USER MOD reduce.3.24.130724 H: found=0, std=0, add=802, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 798 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 179 CYS SG : rot 64:sc= -1.33! USER MOD Set 1.2: A 214 CYS SG : rot 76:sc= 0.397 USER MOD Set 2.1: A 186 GLN : amide:sc= 0.73 K(o=1.9,f=-2.2) USER MOD Set 2.2: A 190 THR OG1 : rot 165:sc= 1.21 USER MOD Set 3.1: A 170 SER OG : rot 128:sc= 1.22 USER MOD Set 3.2: A 225 TYR OH : rot 30:sc= 1.01 USER MOD Set 4.1: A 149 TYR OH : rot 180:sc= -0.0268 USER MOD Set 4.2: A 199 THR OG1 : rot 114:sc= 0.176 USER MOD Single : A 128 TYR OH : rot 30:sc=-0.00418 USER MOD Single : A 129 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 MET CE :methyl 138:sc= 0 (180deg=-0.0965) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 138 MET CE :methyl -144:sc= -0.702 (180deg=-3.46!) USER MOD Single : A 140 HIS : no HD1:sc= -0.366 X(o=-0.37,f=-0.28) USER MOD Single : A 143 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 150 TYR OH : rot 130:sc= 0.532 USER MOD Single : A 153 ASN : amide:sc= 0.826 K(o=0.83,f=0) USER MOD Single : A 154 MET CE :methyl -171:sc= -0.0461 (180deg=-0.281) USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 TYR OH : rot 52:sc= 1.24 USER MOD Single : A 159 ASN : amide:sc= 0.211 X(o=0.21,f=-0.011) USER MOD Single : A 160 GLN : amide:sc= -0.421 X(o=-0.42,f=-0.017) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 TYR OH : rot -162:sc= 1.23 USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD Single : A 168 GLN : amide:sc= 0.15 X(o=0.15,f=0) USER MOD Single : A 169 TYR OH : rot 170:sc= 0.386 USER MOD Single : A 171 ASN : amide:sc= 0 X(o=0,f=-0.087) USER MOD Single : A 172 GLN : amide:sc= -0.251 X(o=-0.25,f=0.21) USER MOD Single : A 173 ASN : amide:sc= -0.981 K(o=-0.98,f=-0.11) USER MOD Single : A 174 ASN : amide:sc= -0.125 K(o=-0.13,f=-0.74) USER MOD Single : A 177 HIS : no HD1:sc= -0.127 X(o=-0.13,f=0.017) USER MOD Single : A 181 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 183 THR OG1 : rot 75:sc= 1.08 USER MOD Single : A 185 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0365) USER MOD Single : A 187 HIS : no HD1:sc= -0.518 X(o=-0.52,f=-0.57) USER MOD Single : A 188 THR OG1 : rot 110:sc= 1.26 USER MOD Single : A 191 THR OG1 : rot 180:sc= -0.492 USER MOD Single : A 192 THR OG1 : rot -110:sc= -0.324 USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= -0.0724 X(o=-0.072,f=0) USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 205 MET CE :methyl 175:sc= -0.677 (180deg=-0.708) USER MOD Single : A 206 MET CE :methyl 157:sc= -0.866 (180deg=-2.92) USER MOD Single : A 212 GLN : amide:sc= -0.0123 K(o=-0.012,f=-1.2) USER MOD Single : A 213 MET CE :methyl -169:sc=-0.00449 (180deg=-0.135) USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 217 GLN : amide:sc= -1.16 K(o=-1.2,f=-2!) USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 GLN : amide:sc= 0.708 K(o=0.71,f=0) USER MOD Single : A 220 LYS NZ :NH3+ -165:sc= -0.0782 (180deg=-0.363) USER MOD Single : A 222 SER OG : rot 77:sc= 1.23 USER MOD Single : A 223 GLN : amide:sc= 0.989 K(o=0.99,f=0) USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 58 N LEU A 125 4.022 13.998 -1.574 1.00 4.15 N ATOM 59 CA LEU A 125 4.648 13.081 -0.622 1.00 74.02 C ATOM 60 C LEU A 125 5.405 13.780 0.494 1.00 14.41 C ATOM 61 O LEU A 125 5.271 13.372 1.646 1.00 44.21 O ATOM 62 CB LEU A 125 5.572 12.111 -1.375 1.00 31.03 C ATOM 63 CG LEU A 125 4.892 10.853 -1.928 1.00 61.30 C ATOM 64 CD1 LEU A 125 4.328 9.944 -0.840 1.00 53.50 C ATOM 65 CD2 LEU A 125 3.797 11.238 -2.909 1.00 2.14 C ATOM 0 HA LEU A 125 3.842 12.533 -0.134 1.00 74.02 H new ATOM 0 HB2 LEU A 125 6.036 12.647 -2.203 1.00 31.03 H new ATOM 0 HB3 LEU A 125 6.374 11.805 -0.704 1.00 31.03 H new ATOM 0 HG LEU A 125 5.666 10.281 -2.440 1.00 61.30 H new ATOM 0 HD11 LEU A 125 3.861 9.073 -1.300 1.00 53.50 H new ATOM 0 HD12 LEU A 125 5.135 9.619 -0.183 1.00 53.50 H new ATOM 0 HD13 LEU A 125 3.585 10.490 -0.259 1.00 53.50 H new ATOM 0 HD21 LEU A 125 3.321 10.337 -3.295 1.00 2.14 H new ATOM 0 HD22 LEU A 125 3.053 11.852 -2.401 1.00 2.14 H new ATOM 0 HD23 LEU A 125 4.230 11.802 -3.735 1.00 2.14 H new ATOM 77 N GLY A 126 6.240 14.763 0.163 1.00 41.34 N ATOM 78 CA GLY A 126 7.108 15.391 1.138 1.00 20.03 C ATOM 79 C GLY A 126 8.270 14.491 1.539 1.00 11.12 C ATOM 80 O GLY A 126 8.535 14.343 2.729 1.00 64.44 O ATOM 0 H GLY A 126 6.329 15.139 -0.781 1.00 41.34 H new ATOM 0 HA2 GLY A 126 7.497 16.323 0.728 1.00 20.03 H new ATOM 0 HA3 GLY A 126 6.529 15.650 2.024 1.00 20.03 H new ATOM 84 N GLY A 127 8.963 13.889 0.568 1.00 15.31 N ATOM 85 CA GLY A 127 10.279 13.293 0.810 1.00 14.25 C ATOM 86 C GLY A 127 10.373 11.802 0.508 1.00 35.25 C ATOM 87 O GLY A 127 11.268 11.149 1.041 1.00 42.32 O ATOM 0 H GLY A 127 8.634 13.802 -0.393 1.00 15.31 H new ATOM 0 HA2 GLY A 127 11.017 13.819 0.204 1.00 14.25 H new ATOM 0 HA3 GLY A 127 10.549 13.455 1.853 1.00 14.25 H new ATOM 91 N TYR A 128 9.450 11.259 -0.292 1.00 72.02 N ATOM 92 CA TYR A 128 9.316 9.811 -0.516 1.00 40.44 C ATOM 93 C TYR A 128 9.535 9.406 -1.977 1.00 3.43 C ATOM 94 O TYR A 128 9.710 10.259 -2.858 1.00 61.04 O ATOM 95 CB TYR A 128 7.931 9.349 -0.061 1.00 24.43 C ATOM 96 CG TYR A 128 7.650 9.611 1.398 1.00 75.14 C ATOM 97 CD1 TYR A 128 7.316 10.903 1.840 1.00 71.43 C ATOM 98 CD2 TYR A 128 7.768 8.561 2.320 1.00 34.12 C ATOM 99 CE1 TYR A 128 7.111 11.167 3.193 1.00 32.12 C ATOM 100 CE2 TYR A 128 7.622 8.832 3.695 1.00 44.53 C ATOM 101 CZ TYR A 128 7.287 10.137 4.135 1.00 64.34 C ATOM 102 OH TYR A 128 7.075 10.412 5.447 1.00 54.23 O ATOM 0 H TYR A 128 8.768 11.815 -0.808 1.00 72.02 H new ATOM 0 HA TYR A 128 10.097 9.326 0.070 1.00 40.44 H new ATOM 0 HB2 TYR A 128 7.175 9.852 -0.663 1.00 24.43 H new ATOM 0 HB3 TYR A 128 7.833 8.281 -0.254 1.00 24.43 H new ATOM 0 HD1 TYR A 128 7.217 11.703 1.121 1.00 71.43 H new ATOM 0 HD2 TYR A 128 7.969 7.556 1.980 1.00 34.12 H new ATOM 0 HE1 TYR A 128 6.819 