.407 12.145 -6.077 1.00 0.00 N ATOM 330 CA ASN A 143 -16.792 11.816 -5.780 1.00 0.00 C ATOM 331 C ASN A 143 -16.930 11.604 -4.280 1.00 0.00 C ATOM 332 O ASN A 143 -16.168 10.813 -3.720 1.00 0.00 O ATOM 333 CB ASN A 143 -17.240 10.500 -6.438 1.00 0.00 C ATOM 334 CG ASN A 143 -16.846 10.319 -7.890 1.00 0.00 C ATOM 335 OD1 ASN A 143 -17.490 10.818 -8.806 1.00 0.00 O ATOM 336 ND2 ASN A 143 -15.782 9.591 -8.168 1.00 0.00 N ATOM 0 H ASN A 143 -14.887 11.388 -6.520 1.00 0.00 H new ATOM 0 HA ASN A 143 -17.401 12.637 -6.158 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -16.828 9.670 -5.864 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -18.325 10.431 -6.365 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -15.502 9.447 -9.138 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -15.240 9.172 -7.413 1.00 0.00 H new ATOM 343 N ASP A 144 -17.967 12.180 -3.670 1.00 0.00 N ATOM 344 CA ASP A 144 -18.263 11.933 -2.256 1.00 0.00 C ATOM 345 C ASP A 144 -18.552 10.458 -1.966 1.00 0.00 C ATOM 346 O ASP A 144 -18.264 10.004 -0.868 1.00 0.00 O ATOM 347 CB ASP A 144 -19.460 12.770 -1.796 1.00 0.00 C ATOM 348 CG ASP A 144 -19.468 12.972 -0.284 1.00 0.00 C ATOM 349 OD1 ASP A 144 -18.542 13.649 0.219 1.00 0.00 O ATOM 350 OD2 ASP A 144 -20.426 12.527 0.386 1.00 0.00 O ATOM 0 H ASP A 144 -18.615 12.819 -4.130 1.00 0.00 H new ATOM 0 HA ASP A 144 -17.369 12.222 -1.703 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -19.436 13.741 -2.291 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -20.384 12.279 -2.101 1.00 0.00 H new ATOM 355 N TRP A 145 -19.080 9.691 -2.935 1.00 0.00 N ATOM 356 CA TRP A 145 -19.343 8.268 -2.718 1.00 0.00 C ATOM 357 C TRP A 145 -18.055 7.453 -2.627 1.00 0.00 C ATOM 358 O TRP A 145 -17.989 6.521 -1.836 1.00 0.00 O ATOM 359 CB TRP A 145 -20.289 7.688 -3.777 1.00 0.00 C ATOM 360 CG TRP A 145 -19.786 7.614 -5.188 1.00 0.00 C ATOM 361 CD1 TRP A 145 -20.071 8.517 -6.149 1.00 0.00 C ATOM 362 CD2 TRP A 145 -18.967 6.584 -5.836 1.00 0.00 C ATOM 363 NE1 TRP A 145 -19.470 8.144 -7.331 1.00 0.00 N ATOM 364 CE2 TRP A 145 -18.763 6.973 -7.194 1.00 0.00 C ATOM 365 CE3 TRP A 145 -18.345 5.379 -5.432 1.00 0.00 C ATOM 366 CZ2 TRP A 145 -17.987 6.221 -8.085 1.00 0.00 C ATOM 367 CZ3 TRP A 145 -17.637 4.577 -6.340 1.00 0.00 C ATOM 368 CH2 TRP A 145 -17.452 4.997 -7.665 1.00 0.00 C ATOM 0 H TRP A 145 -19.329 10.032 -3.864 1.00 0.00 H new ATOM 0 HA TRP A 145 -19.846 8.193 -1.754 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -20.566 6.681 -3.465 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -21.201 8.284 -3.776 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -20.679 9.399 -6.012 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -19.541 8.672 -8.201 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -18.417 5.069 -4.400 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -17.803 6.582 -9.086 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -17.232 3.630 -6.016 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -16.900 4.380 -8.358 1.00 0.00 H new ATOM 379 N GLU A 146 -17.037 7.788 -3.426 1.00 0.00 N ATOM 380 CA GLU A 146 -15.735 7.139 -3.339 1.00 0.00 C ATOM 381 C GLU A 146 -15.098 7.431 -1.987 1.00 0.00 C ATOM 382 O GLU A 146 -14.611 6.517 -1.338 1.00 0.00 O ATOM 383 CB GLU A 146 -14.798 7.574 -4.480 1.00 0.00 C ATOM 384 CG GLU A 146 -15.237 6.967 -5.812 1.00 0.00 C ATOM 385 CD GLU A 146 -14.141 6.946 -6.875 1.00 0.00 C ATOM 386 OE1 GLU A 146 -13.710 8.019 -7.371 1.00 0.00 O ATOM 387 OE2 GLU A 146 -13.749 5.830 -7.280 1.00 0.00 O ATOM 0 H GLU A 146 -17.096 8.511 -4.143 1.00 0.00 H new ATOM 0 HA GLU A 146 -15.891 6.065 -3.440 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -14.793 8.661 -4.556 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -13.777 7.265 -4.255 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -15.581 5.947 -5.639 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -16.088 7.530 -6.194 1.00 0.00 H new ATOM 394 N ASP A 147 -15.126 8.692 -1.564 1.00 0.00 N ATOM 395 CA ASP A 147 -14.614 9.165 -0.281 1.00 0.00 C ATOM 396 C ASP A 147 -15.319 8.519 0.893 1.00 0.00 C ATOM 397 O ASP A 147 -14.655 7.978 1.779 1.00 0.00 O ATOM 398 CB ASP A 147 -14.701 10.686 -0.304 1.00 0.00 C ATOM 399 CG ASP A 147 -14.835 11.524 0.972 1.00 0.00 C ATOM 400 OD1 ASP A 147 -15.598 11.213 1.906 1.00 0.00 O ATOM 401 OD2 ASP A 147 -14.271 12.649 0.935 1.00 0.00 O ATOM 0 H ASP A 147 -15.522 9.443 -2.129 1.00 0.00 H new ATOM 0 HA ASP A 147 -13.574 8.870 -0.140 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -13.808 11.041 -0.818 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -15.553 10.940 -0.934 1.00 0.00 H new ATOM 406 N ARG A 148 -16.650 8.498 0.863 1.00 0.00 N ATOM 407 CA ARG A 148 -17.434 7.812 1.868 1.00 0.00 C ATOM 408 C ARG A 148 -17.085 6.332 1.863 1.00 0.00 C ATOM 409 O ARG A 148 -16.806 5.799 2.929 1.00 0.00 O ATOM 410 CB ARG A 148 -18.937 8.054 1.657 1.00 0.00 C ATOM 411 CG ARG A 148 -19.771 7.130 2.560 1.00 0.00 C ATOM 412 CD ARG A 148 -21.271 7.358 2.417 1.00 0.00 C ATOM 413 NE ARG A 148 -21.831 8.324 3.362 1.00 0.00 N ATOM 414 CZ ARG A 148 -23.142 8.433 3.612 1.00 0.00 C ATOM 415 NH1 ARG A 148 -24.026 7.623 3.020 1.00 0.00 N ATOM 416 NH2 ARG A 148 -23.573 9.355 4.456 1.00 0.00 N ATOM 0 H ARG A 148 -17.206 8.956 0.141 1.00 0.00 H new ATOM 0 HA ARG A 148 -17.190 8.215 2.851 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -19.176 9.095 1.874 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -19.195 7.879 0.613 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -19.542 6.092 2.320 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -19.482 7.288 3.599 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -21.479 7.699 1.403 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -21.784 6.405 2.544 1.00 0.00 H new ATOM 0 HE ARG A 148 -21.191 8.946 3.855 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -23.705 6.908 2.367 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -25.021 7.720 3.222 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -22.908 9.979 4.913 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -24.571 9.442 4.650 1.00 0.00 H new ATOM 430 N TYR A 149 -17.143 5.657 0.714 1.00 0.00 N ATOM 431 CA TYR A 149 -16.951 4.214 0.635 1.00 0.00 C ATOM 432 C TYR A 149 -15.561 3.856 1.153 1.00 0.00 C ATOM 433 O TYR A 149 -15.439 2.952 1.982 1.00 0.00 O ATOM 434 CB TYR A 149 -17.179 3.737 -0.813 1.00 0.00 C ATOM 435 CG TYR A 149 -17.109 2.236 -1.014 1.00 0.00 C ATOM 436 CD1 TYR A 149 -18.259 1.444 -0.850 1.00 0.00 C ATOM 437 CD2 TYR A 149 -15.889 1.621 -1.342 1.00 0.00 C ATOM 438 CE1 TYR A 149 -18.169 0.043 -0.917 1.00 0.00 C ATOM 439 CE2 TYR A 149 -15.795 0.223 -1.433 1.00 0.00 C ATOM 440 CZ TYR A 149 -16.928 -0.574 -1.178 1.00 0.00 C ATOM 441 OH TYR A 149 -16.833 -1.928 -1.179 1.00 0.00 O ATOM 0 H TYR A 149 -17.325 6.099 -0.187 1.00 0.00 H new ATOM 0 HA TYR A 149 -17.678 3.700 1.264 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -18.156 4.087 -1.145 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -16.436 4.209 -1.456 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -19.215 1.914 -0.672 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -15.016 2.229 -1.526 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -19.051 -0.562 -0.768 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -14.856 -0.240 -1.698 1.00 0.00 H new ATOM 0 HH TYR A 149 -16.065 -2.202 -0.636 1.00 0.00 H new ATOM 451 N TYR A 150 -14.542 4.611 0.736 1.00 0.00 N ATOM 452 CA TYR A 150 -13.181 4.518 1.230 1.00 0.00 C ATOM 453 C TYR A 150 -13.161 4.667 2.753 1.00 0.00 C ATOM 454 O TYR A 150 -12.688 3.765 3.448 1.00 0.00 O ATOM 455 CB TYR A 150 -12.307 5.576 0.541 1.00 0.00 C ATOM 456 CG TYR A 150 -10.884 5.593 1.049 1.00 0.00 C ATOM 457 CD1 TYR A 150 -10.082 4.441 0.935 1.00 0.00 C ATOM 458 CD2 TYR A 150 -10.392 6.732 1.711 1.00 0.00 C ATOM 459 CE1 TYR A 150 -8.826 4.391 1.563 1.00 0.00 C ATOM 460 CE2 TYR A 150 -9.109 6.704 2.284 1.00 0.00 C ATOM 461 CZ TYR A 150 -8.353 5.516 2.270 1.00 0.00 C ATOM 462 OH TYR A 150 -7.227 5.438 3.021 1.00 0.00 O ATOM 0 H TYR A 150 -14.654 5.328 0.019 1.00 0.00 H new ATOM 0 HA TYR A 150 -12.770 3.537 0.992 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -12.301 5.390 -0.533 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -12.752 6.560 0.691 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -10.433 3.594 0.364 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -10.997 7.624 1.779 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -8.226 3.495 1.505 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -8.702 7.596 2.736 1.00 0.00 H new ATOM 0 HH TYR A 150 -7.118 6.266 3.534 1.00 0.00 H new ATOM 472 N ARG A 151 -13.672 5.783 3.296 1.00 0.00 N ATOM 473 CA ARG A 151 -13.780 5.965 4.750 1.00 0.00 C ATOM 474 C ARG A 151 -14.502 4.807 5.441 1.00 0.00 C ATOM 475 O ARG A 151 -14.018 4.333 6.468 1.00 0.00 O ATOM 476 CB ARG A 151 -14.438 7.313 5.074 1.00 0.00 C ATOM 477 CG ARG A 151 -13.507 8.476 4.704 1.00 0.00 C ATOM 478 CD ARG A 151 -14.268 9.786 4.567 1.00 0.00 C ATOM 479 NE ARG A 151 -13.400 10.830 4.017 1.00 0.00 N ATOM 480 CZ ARG A 151 -13.537 12.143 4.190 1.00 0.00 C ATOM 481 NH1 ARG A 151 -14.516 12.642 4.932 1.00 0.00 N ATOM 482 NH2 ARG A 151 -12.665 12.970 3.637 1.00 0.00 N ATOM 0 H ARG A 151 -14.017 6.572 2.749 1.00 0.00 H new ATOM 0 HA ARG A 151 -12.766 5.968 5.150 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -15.377 7.405 4.528 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -14.680 7.359 6.136 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -12.736 8.581 5.467 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -12.999 8.251 3.766 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -15.132 9.645 3.918 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -14.647 10.096 5.541 1.00 0.00 H new ATOM 0 HE ARG A 151 -12.614 10.521 3.446 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -15.183 12.016 5.384 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -14.602 13.651 5.051 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -11.893 12.601 3.082 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -12.765 13.977 3.766 1.00 0.00 H new ATOM 496 N GLU A 152 -15.601 4.301 4.896 1.00 0.00 N ATOM 497 CA GLU A 152 -16.406 3.229 5.476 1.00 0.00 C ATOM 498 C GLU A 152 -15.595 1.960 5.707 1.00 0.00 C ATOM 499 O GLU A 152 -15.921 1.205 6.625 1.00 0.00 O ATOM 500 CB GLU A 152 -17.607 2.934 4.571 1.00 0.00 C ATOM 501 CG GLU A 152 -18.757 3.929 4.734 1.00 0.00 C ATOM 502 CD GLU A 152 -19.759 3.459 5.786 1.00 0.00 C ATOM 503 OE1 GLU A 152 -19.356 3.094 6.914 1.00 0.00 O ATOM 504 OE2 GLU A 152 -20.974 3.403 5.488 1.00 0.00 O ATOM 0 H GLU A 152 -15.971 4.636 4.007 1.00 0.00 H new ATOM 0 HA GLU A 152 -16.755 3.569 6.451 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -17.278 2.939 3.532 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -17.974 1.930 4.784 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -18.359 4.903 5.019 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -19.265 4.059 3.779 1.00 0.00 H new ATOM 511 N ASN A 153 -14.528 1.734 4.937 1.00 0.00 N ATOM 512 CA ASN A 153 -13.705 0.537 5.058 1.00 0.00 C ATOM 513 C ASN A 153 -12.281 0.874 5.469 1.00 0.00 C ATOM 514 O ASN A 153 -11.462 -0.035 5.530 1.00 0.00 O ATOM 515 CB ASN A 153 -13.709 -0.262 3.746 1.00 0.00 C ATOM 516 CG ASN A 153 -15.104 -0.672 3.318 1.00 0.00 C ATOM 517 OD1 ASN A 153 -15.676 -1.590 3.897 1.00 0.00 O ATOM 518 ND2 ASN A 153 -15.689 -0.008 2.342 1.00 0.00 N ATOM 0 H ASN A 153 -14.213 2.379 4.212 1.00 0.00 H new ATOM 0 HA ASN A 153 -14.141 -0.079 5.844 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -13.253 0.338 2.958 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -13.093 -1.153 3.866 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -16.636 -0.254 2.054 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -15.195 0.752 1.874 1.00 0.00 H new ATOM 525 N MET A 154 -11.945 2.128 5.780 1.00 0.00 N ATOM 526 CA MET A 154 -10.566 2.620 5.888 1.00 0.00 C ATOM 527 C MET A 154 -9.647 1.799 6.807 1.00 0.00 C ATOM 528 O MET A 154 -8.432 1.841 6.636 1.00 0.00 O ATOM 529 CB MET A 154 -10.587 4.098 6.307 1.00 0.00 C ATOM 530 CG MET A 154 -11.106 4.329 7.738 1.00 0.00 C ATOM 531 SD MET A 154 -11.857 5.947 8.101 1.00 0.00 S ATOM 532 CE MET A 154 -10.728 7.169 7.392 1.00 0.00 C ATOM 0 H MET A 154 -12.641 2.849 5.969 1.00 0.00 H new ATOM 0 HA MET A 154 -10.125 2.505 4.898 1.00 0.00 H new ATOM 0 HB2 MET A 154 -9.579 4.504 6.226 1.00 0.00 H new ATOM 0 HB3 MET A 154 -11.212 4.655 5.609 1.00 0.00 H new ATOM 0 HG2 MET A 154 -11.844 3.557 7.958 1.00 0.00 H new ATOM 0 HG3 MET A 154 -10.274 4.181 8.427 1.00 0.00 H new ATOM 0 HE1 MET A 154 -11.028 8.168 7.708 1.00 0.00 H new ATOM 0 HE2 MET A 154 -9.713 6.970 7.736 1.00 0.00 H new ATOM 0 HE3 MET A 154 -10.761 7.107 6.304 1.00 0.00 H new ATOM 542 N TYR A 155 -10.221 1.046 7.746 1.00 0.00 N ATOM 543 CA TYR A 155 -9.546 0.222 8.733 1.00 0.00 C ATOM 544 C TYR A 155 -9.347 -1.243 8.313 1.00 0.00 C ATOM 545 O TYR A 155 -8.483 -1.912 8.880 1.00 0.00 O ATOM 546 CB TYR A 155 -10.383 0.289 10.016 1.00 0.00 C ATOM 547 CG TYR A 155 -11.782 -0.305 9.910 1.00 0.00 C ATOM 548 CD1 TYR A 155 -12.848 0.421 9.329 1.00 0.00 C ATOM 549 CD2 TYR A 155 -12.014 -1.600 10.407 1.00 0.00 C ATOM 550 CE1 TYR A 155 -14.145 -0.124 9.271 1.00 0.00 C ATOM 551 CE2 TYR A 155 -13.302 -2.155 10.354 1.00 0.00 C ATOM 552 CZ TYR A 155 -14.373 -1.417 9.804 1.00 0.00 C ATOM 553 OH TYR A 155 -15.609 -1.983 9.802 1.00 0.00 O ATOM 0 H TYR A 155 -11.236 0.997 7.838 1.00 0.00 H new ATOM 0 HA TYR A 155 -8.537 0.613 8.866 1.00 0.00 H new ATOM 0 HB2 TYR A 155 -9.845 -0.230 10.809 1.00 0.00 H new ATOM 0 HB3 TYR A 155 -10.471 1.332 10.319 1.00 0.00 H new ATOM 0 HD1 TYR A 155 -12.665 1.406 8.925 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -11.199 -2.169 10.830 1.00 0.00 H new ATOM 0 HE1 TYR A 155 -14.955 0.436 8.826 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -13.475 -3.151 10.735 1.00 0.00 H new ATOM 0 HH TYR A 155 -15.562 -2.873 10.210 1.00 0.00 H new ATOM 563 N ARG A 156 -10.128 -1.778 7.364 1.00 0.00 N ATOM 564 CA ARG A 156 -9.999 -3.173 6.913 1.00 0.00 C ATOM 565 C ARG A 156 -8.712 -3.373 6.101 1.00 0.00 C ATOM 566 O ARG A 156 -8.191 -4.486 6.100 1.00 0.00 O ATOM 567 CB ARG A 156 -11.286 -3.623 6.157 1.00 0.00 C ATOM 568 CG ARG A 156 -12.375 -4.153 7.116 1.00 0.00 C ATOM 569 CD ARG A 156 -13.734 -3.437 7.011 1.00 0.00 C ATOM 570 NE ARG A 156 -14.397 -3.509 5.694 1.00 0.00 N ATOM 571 CZ ARG A 156 -14.936 -4.572 5.083 1.00 0.00 C ATOM 572 NH1 ARG A 156 -14.755 -5.809 5.537 1.00 0.00 N ATOM 573 NH2 ARG A 156 -15.676 -4.365 4.002 1.00 0.00 N ATOM 0 H ARG A 156 -10.865 -1.258 6.888 1.00 0.00 H new ATOM 0 HA ARG A 156 -9.907 -3.823 7.783 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -11.684 -2.782 5.589 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -11.029 -4.401 5.438 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -12.524 -5.215 6.922 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -12.012 -4.064 8.140 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -14.405 -3.860 7.758 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -13.591 -2.387 7.268 1.00 0.00 H new ATOM 0 HE ARG A 156 -14.452 -2.630 5.180 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -14.192 -5.968 6.373 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -15.179 -6.598 5.049 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -15.821 -3.416 3.658 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -16.100 -5.155 3.515 1.00 0.00 H new ATOM 587 N TYR A 157 -8.189 -2.322 5.458 1.00 0.00 N ATOM 588 CA TYR A 157 -6.955 -2.320 4.666 1.00 0.00 C ATOM 589 C TYR A 157 -5.719 -2.626 5.533 1.00 0.00 C ATOM 590 O TYR A 157 -5.797 -2.544 6.767 1.00 0.00 O ATOM 591 CB TYR A 157 -6.816 -0.934 3.998 1.00 0.00 C ATOM 592 CG TYR A 157 -7.931 -0.541 3.050 1.00 0.00 C ATOM 593 CD1 TYR A 157 -8.349 -1.432 2.041 1.00 0.00 C ATOM 594 CD2 TYR A 157 -8.557 0.712 3.179 1.00 0.00 C ATOM 595 CE1 TYR A 157 -9.392 -1.091 1.165 1.00 0.00 C ATOM 596 CE2 TYR A 157 -9.612 1.058 2.318 1.00 0.00 C ATOM 597 CZ TYR A 157 -10.029 0.158 1.313 1.00 0.00 C ATOM 598 OH TYR A 157 -11.100 0.468 0.551 1.00 0.00 O ATOM 0 H TYR A 157 -8.637 -1.406 5.477 1.00 0.00 H new ATOM 0 HA TYR A 157 -7.012 -3.105 3.911 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -6.749 -0.180 4.782 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -5.874 -0.909 3.450 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -7.860 -2.390 1.940 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -8.228 1.406 3.938 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -9.702 -1.775 0.389 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -10.104 2.013 2.425 1.00 0.00 H new ATOM 0 HH TYR A 157 -11.744 -0.270 0.576 1.00 0.00 H new ATOM 608 N PRO A 158 -4.549 -2.934 4.935 1.00 0.00 N ATOM 609 CA PRO A 158 -3.328 -3.107 5.693 1.00 0.00 C ATOM 610 C PRO A 158 -2.789 -1.736 6.112 1.00 0.00 C ATOM 611 O PRO A 158 -3.306 -0.674 5.748 1.00 0.00 O ATOM 612 CB PRO A 158 -2.371 -3.855 4.754 1.00 0.00 C ATOM 613 CG PRO A 158 -2.760 -3.351 3.372 1.00 0.00 C ATOM 614 CD PRO A 158 -4.252 -3.069 3.513 1.00 0.00 C ATOM 0 HA PRO A 158 -3.469 -3.671 6.615 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -1.329 -3.633 4.983 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -2.492 -4.935 4.836 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.204 -2.454 3.099 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -2.562 -4.096 2.601 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -4.520 -2.158 2.979 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -4.837 -3.879 3.076 1.00 0.00 H new ATOM 622 N ASN A 159 -1.691 -1.768 6.856 1.00 0.00 N ATOM 623 CA ASN A 159 -0.852 -0.619 7.162 1.00 0.00 C ATOM 624 C ASN A 159 0.604 -0.858 6.787 1.00 0.00 C ATOM 625 O ASN A 159 1.376 0.097 6.766 1.00 0.00 O ATOM 626 CB ASN A 159 -0.924 -0.210 8.640 1.00 0.00 C ATOM 627 CG ASN A 159 -1.544 -1.175 9.627 1.00 0.00 C ATOM 628 OD1 ASN A 159 -2.586 -0.896 10.207 1.00 0.00 O ATOM 629 ND2 ASN A 159 -0.889 -2.291 9.907 1.00 0.00 N ATOM 0 H ASN A 159 -1.348 -2.630 7.279 1.00 0.00 H new ATOM 0 HA ASN A 159 -1.250 0.195 6.556 1.00 0.00 H new ATOM 0 HB2 ASN A 159 0.092 0.000 8.976 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -1.479 0.726 8.698 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -1.251 -2.931 10.614 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -0.022 -2.511 9.416 1.00 0.00 H new ATOM 636 N GLN A 160 1.012 -2.100 6.553 1.00 0.00 N ATOM 637 CA GLN A 160 2.364 -2.413 6.125 1.00 0.00 C ATOM 638 C GLN A 160 2.335 -2.526 4.602 1.00 0.00 C ATOM 639 O GLN A 160 1.290 -2.827 4.018 1.00 0.00 O ATOM 640 CB GLN A 160 2.828 -3.701 6.832 1.00 0.00 C ATOM 641 CG GLN A 160 2.851 -3.479 8.353 1.00 0.00 C ATOM 642 CD GLN A 160 3.341 -4.660 9.181 1.00 0.00 C ATOM 643 OE1 GLN A 160 2.604 -5.170 10.024 1.00 0.00 O ATOM 644 NE2 GLN A 160 4.597 -5.041 9.044 1.00 0.00 N ATOM 0 H GLN A 160 0.411 -2.918 6.656 1.00 0.00 H new ATOM 0 HA GLN A 160 3.085 -1.641 6.396 1.00 0.00 H new ATOM 0 HB2 GLN A 160 2.158 -4.524 6.585 1.00 0.00 H new ATOM 0 HB3 GLN A 160 3.821 -3.982 6.481 1.00 0.00 H new ATOM 0 HG2 GLN A 160 3.486 -2.619 8.568 1.00 0.00 H new ATOM 0 HG3 GLN A 160 1.844 -3.221 8.680 1.00 0.00 H new ATOM 0 HE21 GLN A 160 5.189 -4.603 8.338 1.00 0.00 H new ATOM 0 HE22 GLN A 160 4.976 -5.773 9.644 1.00 0.00 H new ATOM 653 N VAL A 161 3.467 -2.260 3.959 1.00 0.00 N ATOM 654 CA VAL A 161 3.629 -2.330 2.509 1.00 0.00 C ATOM 655 C VAL A 161 4.961 -3.014 2.227 1.00 0.00 C ATOM 656 O VAL A 161 5.903 -2.826 2.999 1.00 0.00 O ATOM 657 CB VAL A 161 3.552 -0.920 1.879 1.00 0.00 C ATOM 658 CG1 VAL A 161 2.177 -0.278 2.108 1.00 0.00 C ATOM 659 CG2 VAL A 161 4.612 0.056 2.415 1.00 0.00 C ATOM 0 H VAL A 161 4.320 -1.982 4.444 1.00 0.00 H new ATOM 0 HA VAL A 161 2.823 -2.907 2.057 1.00 0.00 H new ATOM 0 HB VAL A 161 3.736 -1.086 0.817 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.157 0.712 1.652 1.00 0.00 H new ATOM 0 HG12 VAL A 161 1.405 -0.901 1.656 1.00 0.00 H new ATOM 0 HG13 VAL A 161 1.991 -0.189 3.178 1.00 0.00 H new ATOM 0 HG21 VAL A 161 4.495 1.024 1.927 1.00 0.00 H new ATOM 0 HG22 VAL A 161 4.486 0.175 3.491 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.607 -0.338 2.207 1.00 0.00 H new ATOM 669 N TYR A 162 5.051 -3.823 1.172 1.00 0.00 N ATOM 