12.155 3.516 1.00 32.12 H new ATOM 0 HE2 TYR A 128 7.766 8.042 4.417 1.00 44.53 H new ATOM 0 HH TYR A 128 6.398 11.116 5.528 1.00 54.23 H new ATOM 112 N MET A 129 9.451 8.102 -2.242 1.00 74.31 N ATOM 113 CA MET A 129 9.448 7.500 -3.566 1.00 54.24 C ATOM 114 C MET A 129 8.140 6.736 -3.768 1.00 42.41 C ATOM 115 O MET A 129 7.659 6.042 -2.873 1.00 0.14 O ATOM 116 CB MET A 129 10.711 6.673 -3.835 1.00 32.11 C ATOM 117 CG MET A 129 11.129 5.806 -2.662 1.00 63.40 C ATOM 118 SD MET A 129 12.670 4.901 -2.936 1.00 31.01 S ATOM 119 CE MET A 129 13.765 6.211 -2.424 1.00 52.42 C ATOM 0 H MET A 129 9.380 7.407 -1.499 1.00 74.31 H new ATOM 0 HA MET A 129 9.486 8.284 -4.322 1.00 54.24 H new ATOM 0 HB2 MET A 129 10.541 6.037 -4.704 1.00 32.11 H new ATOM 0 HB3 MET A 129 11.530 7.347 -4.088 1.00 32.11 H new ATOM 0 HG2 MET A 129 11.240 6.435 -1.779 1.00 63.40 H new ATOM 0 HG3 MET A 129 10.333 5.093 -2.447 1.00 63.40 H new ATOM 0 HE1 MET A 129 14.799 5.876 -2.510 1.00 52.42 H new ATOM 0 HE2 MET A 129 13.612 7.082 -3.061 1.00 52.42 H new ATOM 0 HE3 MET A 129 13.554 6.477 -1.388 1.00 52.42 H new ATOM 129 N LEU A 130 7.544 6.936 -4.941 1.00 2.51 N ATOM 130 CA LEU A 130 6.480 6.126 -5.530 1.00 53.11 C ATOM 131 C LEU A 130 7.152 5.133 -6.499 1.00 12.41 C ATOM 132 O LEU A 130 8.137 5.506 -7.139 1.00 32.03 O ATOM 133 CB LEU A 130 5.535 7.125 -6.230 1.00 22.23 C ATOM 134 CG LEU A 130 4.216 6.642 -6.862 1.00 20.32 C ATOM 135 CD1 LEU A 130 4.376 6.453 -8.368 1.00 75.21 C ATOM 136 CD2 LEU A 130 3.611 5.413 -6.196 1.00 13.54 C ATOM 0 H LEU A 130 7.807 7.716 -5.543 1.00 2.51 H new ATOM 0 HA LEU A 130 5.900 5.540 -4.817 1.00 53.11 H new ATOM 0 HB2 LEU A 130 5.280 7.892 -5.499 1.00 22.23 H new ATOM 0 HB3 LEU A 130 6.109 7.613 -7.017 1.00 22.23 H new ATOM 0 HG LEU A 130 3.491 7.436 -6.683 1.00 20.32 H new ATOM 0 HD11 LEU A 130 3.433 6.112 -8.794 1.00 75.21 H new ATOM 0 HD12 LEU A 130 4.659 7.401 -8.826 1.00 75.21 H new ATOM 0 HD13 LEU A 130 5.151 5.711 -8.561 1.00 75.21 H new ATOM 0 HD21 LEU A 130 2.685 5.142 -6.704 1.00 13.54 H new ATOM 0 HD22 LEU A 130 4.315 4.583 -6.257 1.00 13.54 H new ATOM 0 HD23 LEU A 130 3.399 5.633 -5.150 1.00 13.54 H new ATOM 148 N GLY A 131 6.668 3.892 -6.600 1.00 63.21 N ATOM 149 CA GLY A 131 7.310 2.822 -7.375 1.00 3.32 C ATOM 150 C GLY A 131 6.737 2.733 -8.786 1.00 10.52 C ATOM 151 O GLY A 131 6.553 3.758 -9.443 1.00 13.31 O ATOM 0 H GLY A 131 5.807 3.596 -6.140 1.00 63.21 H new ATOM 0 HA2 GLY A 131 8.383 3.003 -7.428 1.00 3.32 H new ATOM 0 HA3 GLY A 131 7.173 1.869 -6.865 1.00 3.32 H new ATOM 155 N SER A 132 6.314 1.543 -9.214 1.00 24.11 N ATOM 156 CA SER A 132 5.441 1.309 -10.363 1.00 21.05 C ATOM 157 C SER A 132 4.124 0.653 -9.934 1.00 22.41 C ATOM 158 O SER A 132 3.951 0.216 -8.795 1.00 14.24 O ATOM 159 CB SER A 132 6.169 0.457 -11.401 1.00 65.41 C ATOM 160 OG SER A 132 6.986 -0.551 -10.834 1.00 32.44 O ATOM 0 H SER A 132 6.583 0.677 -8.747 1.00 24.11 H new ATOM 0 HA SER A 132 5.191 2.270 -10.813 1.00 21.05 H new ATOM 0 HB2 SER A 132 5.434 -0.009 -12.057 1.00 65.41 H new ATOM 0 HB3 SER A 132 6.786 1.105 -12.023 1.00 65.41 H new ATOM 0 HG SER A 132 7.421 -1.060 -11.549 1.00 32.44 H new ATOM 166 N ALA A 133 3.165 0.604 -10.854 1.00 61.24 N ATOM 167 CA ALA A 133 1.852 0.065 -10.647 1.00 21.23 C ATOM 168 C ALA A 133 1.978 -1.417 -10.347 1.00 24.24 C ATOM 169 O ALA A 133 2.977 -2.065 -10.684 1.00 42.50 O ATOM 170 CB ALA A 133 1.008 0.312 -11.894 1.00 21.42 C ATOM 0 H ALA A 133 3.302 0.958 -11.801 1.00 61.24 H new ATOM 0 HA ALA A 133 1.360 0.550 -9.804 1.00 21.23 H new ATOM 0 HB1 ALA A 133 0.008 -0.095 -11.743 1.00 21.42 H new ATOM 0 HB2 ALA A 133 0.939 1.384 -12.080 1.00 21.42 H new ATOM 0 HB3 ALA A 133 1.473 -0.176 -12.751 1.00 21.42 H new ATOM 176 N MET A 134 0.963 -1.933 -9.679 1.00 33.22 N ATOM 177 CA MET A 134 0.974 -3.247 -9.097 1.00 73.20 C ATOM 178 C MET A 134 -0.445 -3.774 -8.971 1.00 65.22 C ATOM 179 O MET A 134 -1.427 -3.055 -9.157 1.00 10.33 O ATOM 180 CB MET A 134 1.656 -3.154 -7.737 1.00 64.02 C ATOM 181 CG MET A 134 3.161 -3.395 -7.805 1.00 11.13 C ATOM 182 SD MET A 134 3.785 -4.455 -6.466 1.00 14.53 S ATOM 183 CE MET A 134 3.832 -3.254 -5.108 1.00 44.40 C ATOM 0 H MET A 134 0.089 -1.430 -9.527 1.00 33.22 H new ATOM 0 HA MET A 134 1.523 -3.944 -9.730 1.00 73.20 H new ATOM 0 HB2 MET A 134 1.471 -2.168 -7.311 1.00 64.02 H new ATOM 0 HB3 MET A 134 1.207 -3.883 -7.062 1.00 64.02 H new ATOM 0 HG2 MET A 134 3.405 -3.852 -8.764 1.00 11.13 H new ATOM 0 HG3 MET A 134 3.677 -2.436 -7.769 1.00 11.13 H new ATOM 0 HE1 MET A 134 3.459 -3.721 -4.196 1.00 44.40 H new ATOM 0 HE2 MET A 134 4.858 -2.922 -4.952 1.00 44.40 H new ATOM 0 HE3 MET A 134 3.207 -2.397 -5.359 1.00 44.40 H new ATOM 193 N SER A 135 -0.536 -5.051 -8.640 1.00 63.43 N ATOM 194 CA SER A 135 -1.758 -5.830 -8.799 1.00 51.32 C ATOM 195 C SER A 135 -2.597 -5.795 -7.531 1.00 10.45 C ATOM 196 O SER A 135 -2.088 -5.820 -6.406 1.00 34.05 O ATOM 197 CB SER A 135 -1.456 -7.273 -9.219 1.00 65.22 C ATOM 198 OG SER A 135 -2.657 -7.950 -9.561 1.00 2.14 O ATOM 0 H SER A 135 0.242 -5.583 -8.250 1.00 63.43 H new ATOM 0 HA SER A 135 -2.337 -5.370 -9.600 1.00 51.32 H new ATOM 0 HB2 SER A 135 -0.774 -7.276 -10.070 1.00 65.22 H new ATOM 0 HB3 SER A 135 -0.954 -7.798 -8.406 1.00 65.22 H new ATOM 0 HG SER A 135 -2.449 -8.870 -9.829 1.00 2.14 H new ATOM 204 N ARG A 136 -3.907 -5.796 -7.751 1.00 13.24 N ATOM 205 CA ARG A 136 -4.941 -5.893 -6.734 1.00 52.33 C ATOM 206 C ARG A 136 -4.943 -7.304 -6.129 1.00 25.21 C ATOM 207 O ARG A 136 -5.232 -8.259 -6.859 1.00 22.14 O ATOM 208 CB ARG A 136 -6.299 -5.419 -7.297 1.00 5.11 C ATOM 209 CG ARG A 136 -6.748 -5.890 -8.694 1.00 51.31 C ATOM 210 CD ARG A 136 -7.539 -7.201 -8.707 1.00 53.21 C ATOM 211 NE ARG A 136 -8.299 -7.369 -9.958 1.00 10.14 N ATOM 212 CZ ARG A 136 -7.807 -7.718 -11.152 1.00 64.33 C ATOM 213 NH1 ARG A 136 -6.499 -7.891 -11.328 1.00 63.44 N ATOM 214 NH2 ARG A 136 -8.626 -7.899 -12.178 1.00 32.21 N ATOM 0 H ARG A 136 -4.293 -5.725 -8.692 1.00 13.24 H new ATOM 0 HA ARG A 136 -4.732 -5.218 -5.904 1.00 52.33 H new ATOM 0 HB2 ARG A 136 -7.070 -5.720 -6.588 1.00 5.11 H new ATOM 0 HB3 ARG A 136 -6.285 -4.329 -7.309 1.00 5.11 H new ATOM 0 HG2 ARG A 136 -7.359 -5.109 -9.146 1.00 51.31 H new ATOM 0 HG3 ARG A 136 -5.866 -6.008 -9.323 1.00 51.31 H new ATOM 0 HD2 ARG A 136 -6.854 -8.040 -8.582 1.00 53.21 H new ATOM 0 HD3 ARG A 136 -8.225 -7.220 -7.860 1.00 53.21 H new ATOM 0 HE ARG A 136 -9.304 -7.202 -9.909 1.00 10.14 H new ATOM 0 HH11 ARG A 136 -5.857 -7.757 -10.547 1.00 63.44 H new ATOM 0 HH12 ARG A 136 -6.139 -8.157 -12.244 1.00 63.44 H new ATOM 0 HH21 ARG A 136 -9.631 -7.772 -12.057 1.00 32.21 H new ATOM 0 HH22 ARG A 136 -8.252 -8.165 -13.089 1.00 32.21 H new ATOM 228 N PRO A 137 -4.588 -7.484 -4.844 1.00 1.01 N ATOM 229 CA PRO A 137 -4.720 -8.768 -4.165 1.00 13.12 C ATOM 230 C PRO A 137 -6.210 -9.084 -3.995 1.00 34.23 C ATOM 231 O PRO A 137 -7.008 -8.186 -3.748 1.00 44.22 O ATOM 232 CB PRO A 137 -4.019 -8.582 -2.818 1.00 12.15 C ATOM 233 CG PRO A 137 -4.157 -7.095 -2.527 1.00 30.41 C ATOM 234 CD PRO A 137 -4.200 -6.446 -3.900 1.00 65.32 C ATOM 0 HA PRO A 137 -4.278 -9.599 -4.714 1.00 13.12 H new ATOM 0 HB2 PRO A 137 -4.486 -9.185 -2.039 1.00 12.15 H new ATOM 0 HB3 PRO A 137 -2.972 -8.882 -2.869 1.00 12.15 H new ATOM 0 HG2 PRO A 137 -5.063 -6.883 -1.958 1.00 30.41 H new ATOM 0 HG3 PRO A 137 -3.317 -6.725 -1.938 1.00 30.41 H new ATOM 0 HD2 PRO A 137 -4.914 -5.622 -3.916 1.00 65.32 H new ATOM 0 HD3 PRO A 137 -3.227 -6.030 -4.161 1.00 65.32 H new ATOM 242 N MET A 138 -6.622 -10.343 -4.130 1.00 63.42 N ATOM 243 CA MET A 138 -8.013 -10.732 -3.978 1.00 33.25 C ATOM 244 C MET A 138 -8.300 -10.884 -2.486 1.00 53.03 C ATOM 245 O MET A 138 -8.135 -11.965 -1.918 1.00 61.45 O ATOM 246 CB MET A 138 -8.269 -11.991 -4.809 1.00 70.24 C ATOM 247 CG MET A 138 -9.647 -12.638 -4.653 1.00 4.12 C ATOM 248 SD MET A 138 -11.054 -11.712 -5.304 1.00 3.20 S ATOM 249 CE MET A 138 -11.369 -10.571 -3.941 1.00 71.52 C ATOM 0 H MET A 138 -5.997 -11.119 -4.348 1.00 63.42 H new ATOM 0 HA MET A 138 -8.705 -9.980 -4.356 1.00 33.25 H new ATOM 0 HB2 MET A 138 -8.125 -11.742 -5.860 1.00 70.24 H new ATOM 0 HB3 MET A 138 -7.512 -12.731 -4.550 1.00 70.24 H new ATOM 0 HG2 MET A 138 -9.624 -13.611 -5.143 1.00 4.12 H new ATOM 0 HG3 MET A 138 -9.820 -12.819 -3.592 1.00 4.12 H new ATOM 0 HE1 MET A 138 -12.442 -10.408 -3.844 1.00 71.52 H new ATOM 0 HE2 MET A 138 -10.981 -10.995 -3.015 1.00 71.52 H new ATOM 0 HE3 MET A 138 -10.874 -9.620 -4.141 1.00 71.52 H new ATOM 259 N ILE A 139 -8.681 -9.781 -1.843 1.00 41.42 N ATOM 260 CA ILE A 139 -9.009 -9.779 -0.426 1.00 74.34 C ATOM 261 C ILE A 139 -10.498 -10.086 -0.347 1.00 50.02 C ATOM 262 O ILE A 139 -11.334 -9.259 -0.696 1.00 62.52 O ATOM 263 CB ILE A 139 -8.580 -8.496 0.321 1.00 42.00 C ATOM 264 CG1 ILE A 139 -7.302 -7.897 -0.307 1.00 65.51 C ATOM 265 CG2 ILE A 139 -8.374 -8.852 1.812 1.00 54.21 C ATOM 266 CD1 ILE A 139 -6.398 -7.149 0.667 1.00 30.55 C ATOM 0 H ILE A 139 -8.769 -8.869 -2.291 1.00 41.42 H new ATOM 0 HA ILE A 139 -8.434 -10.538 0.105 1.00 74.34 H new ATOM 0 HB ILE A 139 -9.354 -7.733 0.237 1.00 42.00 H new ATOM 0 HG12 ILE A 139 -6.729 -8.702 -0.767 1.00 65.51 H new ATOM 0 HG13 ILE A 139 -7.593 -7.216 -1.107 1.00 65.51 H new ATOM 0 HG21 ILE A 139 -8.070 -7.960 2.360 1.00 54.21 H new ATOM 0 HG22 ILE A 139 -9.307 -9.233 2.227 1.00 54.21 H new ATOM 0 HG23 ILE A 139 -7.599 -9.614 1.901 1.00 54.21 H new ATOM 0 HD11 ILE A 139 -5.528 -6.765 0.134 1.00 30.55 H new ATOM 0 HD12 ILE A 139 -6.948 -6.318 1.109 1.00 30.55 H new ATOM 0 HD13 ILE A 139 -6.071 -7.828 1.455 1.00 30.55 H new ATOM 278 N HIS A 140 -10.813 -11.323 0.013 1.00 30.41 N ATOM 279 CA HIS A 140 -12.170 -11.829 0.167 1.00 23.13 C ATOM 280 C HIS A 140 -12.452 -12.241 1.610 1.00 21.42 C ATOM 281 O HIS A 140 -13.612 -12.416 1.970 1.00 32.10 O ATOM 282 CB HIS A 140 -12.490 -12.930 -0.859 1.00 12.14 C ATOM 283 CG HIS A 140 -11.446 -13.987 -1.126 1.00 21.32 C ATOM 284 ND1 HIS A 140 -11.311 -14.666 -2.316 1.00 2.44 N ATOM 285 CD2 HIS A 140 -10.483 -14.457 -0.274 1.00 14.11 C ATOM 286 CE1 HIS A 140 -10.263 -15.492 -2.199 1.00 4.42 C ATOM 287 NE2 HIS A 140 -9.709 -15.385 -0.978 1.00 41.44 N ATOM 0 H HIS A 140 -10.103 -12.028 0.213 1.00 30.41 H new ATOM 0 HA HIS A 140 -12.859 -11.014 -0.053 1.00 23.13 H new ATOM 0 HB2 HIS A 140 -13.398 -13.436 -0.531 1.00 12.14 H new ATOM 0 HB3 HIS A 140 -12.720 -12.444 -1.807 1.00 12.14 H new ATOM 0 HD2 HIS A 140 -10.346 -14.164 0.756 1.00 14.11 H new ATOM 0 HE1 HIS A 140 -9.911 -16.153 -2.978 1.00 4.42 H new ATOM 0 HE2 HIS A 140 -8.887 -15.882 -0.634 1.00 41.44 H new ATOM 295 N PHE A 141 -11.421 -12.311 2.464 1.00 74.33 N ATOM 296 CA PHE A 141 -11.466 -12.426 3.924 1.00 22.24 C ATOM 297 C PHE A 141 -12.071 -13.755 4.433 1.00 74.12 C ATOM 298 O PHE A 141 -11.662 -14.252 5.484 1.00 71.43 O ATOM 299 CB PHE A 141 -12.163 -11.185 4.529 1.00 32.41 C ATOM 300 CG PHE A 141 -11.703 -9.824 4.001 1.00 44.12 C ATOM 301 CD1 PHE A 141 -12.284 -9.293 2.832 1.00 63.15 C ATOM 302 CD2 PHE A 141 -10.721 -9.061 4.668 1.00 54.04 C ATOM 303 CE1 PHE A 141 -11.913 -8.032 2.343 1.00 11.44 C ATOM 304 CE2 PHE A 141 -10.381 -7.775 4.199 1.00 64.22 C ATOM 305 CZ PHE A 141 -10.986 -7.245 3.044 1.00 70.44 C ATOM 0 H PHE A 141 -10.460 -12.287 2.122 1.00 74.33 H new ATOM 0 HA PHE A 141 -10.434 -12.453 4.275 1.00 22.24 H new ATOM 0 HB2 PHE A 141 -13.235 -11.275 4.354 1.00 32.41 H new ATOM 0 HB3 PHE A 141 -12.014 -11.201 5.609 1.00 32.41 H new ATOM 0 HD1 PHE A 141 -13.029 -9.868 2.303 1.00 63.15 H new ATOM 0 HD2 PHE A 141 -10.228 -9.463 5.541 1.00 54.04 H new ATOM 0 HE1 PHE A 141 -12.343 -7.665 1.423 1.00 11.44 H new ATOM 0 HE2 PHE A 141 -9.647 -7.190 4.733 1.00 64.22 H new ATOM 0 HZ PHE A 141 -10.741 -6.250 2.703 1.00 70.44 H new ATOM 315 N GLY A 142 -12.966 -14.394 3.677 1.00 43.31 N ATOM 316 CA GLY A 142 -13.906 -15.418 4.109 1.00 24.24 C ATOM 317 C GLY A 142 -15.315 -14.843 4.292 1.00 33.40 C ATOM 318 O GLY A 142 -16.212 -15.557 4.746 1.00 14.01 O ATOM 0 H GLY A 142 -13.055 -14.193 2.681 1.00 43.31 H new ATOM 0 HA2 GLY A 142 -13.933 -16.223 3.374 1.00 24.24 H new ATOM 0 HA3 GLY A 142 -13.565 -15.854 5.048 1.00 24.24 H new ATOM 322 N ASN A 143 -15.535 -13.557 3.999 1.00 61.33 N ATOM 323 CA ASN A 143 -16.698 -12.826 4.464 1.00 11.33 C ATOM 324 C ASN A 143 -17.581 -12.466 3.289 1.00 30.44 C ATOM 325 O ASN A 143 -17.153 -11.723 2.412 1.00 31.30 O ATOM 326 CB ASN A 143 -16.225 -11.573 5.191 1.00 24.32 C ATOM 327 CG ASN A 143 -15.914 -11.888 6.632 1.00 23.41 C ATOM 328 OD1 ASN A 143 -14.772 -12.121 7.017 1.00 53.12 O ATOM 329 ND2 ASN A 143 -16.949 -11.984 7.436 1.00 30.21 N ATOM 0 H ASN A 143 -14.901 -12.998 3.428 1.00 61.33 H new ATOM 0 HA ASN A 143 -17.282 -13.440 5.149 1.00 11.33 H new ATOM 0 HB2 ASN A 143 -15.338 -11.173 4.700 1.00 24.32 H new ATOM 0 HB3 ASN A 143 -16.994 -10.802 5.138 1.00 24.32 H new ATOM 0 HD21 ASN A 143 -16.815 -12.259 8.409 1.00 30.21 H new ATOM 0 HD22 ASN A 143 -17.886 -11.784 7.087 1.00 30.21 H new ATOM 336 N ASP A 144 -18.820 -12.958 3.305 1.00 43.24 N ATOM 337 CA ASP A 144 -19.782 -12.799 2.217 1.00 70.25 C ATOM 338 C ASP A 144 -20.034 -11.326 1.906 1.00 32.44 C ATOM 339 O ASP A 144 -20.316 -10.977 0.758 1.00 14.10 O ATOM 340 CB ASP A 144 -21.122 -13.477 2.549 1.00 24.54 C ATOM 341 CG ASP A 144 -21.113 -14.990 2.331 1.00 73.31 C ATOM 342 OD1 ASP A 144 -20.615 -15.726 3.209 1.00 34.51 O ATOM 343 OD2 ASP A 144 -21.693 -15.462 1.323 1.00 63.24 O ATOM 0 H ASP A 144 -19.190 -13.490 4.093 1.00 43.24 H new ATOM 0 HA ASP A 144 -19.345 -13.279 1.342 1.00 70.25 H new ATOM 0 HB2 ASP A 144 -21.377 -13.270 3.588 1.00 24.54 H new ATOM 0 HB3 ASP A 144 -21.906 -13.034 1.934 1.00 24.54 H new ATOM 348 N TRP A 145 -19.955 -10.468 2.929 1.00 50.13 N ATOM 349 CA TRP A 145 -20.066 -9.035 2.746 1.00 62.31 C ATOM 350 C TRP A 145 -18.729 -8.436 2.303 1.00 25.22 C ATOM 351 O TRP A 145 -18.679 -7.841 1.233 1.00 5.23 O ATOM 352 CB TRP A 145 -20.691 -8.356 3.966 1.00 45.41 C ATOM 353 CG TRP A 145 -19.867 -8.293 5.206 1.00 50.12 C ATOM 354 CD1 TRP A 145 -19.623 -9.318 6.044 1.00 42.13 C ATOM 355 CD2 TRP A 145 -19.112 -7.163 5.716 1.00 13.00 C ATOM 356 NE1 TRP A 145 -18.872 -8.861 7.118 1.00 70.24 N ATOM 357 CE2 TRP A 145 -18.527 -7.530 6.962 1.00 4.41 C ATOM 358 CE3 TRP A 145 -18.788 -5.900 5.186 1.00 25.11 C ATOM 359 CZ2 TRP A 145 -17.688 -6.647 7.667 1.00 5.01 C ATOM 360 CZ3 TRP A 145 -17.936 -5.023 5.873 1.00 61.22 C ATOM 361 CH2 TRP A 145 -17.388 -5.389 7.115 1.00 44.05 C ATOM 0 H TRP A 145 -19.813 -10.755 3.897 1.00 50.13 H new ATOM 0 HA TRP A 145 -20.762 -8.837 1.931 1.00 62.31 H new ATOM 0 HB2 TRP A 145 -20.958 -7.337 3.686 1.00 45.41 H new ATOM 0 HB3 TRP A 145 -21.619 -8.875 4.203 1.00 45.41 H new ATOM 0 HD1 TRP A 145 -19.958 -10.335 5.903 1.00 42.13 H new ATOM 0 HE1 TRP A 145 -18.608 -9.433 7.920 1.00 70.24 H new ATOM 0 HE3 TRP A 145 -19.202 -5.601 4.234 1.00 25.11 H new ATOM 0 HZ2 TRP A 145 -17.278 -6.933 8.624 1.00 5.01 H new ATOM 0 HZ3 TRP A 145 -17.699 -4.060 5.445 1.00 61.22 H new ATOM 0 HH2 TRP A 145 -16.739 -4.706 7.643 1.00 44.05 H new ATOM 372 N GLU A 146 -17.653 -8.588 3.088 1.00 30.10 N ATOM 373 CA GLU A 146 -16.374 -7.919 2.830 1.00 30.44 C ATOM 374 C GLU A 146 -15.792 -8.269 1.454 1.00 42.13 C ATOM 375 O GLU A 146 -15.225 -7.395 0.806 1.00 51.11 O ATOM 376 CB GLU A 146 -15.348 -8.195 3.945 1.00 22.40 C ATOM 377 CG GLU A 146 -15.560 -7.289 5.154 1.00 30.20 C ATOM 378 CD GLU A 146 -14.402 -7.208 6.155 1.00 10.13 C ATOM 379 OE1 GLU A 146 -13.897 -8.254 6.622 1.00 61.22 O ATOM 380 OE2 GLU A 146 -14.049 -6.073 6.566 1.00 23.35 O ATOM 0 H GLU A 146 -17.647 -9.179 3.919 1.00 30.10 H new ATOM 0 HA GLU A 146 -16.588 -6.850 2.826 1.00 30.44 H new ATOM 0 HB2 GLU A 146 -15.422 -9.237 4.256 1.00 22.40 H new ATOM 0 HB3 GLU A 146 -14.341 -8.049 3.555 1.00 22.40 H new ATOM 0 HG2 GLU A 146 -15.772 -6.282 4.794 1.00 30.20 H new ATOM 0 HG3 GLU A 146 -16.448 -7.631 5.686 1.00 30.20 H new ATOM 387 N ASP A 147 -15.961 -9.504 0.978 1.00 22.42 N ATOM 388 CA ASP A 147 -15.540 -9.927 -0.358 1.00 52.41 C ATOM 389 C ASP A 147 -16.205 -9.063 -1.425 1.00 13.33 C ATOM 390 O ASP A 147 -15.531 -8.411 -2.224 1.00 70.25 O ATOM 391 CB ASP A 147 -15.900 -11.403 -0.556 1.00 74.35 C ATOM 392 CG ASP A 147 -15.591 -11.955 -1.950 1.00 14.20 C ATOM 393 OD1 ASP A 147 -14.780 -11.392 -2.713 1.00 2.31 O ATOM 394 OD2 ASP A 147 -16.151 -13.029 -2.280 1.00 12.42 O ATOM 0 H ASP A 147 -16.401 -10.249 1.518 1.00 22.42 H new ATOM 0 HA ASP A 147 -14.461 -9.806 -0.453 1.00 52.41 H new ATOM 0 HB2 ASP A 147 -15.361 -11.997 0.183 1.00 74.35 H new ATOM 0 HB3 ASP A 147 -16.963 -11.534 -0.356 1.00 74.35 H new ATOM 399 N ARG A 148 -17.541 -9.010 -1.410 1.00 31.52 N ATOM 400 CA ARG A 148 -18.319 -8.227 -2.340 1.00 23.42 C ATOM 401 C ARG A 148 -17.976 -6.749 -2.176 1.00 33.13 C ATOM 402 O ARG A 148 -17.884 -6.049 -3.179 1.00 74.15 O ATOM 403 CB ARG A 148 -19.801 -8.552 -2.092 1.00 65.21 C ATOM 404 CG ARG A 148 -20.701 -7.502 -2.730 1.00 45.05 C ATOM 405 CD ARG A 148 -22.189 -7.849 -2.673 1.00 22.22 C ATOM 406 NE ARG A 148 -22.952 -6.808 -3.383 1.00 54.43 N ATOM 407 CZ ARG A 148 -23.401 -6.849 -4.642 1.00 10.01 C ATOM 408 NH1 ARG A 148 -23.657 -8.014 -5.223 1.00 30.14 N ATOM 409 NH2 ARG A 148 -23.576 -5.716 -5.309 1.00 62.33 N ATOM 0 H ARG A 148 -18.109 -9.523 -0.736 1.00 31.52 H new ATOM 0 HA ARG A 148 -18.091 -8.471 -3.378 1.00 23.42 H new ATOM 0 HB2 ARG A 148 -20.035 -9.535 -2.501 1.00 65.21 H new ATOM 0 HB3 ARG A 148 -19.993 -8.599 -1.020 1.00 65.21 H new ATOM 0 HG2 ARG A 148 -20.541 -6.547 -2.230 1.00 45.05 H new ATOM 0 HG3 ARG A 148 -20.408 -7.370 -3.771 1.00 45.05 H new ATOM 0 HD2 ARG A 148 -22.366 -8.823 -3.129 1.00 22.22 H new ATOM 0 HD3 ARG A 148 -22.520 -7.918 -1.637 1.00 22.22 H new ATOM 0 HE ARG A 148 -23.161 -5.961 -2.855 1.00 54.43 H new ATOM 0 HH11 ARG A 148 -23.511 -8.883 -4.709 1.00 30.14 H new ATOM 0 HH12 ARG A 148 -23.999 -8.041 -6.183 1.00 30.14 H new ATOM 0 HH21 ARG A 148 -23.368 -4.823 -4.861 1.00 62.33 H new ATOM 0 HH22 ARG A 148 -23.918 -5.737 -6.270 1.00 62.33 H new ATOM 423 N TYR A 149 -17.831 -6.269 -0.941 1.00 53.13 N ATOM 424 CA TYR A 149 -17.536 -4.886 -0.619 1.00 50.21 C ATOM 425 C TYR A 149 -16.246 -4.481 -1.330 1.00 30.41 C ATOM 426 O TYR A 149 -16.276 -3.552 -2.142 1.00 44.34 O ATOM 427 CB TYR A 149 -17.464 -4.741 0.908 1.00 14.30 C ATOM 428 CG TYR A 149 -17.347 -3.329 1.435 1.00 4.33 C ATOM 429 CD1 TYR A 149 -16.241 -2.534 1.095 1.00 5.22 C ATOM 430 CD2 TYR A 149 -18.303 -2.837 2.340 1.00 1.03 C ATOM 431 CE1 TYR A 149 -16.077 -1.266 1.658 1.00 30.24 C ATOM 432 CE2 TYR A 149 -18.160 -1.553 2.893 1.00 4.41 C ATOM 433 CZ TYR A 149 -17.045 -0.755 2.555 1.00 22.11 C ATOM 434 OH TYR A 149 -16.910 0.476 3.119 1.00 20.11 O ATOM 0 H TYR A 149 -17.920 -6.858 -0.113 1.00 53.13 H new ATOM 0 HA TYR A 149 -18.318 -4.211 -0.968 1.00 50.21 H new ATOM 0 HB2 TYR A 149 -18.356 -5.196 1.339 1.00 14.30 H new ATOM 0 HB3 TYR A 149 -16.609 -5.314 1.268 1.00 14.30 H new ATOM 0 HD1 TYR A 149 -15.510 -2.906 0.392 1.00 5.22 H new ATOM 0 HD2 TYR A 149 -19.151 -3.448 2.612 1.00 1.03 H new ATOM 0 HE1 TYR A 149 -15.209 -0.674 1.408 1.00 30.24 H new ATOM 0 HE2 TYR A 149 -18.905 -1.176 3.578 1.00 4.41 H new ATOM 0 HH TYR A 149 -17.675 0.653 3.706 1.00 20.11 H new ATOM 444 N TYR A 150 -15.139 -5.167 -1.014 1.00 41.21 N ATOM 445 CA TYR A 150 -13.850 -5.057 -1.683 1.00 63.24 C ATOM 446 C TYR A 150 -14.058 -5.076 -3.188 1.00 13.04 C ATOM 447 O TYR A 150 -13.764 -4.080 -3.839 1.00 3.35 O ATOM 448 CB TYR A 150 -12.867 -6.177 -1.262 1.00 21.51 C ATOM 449 CG TYR A 150 -11.522 -6.100 -1.975 1.00 41.43 C ATOM 450 CD1 TYR A 150 -10.695 -4.983 -1.771 1.00 1.25 C ATOM 451 CD2 TYR A 150 -11.106 -7.113 -2.863 1.00 51.01 C ATOM 452 CE1 TYR A 150 -9.518 -4.826 -2.528 1.00 44.11 C ATOM 453 CE2 TYR A 150 -9.932 -6.968 -3.629 1.00 53.43 C ATOM 454 CZ TYR A 150 -9.165 -5.788 -3.496 1.00 62.50 C ATOM 455 OH TYR A 150 -8.102 -5.568 -4.313 1.00 42.10 O ATOM 0 H TYR A 150 -15.125 -5.842 -0.250 1.00 41.21 H new ATOM 0 HA TYR A 150 -13.399 -4.112 -1.381 1.00 63.24 H new ATOM 0 HB2 TYR A 150 -12.703 -6.121 -0.186 1.00 21.51 H new ATOM 0 HB3 TYR A 150 -13.323 -7.146 -1.465 1.00 21.51 H new ATOM 0 HD1 TYR A 150 -10.963 -4.243 -1.032 1.00 1.25 H new ATOM 0 HD2 TYR A 150 -11.695 -8.013 -2.958 1.00 51.01 H new ATOM 0 HE1 TYR A 150 -8.884 -3.967 -2.367 1.00 44.11 H new ATOM 0 HE2 TYR A 150 -9.622 -7.748 -4.309 1.00 53.43 H new ATOM 0 HH TYR A 150 -7.519 -6.356 -4.311 1.00 42.10 H new ATOM 465 N ARG A 151 -14.586 -6.172 -3.738 1.00 71.35 N ATOM 466 CA ARG A 151 -14.732 -6.359 -5.175 1.00 71.31 C ATOM 467 C ARG A 151 -15.467 -5.207 -5.829 1.00 51.34 C ATOM 468 O ARG A 151 -15.065 -4.792 -6.912 1.00 5.01 O ATOM 469 CB ARG A 151 -15.463 -7.674 -5.459 1.00 3.34 C ATOM 470 CG ARG A 151 -14.477 -8.837 -5.571 1.00 12.22 C ATOM 471 CD ARG A 151 -15.261 -10.115 -5.865 1.00 3.11 C ATOM 472 NE ARG A 151 -14.523 -11.093 -6.680 1.00 70.51 N ATOM 473 CZ ARG A 151 -14.231 -12.342 -6.305 1.00 51.14 C ATOM 474 NH1 ARG A 151 -14.344 -12.720 -5.042 1.00 5.40 N ATOM 475 NH2 ARG A 151 -13.852 -13.233 -7.221 1.00 74.11 N ATOM 0 H ARG A 151 -14.927 -6.961 -3.188 1.00 71.35 H new ATOM 0 HA ARG A 151 -13.731 -6.394 -5.604 1.00 71.31 H new ATOM 0 HB2 ARG A 151 -16.179 -7.875 -4.662 1.00 3.34 H new ATOM 0 HB3 ARG A 151 -16.032 -7.585 -6.384 1.00 3.34 H new ATOM 0 HG2 ARG A 151 -13.755 -8.645 -6.365 1.00 12.22 H new ATOM 0 HG3 ARG A 151 -13.912 -8.944 -4.645 1.00 12.22 H new ATOM 0 HD2 ARG A 151 -15.543 -10.582 -4.921 1.00 3.11 H new ATOM 0 HD3 ARG A 151 -16.186 -9.852 -6.379 1.00 3.11 H new ATOM 0 HE ARG A 151 -14.210 -10.794 -7.604 1.00 70.51 H new ATOM 0 HH11 ARG A 151 -14.658 -12.054 -4.336 1.00 5.40 H new ATOM 0 HH12 ARG A 151 -14.117 -13.678 -4.774 1.00 5.40 H new ATOM 0 HH21 ARG A 151 -13.786 -12.960 -8.202 1.00 74.11 H new ATOM 0 HH22 ARG A 151 -13.628 -14.188 -6.941 1.00 74.11 H new ATOM 489 N GLU A 152 -16.555 -4.703 -5.254 1.00 3.20 N ATOM 490 CA GLU A 152 -17.225 -3.566 -5.861 1.00 23.45 C ATOM 491 C GLU A 152 -16.299 -2.361 -5.799 1.00 1.04 C ATOM 492 O GLU A 152 -16.078 -1.736 -6.829 1.00 41.13 O ATOM 493 CB GLU A 152 -18.601 -3.274 -5.245 1.00 34.12 C ATOM 494 CG GLU A 152 -19.633 -4.322 -5.725 1.00 63.31 C ATOM 495 CD GLU A 152 -21.058 -3.778 -5.913 1.00 3.14 C ATOM 496 OE1 GLU A 152 -21.802 -3.604 -4.914 1.00 42.05 O ATOM 497 OE2 GLU A 152 -21.490 -3.583 -7.074 1.00 3.21 O ATOM 0 H GLU A 152 -16.979 -5.053 -4.395 1.00 3.20 H new ATOM 0 HA GLU A 152 -17.436 -3.808 -6.903 1.00 23.45 H new ATOM 0 HB2 GLU A 152 -18.532 -3.292 -4.157 1.00 34.12 H new ATOM 0 HB3 GLU A 152 -18.929 -2.274 -5.527 1.00 34.12 H new ATOM 0 HG2 GLU A 152 -19.291 -4.742 -6.671 1.00 63.31 H new ATOM 0 HG3 GLU A 152 -19.663 -5.140 -5.005 1.00 63.31 H new ATOM 504 N ASN A 153 -15.754 -2.026 -4.629 1.00 61.54 N ATOM 505 CA ASN A 153 -15.057 -0.760 -4.383 1.00 52.04 C ATOM 506 C ASN A 153 -13.609 -0.736 -4.865 1.00 41.02 C ATOM 507 O ASN A 153 -12.974 0.314 -4.815 1.00 42.03 O ATOM 508 CB ASN A 153 -15.135 -0.393 -2.897 1.00 24.51 C ATOM 509 CG ASN A 153 -16.547 0.040 -2.569 1.00 70.42 C ATOM 510 OD1 ASN A 153 -16.899 1.209 -2.719 1.00 64.12 O ATOM 511 ND2 ASN A 153 -17.412 -0.879 -2.186 1.00 72.43 N ATOM 0 H ASN A 153 -15.784 -2.635 -3.812 1.00 61.54 H new ATOM 0 HA ASN A 153 -15.577 -0.011 -4.981 1.00 52.04 H new ATOM 0 HB2 ASN A 153 -14.851 -1.248 -2.283 1.00 24.51 H new ATOM 0 HB3 ASN A 153 -14.433 0.409 -2.670 1.00 24.51 H new ATOM 0 HD21 ASN A 153 -18.384 -0.623 -2.011 1.00 72.43 H new ATOM 0 HD22 ASN A 153 -17.109 -1.845 -2.065 1.00 72.43 H new ATOM 518 N MET A 154 -13.084 -1.854 -5.360 1.00 13.03 N ATOM 519 CA MET A 154 -11.668 -2.116 -5.593 1.00 30.22 C ATOM 520 C MET A 154 -10.936 -1.121 -6.495 1.00 64.32 C ATOM 521 O MET A 154 -9.705 -1.090 -6.477 1.00 42.00 O ATOM 522 CB MET A 154 -11.518 -3.540 -6.136 1.00 74.22 C