670 CA TYR A 162 6.349 -4.322 0.738 1.00 0.00 C ATOM 671 C TYR A 162 7.011 -3.302 -0.168 1.00 0.00 C ATOM 672 O TYR A 162 6.312 -2.609 -0.900 1.00 0.00 O ATOM 673 CB TYR A 162 6.229 -5.631 -0.032 1.00 0.00 C ATOM 674 CG TYR A 162 5.763 -6.796 0.804 1.00 0.00 C ATOM 675 CD1 TYR A 162 4.390 -7.031 0.945 1.00 0.00 C ATOM 676 CD2 TYR A 162 6.691 -7.643 1.436 1.00 0.00 C ATOM 677 CE1 TYR A 162 3.943 -8.134 1.672 1.00 0.00 C ATOM 678 CE2 TYR A 162 6.245 -8.725 2.215 1.00 0.00 C ATOM 679 CZ TYR A 162 4.860 -8.968 2.343 1.00 0.00 C ATOM 680 OH TYR A 162 4.392 -9.946 3.160 1.00 0.00 O ATOM 0 H TYR A 162 4.258 -4.140 0.614 1.00 0.00 H new ATOM 0 HA TYR A 162 6.943 -4.496 1.635 1.00 0.00 H new ATOM 0 HB2 TYR A 162 5.534 -5.491 -0.860 1.00 0.00 H new ATOM 0 HB3 TYR A 162 7.198 -5.874 -0.467 1.00 0.00 H new ATOM 0 HD1 TYR A 162 3.677 -6.358 0.491 1.00 0.00 H new ATOM 0 HD2 TYR A 162 7.750 -7.462 1.323 1.00 0.00 H new ATOM 0 HE1 TYR A 162 2.886 -8.351 1.721 1.00 0.00 H new ATOM 0 HE2 TYR A 162 6.957 -9.366 2.712 1.00 0.00 H new ATOM 0 HH TYR A 162 5.146 -10.436 3.549 1.00 0.00 H new ATOM 690 N TYR A 163 8.339 -3.306 -0.223 1.00 0.00 N ATOM 691 CA TYR A 163 9.131 -2.543 -1.166 1.00 0.00 C ATOM 692 C TYR A 163 10.374 -3.356 -1.522 1.00 0.00 C ATOM 693 O TYR A 163 10.614 -4.421 -0.948 1.00 0.00 O ATOM 694 CB TYR A 163 9.487 -1.189 -0.538 1.00 0.00 C ATOM 695 CG TYR A 163 10.207 -1.230 0.803 1.00 0.00 C ATOM 696 CD1 TYR A 163 9.475 -1.325 2.005 1.00 0.00 C ATOM 697 CD2 TYR A 163 11.615 -1.158 0.855 1.00 0.00 C ATOM 698 CE1 TYR A 163 10.137 -1.324 3.243 1.00 0.00 C ATOM 699 CE2 TYR A 163 12.285 -1.196 2.092 1.00 0.00 C ATOM 700 CZ TYR A 163 11.544 -1.255 3.292 1.00 0.00 C ATOM 701 OH TYR A 163 12.193 -1.260 4.487 1.00 0.00 O ATOM 0 H TYR A 163 8.909 -3.863 0.414 1.00 0.00 H new ATOM 0 HA TYR A 163 8.577 -2.347 -2.084 1.00 0.00 H new ATOM 0 HB2 TYR A 163 10.110 -0.639 -1.243 1.00 0.00 H new ATOM 0 HB3 TYR A 163 8.567 -0.618 -0.414 1.00 0.00 H new ATOM 0 HD1 TYR A 163 8.398 -1.399 1.973 1.00 0.00 H new ATOM 0 HD2 TYR A 163 12.182 -1.073 -0.060 1.00 0.00 H new ATOM 0 HE1 TYR A 163 9.567 -1.376 4.159 1.00 0.00 H new ATOM 0 HE2 TYR A 163 13.364 -1.180 2.123 1.00 0.00 H new ATOM 0 HH TYR A 163 13.160 -1.208 4.334 1.00 0.00 H new ATOM 711 N ARG A 164 11.202 -2.864 -2.440 1.00 0.00 N ATOM 712 CA ARG A 164 12.570 -3.345 -2.620 1.00 0.00 C ATOM 713 C ARG A 164 13.518 -2.205 -2.283 1.00 0.00 C ATOM 714 O ARG A 164 13.130 -1.049 -2.447 1.00 0.00 O ATOM 715 CB ARG A 164 12.792 -3.808 -4.060 1.00 0.00 C ATOM 716 CG ARG A 164 11.978 -5.074 -4.347 1.00 0.00 C ATOM 717 CD ARG A 164 12.055 -5.440 -5.826 1.00 0.00 C ATOM 718 NE ARG A 164 13.393 -5.937 -6.195 1.00 0.00 N ATOM 719 CZ ARG A 164 13.758 -6.310 -7.424 1.00 0.00 C ATOM 720 NH1 ARG A 164 12.883 -6.291 -8.426 1.00 0.00 N ATOM 721 NH2 ARG A 164 15.011 -6.691 -7.647 1.00 0.00 N ATOM 0 H ARG A 164 10.942 -2.117 -3.083 1.00 0.00 H new ATOM 0 HA ARG A 164 12.754 -4.197 -1.965 1.00 0.00 H new ATOM 0 HB2 ARG A 164 12.502 -3.017 -4.752 1.00 0.00 H new ATOM 0 HB3 ARG A 164 13.851 -4.004 -4.226 1.00 0.00 H new ATOM 0 HG2 ARG A 164 12.355 -5.899 -3.743 1.00 0.00 H new ATOM 0 HG3 ARG A 164 10.938 -4.917 -4.060 1.00 0.00 H new ATOM 0 HD2 ARG A 164 11.309 -6.202 -6.052 1.00 0.00 H new ATOM 0 HD3 ARG A 164 11.812 -4.566 -6.430 1.00 0.00 H new ATOM 0 HE ARG A 164 14.093 -6.001 -5.456 1.00 0.00 H new ATOM 0 HH11 ARG A 164 11.923 -5.989 -8.259 1.00 0.00 H new ATOM 0 HH12 ARG A 164 13.172 -6.578 -9.361 1.00 0.00 H new ATOM 0 HH21 ARG A 164 15.686 -6.697 -6.882 1.00 0.00 H new ATOM 0 HH22 ARG A 164 15.298 -6.977 -8.583 1.00 0.00 H new ATOM 735 N PRO A 165 14.750 -2.493 -1.841 1.00 0.00 N ATOM 736 CA PRO A 165 15.707 -1.450 -1.513 1.00 0.00 C ATOM 737 C PRO A 165 15.938 -0.513 -2.701 1.00 0.00 C ATOM 738 O PRO A 165 15.974 -0.959 -3.856 1.00 0.00 O ATOM 739 CB PRO A 165 16.981 -2.175 -1.082 1.00 0.00 C ATOM 740 CG PRO A 165 16.491 -3.557 -0.654 1.00 0.00 C ATOM 741 CD PRO A 165 15.313 -3.811 -1.592 1.00 0.00 C ATOM 0 HA PRO A 165 15.344 -0.805 -0.713 1.00 0.00 H new ATOM 0 HB2 PRO A 165 17.699 -2.241 -1.900 1.00 0.00 H new ATOM 0 HB3 PRO A 165 17.478 -1.656 -0.263 1.00 0.00 H new ATOM 0 HG2 PRO A 165 17.268 -4.313 -0.768 1.00 0.00 H new ATOM 0 HG3 PRO A 165 16.184 -3.570 0.392 1.00 0.00 H new ATOM 0 HD2 PRO A 165 15.639 -4.284 -2.518 1.00 0.00 H new ATOM 0 HD3 PRO A 165 14.579 -4.476 -1.136 1.00 0.00 H new ATOM 749 N VAL A 166 16.077 0.784 -2.431 1.00 0.00 N ATOM 750 CA VAL A 166 16.229 1.805 -3.456 1.00 0.00 C ATOM 751 C VAL A 166 17.640 1.740 -4.030 1.00 0.00 C ATOM 752 O VAL A 166 18.586 2.100 -3.341 1.00 0.00 O ATOM 753 CB VAL A 166 15.896 3.216 -2.912 1.00 0.00 C ATOM 754 CG1 VAL A 166 14.442 3.553 -3.230 1.00 0.00 C ATOM 755 CG2 VAL A 166 16.086 3.423 -1.403 1.00 0.00 C ATOM 0 H VAL A 166 16.087 1.156 -1.481 1.00 0.00 H new ATOM 0 HA VAL A 166 15.515 1.609 -4.256 1.00 0.00 H new ATOM 0 HB VAL A 166 16.616 3.867 -3.408 1.00 0.00 H new ATOM 0 HG11 VAL A 166 14.207 4.546 -2.847 1.00 0.00 H new ATOM 0 HG12 VAL A 166 14.292 3.535 -4.309 1.00 0.00 H new ATOM 0 HG13 VAL A 166 13.787 2.819 -2.761 1.00 0.00 H new ATOM 0 HG21 VAL A 166 15.822 4.447 -1.140 1.00 0.00 H new ATOM 0 HG22 VAL A 166 15.444 2.732 -0.857 1.00 0.00 H new ATOM 0 HG23 VAL A 166 17.127 3.237 -1.138 1.00 0.00 H new ATOM 765 N ASP A 167 17.791 1.293 -5.278 1.00 0.00 N ATOM 766 CA ASP A 167 18.985 1.544 -6.089 1.00 0.00 C ATOM 767 C ASP A 167 18.728 1.136 -7.536 1.00 0.00 C ATOM 768 O ASP A 167 19.119 1.859 -8.450 1.00 0.00 O ATOM 769 CB ASP A 167 20.215 0.747 -5.611 1.00 0.00 C ATOM 770 CG ASP A 167 21.148 1.487 -4.657 1.00 0.00 C ATOM 771 OD1 ASP A 167 21.429 2.686 -4.878 1.00 0.00 O ATOM 772 OD2 ASP A 167 21.666 0.819 -3.725 1.00 0.00 O ATOM 0 H ASP A 167 17.081 0.741 -5.759 1.00 0.00 H new ATOM 0 HA ASP A 167 19.192 2.610 -5.994 1.00 0.00 H new ATOM 0 HB2 ASP A 167 19.868 -0.162 -5.120 1.00 0.00 H new ATOM 0 HB3 ASP A 167 20.788 0.438 -6.485 1.00 0.00 H new ATOM 777 N GLN A 168 18.154 -0.051 -7.770 1.00 0.00 N ATOM 778 CA GLN A 168 18.062 -0.623 -9.122 1.00 0.00 C ATOM 779 C GLN A 168 16.820 -0.160 -9.884 1.00 0.00 C ATOM 780 O GLN A 168 16.775 -0.335 -11.102 1.00 0.00 O ATOM 781 CB GLN A 168 18.060 -2.162 -9.085 1.00 0.00 C ATOM 782 CG GLN A 168 19.454 -2.793 -9.024 1.00 0.00 C ATOM 783 CD GLN A 168 20.016 -2.866 -7.612 1.00 0.00 C ATOM 784 OE1 GLN A 168 19.723 -3.794 -6.865 1.00 0.00 O ATOM 785 NE2 GLN A 168 20.867 -1.936 -7.224 1.00 0.00 N ATOM 0 H GLN A 168 17.746 -0.635 -7.041 1.00 0.00 H new ATOM 0 HA GLN A 168 18.946 -0.260 -9.646 1.00 0.00 H new ATOM 0 HB2 GLN A 168 17.486 -2.492 -8.219 1.00 0.00 H new ATOM 0 HB3 GLN A 168 17.544 -2.534 -9.970 1.00 0.00 H new ATOM 0 HG2 GLN A 168 19.410 -3.798 -9.443 1.00 0.00 H new ATOM 0 HG3 GLN A 168 20.135 -2.216 -9.650 1.00 0.00 H new ATOM 0 HE21 GLN A 168 21.105 -1.168 -7.852 1.00 0.00 H new ATOM 0 HE22 GLN A 168 21.288 -1.985 -6.296 1.00 0.00 H new ATOM 794 N ALA A 169 15.816 0.378 -9.194 1.00 0.00 N ATOM 795 CA ALA A 169 14.535 0.745 -9.779 1.00 0.00 C ATOM 796 C ALA A 169 14.124 2.136 -9.307 1.00 0.00 C ATOM 797 O ALA A 169 13.759 2.964 -10.139 1.00 0.00 O ATOM 798 CB ALA A 169 13.481 -0.315 -9.433 1.00 0.00 C ATOM 0 H ALA A 169 15.875 0.573 -8.195 1.00 0.00 H new ATOM 0 HA ALA A 169 14.623 0.781 -10.865 1.00 0.00 H new ATOM 0 HB1 ALA A 169 12.524 -0.034 -9.874 1.00 0.00 H new ATOM 0 HB2 ALA A 169 13.793 -1.281 -9.829 1.00 0.00 H new ATOM 0 HB3 ALA A 169 13.375 -0.383 -8.350 1.00 0.00 H new ATOM 804 N SER A 170 14.163 2.369 -7.989 1.00 0.00 N ATOM 805 CA SER A 170 14.139 3.664 -7.302 1.00 0.00 C ATOM 806 C SER A 170 13.486 4.804 -8.100 1.00 0.00 C ATOM 807 O SER A 170 14.195 5.658 -8.635 1.00 0.00 O ATOM 808 CB SER A 170 15.565 4.023 -6.846 1.00 0.00 C ATOM 809 OG SER A 170 16.500 3.912 -7.906 1.00 0.00 O ATOM 0 H SER A 170 14.216 1.596 -7.325 1.00 0.00 H new ATOM 0 HA SER A 170 13.489 3.549 -6.434 1.00 0.00 H new ATOM 0 HB2 SER A 170 15.577 5.041 -6.456 1.00 0.00 H new ATOM 0 HB3 SER A 170 15.862 3.365 -6.029 1.00 0.00 H new ATOM 0 HG SER A 170 16.206 4.464 -8.660 1.00 0.00 H new ATOM 815 N ASN A 171 12.158 4.802 -8.222 1.00 0.00 N ATOM 816 CA ASN A 171 11.368 5.922 -8.733 1.00 0.00 C ATOM 817 C ASN A 171 9.910 5.719 -8.310 1.00 0.00 C ATOM 818 O ASN A 171 9.476 4.598 -8.034 1.00 0.00 O ATOM 819 CB ASN A 171 11.551 6.092 -10.250 1.00 0.00 C ATOM 820 CG ASN A 171 10.507 6.998 -10.877 1.00 0.00 C ATOM 821 OD1 ASN A 171 10.314 8.126 -10.442 1.00 0.00 O ATOM 822 ND2 ASN A 171 9.747 6.510 -11.835 1.00 0.00 N ATOM 0 H ASN A 171 11.587 3.998 -7.961 1.00 0.00 H new ATOM 0 HA ASN A 171 11.717 6.861 -8.303 1.00 0.00 H new ATOM 0 HB2 ASN A 171 12.543 6.499 -10.447 1.00 0.00 H new ATOM 0 HB3 ASN A 171 11.508 5.113 -10.727 1.00 0.00 H new ATOM 0 HD21 ASN A 171 8.989 7.073 -12.222 1.00 0.00 H new ATOM 0 HD22 ASN A 171 9.916 5.569 -12.191 1.00 0.00 H new ATOM 829 N GLN A 172 9.151 6.811 -8.247 1.00 0.00 N ATOM 830 CA GLN A 172 7.963 6.991 -7.419 1.00 0.00 C ATOM 831 C GLN A 172 6.697 6.505 -8.113 1.00 0.00 C ATOM 832 O GLN A 172 5.622 6.544 -7.514 1.00 0.00 O ATOM 833 CB GLN A 172 7.819 8.473 -7.014 1.00 0.00 C ATOM 834 CG GLN A 172 6.991 8.646 -5.727 1.00 0.00 C ATOM 835 CD GLN A 172 7.428 9.849 -4.884 1.00 0.00 C ATOM 836 OE1 GLN A 172 6.534 10.790 -4.666 1.00 0.00 O flip ATOM 837 NE2 GLN A 172 8.535 9.926 -4.361 1.00 0.00 N flip ATOM 0 H GLN A 172 9.361 7.639 -8.804 1.00 0.00 H new ATOM 0 HA GLN A 172 8.093 6.382 -6.525 1.00 0.00 H new ATOM 0 HB2 GLN A 172 8.809 8.906 -6.868 1.00 0.00 H new ATOM 0 HB3 GLN A 172 7.346 9.025 -7.826 1.00 0.00 H new ATOM 0 HG2 GLN A 172 5.940 8.759 -5.992 1.00 0.00 H new ATOM 0 HG3 GLN A 172 7.073 7.741 -5.126 1.00 0.00 H new ATOM 0 HE21 GLN A 172 9.230 9.198 -4.528 1.00 0.00 H new ATOM 0 HE22 GLN A 172 8.761 10.718 -3.759 1.00 0.00 H new ATOM 846 N ASN A 173 6.803 6.053 -9.363 1.00 0.00 N ATOM 847 CA ASN A 173 5.767 5.245 -9.971 1.00 0.00 C ATOM 848 C ASN A 173 6.097 3.787 -9.682 1.00 0.00 C ATOM 849 O ASN A 173 5.291 3.053 -9.126 1.00 0.00 O ATOM 850 CB ASN A 173 5.736 5.469 -11.493 1.00 0.00 C ATOM 851 CG ASN A 173 4.532 6.277 -11.953 1.00 0.00 C ATOM 852 OD1 ASN A 173 3.391 5.883 -11.756 1.00 0.00 O ATOM 853 ND2 ASN A 173 4.736 