ATOM 523 CG MET A 154 -12.140 -3.727 -7.531 1.00 73.30 C ATOM 524 SD MET A 154 -12.269 -5.464 -8.096 1.00 32.11 S ATOM 525 CE MET A 154 -10.938 -6.313 -7.193 1.00 42.01 C ATOM 0 H MET A 154 -13.670 -2.646 -5.624 1.00 13.03 H new ATOM 0 HA MET A 154 -11.182 -1.993 -4.625 1.00 30.22 H new ATOM 0 HB2 MET A 154 -10.459 -3.795 -6.181 1.00 74.22 H new ATOM 0 HB3 MET A 154 -11.985 -4.238 -5.441 1.00 74.22 H new ATOM 0 HG2 MET A 154 -13.137 -3.287 -7.529 1.00 73.30 H new ATOM 0 HG3 MET A 154 -11.546 -3.169 -8.255 1.00 73.30 H new ATOM 0 HE1 MET A 154 -10.826 -7.326 -7.579 1.00 42.01 H new ATOM 0 HE2 MET A 154 -10.003 -5.768 -7.326 1.00 42.01 H new ATOM 0 HE3 MET A 154 -11.186 -6.354 -6.132 1.00 42.01 H new ATOM 535 N TYR A 155 -11.661 -0.339 -7.293 1.00 30.55 N ATOM 536 CA TYR A 155 -11.110 0.703 -8.147 1.00 74.44 C ATOM 537 C TYR A 155 -10.676 1.933 -7.337 1.00 54.00 C ATOM 538 O TYR A 155 -9.820 2.680 -7.798 1.00 1.24 O ATOM 539 CB TYR A 155 -12.159 1.090 -9.202 1.00 42.34 C ATOM 540 CG TYR A 155 -13.450 1.627 -8.606 1.00 21.11 C ATOM 541 CD1 TYR A 155 -14.434 0.738 -8.136 1.00 70.44 C ATOM 542 CD2 TYR A 155 -13.628 3.012 -8.434 1.00 22.24 C ATOM 543 CE1 TYR A 155 -15.563 1.224 -7.456 1.00 44.02 C ATOM 544 CE2 TYR A 155 -14.775 3.508 -7.789 1.00 30.15 C ATOM 545 CZ TYR A 155 -15.739 2.614 -7.275 1.00 54.42 C ATOM 546 OH TYR A 155 -16.811 3.112 -6.597 1.00 51.12 O ATOM 0 H TYR A 155 -12.676 -0.418 -7.363 1.00 30.55 H new ATOM 0 HA TYR A 155 -10.217 0.316 -8.638 1.00 74.44 H new ATOM 0 HB2 TYR A 155 -11.734 1.843 -9.866 1.00 42.34 H new ATOM 0 HB3 TYR A 155 -12.386 0.217 -9.814 1.00 42.34 H new ATOM 0 HD1 TYR A 155 -14.321 -0.324 -8.299 1.00 70.44 H new ATOM 0 HD2 TYR A 155 -12.879 3.699 -8.800 1.00 22.24 H new ATOM 0 HE1 TYR A 155 -16.298 0.533 -7.071 1.00 44.02 H new ATOM 0 HE2 TYR A 155 -14.918 4.574 -7.687 1.00 30.15 H new ATOM 0 HH TYR A 155 -16.759 4.090 -6.575 1.00 51.12 H new ATOM 556 N ARG A 156 -11.244 2.164 -6.143 1.00 5.25 N ATOM 557 CA ARG A 156 -10.866 3.271 -5.270 1.00 72.22 C ATOM 558 C ARG A 156 -9.417 3.154 -4.846 1.00 25.31 C ATOM 559 O ARG A 156 -8.707 4.159 -4.803 1.00 30.32 O ATOM 560 CB ARG A 156 -11.767 3.294 -4.021 1.00 10.11 C ATOM 561 CG ARG A 156 -13.204 3.734 -4.351 1.00 74.44 C ATOM 562 CD ARG A 156 -13.602 4.991 -3.575 1.00 4.12 C ATOM 563 NE ARG A 156 -14.102 4.699 -2.216 1.00 60.31 N ATOM 564 CZ ARG A 156 -14.957 5.489 -1.557 1.00 72.22 C ATOM 565 NH1 ARG A 156 -15.029 6.792 -1.820 1.00 53.32 N ATOM 566 NH2 ARG A 156 -15.746 4.972 -0.618 1.00 63.30 N ATOM 0 H ARG A 156 -11.985 1.578 -5.759 1.00 5.25 H new ATOM 0 HA ARG A 156 -10.994 4.199 -5.827 1.00 72.22 H new ATOM 0 HB2 ARG A 156 -11.787 2.302 -3.571 1.00 10.11 H new ATOM 0 HB3 ARG A 156 -11.342 3.972 -3.281 1.00 10.11 H new ATOM 0 HG2 ARG A 156 -13.290 3.924 -5.421 1.00 74.44 H new ATOM 0 HG3 ARG A 156 -13.896 2.926 -4.114 1.00 74.44 H new ATOM 0 HD2 ARG A 156 -12.740 5.655 -3.504 1.00 4.12 H new ATOM 0 HD3 ARG A 156 -14.371 5.526 -4.132 1.00 4.12 H new ATOM 0 HE ARG A 156 -13.778 3.849 -1.755 1.00 60.31 H new ATOM 0 HH11 ARG A 156 -14.427 7.202 -2.533 1.00 53.32 H new ATOM 0 HH12 ARG A 156 -15.687 7.380 -1.308 1.00 53.32 H new ATOM 0 HH21 ARG A 156 -15.698 3.976 -0.403 1.00 63.30 H new ATOM 0 HH22 ARG A 156 -16.399 5.572 -0.114 1.00 63.30 H new ATOM 580 N TYR A 157 -8.993 1.966 -4.428 1.00 30.15 N ATOM 581 CA TYR A 157 -7.699 1.821 -3.785 1.00 45.03 C ATOM 582 C TYR A 157 -6.598 2.008 -4.831 1.00 13.03 C ATOM 583 O TYR A 157 -6.761 1.567 -5.973 1.00 73.51 O ATOM 584 CB TYR A 157 -7.596 0.465 -3.089 1.00 34.45 C ATOM 585 CG TYR A 157 -8.862 0.087 -2.346 1.00 25.33 C ATOM 586 CD1 TYR A 157 -9.398 0.932 -1.355 1.00 5.34 C ATOM 587 CD2 TYR A 157 -9.550 -1.075 -2.719 1.00 22.52 C ATOM 588 CE1 TYR A 157 -10.629 0.631 -0.743 1.00 25.15 C ATOM 589 CE2 TYR A 157 -10.771 -1.392 -2.107 1.00 72.33 C ATOM 590 CZ TYR A 157 -11.342 -0.527 -1.145 1.00 71.41 C ATOM 591 OH TYR A 157 -12.540 -0.866 -0.599 1.00 71.52 O ATOM 0 H TYR A 157 -9.523 1.100 -4.523 1.00 30.15 H new ATOM 0 HA TYR A 157 -7.580 2.584 -3.016 1.00 45.03 H new ATOM 0 HB2 TYR A 157 -7.373 -0.302 -3.830 1.00 34.45 H new ATOM 0 HB3 TYR A 157 -6.761 0.484 -2.388 1.00 34.45 H new ATOM 0 HD1 TYR A 157 -8.859 1.820 -1.062 1.00 5.34 H new ATOM 0 HD2 TYR A 157 -9.140 -1.726 -3.477 1.00 22.52 H new ATOM 0 HE1 TYR A 157 -11.027 1.276 0.026 1.00 25.15 H new ATOM 0 HE2 TYR A 157 -11.281 -2.306 -2.373 1.00 72.33 H new ATOM 0 HH TYR A 157 -13.147 -0.097 -0.638 1.00 71.52 H new ATOM 601 N PRO A 158 -5.468 2.632 -4.470 1.00 11.14 N ATOM 602 CA PRO A 158 -4.430 2.944 -5.429 1.00 31.11 C ATOM 603 C PRO A 158 -3.889 1.688 -6.096 1.00 22.42 C ATOM 604 O PRO A 158 -3.608 0.681 -5.437 1.00 62.11 O ATOM 605 CB PRO A 158 -3.355 3.705 -4.665 1.00 42.44 C ATOM 606 CG PRO A 158 -3.670 3.495 -3.185 1.00 41.13 C ATOM 607 CD PRO A 158 -5.159 3.183 -3.163 1.00 62.31 C ATOM 0 HA PRO A 158 -4.817 3.553 -6.246 1.00 31.11 H new ATOM 0 HB2 PRO A 158 -2.361 3.330 -4.910 1.00 42.44 H new ATOM 0 HB3 PRO A 158 -3.369 4.764 -4.921 1.00 42.44 H new ATOM 0 HG2 PRO A 158 -3.085 2.677 -2.765 1.00 41.13 H new ATOM 0 HG3 PRO A 158 -3.440 4.385 -2.598 1.00 41.13 H new ATOM 0 HD2 PRO A 158 -5.398 2.471 -2.373 1.00 62.31 H new ATOM 0 HD3 PRO A 158 -5.744 4.082 -2.970 1.00 62.31 H new ATOM 615 N ASN A 159 -3.685 1.754 -7.408 1.00 32.11 N ATOM 616 CA ASN A 159 -3.142 0.652 -8.204 1.00 22.02 C ATOM 617 C ASN A 159 -1.605 0.591 -8.089 1.00 13.15 C ATOM 618 O ASN A 159 -0.931 0.121 -9.000 1.00 62.34 O ATOM 619 CB ASN A 159 -3.655 0.794 -9.653 1.00 61.30 C ATOM 620 CG ASN A 159 -3.698 -0.506 -10.449 1.00 50.10 C ATOM 621 OD1 ASN A 159 -4.766 -1.064 -10.679 1.00 54.10 O ATOM 622 ND2 ASN A 159 -2.575 -1.010 -10.915 1.00 22.05 N ATOM 0 H ASN A 159 -3.895 2.586 -7.959 1.00 32.11 H new ATOM 0 HA ASN A 159 -3.491 -0.307 -7.822 1.00 22.02 H new ATOM 0 HB2 ASN A 159 -4.658 1.221 -9.628 1.00 61.30 H new ATOM 0 HB3 ASN A 159 -3.019 1.505 -10.180 1.00 61.30 H new ATOM 0 HD21 ASN A 159 -2.591 -1.866 -11.469 1.00 22.05 H new ATOM 0 HD22 ASN A 159 -1.688 -0.544 -10.722 1.00 22.05 H new ATOM 629 N GLN A 160 -1.022 1.140 -7.014 1.00 44.42 N ATOM 630 CA GLN A 160 0.412 1.347 -6.813 1.00 11.34 C ATOM 631 C GLN A 160 0.677 1.744 -5.359 1.00 1.22 C ATOM 632 O GLN A 160 -0.285 1.888 -4.596 1.00 45.32 O ATOM 633 CB GLN A 160 0.882 2.452 -7.758 1.00 11.54 C ATOM 634 CG GLN A 160 0.303 3.858 -7.518 1.00 42.52 C ATOM 635 CD GLN A 160 0.431 4.706 -8.776 1.00 3.22 C ATOM 636 OE1 GLN A 160 -0.515 5.362 -9.199 1.00 63.03 O ATOM 637 NE2 GLN A 160 1.534 4.593 -9.488 1.00 4.23 N ATOM 0 H GLN A 160 -1.572 1.468 -6.220 1.00 44.42 H new ATOM 0 HA GLN A 160 0.958 0.428 -7.025 1.00 11.34 H new ATOM 0 HB2 GLN A 160 1.968 2.516 -7.694 1.00 11.54 H new ATOM 0 HB3 GLN A 160 0.640 2.154 -8.778 1.00 11.54 H new ATOM 0 HG2 GLN A 160 -0.745 3.782 -7.228 1.00 42.52 H new ATOM 0 HG3 GLN A 160 0.828 4.339 -6.693 1.00 42.52 H new ATOM 0 HE21 GLN A 160 2.318 4.046 -9.131 1.00 4.23 H new ATOM 0 HE22 GLN A 160 1.604 5.052 -10.396 1.00 4.23 H new ATOM 646 N VAL A 161 1.931 1.935 -4.935 1.00 50.24 N ATOM 647 CA VAL A 161 2.257 2.164 -3.542 1.00 21.43 C ATOM 648 C VAL A 161 3.520 3.011 -3.370 1.00 44.22 C ATOM 649 O VAL A 161 4.400 3.058 -4.231 1.00 61.42 O ATOM 650 CB VAL A 161 2.318 0.776 -2.884 1.00 4.14 C ATOM 651 CG1 VAL A 161 3.563 -0.065 -3.189 1.00 31.43 C ATOM 652 CG2 VAL A 161 2.012 0.841 -1.408 1.00 21.44 C ATOM 0 H VAL A 161 2.741 1.933 -5.555 1.00 50.24 H new ATOM 0 HA VAL A 161 1.498 2.766 -3.043 1.00 21.43 H new ATOM 0 HB VAL A 161 1.520 0.219 -3.376 1.00 4.14 H new ATOM 0 HG11 VAL A 161 3.492 -1.021 -2.670 1.00 31.43 H new ATOM 0 HG12 VAL A 161 3.630 -0.239 -4.263 1.00 31.43 H new ATOM 0 HG13 VAL A 161 4.453 0.466 -2.851 1.00 31.43 H new ATOM 0 HG21 VAL A 161 2.066 -0.160 -0.981 1.00 21.44 H new ATOM 0 HG22 VAL A 161 2.739 1.486 -0.914 1.00 21.44 H new ATOM 0 HG23 VAL A 161 1.010 1.245 -1.262 1.00 21.44 H new ATOM 662 N TYR A 162 3.587 3.683 -2.228 1.00 2.32 N ATOM 663 CA TYR A 162 4.689 4.572 -1.852 1.00 42.23 C ATOM 664 C TYR A 162 5.599 3.876 -0.852 1.00 2.52 C ATOM 665 O TYR A 162 5.226 2.833 -0.313 1.00 63.31 O ATOM 666 CB TYR A 162 4.152 5.863 -1.235 1.00 4.15 C ATOM 667 CG TYR A 162 3.117 6.581 -2.069 1.00 60.13 C ATOM 668 CD1 TYR A 162 3.498 7.343 -3.184 1.00 43.23 C ATOM 669 CD2 TYR A 162 1.766 6.499 -1.709 1.00 52.12 C ATOM 670 CE1 TYR A 162 2.533 8.070 -3.902 1.00 34.01 C ATOM 671 CE2 TYR A 162 0.796 7.250 -2.389 1.00 41.51 C ATOM 672 CZ TYR A 162 1.186 8.074 -3.466 1.00 31.01 C ATOM 673 OH TYR A 162 0.265 8.892 -4.040 1.00 64.23 O ATOM 0 H TYR A 162 2.859 3.626 -1.516 1.00 2.32 H new ATOM 0 HA TYR A 162 5.254 4.818 -2.751 1.00 42.23 H new ATOM 0 HB2 TYR A 162 3.717 5.631 -0.263 1.00 4.15 H new ATOM 0 HB3 TYR A 162 4.988 6.539 -1.057 1.00 4.15 H new ATOM 0 HD1 TYR A 162 4.533 7.371 -3.491 1.00 43.23 H new ATOM 0 HD2 TYR A 162 1.468 5.850 -0.899 1.00 52.12 H new ATOM 0 HE1 TYR A 162 2.818 8.624 -4.784 1.00 34.01 H new ATOM 0 HE2 TYR A 162 -0.241 7.198 -2.091 1.00 41.51 H new ATOM 0 HH TYR A 162 -0.606 8.756 -3.611 1.00 64.23 H new ATOM 683 N TYR A 163 6.771 4.449 -0.570 1.00 0.42 N ATOM 684 CA TYR A 163 7.765 3.879 0.315 1.00 0.23 C ATOM 685 C TYR A 163 8.851 4.914 0.603 1.00 42.41 C ATOM 686 O TYR A 163 8.882 6.008 0.030 1.00 20.34 O ATOM 687 CB TYR A 163 8.339 2.568 -0.262 1.00 62.43 C ATOM 688 CG TYR A 163 8.917 2.582 -1.671 1.00 73.33 C ATOM 689 CD1 TYR A 163 8.078 2.556 -2.807 1.00 34.24 C ATOM 690 CD2 TYR A 163 10.309 2.496 -1.854 1.00 52.51 C ATOM 691 CE1 TYR A 163 8.620 2.462 -4.096 1.00 44.11 C ATOM 692 CE2 TYR A 163 10.848 2.401 -3.149 1.00 74.12 C ATOM 693 CZ TYR A 163 10.012 2.387 -4.283 1.00 64.14 C ATOM 694 OH TYR A 163 10.536 2.242 -5.534 1.00 4.14 O ATOM 0 H TYR A 163 7.053 5.346 -0.966 1.00 0.42 H new ATOM 0 HA TYR A 163 7.294 3.616 1.262 1.00 0.23 H new ATOM 0 HB2 TYR A 163 9.122 2.224 0.414 1.00 62.43 H new ATOM 0 HB3 TYR A 163 7.546 1.820 -0.237 1.00 62.43 H new ATOM 0 HD1 TYR A 163 7.007 2.609 -2.681 1.00 34.24 H new ATOM 0 HD2 TYR A 163 10.966 2.503 -0.997 1.00 52.51 H new ATOM 0 HE1 TYR A 163 7.963 2.447 -4.953 1.00 44.11 H new ATOM 0 HE2 TYR A 163 11.919 2.338 -3.276 1.00 74.12 H new ATOM 0 HH TYR A 163 11.461 1.924 -5.467 1.00 4.14 H new ATOM 704 N ARG A 164 9.732 4.562 1.531 1.00 11.43 N ATOM 705 CA ARG A 164 10.905 5.306 1.967 1.00 11.52 C ATOM 706 C ARG A 164 12.072 4.324 1.841 1.00 55.20 C ATOM 707 O ARG A 164 11.842 3.117 1.924 1.00 20.21 O ATOM 708 CB ARG A 164 10.687 5.749 3.423 1.00 73.21 C ATOM 709 CG ARG A 164 10.936 7.229 3.717 1.00 14.31 C ATOM 710 CD ARG A 164 10.569 7.533 5.176 1.00 44.24 C ATOM 711 NE ARG A 164 10.493 8.968 5.454 1.00 62.40 N ATOM 712 CZ ARG A 164 9.840 9.537 6.471 1.00 14.53 C ATOM 713 NH1 ARG A 164 9.002 8.834 7.241 1.00 51.54 N ATOM 714 NH2 ARG A 164 10.025 10.832 6.694 1.00 14.53 N ATOM 0 H ARG A 164 9.637 3.681 2.037 1.00 11.43 H new ATOM 0 HA ARG A 164 11.097 6.204 1.380 1.00 11.52 H new ATOM 0 HB2 ARG A 164 9.662 5.510 3.705 1.00 73.21 H new ATOM 0 HB3 ARG A 164 11.340 5.157 4.064 1.00 73.21 H new ATOM 0 HG2 ARG A 164 11.982 7.475 3.536 1.00 14.31 H new ATOM 0 HG3 ARG A 164 10.342 7.849 3.045 1.00 14.31 H new ATOM 0 HD2 ARG A 164 9.609 7.071 5.408 1.00 44.24 H new ATOM 0 HD3 ARG A 164 11.309 7.079 5.834 1.00 44.24 H new ATOM 0 HE ARG A 164 10.984 9.591 4.812 1.00 62.40 H new ATOM 0 HH11 ARG A 164 8.851 7.842 7.057 1.00 51.54 H new ATOM 0 HH12 ARG A 164 8.514 9.290 8.012 1.00 51.54 H new ATOM 0 HH21 ARG A 164 10.653 11.368 6.095 1.00 14.53 H new ATOM 0 HH22 ARG A 164 9.539 11.291 7.464 1.00 14.53 H new ATOM 728 N PRO A 165 13.309 4.784 1.635 1.00 55.50 N ATOM 729 CA PRO A 165 14.368 3.914 1.179 1.00 42.13 C ATOM 730 C PRO A 165 14.810 2.964 2.291 1.00 3.21 C ATOM 731 O PRO A 165 15.255 3.434 3.341 1.00 12.41 O ATOM 732 CB PRO A 165 15.474 4.834 0.661 1.00 72.13 C ATOM 733 CG PRO A 165 15.227 6.176 1.351 1.00 44.22 C ATOM 