7.396 -12.631 1.00 0.00 N ATOM 0 H ASN A 173 7.602 6.238 -9.969 1.00 0.00 H new ATOM 0 HA ASN A 173 4.792 5.516 -9.566 1.00 0.00 H new ATOM 0 HB2 ASN A 173 6.648 5.982 -11.797 1.00 0.00 H new ATOM 0 HB3 ASN A 173 5.731 4.502 -11.996 1.00 0.00 H new ATOM 0 HD21 ASN A 173 3.942 7.928 -12.988 1.00 0.00 H new ATOM 0 HD22 ASN A 173 5.687 7.726 -12.796 1.00 0.00 H new ATOM 860 N ASN A 174 7.286 3.340 -10.092 1.00 0.00 N ATOM 861 CA ASN A 174 7.540 1.920 -10.305 1.00 0.00 C ATOM 862 C ASN A 174 7.780 1.182 -9.002 1.00 0.00 C ATOM 863 O ASN A 174 7.179 0.128 -8.813 1.00 0.00 O ATOM 864 CB ASN A 174 8.684 1.687 -11.297 1.00 0.00 C ATOM 865 CG ASN A 174 9.875 2.603 -11.122 1.00 0.00 C ATOM 866 OD1 ASN A 174 9.744 3.783 -11.404 1.00 0.00 O ATOM 867 ND2 ASN A 174 11.016 2.115 -10.673 1.00 0.00 N ATOM 0 H ASN A 174 8.086 3.944 -10.282 1.00 0.00 H new ATOM 0 HA ASN A 174 6.635 1.505 -10.748 1.00 0.00 H new ATOM 0 HB2 ASN A 174 9.021 0.655 -11.204 1.00 0.00 H new ATOM 0 HB3 ASN A 174 8.298 1.806 -12.309 1.00 0.00 H new ATOM 0 HD21 ASN A 174 11.821 2.729 -10.553 1.00 0.00 H new ATOM 0 HD22 ASN A 174 11.093 1.123 -10.446 1.00 0.00 H new ATOM 874 N PHE A 175 8.611 1.726 -8.107 1.00 0.00 N ATOM 875 CA PHE A 175 8.782 1.187 -6.748 1.00 0.00 C ATOM 876 C PHE A 175 7.399 1.049 -6.105 1.00 0.00 C ATOM 877 O PHE A 175 7.073 0.020 -5.526 1.00 0.00 O ATOM 878 CB PHE A 175 9.716 2.118 -5.939 1.00 0.00 C ATOM 879 CG PHE A 175 9.937 1.848 -4.450 1.00 0.00 C ATOM 880 CD1 PHE A 175 8.889 2.061 -3.530 1.00 0.00 C ATOM 881 CD2 PHE A 175 11.229 1.566 -3.948 1.00 0.00 C ATOM 882 CE1 PHE A 175 9.124 2.026 -2.146 1.00 0.00 C ATOM 883 CE2 PHE A 175 11.454 1.530 -2.559 1.00 0.00 C ATOM 884 CZ PHE A 175 10.414 1.791 -1.657 1.00 0.00 C ATOM 0 H PHE A 175 9.183 2.548 -8.300 1.00 0.00 H new ATOM 0 HA PHE A 175 9.248 0.202 -6.770 1.00 0.00 H new ATOM 0 HB2 PHE A 175 10.693 2.103 -6.423 1.00 0.00 H new ATOM 0 HB3 PHE A 175 9.329 3.133 -6.034 1.00 0.00 H new ATOM 0 HD1 PHE A 175 7.891 2.254 -3.895 1.00 0.00 H new ATOM 0 HD2 PHE A 175 12.044 1.378 -4.631 1.00 0.00 H new ATOM 0 HE1 PHE A 175 8.307 2.181 -1.457 1.00 0.00 H new ATOM 0 HE2 PHE A 175 12.440 1.298 -2.184 1.00 0.00 H new ATOM 0 HZ PHE A 175 10.606 1.811 -0.594 1.00 0.00 H new ATOM 894 N VAL A 176 6.583 2.094 -6.232 1.00 0.00 N ATOM 895 CA VAL A 176 5.325 2.279 -5.525 1.00 0.00 C ATOM 896 C VAL A 176 4.246 1.320 -6.058 1.00 0.00 C ATOM 897 O VAL A 176 3.548 0.687 -5.266 1.00 0.00 O ATOM 898 CB VAL A 176 4.983 3.782 -5.619 1.00 0.00 C ATOM 899 CG1 VAL A 176 3.668 4.160 -4.934 1.00 0.00 C ATOM 900 CG2 VAL A 176 6.112 4.620 -4.976 1.00 0.00 C ATOM 0 H VAL A 176 6.794 2.869 -6.861 1.00 0.00 H new ATOM 0 HA VAL A 176 5.393 2.016 -4.470 1.00 0.00 H new ATOM 0 HB VAL A 176 4.877 3.994 -6.683 1.00 0.00 H new ATOM 0 HG11 VAL A 176 3.496 5.231 -5.042 1.00 0.00 H new ATOM 0 HG12 VAL A 176 2.847 3.612 -5.396 1.00 0.00 H new ATOM 0 HG13 VAL A 176 3.723 3.907 -3.875 1.00 0.00 H new ATOM 0 HG21 VAL A 176 5.864 5.679 -5.046 1.00 0.00 H new ATOM 0 HG22 VAL A 176 6.220 4.341 -3.928 1.00 0.00 H new ATOM 0 HG23 VAL A 176 7.049 4.431 -5.500 1.00 0.00 H new ATOM 910 N HIS A 177 4.130 1.152 -7.378 1.00 0.00 N ATOM 911 CA HIS A 177 3.224 0.188 -7.994 1.00 0.00 C ATOM 912 C HIS A 177 3.638 -1.233 -7.589 1.00 0.00 C ATOM 913 O HIS A 177 2.789 -2.045 -7.238 1.00 0.00 O ATOM 914 CB HIS A 177 3.236 0.400 -9.518 1.00 0.00 C ATOM 915 CG HIS A 177 2.231 -0.377 -10.348 1.00 0.00 C ATOM 916 ND1 HIS A 177 1.726 -1.632 -10.130 1.00 0.00 N flip ATOM 917 CD2 HIS A 177 1.723 0.044 -11.556 1.00 0.00 C flip ATOM 918 CE1 HIS A 177 0.953 -1.996 -11.232 1.00 0.00 C flip ATOM 919 NE2 HIS A 177 0.957 -0.942 -12.057 1.00 0.00 N flip ATOM 0 H HIS A 177 4.671 1.690 -8.055 1.00 0.00 H new ATOM 0 HA HIS A 177 2.201 0.333 -7.647 1.00 0.00 H new ATOM 0 HB2 HIS A 177 3.079 1.462 -9.710 1.00 0.00 H new ATOM 0 HB3 HIS A 177 4.233 0.154 -9.883 1.00 0.00 H new ATOM 0 HD1 HIS A 177 1.888 -2.204 -9.301 1.00 0.00 H new ATOM 0 HD2 HIS A 177 1.908 1.001 -12.021 1.00 0.00 H new ATOM 0 HE1 HIS A 177 0.451 -2.940 -11.389 1.00 0.00 H new ATOM 927 N ASP A 178 4.928 -1.560 -7.616 1.00 0.00 N ATOM 928 CA ASP A 178 5.446 -2.859 -7.181 1.00 0.00 C ATOM 929 C ASP A 178 5.012 -3.183 -5.754 1.00 0.00 C ATOM 930 O ASP A 178 4.590 -4.309 -5.473 1.00 0.00 O ATOM 931 CB ASP A 178 6.971 -2.810 -7.269 1.00 0.00 C ATOM 932 CG ASP A 178 7.656 -4.161 -7.164 1.00 0.00 C ATOM 933 OD1 ASP A 178 7.087 -5.189 -7.596 1.00 0.00 O ATOM 934 OD2 ASP A 178 8.819 -4.203 -6.711 1.00 0.00 O ATOM 0 H ASP A 178 5.654 -0.923 -7.945 1.00 0.00 H new ATOM 0 HA ASP A 178 5.047 -3.643 -7.825 1.00 0.00 H new ATOM 0 HB2 ASP A 178 7.252 -2.348 -8.215 1.00 0.00 H new ATOM 0 HB3 ASP A 178 7.347 -2.165 -6.475 1.00 0.00 H new ATOM 939 N CYS A 179 5.039 -2.169 -4.882 1.00 0.00 N ATOM 940 CA CYS A 179 4.457 -2.274 -3.547 1.00 0.00 C ATOM 941 C CYS A 179 2.985 -2.665 -3.615 1.00 0.00 C ATOM 942 O CYS A 179 2.591 -3.611 -2.936 1.00 0.00 O ATOM 943 CB CYS A 179 4.519 -0.985 -2.725 1.00 0.00 C ATOM 944 SG CYS A 179 6.044 -0.035 -2.655 1.00 0.00 S ATOM 0 H CYS A 179 5.461 -1.262 -5.082 1.00 0.00 H new ATOM 0 HA CYS A 179 5.066 -3.035 -3.059 1.00 0.00 H new ATOM 0 HB2 CYS A 179 3.741 -0.322 -3.103 1.00 0.00 H new ATOM 0 HB3 CYS A 179 4.249 -1.241 -1.700 1.00 0.00 H new ATOM 949 N VAL A 180 2.165 -1.916 -4.364 1.00 0.00 N ATOM 950 CA VAL A 180 0.732 -2.154 -4.532 1.00 0.00 C ATOM 951 C VAL A 180 0.525 -3.607 -4.937 1.00 0.00 C ATOM 952 O VAL A 180 -0.072 -4.361 -4.175 1.00 0.00 O ATOM 953 CB VAL A 180 0.133 -1.116 -5.508 1.00 0.00 C ATOM 954 CG1 VAL A 180 -1.278 -1.459 -5.991 1.00 0.00 C ATOM 955 CG2 VAL A 180 0.053 0.246 -4.822 1.00 0.00 C ATOM 0 H VAL A 180 2.495 -1.103 -4.885 1.00 0.00 H new ATOM 0 HA VAL A 180 0.188 -2.011 -3.599 1.00 0.00 H new ATOM 0 HB VAL A 180 0.796 -1.112 -6.373 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.628 -0.683 -6.672 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -1.262 -2.417 -6.510 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -1.950 -1.521 -5.135 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -0.370 0.977 -5.512 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -0.581 0.172 -3.939 1.00 0.00 H new ATOM 0 HG23 VAL A 180 1.053 0.563 -4.525 1.00 0.00 H new ATOM 965 N ASN A 181 1.086 -4.005 -6.079 1.00 0.00 N ATOM 966 CA ASN A 181 1.080 -5.344 -6.646 1.00 0.00 C ATOM 967 C ASN A 181 1.270 -6.397 -5.570 1.00 0.00 C ATOM 968 O ASN A 181 0.371 -7.214 -5.365 1.00 0.00 O ATOM 969 CB ASN A 181 2.179 -5.478 -7.718 1.00 0.00 C ATOM 970 CG ASN A 181 1.709 -5.107 -9.112 1.00 0.00 C ATOM 971 OD1 ASN A 181 0.556 -5.325 -9.485 1.00 0.00 O ATOM 972 ND2 ASN A 181 2.606 -4.594 -9.931 1.00 0.00 N ATOM 0 H ASN A 181 1.593 -3.348 -6.672 1.00 0.00 H new ATOM 0 HA ASN A 181 0.108 -5.506 -7.112 1.00 0.00 H new ATOM 0 HB2 ASN A 181 3.022 -4.842 -7.445 1.00 0.00 H new ATOM 0 HB3 ASN A 181 2.544 -6.505 -7.727 1.00 0.00 H new ATOM 0 HD21 ASN A 181 2.350 -4.370 -10.893 1.00 0.00 H new ATOM 0 HD22 ASN A 181 3.556 -4.421 -9.603 1.00 0.00 H new ATOM 979 N ILE A 182 2.434 -6.399 -4.916 1.00 0.00 N ATOM 980 CA ILE A 182 2.781 -7.425 -3.950 1.00 0.00 C ATOM 981 C ILE A 182 1.917 -7.337 -2.688 1.00 0.00 C ATOM 982 O ILE A 182 1.491 -8.375 -2.193 1.00 0.00 O ATOM 983 CB ILE A 182 4.309 -7.405 -3.683 1.00 0.00 C ATOM 984 CG1 ILE A 182 5.149 -8.265 -4.660 1.00 0.00 C ATOM 985 CG2 ILE A 182 4.656 -7.804 -2.250 1.00 0.00 C ATOM 986 CD1 ILE A 182 4.502 -9.498 -5.302 1.00 0.00 C ATOM 0 H ILE A 182 3.155 -5.689 -5.046 1.00 0.00 H new ATOM 0 HA ILE A 182 2.551 -8.406 -4.367 1.00 0.00 H new ATOM 0 HB ILE A 182 4.580 -6.363 -3.853 1.00 0.00 H new ATOM 0 HG12 ILE A 182 5.488 -7.613 -5.465 1.00 0.00 H new ATOM 0 HG13 ILE A 182 6.038 -8.600 -4.125 1.00 0.00 H new ATOM 0 HG21 ILE A 182 5.737 -7.774 -2.116 1.00 0.00 H new ATOM 0 HG22 ILE A 182 4.184 -7.110 -1.555 1.00 0.00 H new ATOM 0 HG23 ILE A 182 4.294 -8.814 -2.056 1.00 0.00 H new ATOM 0 HD11 ILE A 182 5.223 -9.987 -5.957 1.00 0.00 H new ATOM 0 HD12 ILE A 182 4.190 -10.193 -4.522 1.00 0.00 H new ATOM 0 HD13 ILE A 182 3.633 -9.191 -5.883 1.00 0.00 H new ATOM 998 N THR A 183 1.660 -6.151 -2.142 1.00 0.00 N ATOM 999 CA THR A 183 0.957 -6.005 -0.872 1.00 0.00 C ATOM 1000 C THR A 183 -0.495 -6.452 -1.036 1.00 0.00 C ATOM 1001 O THR A 183 -1.002 -7.184 -0.191 1.00 0.00 O ATOM 1002 CB THR A 183 1.065 -4.562 -0.353 1.00 0.00 C ATOM 1003 OG1 THR A 183 2.419 -4.141 -0.357 1.00 0.00 O ATOM 1004 CG2 THR A 183 0.523 -4.395 1.070 1.00 0.00 C ATOM 0 H THR A 183 1.933 -5.265 -2.568 1.00 0.00 H new ATOM 0 HA THR A 183 1.423 -6.644 -0.122 1.00 0.00 H new ATOM 0 HB THR A 183 0.459 -3.954 -1.025 1.00 0.00 H new ATOM 0 HG1 THR A 183 2.618 -3.687 -1.202 1.00 0.00 H new ATOM 0 HG21 THR A 183 0.627 -3.355 1.379 1.00 0.00 H new ATOM 0 HG22 THR A 183 -0.530 -4.677 1.094 1.00 0.00 H new ATOM 0 HG23 THR A 183 1.085 -5.034 1.751 1.00 0.00 H new ATOM 1012 N ILE A 184 -1.141 -6.088 -2.146 1.00 0.00 N ATOM 1013 CA ILE A 184 -2.428 -6.620 -2.575 1.00 0.00 C ATOM 1014 C ILE A 184 -2.274 -8.138 -2.714 1.00 0.00 C ATOM 1015 O ILE A 184 -2.975 -8.905 -2.060 1.00 0.00 O ATOM 1016 CB ILE A 184 -2.868 -5.867 -3.863 1.00 0.00 C ATOM 1017 CG1 ILE A 184 -3.362 -4.450 -3.501 1.00 0.00 C ATOM 1018 CG2 ILE A 184 -3.880 -6.559 -4.781 1.00 0.00 C ATOM 1019 CD1 ILE A 184 -3.776 -3.567 -4.682 1.00 0.00 C ATOM 0 H ILE A 184 -0.766 -5.391 -2.790 1.00 0.00 H new ATOM 0 HA ILE A 184 -3.233 -6.457 -1.858 1.00 0.00 H new ATOM 0 HB ILE A 184 -1.960 -5.844 -4.466 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -4.213 -4.544 -2.826 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -2.572 -3.940 -2.950 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -4.093 -5.918 -5.637 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -3.467 -7.505 -5.130 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -4.802 -6.747 -4.230 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -4.105 -2.596 -4.312 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -2.926 -3.431 -5.351 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.592 -4.044 -5.225 1.00 0.00 H new ATOM 1031 N LYS A 185 -1.281 -8.635 -3.454 1.00 0.00 N ATOM 1032 CA LYS A 185 -1.000 -10.070 -3.528 1.00 0.00 C ATOM 1033 C LYS A 185 -0.554 -10.665 -2.174 1.00 0.00 C ATOM 1034 O LYS A 185 -0.180 -11.836 -2.125 1.00 0.00 O ATOM 1035 CB LYS A 185 -0.015 -10.284 -4.689 1.00 0.00 C ATOM 1036 CG LYS A 185 0.268 -11.746 -5.046 1.00 0.00 C ATOM 1037 CD LYS A 185 0.793 -11.843 -6.488 1.00 0.00 C ATOM 1038 CE LYS A 185 1.475 -13.189 -6.770 1.00 0.00 C ATOM 1039 NZ LYS A 185 1.689 -13.418 -8.214 1.00 0.00 N ATOM 0 H LYS A 185 -0.653 -8.059 -4.015 1.00 0.00 H new ATOM 0 HA LYS A 185 -1.910 -10.632 -3.740 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -0.406 -9.780 -5.573 1.00 0.00 H new ATOM 0 HB3 LYS A 185 0.928 -9.799 -4.437 1.00 0.00 H new ATOM 0 HG2 LYS A 185 1.001 -12.162 -4.355 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -0.642 -12.337 -4.941 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -0.035 -11.705 -7.184 1.00 0.00 H new ATOM 0 HD3 LYS A 185 1.501 -11.034 -6.670 1.00 0.00 H new ATOM 0 HE2 LYS A 185 2.434 -13.223 -6.253 1.00 0.00 H new ATOM 0 HE3 LYS A 185 0.865 -13.995 -6.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 2.152 -14.339 -8.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 0.773 -13.412 -8.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 2.293 -12.664 -8.599 1.00 0.00 H new ATOM 1053 N GLN A 186 -0.637 -9.950 -1.046 1.00 0.00 N ATOM 1054 CA GLN A 186 -0.347 -10.462 0.286 1.00 0.00 C ATOM 1055 C GLN A 186 -1.381 -10.020 1.323 1.00 0.00 C ATOM 1056 O GLN A 186 -1.201 -10.241 2.518 1.00 0.00 O ATOM 1057 CB GLN A 186 1.065 -10.001 0.677 1.00 0.00 C ATOM 1058 CG GLN A 186 2.196 -10.780 0.003 1.00 0.00 C ATOM 1059 CD GLN A 186 2.207 -12.213 0.509 1.00 0.00 C ATOM 1060 OE1 GLN A 186 2.750 -12.515 1.564 1.00 0.00 O ATOM 1061 NE2 GLN A 186 1.546 -13.126 -0.179 1.00 0.00 N ATOM 0 H GLN A 186 -0.917 -8.969 -1.042 1.00 0.00 H new ATOM 0 HA GLN A 186 -0.398 -11.551 0.265 1.00 0.00 H new ATOM 0 HB2 GLN A 186 1.170 -8.945 0.429 1.00 0.00 H new ATOM 0 HB3 GLN A 186 1.175 -10.087 1.758 1.00 0.00 H new ATOM 0 HG2 GLN A 186 2.064 -10.768 -1.079 1.00 0.00 H new ATOM 0 HG3 GLN A 186 3.154 -10.303 0.213 1.00 0.00 H new ATOM 0 HE21 GLN A 186 1.094 -12.874 -1.058 1.00 0.00 H new ATOM 0 HE22 GLN A 186 1.488 -14.083 0.168 1.00 0.00 H new ATOM 1070 N HIS A 187 -2.472 -9.414 0.881 1.00 0.00 N ATOM 1071 CA HIS A 187 -3.580 -8.961 1.707 1.00 0.00 C ATOM 1072 C HIS A 187 -4.923 -9.194 0.978 1.00 0.00 C ATOM 1073 O HIS A 187 -5.991 -9.058 1.552 1.00 0.00 O ATOM 1074 CB HIS A 187 -3.289 -7.507 2.075 1.00 0.00 C ATOM 1075 CG HIS A 187 -4.417 -6.833 2.775 1.00 0.00 C ATOM 1076 ND1 HIS A 187 -4.812 -6.859 4.095 1.00 0.00 N ATOM 1077 CD2 HIS A 187 -5.384 -6.224 2.059 1.00 0.00 C ATOM 1078 CE1 HIS A 187 -5.993 -6.216 4.154 1.00 0.00 C ATOM 1079 NE2 HIS A 187 -6.357 -5.769 2.942 1.00 0.00 N ATOM 0 H HIS A 187 -2.615 -9.216 -0.109 1.00 0.00 H new ATOM 0 HA HIS A 187 -3.677 -9.528 2.633 1.00 0.00 H new ATOM 0 HB2 HIS A 187 -2.405 -7.472 2.711 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -3.051 -6.952 1.168 1.00 0.00 H new ATOM 0 HD1 HIS A 187 -4.308 -7.282 4.874 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -5.400 -6.109 0.985 1.00 0.00 H new ATOM 0 HE1 HIS A 187 -6.571 -6.078 5.056 1.00 0.00 H new ATOM 1087 N THR A 188 -4.890 -9.646 -0.274 1.00 0.00 N ATOM 1088 CA THR A 188 -6.045 -9.759 -1.165 1.00 0.00 C ATOM 1089 C THR A 188 -6.093 -11.180 -1.755 1.00 0.00 C ATOM 1090 O THR A 188 -6.988 -11.534 -2.524 1.00 0.00 O ATOM 1091 CB THR A 188 -5.925 -8.679 -2.258 1.00 0.00 C ATOM 1092 OG1 THR A 188 -5.536 -7.442 -1.684 1.00 0.00 O ATOM 1093 CG2 THR A 188 -7.201 -8.447 -3.051 1.00 0.00 C ATOM 0 H THR A 188 -4.024 -9.956 -0.714 1.00 0.00 H new ATOM 0 HA THR A 188 -6.978 -9.597 -0.625 1.00 0.00 H new ATOM 0 HB THR A 188 -5.173 -9.058 -2.950 1.00 0.00 H new ATOM 0 HG1 THR A 188 -5.903 -6.705 -2.215 1.00 0.00 H new ATOM 0 HG21 THR A 188 -7.029 -7.672 -3.798 1.00 0.00 H new ATOM 0 HG22 THR A 188 -7.494 -9.372 -3.548 1.00 0.00 H new ATOM 0 HG23 THR A 188 -7.996 -8.130 -2.376 1.00 0.00 H new ATOM 1101 N VAL A 189 -5.121 -12.025 -1.401 1.00 0.00 N ATOM 1102 CA VAL A 189 -5.108 -13.433 -1.748 1.00 0.00 C ATOM 1103 C VAL A 189 -4.912 -14.224 -0.473 1.00 0.00 C ATOM 1104 O VAL A 189 -5.797 -14.970 -0.068 1.00 0.00 O ATOM 1105 CB VAL A 189 -4.068 -13.679 -2.861 1.00 0.00 C ATOM 1106 CG1 VAL A 189 -2.614 -13.964 -2.463 1.00 0.00 C ATOM 1107 CG2 VAL A 189 -4.563 -14.801 -3.767 1.00 0.00 C ATOM 0 H VAL A 189 -4.309 -11.736 -0.855 1.00 0.00 H new ATOM 0 HA VAL A 189 -6.050 -13.775 -2.176 1.00 0.00 H new ATOM 0 HB VAL A 189 -4.003 -12.709 -3.353 1.00 0.00 H new ATOM 0 HG11 VAL A 189 -2.014 -14.114 -3.360 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -2.219 -13.119 -1.899 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -2.575 -14.862 -1.846 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -3.833 -14.980 -4.556 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -4.695 -15.711 -3.181 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -5.516 -14.515 -4.213 1.00 0.00 H new ATOM 1117 N THR A 190 -3.811 -13.969 0.237 1.00 0.00 N ATOM 1118 CA THR A 190 -3.414 -14.807 1.380 1.00 0.00 C ATOM 1119 C THR A 190 -4.225 -14.440 2.642 1.00 0.00 C ATOM 1120 O THR A 190 -3.788 -14.683 3.766 1.00 0.00 O ATOM 1121 CB THR A 190 -1.873 -14.783 1.533 1.00 0.00 C ATOM 1122 OG1 THR A 190 -1.405 -15.797 2.390 1.00 0.00 O ATOM 1123 CG2 THR A 190 -1.328 -13.450 2.035 1.00 0.00 C ATOM 0 H THR A 190 -3.178 -13.193 0.045 1.00 0.00 H new ATOM 0 HA THR A 190 -3.668 -15.852 1.203 1.00 0.00 H new ATOM 0 HB THR A 190 -1.505 -14.950 0.521 1.00 0.00 H new ATOM 0 HG1 THR A 190 -0.429 -15.745 2.456 1.00 0.00 H new ATOM 0 HG21 THR A 190 -0.243 -13.508 2.117 1.00 0.00 H new ATOM 0 HG22 THR A 190 -1.597 -12.660 1.334 1.00 0.00 H new ATOM 0 HG23 THR A 190 -1.755 -13.228 3.013 1.00 0.00 H new ATOM 1131 N THR A 191 -5.389 -13.819 2.465 1.00 0.00 N ATOM 1132 CA THR A 191 -6.108 -13.055 3.466 1.00 0.00 C ATOM 1133 C THR A 191 -7.594 -13.109 3.099 1.00 0.00 C ATOM 1134 O THR A 191 -8.396 -13.588 3.900 1.00 0.00 O ATOM 1135 CB THR A 191 -5.555 -11.626 3.445 1.00 0.00 C ATOM 1136 OG1 THR A 191 -4.135 -11.628 3.401 1.00 0.00 O ATOM 1137 CG2 THR A 191 -6.011 -10.807 4.623 1.00 0.00 C ATOM 0 H THR A 191 -5.877 -13.840 1.569 1.00 0.00 H new ATOM 0 HA THR A 191 -5.987 -13.451 4.474 1.00 0.00 H new ATOM 0 HB THR A 191 -5.952 -11.165 2.540 1.00 0.00 H new ATOM 0 HG1 THR A 191 -3.783 -11.163 4.188 1.00 0.00 H new ATOM 0 HG21 THR A 191 -5.588 -9.805 4.555 1.00 0.00 H new ATOM 0 HG22 THR A 191 -7.099 -10.743 4.622 1.00 0.00 H new ATOM 0 HG23 THR A 191 -5.676 -11.280 5.546 1.00 0.00 H new ATOM 1145 N THR A 192 -7.953 -12.792 1.845 1.00 0.00 N ATOM 1146 CA THR A 192 -9.308 -12.997 1.303 1.00 0.00 C ATOM 1147 C THR A 192 -9.710 -14.485 1.323 1.00 0.00 C ATOM 1148 O THR A 192 -10.872 -14.835 1.166 1.00 0.00 O ATOM 1149 CB THR A 192 -9.370 -12.423 -0.125 1.00 0.00 C ATOM 1150 OG1 THR A 192 -8.775 -11.143 -0.143 1.00 0.00 O ATOM 1151 CG2 THR A 192 -10.785 -12.259 -0.682 1.00 0.00 C ATOM 0 H THR A 192 -7.306 -12.382 1.172 1.00 0.00 H new ATOM 0 HA THR A 192 -10.024 -12.472 1.935 1.00 0.00 H new ATOM 0 HB THR A 192 -8.846 -13.148 -0.747 1.00 0.00 H new ATOM 0 HG1 THR A 192 -8.682 -10.838 -1.070 1.00 0.00 H new ATOM 0 HG21 THR A 192 -10.734 -11.849 -1.691 1.00 0.00 H new ATOM 0 HG22 THR A 192 -11.280 -13.230 -0.709 1.00 0.00 H new ATOM 0 HG23 THR A 192 -11.351 -11.581 -0.043 1.00 0.00 H new ATOM 1159 N THR A 193 -8.756 -15.382 1.570 1.00 0.00 N ATOM 1160 CA THR A 193 -8.981 -16.815 1.655 1.00 0.00 C ATOM 1161 C THR A 193 -8.596 -17.343 3.045 1.00 0.00 C ATOM 1162 O THR A 193 -8.585 -18.549 3.289 1.00 0.00 O ATOM 1163 CB THR A 193 -8.315 -17.452 0.418 1.00 0.00 C ATOM 1164 OG1 THR A 193 -9.046 -18.563 -0.049 1.00 0.00 O ATOM 1165 CG2 THR A 193 -6.844 -17.844 0.605 1.00 0.00 C ATOM 0 H THR A 193 -7.782 -15.120 1.720 1.00 0.00 H new ATOM 0 HA THR A 193 -10.031 -17.103 1.599 1.00 0.00 H new ATOM 0 HB THR A 193 -8.326 -16.658 -0.328 1.00 0.00 H new ATOM 0 HG1 THR A 193 -8.598 -18.943 -0.834 1.00 0.00 H new ATOM 0 HG21 THR A 193 -6.464 -18.283 -0.318 1.00 0.00 H new ATOM 0 HG22 THR A 193 -6.260 -16.958 0.853 1.00 0.00 H new ATOM 0 HG23 THR A 193 -6.761 -18.571 1.413 1.00 0.00 H new ATOM 1173 N LYS A 194 -8.316 -16.444 3.997 1.00 0.00 N ATOM 1174 CA LYS A 194 -7.978 -16.761 5.383 1.00 0.00 C ATOM 1175 C LYS A 194 -8.858 -16.000 6.379 1.00 0.00 C ATOM 1176 O LYS A 194 -8.591 -16.089 7.574 1.00 0.00 O ATOM 1177 CB LYS A 194 -6.479 -16.561 5.651 1.00 0.00 C ATOM 1178 CG LYS A 194 -5.603 -17.311 4.639 1.00 0.00 C ATOM 1179 CD LYS A 194 -4.182 -17.510 5.172 1.00 0.00 C ATOM 1180 CE LYS A 194 -3.266 -17.827 3.989 1.00 0.00 C ATOM 1181 NZ LYS A 194 -1.878 -18.110 4.406 1.00 0.00 N ATOM 0 H LYS A 194 -8.320 -15.441 3.813 1.00 0.00 H new ATOM 0 HA LYS A 194 -8.191 -17.819 5.538 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -6.244 -15.497 5.614 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -6.243 -16.905 6.658 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -6.049 -18.280 4.417 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -5.568 -16.754 3.703 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -3.840 -16.612 5.687 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -4.159 -18.322 5.898 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -3.661 -18.687 3.448 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -3.269 -16.986 3.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 -1.228 -17.467 3.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 -1.788 -17.969 5.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -1.638 -19.094 4.170 1.00 0.00 H new ATOM 1195 N GLY A 195 -9.890 -15.277 5.935 1.00 0.00 N ATOM 1196 CA GLY A 195 -10.871 -14.658 6.819 1.00 0.00 C ATOM 1197 C GLY A 195 -11.443 -13.349 6.285 1.00 0.00 C ATOM 1198 O GLY A 195 -12.479 -12.913 6.784 1.00 0.00 O ATOM 0 H GLY A 195 -10.066 -15.106 4.945 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -11.689 -15.359 6.986 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -10.407 -14.472 7.788 1.00 0.00 H new ATOM 1202 N GLU A 196 -10.820 -12.713 5.291 1.00 0.00 N ATOM 1203 CA GLU A 196 -11.378 -11.516 4.660 1.00 0.00 C ATOM 1204 C GLU A 196 -12.245 -11.939 3.471 1.00 0.00 C ATOM 1205 O GLU A 196 -12.364 -13.132 3.191 1.00 0.00 O ATOM 1206 CB GLU A 196 -10.251 -10.541 4.279 1.00 0.00 C ATOM 1207 CG GLU A 196 -9.571 -10.042 5.567 1.00 0.00 C ATOM 1208 CD GLU A 196 -8.531 -8.945 5.383 1.00 0.00 C ATOM 1209 OE1 GLU A 196 -8.186 -8.643 4.233 1.00 0.00 O ATOM 1210 OE2 GLU A 196 -8.045 -8.421 6.417 1.00 0.00 O ATOM 0 H GLU A 196 -9.924 -13.009 4.904 1.00 0.00 H new ATOM 0 HA GLU A 196 -12.020 -10.976 5.356 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -9.524 -11.037 3.636 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -10.654 -9.700 3.715 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -10.342 -9.676 6.245 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -9.094 -10.891 6.056 1.00 0.00 H new ATOM 1217 N ASN A 197 -12.884 -10.989 2.783 1.00 0.00 N ATOM 1218 CA ASN A 197 -13.567 -11.210 1.507 1.00 0.00 C ATOM 1219 C ASN A 197 -13.730 -9.874 0.780 1.00 0.00 C ATOM 1220 O ASN A 197 -14.837 -9.439 0.452 1.00 0.00 O ATOM 1221 CB ASN A 197 -14.910 -11.909 1.718 1.00 0.00 C ATOM 1222 CG ASN A 197 -15.645 -12.165 0.409 1.00 0.00 C ATOM 1223 OD1 ASN A 197 -16.763 -11.697 0.231 1.00 0.00 O ATOM 1224 ND2 ASN A 197 -15.081 -12.899 -0.533 1.00 0.00 N ATOM 0 H ASN A 197 -12.942 -10.023 3.106 1.00 0.00 H new ATOM 0 HA ASN A 197 -12.963 -11.870 0.885 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -14.746 -12.857 2.231 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -15.536 -11.298 2.369 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -15.576 -13.075 -1.407 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -14.150 -13.289 -0.386 1.00 0.00 H new ATOM 1231 N PHE A 198 -12.614 -9.173 0.593 1.00 0.00 N ATOM 1232 CA PHE A 198 -12.619 -7.921 -0.153 1.00 0.00 C ATOM 1233 C PHE A 198 -13.070 -8.109 -1.608 1.00 0.00 C ATOM 1234 O PHE A 198 -12.863 -9.179 -2.191 1.00 0.00 O ATOM 1235 CB PHE A 198 -11.219 -7.326 -0.149 1.00 0.00 C ATOM 1236 CG PHE A 198 -10.868 -6.524 1.075 1.00 0.00 C ATOM 1237 CD1 PHE A 198 -11.453 -5.259 1.218 1.00 0.00 C ATOM 1238 CD2 PHE A 198 -9.908 -6.955 2.010 1.00 0.00 C ATOM 1239 CE1 PHE A 198 -11.010 -4.377 2.201 1.00 0.00 C ATOM 1240 CE2 PHE A 198 -9.477 -6.069 3.005 1.00 0.00 C ATOM 1241 CZ PHE A 198 -9.981 -4.764 3.066 1.00 0.00 C ATOM 0 H PHE A 198 -11.699 -9.451 0.947 1.00 0.00 H new ATOM 0 HA PHE A 198 -13.330 -7.255 0.336 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -10.497 -8.136 -0.253 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -11.110 -6.688 -1.026 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -12.256 -4.964 0.559 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -9.509 -7.957 1.961 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -11.459 -3.399 2.295 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -8.749 -6.395 3.733 1.00 0.00 H new ATOM 0 HZ PHE A 198 -9.577 -4.059 3.778 1.00 0.00 H new ATOM 1251 N THR A 199 -13.570 -7.032 -2.214 1.00 0.00 N ATOM 1252 CA THR A 199 -14.190 -6.977 -3.540 1.00 0.00 C ATOM 1253 C THR A 199 -13.353 -6.139 -4.501 1.00 0.00 C ATOM 1254 O THR A 199 -12.508 -5.369 -4.054 1.00 0.00 O ATOM 1255 CB THR A 199 -15.578 -6.334 -3.410 1.00 0.00 C ATOM 1256 OG1 THR A 199 -15.505 -5.056 -2.805 1.00 0.00 O ATOM 1257 CG2 THR A 199 -16.549 -7.203 -2.605 1.00 0.00 C ATOM 0 H THR A 199 -13.552 -6.117 -1.764 1.00 0.00 H new ATOM 0 HA THR A 199 -14.264 -7.991 -3.932 1.00 0.00 H new ATOM 0 HB THR A 199 -15.955 -6.236 -4.428 1.00 0.00 H new ATOM 0 HG1 THR A 199 -16.405 -4.674 -2.739 1.00 0.00 H new ATOM 0 HG21 THR A 199 -17.516 -6.705 -2.542 1.00 0.00 H new ATOM 0 HG22 THR A 199 -16.669 -8.167 -3.099 1.00 0.00 H new ATOM 0 HG23 THR A 199 -16.153 -7.356 -1.601 1.00 0.00 H new ATOM 1265 N GLU A 200 -13.624 -6.206 -5.808 1.00 0.00 N ATOM 1266 CA GLU A 200 -12.940 -5.423 -6.817 1.00 0.00 C ATOM 1267 C GLU A 200 -12.960 -3.923 -6.520 1.00 0.00 C ATOM 1268 O GLU A 200 -11.900 -3.309 -6.574 1.00 0.00 O ATOM 1269 CB GLU A 200 -13.521 -5.736 -8.204 1.00 0.00 C ATOM 1270 CG GLU A 200 -12.353 -5.872 -9.173 1.00 0.00 C ATOM 1271 CD GLU A 200 -12.801 -6.191 -10.595 1.00 0.00 C ATOM 1272 OE1 GLU A 200 -13.248 -7.341 -10.802 1.00 0.00 O ATOM 1273 OE2 GLU A 200 -12.625 -5.352 -11.506 1.00 0.00 O ATOM 0 H GLU A 200 -14.341 -6.821 -6.192 1.00 0.00 H new ATOM 0 HA GLU A 200 -11.889 -5.711 -6.802 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -14.104 -6.656 -8.176 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -14.194 -4.941 -8.525 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -11.780 -4.945 -9.177 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -11.685 -6.659 -8.822 1.00 0.00 H new ATOM 1280 N THR A 201 -14.099 -3.334 -6.132 1.00 0.00 N ATOM 1281 CA THR A 201 -14.156 -1.907 -5.796 1.00 0.00 C ATOM 1282 C THR A 201 -13.182 -1.604 -4.654 1.00 0.00 C ATOM 1283 O THR A 201 -12.569 -0.536 -4.655 1.00 0.00 O ATOM 1284 CB THR A 201 -15.587 -1.495 -5.375 1.00 0.00 C ATOM 1285 OG1 THR A 201 -16.539 -2.180 -6.161 1.00 0.00 O ATOM 1286 CG2 THR A 201 -15.861 0.026 -5.434 1.00 0.00 C ATOM 0 H THR A 201 -14.990 -3.823 -6.044 1.00 0.00 H new ATOM 0 HA THR A 201 -13.876 -1.336 -6.681 1.00 0.00 H new ATOM 0 HB THR A 201 -15.676 -1.776 -4.326 1.00 0.00 H new ATOM 0 HG1 THR A 201 -17.442 -1.915 -5.887 1.00 0.00 H new ATOM 0 HG21 THR A 201 -16.887 0.223 -5.123 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.173 0.546 -4.767 1.00 0.00 H new ATOM 0 HG23 THR A 201 -15.716 0.382 -6.454 1.00 0.00 H new ATOM 1294 N ASP A 202 -13.008 -2.526 -3.696 1.00 0.00 N ATOM 1295 CA ASP A 202 -12.066 -2.310 -2.598 1.00 0.00 C ATOM 1296 C ASP A 202 -10.625 -2.553 -3.008 1.00 0.00 C ATOM 1297 O ASP A 202 -9.749 -1.876 -2.490 1.00 0.00 O ATOM 1298 CB ASP A 202 -12.386 -3.153 -1.363 1.00 0.00 C ATOM 1299 CG ASP A 202 -13.368 -2.395 -0.483 1.00 0.00 C ATOM 1300 OD1 ASP A 202 -12.965 -1.341 0.056 1.00 0.00 O ATOM 1301 OD2 ASP A 202 -14.547 -2.810 -0.413 1.00 0.00 O ATOM 0 H ASP A 202 -13.503 -3.417 -3.662 1.00 0.00 H new ATOM 0 HA ASP A 202 -12.184 -1.258 -2.337 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -12.811 -4.111 -1.662 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -11.473 -3.369 -0.808 1.00 0.00 H new ATOM 1306 N VAL A 203 -10.344 -3.461 -3.939 1.00 0.00 N ATOM 1307 CA VAL A 203 -9.026 -3.565 -4.563 1.00 0.00 C ATOM 1308 C VAL A 203 -8.712 -2.248 -5.270 1.00 0.00 C ATOM 1309 O VAL A 203 -7.608 -1.731 -5.140 1.00 0.00 O ATOM 1310 CB VAL A 203 -8.959 -4.770 -5.529 1.00 0.00 C ATOM 1311 CG1 VAL A 203 -7.559 -4.936 -6.146 1.00 0.00 C ATOM 1312 CG2 VAL A 203 -9.336 -6.101 -4.857 1.00 0.00 C ATOM 0 H VAL A 203 -11.020 -4.143 -4.282 1.00 0.00 H new ATOM 0 HA VAL A 203 -8.270 -3.743 -3.798 1.00 0.00 H new ATOM 0 HB VAL A 203 -9.689 -4.542 -6.306 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -7.557 -5.794 -6.818 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -7.299 -4.037 -6.705 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -6.828 -5.095 -5.353 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -9.270 -6.908 -5.586 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -8.651 -6.299 -4.033 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -10.355 -6.040 -4.475 1.00 0.00 H new ATOM 1322 N LYS A 204 -9.681 -1.673 -5.977 1.00 0.00 N ATOM 1323 CA LYS A 204 -9.530 -0.419 -6.700 1.00 0.00 C ATOM 1324 C LYS A 204 -9.329 0.743 -5.721 1.00 0.00 C ATOM 1325 O LYS A 204 -8.571 1.657 -6.040 1.00 0.00 O ATOM 1326 CB LYS A 204 -10.751 -0.242 -7.621 1.00 0.00 C ATOM 1327 CG LYS A 204 -10.830 -1.333 -8.709 1.00 0.00 C ATOM 1328 CD LYS A 204 -10.188 -0.891 -10.022 1.00 0.00 C ATOM 1329 CE LYS A 204 -9.795 -2.108 -10.873 1.00 0.00 C ATOM 1330 NZ LYS A 204 -9.104 -1.729 -12.125 1.00 0.00 N ATOM 0 H LYS A 204 -10.613 -2.077 -6.063 1.00 0.00 H new ATOM 0 HA LYS A 204 -8.638 -0.432 -7.326 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -11.661 -0.264 -7.022 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -10.706 0.738 -8.096 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -10.335 -2.236 -8.351 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -11.874 -1.591 -8.887 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -10.883 -0.262 -10.578 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -9.305 -0.286 -9.815 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -9.147 -2.761 -10.288 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -10.690 -2.681 -11.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -8.861 -2.587 -12.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -9.730 -1.128 -12.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -8.235 -1.206 -11.897 1.00 0.00 H new ATOM 1344 N MET A 205 -9.923 0.711 -4.524 1.00 0.00 N ATOM 1345 CA MET A 205 -9.585 1.653 -3.459 1.00 0.00 C ATOM 1346 C MET A 205 -8.174 1.374 -2.935 1.00 0.00 C ATOM 1347 O MET A 205 -7.400 2.296 -2.686 1.00 0.00 O ATOM 1348 CB MET A 205 -10.576 1.531 -2.293 1.00 0.00 C ATOM 1349 CG MET A 205 -11.987 2.036 -2.588 1.00 0.00 C ATOM 1350 SD MET A 205 -12.051 3.796 -2.965 1.00 0.00 S ATOM 1351 CE MET A 205 -13.794 3.995 -3.383 1.00 0.00 C ATOM 0 H MET A 205 -10.645 0.037 -4.270 1.00 0.00 H new ATOM 0 HA MET A 205 -9.635 2.660 -3.874 1.00 0.00 H new ATOM 0 HB2 MET A 205 -10.636 0.484 -1.995 1.00 0.00 H new ATOM 0 HB3 MET A 205 -10.180 2.083 -1.440 1.00 0.00 H new ATOM 0 HG2 MET A 205 -12.397 1.477 -3.429 1.00 0.00 H new ATOM 0 HG3 MET A 205 -12.625 1.832 -1.728 1.00 0.00 H new ATOM 0 HE1 MET A 205 -13.906 4.812 -4.096 1.00 0.00 H new ATOM 0 HE2 MET A 205 -14.170 3.073 -3.826 1.00 0.00 H new ATOM 0 HE3 MET A 205 -14.361 4.221 -2.480 1.00 0.00 H new ATOM 1361 N MET A 206 -7.834 0.103 -2.733 1.00 0.00 N ATOM 1362 CA MET A 206 -6.594 -0.325 -2.112 1.00 0.00 C ATOM 1363 C MET A 206 -5.384 -0.068 -2.995 1.00 0.00 C ATOM 1364 O MET A 206 -4.298 0.170 -2.468 1.00 0.00 O ATOM 1365 CB MET A 206 -6.699 -1.791 -1.725 1.00 0.00 C ATOM 1366 CG MET A 206 -5.456 -2.329 -1.007 1.00 0.00 C ATOM 1367 SD MET A 206 -5.788 -3.109 0.576 1.00 0.00 S ATOM 1368 CE MET A 206 -6.996 -4.354 0.064 1.00 0.00 C ATOM 0 H MET A 206 -8.434 -0.675 -3.006 1.00 0.00 H new ATOM 0 HA MET A 206 -6.442 0.272 -1.213 1.00 0.00 H new ATOM 0 HB2 MET A 206 -7.567 -1.926 -1.080 1.00 0.00 H new ATOM 0 HB3 MET A 206 -6.874 -2.383 -2.623 1.00 0.00 H new ATOM 0 HG2 MET A 206 -4.961 -3.051 -1.657 1.00 0.00 H new ATOM 0 HG3 MET A 206 -4.757 -1.507 -0.853 1.00 0.00 H new ATOM 0 HE1 MET A 206 -7.531 -4.723 0.939 1.00 0.00 H new ATOM 0 HE2 MET A 206 -7.705 -3.908 -0.633 1.00 0.00 H new ATOM 0 HE3 MET A 206 -6.481 -5.182 -0.423 1.00 0.00 H new ATOM 1378 N GLU A 207 -5.565 -0.044 -4.313 1.00 0.00 N ATOM 1379 CA GLU A 207 -4.552 0.446 -5.222 1.00 0.00 C ATOM 1380 C GLU A 207 -4.110 1.832 -4.741 1.00 0.00 C ATOM 1381 O GLU A 207 -2.916 2.076 -4.612 1.00 0.00 O ATOM 1382 CB GLU A 207 -5.082 0.544 -6.659 1.00 0.00 C ATOM 1383 CG GLU A 207 -5.051 -0.775 -7.452 1.00 0.00 C ATOM 1384 CD GLU A 207 -4.551 -0.561 -8.893 1.00 0.00 C ATOM 1385 OE1 GLU A 207 -3.445 0.006 -9.078 1.00 0.00 O ATOM 1386 OE2 GLU A 207 -5.258 -0.941 -9.855 1.00 0.00 O ATOM 0 H GLU A 207 -6.418 -0.364 -4.772 1.00 0.00 H new ATOM 0 HA GLU A 207 -3.714 -0.251 -5.229 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -6.109 0.908 -6.628 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -4.495 1.289 -7.197 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -4.403 -1.490 -6.944 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -6.050 -1.210 -7.474 1.00 0.00 H new ATOM 1393 N ARG A 208 -5.066 2.715 -4.409 1.00 0.00 N ATOM 1394 CA ARG A 208 -4.774 4.072 -3.958 1.00 0.00 C ATOM 1395 C ARG A 208 -4.224 4.061 -2.540 1.00 0.00 C ATOM 1396 O ARG A 208 -3.316 4.834 -2.236 1.00 0.00 O ATOM 1397 CB ARG A 208 -5.992 5.005 -4.038 1.00 0.00 C ATOM 1398 CG ARG A 208 -6.334 5.448 -5.452 1.00 0.00 C ATOM 1399 CD ARG A 208 -7.185 4.444 -6.210 1.00 0.00 C ATOM 1400 NE ARG A 208 -7.402 4.923 -7.579 1.00 0.00 N ATOM 1401 CZ ARG A 208 -8.275 4.440 -8.474 1.00 0.00 C ATOM 1402 NH1 ARG A 208 -9.000 3.363 -8.213 1.00 0.00 N ATOM 1403 NH2 ARG A 208 -8.444 5.052 -9.637 1.00 0.00 N ATOM 0 H ARG A 208 -6.062 2.501 -4.448 1.00 0.00 H new ATOM 0 HA ARG A 208 -4.020 4.466 -4.640 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -6.855 4.498 -3.607 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -5.803 5.887 -3.427 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -6.862 6.401 -5.409 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -5.410 5.620 -6.004 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -6.692 3.472 -6.227 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -8.141 4.307 -5.705 1.00 0.00 H new ATOM 0 HE ARG A 208 -6.827 5.708 -7.883 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -8.899 2.885 -7.317 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -9.659 3.011 -8.908 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -7.909 5.893 -9.853 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -9.109 4.682 -10.316 1.00 0.00 H new ATOM 1417 N VAL A 209 -4.763 3.216 -1.662 1.00 0.00 N ATOM 1418 CA VAL A 209 -4.314 3.151 -0.276 1.00 0.00 C ATOM 1419 C VAL A 209 -2.841 2.751 -0.200 1.00 0.00 C ATOM 1420 O VAL A 209 -2.047 3.467 0.409 1.00 0.00 O ATOM 1421 CB VAL A 209 -5.284 2.321 0.605 1.00 0.00 C ATOM 1422 CG1 VAL A 209 -4.902 0.869 0.911 1.00 0.00 C ATOM 1423 CG2 VAL A 209 -5.427 3.019 1.951 1.00 0.00 C ATOM 0 H VAL A 209 -5.515 2.565 -1.890 1.00 0.00 H new ATOM 0 HA VAL A 209 -4.355 4.147 0.165 1.00 0.00 H new ATOM 0 HB VAL A 209 -6.193 2.268 0.005 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -5.671 0.414 1.535 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -4.815 0.311 -0.022 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -3.948 0.847 1.438 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -6.106 2.450 2.586 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -4.451 3.086 2.432 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -5.826 4.022 1.800 1.00 0.00 H new ATOM 1433 N VAL A 210 -2.447 1.648 -0.837 1.00 0.00 N ATOM 1434 CA VAL A 210 -1.065 1.197 -0.819 1.00 0.00 C ATOM 1435 C VAL A 210 -0.212 2.079 -1.746 1.00 0.00 C ATOM 1436 O VAL A 210 0.991 2.167 -1.521 1.00 0.00 O ATOM 1437 CB VAL A 210 -1.002 -0.317 -1.115 1.00 0.00 C ATOM 1438 CG1 VAL A 210 0.441 -0.820 -1.260 1.00 0.00 C ATOM 1439 CG2 VAL A 210 -1.663 -1.136 0.008 1.00 0.00 C ATOM 0 H VAL A 210 -3.075 1.050 -1.374 1.00 0.00 H new ATOM 0 HA VAL A 210 -0.629 1.316 0.173 1.00 0.00 H new ATOM 0 HB VAL A 210 -1.536 -0.454 -2.055 1.00 0.00 H new ATOM 0 HG11 VAL A 210 0.434 -1.890 -1.467 1.00 0.00 H new ATOM 0 HG12 VAL A 210 0.929 -0.294 -2.081 1.00 0.00 H new ATOM 0 HG13 VAL A 210 0.986 -0.633 -0.335 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -1.602 -2.198 -0.231 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -1.147 -0.946 0.949 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -2.709 -0.845 0.103 1.00 0.00 H new ATOM 1449 N GLU A 211 -0.800 2.807 -2.702 1.00 0.00 N ATOM 1450 CA GLU A 211 -0.101 3.823 -3.479 1.00 0.00 C ATOM 1451 C GLU A 211 0.358 4.871 -2.493 1.00 0.00 C ATOM 1452 O GLU A 211 1.551 5.042 -2.312 1.00 0.00 O ATOM 1453 CB GLU A 211 -0.992 4.500 -4.531 1.00 0.00 C ATOM 1454 CG GLU A 211 -0.742 4.052 -5.968 1.00 0.00 C ATOM 1455 CD GLU A 211 -1.810 4.571 -6.937 1.00 0.00 C ATOM 1456 OE1 GLU A 211 -2.553 5.522 -6.593 1.00 0.00 O ATOM 1457 OE2 GLU A 211 -1.881 4.065 -8.079 1.00 0.00 O ATOM 0 H GLU A 211 -1.782 2.703 -2.956 1.00 0.00 H new ATOM 0 HA GLU A 211 0.717 3.349 -4.021 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -2.035 4.306 -4.282 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -0.845 5.578 -4.471 1.00 0.00 H new ATOM 0 HG2 GLU A 211 0.238 4.404 -6.290 1.00 0.00 H new ATOM 0 HG3 GLU A 211 -0.718 2.963 -6.007 1.00 0.00 H new ATOM 1464 N GLN A 212 -0.572 5.566 -1.840 1.00 0.00 N ATOM 1465 CA GLN A 212 -0.268 6.672 -0.956 1.00 0.00 C ATOM 1466 C GLN A 212 0.605 6.208 0.215 1.00 0.00 C ATOM 1467 O GLN A 212 1.468 6.957 0.666 1.00 0.00 O ATOM 1468 CB GLN A 212 -1.586 7.247 -0.418 1.00 0.00 C ATOM 1469 CG GLN A 212 -2.531 7.832 -1.479 1.00 0.00 C ATOM 1470 CD GLN A 212 -2.455 9.351 -1.560 1.00 0.00 C ATOM 1471 OE1 GLN A 212 -3.389 10.060 -1.194 1.00 0.00 O ATOM 1472 NE2 GLN A 212 -1.331 9.850 -2.033 1.00 0.00 N ATOM 0 H GLN A 212 -1.570 5.368 -1.916 1.00 0.00 H new ATOM 0 HA GLN A 212 0.281 7.433 -1.511 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -2.114 6.459 0.120 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -1.353 8.027 0.307 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -2.285 7.408 -2.452 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -3.555 7.535 -1.251 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -0.579 9.226 -2.326 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -1.212 10.860 -2.106 1.00 0.00 H new ATOM 1481 N MET A 213 0.412 4.982 0.716 1.00 0.00 N ATOM 1482 CA MET A 213 1.293 4.471 1.761 1.00 0.00 C ATOM 1483 C MET A 213 2.699 4.249 1.200 1.00 0.00 C ATOM 1484 O MET A 213 3.667 4.708 1.806 1.00 0.00 O ATOM 1485 CB MET A 213 0.745 3.196 2.420 1.00 0.00 C ATOM 1486 CG MET A 213 -0.454 3.481 3.338 1.00 0.00 C ATOM 1487 SD MET A 213 -0.870 2.170 4.528 1.00 0.00 S ATOM 1488 CE MET A 213 -1.087 0.727 3.445 1.00 0.00 C ATOM 0 H MET A 213 -0.327 4.343 0.422 1.00 0.00 H new ATOM 0 HA MET A 213 1.343 5.223 2.548 1.00 0.00 H new ATOM 0 HB2 MET A 213 0.447 2.489 1.646 1.00 0.00 H new ATOM 0 HB3 MET A 213 1.537 2.720 2.998 1.00 0.00 H new ATOM 0 HG2 MET A 213 -0.253 4.398 3.892 1.00 0.00 H new ATOM 0 HG3 MET A 213 -1.328 3.670 2.715 1.00 0.00 H new ATOM 0 HE1 MET A 213 -2.006 0.206 3.713 1.00 0.00 H new ATOM 0 HE2 MET A 213 -1.146 1.056 2.408 1.00 0.00 H new ATOM 0 HE3 MET A 213 -0.239 0.052 3.564 1.00 0.00 H new ATOM 1498 N CYS A 214 2.846 3.561 0.064 1.00 0.00 N ATOM 1499 CA CYS A 214 4.171 3.187 -0.408 1.00 0.00 C ATOM 1500 C CYS A 214 4.870 4.323 -1.142 1.00 0.00 C ATOM 1501 O CYS A 214 6.091 4.314 -1.221 1.00 0.00 O ATOM 1502 CB CYS A 214 4.189 1.909 -1.241 1.00 0.00 C ATOM 1503 SG CYS A 214 5.730 0.997 -0.944 1.00 0.00 S ATOM 0 H CYS A 214 2.076 3.259 -0.533 1.00 0.00 H new ATOM 0 HA CYS A 214 4.737 2.974 0.499 1.00 0.00 H new ATOM 0 HB2 CYS A 214 3.332 1.286 -0.984 1.00 0.00 H new ATOM 0 HB3 CYS A 214 4.100 2.154 -2.299 1.00 0.00 H new ATOM 1508 N VAL A 215 4.148 5.333 -1.622 1.00 0.00 N ATOM 1509 CA VAL A 215 4.734 6.574 -2.096 1.00 0.00 C ATOM 1510 C VAL A 215 5.418 7.228 -0.921 1.00 0.00 C ATOM 1511 O VAL A 215 6.552 7.673 -1.055 1.00 0.00 O ATOM 1512 CB VAL A 215 3.678 7.481 -2.757 1.00 0.00 C ATOM 1513 CG1 VAL A 215 3.071 8.607 -1.939 1.00 0.00 C ATOM 1514 CG2 VAL A 215 4.268 8.165 -3.975 1.00 0.00 C ATOM 0 H VAL A 215 3.131 5.308 -1.691 1.00 0.00 H new ATOM 0 HA VAL A 215 5.469 6.381 -2.878 1.00 0.00 H new ATOM 0 HB VAL A 215 2.879 6.766 -2.952 1.00 0.00 H new ATOM 0 HG11 VAL A 215 2.348 9.150 -2.548 1.00 0.00 H new ATOM 0 HG12 VAL A 215 2.571 8.192 -1.064 1.00 0.00 H new ATOM 0 HG13 VAL A 215 3.859 9.289 -1.617 1.00 0.00 H new ATOM 0 HG21 VAL A 215 3.514 8.804 -4.435 1.00 0.00 H new ATOM 0 HG22 VAL A 215 5.122 8.771 -3.674 1.00 0.00 H new ATOM 0 HG23 VAL A 215 4.593 7.412 -4.693 1.00 0.00 H new ATOM 1524 N THR A 216 4.755 7.253 0.234 1.00 0.00 N ATOM 1525 CA THR A 216 5.361 7.826 1.404 1.00 0.00 C ATOM 1526 C THR A 216 6.567 6.974 1.825 1.00 0.00 C ATOM 1527 O THR A 216 7.624 7.541 2.080 1.00 0.00 O ATOM 1528 CB THR A 216 4.330 8.021 2.528 1.00 0.00 C ATOM 1529 OG1 THR A 216 3.521 9.156 2.262 1.00 0.00 O ATOM 1530 CG2 THR A 216 5.013 8.207 3.884 1.00 0.00 C ATOM 0 H THR A 216 3.813 6.886 0.371 1.00 0.00 H new ATOM 0 HA THR A 216 5.732 8.825 1.173 1.00 0.00 H new ATOM 0 HB THR A 216 3.712 7.124 2.564 1.00 0.00 H new ATOM 0 HG1 THR A 216 2.868 9.268 2.984 1.00 0.00 H new ATOM 0 HG21 THR A 216 4.256 8.342 4.657 1.00 0.00 H new ATOM 0 HG22 THR A 216 5.613 7.326 4.113 1.00 0.00 H new ATOM 0 HG23 THR A 216 5.657 9.085 3.849 1.00 0.00 H new ATOM 1538 N GLN A 217 6.450 5.638 1.898 1.00 0.00 N ATOM 1539 CA GLN A 217 7.601 4.791 2.229 1.00 0.00 C ATOM 1540 C GLN A 217 8.732 5.023 1.229 1.00 0.00 C ATOM 1541 O GLN A 217 9.880 5.119 1.638 1.00 0.00 O ATOM 1542 CB GLN A 217 7.240 3.295 2.292 1.00 0.00 C ATOM 1543 CG GLN A 217 7.007 2.756 3.713 1.00 0.00 C ATOM 1544 CD GLN A 217 7.885 1.550 4.022 1.00 0.00 C ATOM 1545 OE1 GLN A 217 7.437 0.415 3.964 1.00 0.00 O ATOM 1546 NE2 GLN A 217 9.141 1.768 4.359 1.00 0.00 N ATOM 0 H GLN A 217 5.581 5.129 1.734 1.00 0.00 H new ATOM 0 HA GLN A 217 7.932 5.079 3.227 1.00 0.00 H new ATOM 0 HB2 GLN A 217 6.340 3.126 1.701 1.00 0.00 H new ATOM 0 HB3 GLN A 217 8.041 2.721 1.826 1.00 0.00 H new ATOM 0 HG2 GLN A 217 7.209 3.545 4.437 1.00 0.00 H new ATOM 0 HG3 GLN A 217 5.959 2.479 3.827 1.00 0.00 H new ATOM 0 HE21 GLN A 217 9.499 2.722 4.403 1.00 0.00 H new ATOM 0 HE22 GLN A 217 9.754 0.983 4.576 1.00 0.00 H new ATOM 1555 N TYR A 218 8.437 5.163 -0.062 1.00 0.00 N ATOM 1556 CA TYR A 218 9.438 5.486 -1.059 1.00 0.00 C ATOM 1557 C TYR A 218 10.066 6.842 -0.752 1.00 0.00 C ATOM 1558 O TYR A 218 11.284 6.922 -0.722 1.00 0.00 O ATOM 1559 CB TYR A 218 8.845 5.458 -2.468 1.00 0.00 C ATOM 1560 CG TYR A 218 9.850 5.854 -3.529 1.00 0.00 C ATOM 1561 CD1 TYR A 218 10.999 5.088 -3.786 1.00 0.00 C ATOM 1562 CD2 TYR A 218 9.685 7.083 -4.174 1.00 0.00 C ATOM 1563 CE1 TYR A 218 11.978 5.569 -4.674 1.00 0.00 C ATOM 1564 CE2 TYR A 218 10.640 7.563 -5.081 1.00 0.00 C ATOM 1565 CZ TYR A 218 11.820 6.824 -5.298 1.00 0.00 C ATOM 1566 OH TYR A 218 12.807 7.332 -6.079 1.00 0.00 O ATOM 0 H TYR A 218 7.496 5.054 -0.439 1.00 0.00 H new ATOM 0 HA TYR A 218 10.219 4.727 -1.021 1.00 0.00 H new ATOM 0 HB2 TYR A 218 8.472 4.456 -2.682 1.00 0.00 H new ATOM 0 HB3 TYR A 218 7.990 6.133 -2.512 1.00 0.00 H new ATOM 0 HD1 TYR A 218 11.131 4.131 -3.303 1.00 0.00 H new ATOM 0 HD2 TYR A 218 8.805 7.674 -3.970 1.00 0.00 H new ATOM 0 HE1 TYR A 218 12.856 4.974 -4.879 1.00 0.00 H new ATOM 0 HE2 TYR A 218 10.473 8.490 -5.609 1.00 0.00 H new ATOM 0 HH TYR A 218 12.530 8.204 -6.430 1.00 0.00 H new ATOM 1576 N GLN A 219 9.285 7.900 -0.514 1.00 0.00 N ATOM 1577 CA GLN A 219 9.787 9.230 -0.172 1.00 0.00 C ATOM 1578 C GLN A 219 10.698 9.166 1.057 1.00 0.00 C ATOM 1579 O GLN A 219 11.756 9.798 1.057 1.00 0.00 O ATOM 1580 CB GLN A 219 8.617 10.213 0.044 1.00 0.00 C ATOM 1581 CG GLN A 219 7.943 10.599 -1.282 1.00 0.00 C ATOM 1582 CD GLN A 219 6.653 11.410 -1.113 1.00 0.00 C ATOM 1583 OE1 GLN A 219 5.639 11.121 -1.907 1.00 0.00 O flip ATOM 1584 NE2 GLN A 219 6.548 12.327 -0.302 1.00 0.00 N flip ATOM 0 H GLN A 219 8.267 7.853 -0.555 1.00 0.00 H new ATOM 0 HA GLN A 219 10.383 9.600 -1.006 1.00 0.00 H new ATOM 0 HB2 GLN A 219 7.880 9.761 0.708 1.00 0.00 H new ATOM 0 HB3 GLN A 219 8.984 11.111 0.540 1.00 0.00 H new ATOM 0 HG2 GLN A 219 8.647 11.176 -1.881 1.00 0.00 H new ATOM 0 HG3 GLN A 219 7.718 9.691 -1.841 1.00 0.00 H new ATOM 0 HE21 GLN A 219 7.328 12.555 0.314 1.00 0.00 H new ATOM 0 HE22 GLN A 219 5.680 12.860 -0.245 1.00 0.00 H new ATOM 1593 N LYS A 220 10.314 8.396 2.079 1.00 0.00 N ATOM 1594 CA LYS A 220 11.072 8.175 3.302 1.00 0.00 C ATOM 1595 C LYS A 220 12.367 7.432 3.005 1.00 0.00 C ATOM 1596 O LYS A 220 13.436 7.972 3.255 1.00 0.00 O ATOM 1597 CB LYS A 220 10.235 7.418 4.340 1.00 0.00 C ATOM 1598 CG LYS A 220 9.134 8.285 4.973 1.00 0.00 C ATOM 1599 CD LYS A 220 8.039 7.440 5.641 1.00 0.00 C ATOM 1600 CE LYS A 220 8.493 6.516 6.778 1.00 0.00 C ATOM 1601 NZ LYS A 220 8.933 7.236 7.990 1.00 0.00 N ATOM 0 H LYS A 220 9.428 7.891 2.071 1.00 0.00 H new ATOM 0 HA LYS A 220 11.325 9.148 3.722 1.00 0.00 H new ATOM 0 HB2 LYS A 220 9.778 6.549 3.866 1.00 0.00 H new ATOM 0 HB3 LYS A 220 10.892 7.044 5.125 1.00 0.00 H new ATOM 0 HG2 LYS A 220 9.579 8.950 5.713 1.00 0.00 H new ATOM 0 HG3 LYS A 220 8.686 8.916 4.206 1.00 0.00 H new ATOM 0 HD2 LYS A 220 7.277 8.114 6.032 1.00 0.00 H new ATOM 0 HD3 LYS A 220 7.562 6.830 4.874 1.00 0.00 H new ATOM 0 HE2 LYS A 220 7.673 5.848 7.041 1.00 0.00 H new ATOM 0 HE3 LYS A 220 9.311 5.890 6.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 9.225 6.550 8.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 9.736 7.854 7.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 8.148 7.813 8.355 1.00 0.00 H new ATOM 1615 N GLU A 221 12.300 6.216 2.472 1.00 0.00 N ATOM 1616 CA GLU A 221 13.466 5.379 2.207 1.00 0.00 C ATOM 1617 C GLU A 221 14.408 6.023 1.183 1.00 0.00 C ATOM 1618 O GLU A 221 15.620 5.821 1.263 1.00 0.00 O ATOM 1619 CB GLU A 221 13.019 3.999 1.704 1.00 0.00 C ATOM 1620 CG GLU A 221 12.248 3.136 2.723 1.00 0.00 C ATOM 1621 CD GLU A 221 13.060 2.795 3.975 1.00 0.00 C ATOM 1622 OE1 GLU A 221 14.195 2.286 3.823 1.00 0.00 O ATOM 1623 OE2 GLU A 221 12.552 2.993 5.106 1.00 0.00 O ATOM 0 H GLU A 221 11.418 5.777 2.207 1.00 0.00 H new ATOM 0 HA GLU A 221 14.013 5.270 3.143 1.00 0.00 H new ATOM 0 HB2 GLU A 221 12.391 4.139 0.824 1.00 0.00 H new ATOM 0 HB3 GLU A 221 13.901 3.447 1.381 1.00 0.00 H new ATOM 0 HG2 GLU A 221 11.341 3.663 3.020 1.00 0.00 H new ATOM 0 HG3 GLU A 221 11.935 2.210 2.240 1.00 0.00 H new ATOM 1630 N SER A 222 13.866 6.801 0.240 1.00 0.00 N ATOM 1631 CA SER A 222 14.637 7.615 -0.687 1.00 0.00 C ATOM 1632 C SER A 222 15.451 8.632 0.080 1.00 0.00 C ATOM 1633 O SER A 222 16.661 8.726 -0.146 1.00 0.00 O ATOM 1634 CB SER A 222 13.748 8.414 -1.640 1.00 0.00 C ATOM 1635 OG SER A 222 13.067 7.571 -2.540 1.00 0.00 O ATOM 0 H SER A 222 12.858 6.879 0.103 1.00 0.00 H new ATOM 0 HA SER A 222 15.260 6.923 -1.254 1.00 0.00 H new ATOM 0 HB2 SER A 222 13.026 8.994 -1.065 1.00 0.00 H new ATOM 0 HB3 SER A 222 14.357 9.126 -2.197 1.00 0.00 H new ATOM 0 HG SER A 222 12.188 7.343 -2.173 1.00 0.00 H new ATOM 1641 N GLN A 223 14.777 9.381 0.965 1.00 0.00 N ATOM 1642 CA GLN A 223 15.404 10.390 1.774 1.00 0.00 C ATOM 1643 C GLN A 223 16.472 9.692 2.563 1.00 0.00 C ATOM 1644 O GLN A 223 17.622 10.033 2.387 1.00 0.00 O ATOM 1645 CB GLN A 223 14.339 11.118 2.605 1.00 0.00 C ATOM 1646 CG GLN A 223 14.722 11.608 4.018 1.00 0.00 C ATOM 1647 CD GLN A 223 14.207 10.679 5.121 1.00 0.00 C ATOM 1648 OE1 GLN A 223 12.927 10.380 5.091 1.00 0.00 O flip ATOM 1649 NE2 GLN A 223 14.915 10.219 6.006 1.00 0.00 N flip ATOM 0 H GLN A 223 13.774 9.289 1.127 1.00 0.00 H new ATOM 0 HA GLN A 223 15.882 11.182 1.197 1.00 0.00 H new ATOM 0 HB2 GLN A 223 14.005 11.983 2.032 1.00 0.00 H new ATOM 0 HB3 GLN A 223 13.482 10.451 2.705 1.00 0.00 H new ATOM 0 HG2 GLN A 223 15.807 11.686 4.090 1.00 0.00 H new ATOM 0 HG3 GLN A 223 14.320 12.609 4.173 1.00 0.00 H new ATOM 0 HE21 GLN A 223 15.909 10.447 6.035 1.00 0.00 H new ATOM 0 HE22 GLN A 223 14.512 9.607 6.715 1.00 0.00 H new ATOM 1658 N ALA A 224 16.139 8.657 3.314 1.00 0.00 N ATOM 1659 CA ALA A 224 17.015 8.037 4.246 1.00 0.00 C ATOM 1660 C ALA A 224 18.270 7.407 3.575 1.00 0.00 C ATOM 1661 O ALA A 224 19.220 7.024 4.254 1.00 0.00 O ATOM 1662 CB ALA A 224 16.177 7.023 5.041 1.00 0.00 C ATOM 0 H ALA A 224 15.216 8.223 3.278 1.00 0.00 H new ATOM 0 HA ALA A 224 17.436 8.782 4.921 1.00 0.00 H new ATOM 0 HB1 ALA A 224 16.811 6.521 5.772 1.00 0.00 H new ATOM 0 HB2 ALA A 224 15.370 7.543 5.557 1.00 0.00 H new ATOM 0 HB3 ALA A 224 15.755 6.285 4.359 1.00 0.00 H new ATOM 1668 N ALA A 225 18.307 7.288 2.237 1.00 0.00 N ATOM 1669 CA ALA A 225 19.434 6.803 1.434 1.00 0.00 C ATOM 1670 C ALA A 225 20.206 7.930 0.727 1.00 0.00 C ATOM 1671 O ALA A 225 21.274 7.680 0.154 1.00 0.00 O ATOM 1672 CB ALA A 225 18.910 5.831 0.373 1.00 0.00 C ATOM 0 H ALA A 225 17.506 7.542 1.659 1.00 0.00 H new ATOM 0 HA ALA A 225 20.126 6.316 2.121 1.00 0.00 H new ATOM 0 HB1 ALA A 225 19.742 5.466 -0.229 1.00 0.00 H new ATOM 0 HB2 ALA A 225 18.419 4.990 0.861 1.00 0.00 H new ATOM 0 HB3 ALA A 225 18.196 6.345 -0.270 1.00 0.00 H new ATOM 1678 N ALA A 226 19.675 9.152 0.722 1.00 0.00 N ATOM 1679 CA ALA A 226 20.219 10.355 0.102 1.00 0.00 C ATOM 1680 C ALA A 226 20.511 11.444 1.134 1.00 0.00 C ATOM 1681 O ALA A 226 21.296 12.356 0.868 1.00 0.00 O ATOM 1682 CB ALA A 226 19.223 10.868 -0.946 1.00 0.00 C ATOM 0 H ALA A 226 18.786 9.339 1.187 1.00 0.00 H new ATOM 0 HA ALA A 226 21.167 10.102 -0.374 1.00 0.00 H new ATOM 0 HB1 ALA A 226 19.620 11.768 -1.416 1.00 0.00 H new ATOM 0 HB2 ALA A 226 19.066 10.101 -1.705 1.00 0.00 H new ATOM 0 HB3 ALA A 226 18.274 11.100 -0.463 1.00 0.00 H new ATOM 1688 N ASP A 227 19.905 11.348 2.308 1.00 0.00 N ATOM 1689 CA ASP A 227 20.124 12.117 3.513 1.00 0.00 C ATOM 1690 C ASP A 227 21.282 11.496 4.289 1.00 0.00 C ATOM 1691 O ASP A 227 22.133 12.229 4.807 1.00 0.00 O ATOM 1692 CB ASP A 227 18.811 12.287 4.319 1.00 0.00 C ATOM 1693 CG ASP A 227 18.399 11.217 5.244 1.00 0.00 C ATOM 1694 OD1 ASP A 227 18.926 10.119 5.045 1.00 0.00 O ATOM 1695 OD2 ASP A 227 17.536 11.492 6.097 1.00 0.00 O ATOM 0 H ASP A 227 19.171 10.654 2.449 1.00 0.00 H new ATOM 0 HA ASP A 227 20.419 13.138 3.272 1.00 0.00 H new ATOM 0 HB2 ASP A 227 18.896 13.207 4.897 1.00 0.00 H new ATOM 0 HB3 ASP A 227 18.002 12.434 3.603 1.00 0.00 H new ATOM 1700 N GLY A 228 21.384 10.164 4.226 1.00 0.00 N ATOM 1701 CA GLY A 228 22.355 9.349 4.924 1.00 0.00 C ATOM 1702 C GLY A 228 21.818 8.616 6.164 1.00 0.00 C ATOM 1703 O GLY A 228 22.627 8.160 6.971 1.00 0.00 O ATOM 0 H GLY A 228 20.752 9.606 3.652 1.00 0.00 H new ATOM 0 HA2 GLY A 228 22.754 8.611 4.229 1.00 0.00 H new ATOM 0 HA3 GLY A 228 23.188 9.983 5.228 1.00 0.00 H new ATOM 1707 N ARG A 229 20.504 8.497 6.369 1.00 0.00 N ATOM 1708 CA ARG A 229 19.876 8.064 7.621 1.00 0.00 C ATOM 1709 C ARG A 229 19.285 6.669 7.501 1.00 0.00 C ATOM 1710 O ARG A 229 18.237 6.418 8.085 1.00 0.00 O ATOM 1711 CB ARG A 229 18.839 9.129 8.034 1.00 0.00 C ATOM 1712 CG ARG A 229 19.380 10.567 8.134 1.00 0.00 C ATOM 1713 CD ARG A 229 20.412 10.814 9.202 1.00 0.00 C ATOM 1714 NE ARG A 229 19.780 10.991 10.508 1.00 0.00 N ATOM 1715 CZ ARG A 229 20.394 10.845 11.685 1.00 0.00 C ATOM 1716 NH1 ARG A 229 21.667 10.447 11.725 1.00 0.00 N ATOM 1717 NH2 ARG A 229 19.741 11.125 12.809 1.00 0.00 N ATOM 0 H ARG A 229 19.822 8.707 5.640 1.00 0.00 H new ATOM 0 HA ARG A 229 20.625 7.984 8.409 1.00 0.00 H new ATOM 0 HB2 ARG A 229 18.021 9.115 7.314 1.00 0.00 H new ATOM 0 HB3 ARG A 229 18.418 8.848 9.000 1.00 0.00 H new ATOM 0 HG2 ARG A 229 19.811 10.839 7.171 1.00 0.00 H new ATOM 0 HG3 ARG A 229 18.539 11.239 8.308 1.00 0.00 H new ATOM 0 HD2 ARG A 229 21.108 9.976 9.241 1.00 0.00 H new ATOM 0 HD3 ARG A 229 20.994 11.701 8.952 1.00 0.00 H new ATOM 0 HE ARG A 229 18.792 11.246 10.522 1.00 0.00 H new ATOM 0 HH11 ARG A 229 22.169 10.255 10.858 1.00 0.00 H new ATOM 0 HH12 ARG A 229 22.138 10.335 12.623 1.00 0.00 H new ATOM 0 HH21 ARG A 229 18.775 11.450 12.770 1.00 0.00 H new ATOM 0 HH22 ARG A 229 20.206 11.015 13.710 1.00 0.00 H new