734 CD PRO A 165 13.749 6.155 1.752 1.00 23.43 C ATOM 0 HA PRO A 165 14.049 3.250 0.375 1.00 42.13 H new ATOM 0 HB2 PRO A 165 16.461 4.441 0.904 1.00 72.13 H new ATOM 0 HB3 PRO A 165 15.429 4.934 -0.424 1.00 72.13 H new ATOM 0 HG2 PRO A 165 15.870 6.295 2.223 1.00 44.22 H new ATOM 0 HG3 PRO A 165 15.442 7.009 0.681 1.00 44.22 H new ATOM 0 HD2 PRO A 165 13.619 6.518 2.772 1.00 23.43 H new ATOM 0 HD3 PRO A 165 13.163 6.807 1.104 1.00 23.43 H new ATOM 742 N VAL A 166 14.709 1.644 2.065 1.00 22.11 N ATOM 743 CA VAL A 166 15.139 0.579 2.975 1.00 64.10 C ATOM 744 C VAL A 166 16.577 0.650 3.479 1.00 22.34 C ATOM 745 O VAL A 166 16.856 -0.075 4.437 1.00 33.31 O ATOM 746 CB VAL A 166 14.906 -0.820 2.349 1.00 50.40 C ATOM 747 CG1 VAL A 166 13.595 -1.377 2.802 1.00 12.22 C ATOM 748 CG2 VAL A 166 15.074 -0.897 0.838 1.00 71.04 C ATOM 0 H VAL A 166 14.306 1.277 1.202 1.00 22.11 H new ATOM 0 HA VAL A 166 14.510 0.742 3.850 1.00 64.10 H new ATOM 0 HB VAL A 166 15.714 -1.448 2.724 1.00 50.40 H new ATOM 0 HG11 VAL A 166 13.443 -2.360 2.355 1.00 12.22 H new ATOM 0 HG12 VAL A 166 13.594 -1.468 3.888 1.00 12.22 H new ATOM 0 HG13 VAL A 166 12.790 -0.710 2.493 1.00 12.22 H new ATOM 0 HG21 VAL A 166 14.889 -1.918 0.503 1.00 71.04 H new ATOM 0 HG22 VAL A 166 14.364 -0.223 0.358 1.00 71.04 H new ATOM 0 HG23 VAL A 166 16.089 -0.605 0.569 1.00 71.04 H new ATOM 758 N SER A 167 17.436 1.519 2.937 1.00 1.12 N ATOM 759 CA SER A 167 18.767 1.808 3.463 1.00 52.43 C ATOM 760 C SER A 167 18.759 1.884 4.985 1.00 4.25 C ATOM 761 O SER A 167 19.529 1.213 5.675 1.00 0.33 O ATOM 762 CB SER A 167 19.309 3.078 2.794 1.00 63.31 C ATOM 763 OG SER A 167 18.322 4.093 2.724 1.00 42.44 O ATOM 0 H SER A 167 17.215 2.054 2.097 1.00 1.12 H new ATOM 0 HA SER A 167 19.445 0.990 3.219 1.00 52.43 H new ATOM 0 HB2 SER A 167 20.170 3.445 3.353 1.00 63.31 H new ATOM 0 HB3 SER A 167 19.659 2.840 1.789 1.00 63.31 H new ATOM 0 HG SER A 167 18.700 4.888 2.294 1.00 42.44 H new ATOM 769 N GLN A 168 17.812 2.653 5.506 1.00 15.12 N ATOM 770 CA GLN A 168 17.714 2.986 6.914 1.00 14.22 C ATOM 771 C GLN A 168 16.800 2.043 7.714 1.00 42.53 C ATOM 772 O GLN A 168 16.520 2.287 8.893 1.00 43.33 O ATOM 773 CB GLN A 168 17.193 4.434 6.974 1.00 75.03 C ATOM 774 CG GLN A 168 15.713 4.561 6.619 1.00 31.34 C ATOM 775 CD GLN A 168 15.323 5.967 6.179 1.00 53.53 C ATOM 776 OE1 GLN A 168 15.214 6.899 6.972 1.00 23.23 O ATOM 777 NE2 GLN A 168 15.126 6.148 4.881 1.00 42.41 N ATOM 0 H GLN A 168 17.072 3.072 4.942 1.00 15.12 H new ATOM 0 HA GLN A 168 18.693 2.876 7.380 1.00 14.22 H new ATOM 0 HB2 GLN A 168 17.354 4.829 7.977 1.00 75.03 H new ATOM 0 HB3 GLN A 168 17.777 5.051 6.291 1.00 75.03 H new ATOM 0 HG2 GLN A 168 15.475 3.858 5.821 1.00 31.34 H new ATOM 0 HG3 GLN A 168 15.112 4.277 7.483 1.00 31.34 H new ATOM 0 HE21 GLN A 168 15.221 5.363 4.236 1.00 42.41 H new ATOM 0 HE22 GLN A 168 14.880 7.072 4.527 1.00 42.41 H new ATOM 786 N TYR A 169 16.230 1.027 7.064 1.00 55.41 N ATOM 787 CA TYR A 169 15.231 0.149 7.656 1.00 63.03 C ATOM 788 C TYR A 169 15.790 -1.255 7.703 1.00 1.41 C ATOM 789 O TYR A 169 16.013 -1.772 8.795 1.00 33.42 O ATOM 790 CB TYR A 169 13.909 0.162 6.883 1.00 53.21 C ATOM 791 CG TYR A 169 13.168 1.473 6.909 1.00 74.22 C ATOM 792 CD1 TYR A 169 13.474 2.449 5.952 1.00 12.35 C ATOM 793 CD2 TYR A 169 12.138 1.693 7.841 1.00 75.14 C ATOM 794 CE1 TYR A 169 12.694 3.608 5.864 1.00 71.20 C ATOM 795 CE2 TYR A 169 11.368 2.867 7.785 1.00 73.11 C ATOM 796 CZ TYR A 169 11.631 3.813 6.769 1.00 23.22 C ATOM 797 OH TYR A 169 10.894 4.937 6.639 1.00 55.41 O ATOM 0 H TYR A 169 16.456 0.791 6.098 1.00 55.41 H new ATOM 0 HA TYR A 169 15.011 0.511 8.660 1.00 63.03 H new ATOM 0 HB2 TYR A 169 14.110 -0.104 5.845 1.00 53.21 H new ATOM 0 HB3 TYR A 169 13.260 -0.613 7.291 1.00 53.21 H new ATOM 0 HD1 TYR A 169 14.310 2.308 5.283 1.00 12.35 H new ATOM 0 HD2 TYR A 169 11.938 0.955 8.604 1.00 75.14 H new ATOM 0 HE1 TYR A 169 12.906 4.345 5.104 1.00 71.20 H new ATOM 0 HE2 TYR A 169 10.586 3.044 8.509 1.00 73.11 H new ATOM 0 HH TYR A 169 10.101 4.876 7.211 1.00 55.41 H new ATOM 807 N SER A 170 15.951 -1.875 6.527 1.00 42.53 N ATOM 808 CA SER A 170 16.326 -3.269 6.353 1.00 25.24 C ATOM 809 C SER A 170 15.549 -4.188 7.315 1.00 41.22 C ATOM 810 O SER A 170 16.055 -5.211 7.771 1.00 30.05 O ATOM 811 CB SER A 170 17.837 -3.317 6.537 1.00 51.33 C ATOM 812 OG SER A 170 18.474 -4.374 5.843 1.00 2.52 O ATOM 0 H SER A 170 15.816 -1.392 5.639 1.00 42.53 H new ATOM 0 HA SER A 170 16.063 -3.647 5.365 1.00 25.24 H new ATOM 0 HB2 SER A 170 18.262 -2.370 6.204 1.00 51.33 H new ATOM 0 HB3 SER A 170 18.059 -3.410 7.600 1.00 51.33 H new ATOM 0 HG SER A 170 19.207 -4.015 5.301 1.00 2.52 H new ATOM 818 N ASN A 171 14.312 -3.806 7.642 1.00 30.42 N ATOM 819 CA ASN A 171 13.361 -4.582 8.406 1.00 11.21 C ATOM 820 C ASN A 171 12.100 -4.470 7.604 1.00 41.53 C ATOM 821 O ASN A 171 11.673 -3.381 7.207 1.00 30.12 O ATOM 822 CB ASN A 171 13.084 -4.024 9.804 1.00 71.21 C ATOM 823 CG ASN A 171 13.411 -4.983 10.934 1.00 71.24 C ATOM 824 OD1 ASN A 171 14.502 -5.538 11.000 1.00 11.31 O ATOM 825 ND2 ASN A 171 12.475 -5.228 11.830 1.00 24.14 N ATOM 0 H ASN A 171 13.938 -2.899 7.362 1.00 30.42 H new ATOM 0 HA ASN A 171 13.739 -5.593 8.561 1.00 11.21 H new ATOM 0 HB2 ASN A 171 13.663 -3.110 9.939 1.00 71.21 H new ATOM 0 HB3 ASN A 171 12.032 -3.748 9.870 1.00 71.21 H new ATOM 0 HD21 ASN A 171 12.655 -5.886 12.589 1.00 24.14 H new ATOM 0 HD22 ASN A 171 11.571 -4.760 11.764 1.00 24.14 H new ATOM 832 N GLN A 172 11.485 -5.615 7.470 1.00 34.23 N ATOM 833 CA GLN A 172 10.327 -5.839 6.626 1.00 3.35 C ATOM 834 C GLN A 172 9.043 -5.445 7.345 1.00 24.32 C ATOM 835 O GLN A 172 7.972 -5.460 6.753 1.00 43.20 O ATOM 836 CB GLN A 172 10.297 -7.304 6.157 1.00 5.34 C ATOM 837 CG GLN A 172 9.286 -7.480 5.016 1.00 31.12 C ATOM 838 CD GLN A 172 9.297 -8.844 4.356 1.00 30.34 C ATOM 839 OE1 GLN A 172 10.232 -9.246 3.664 1.00 45.23 O ATOM 840 NE2 GLN A 172 8.196 -9.541 4.543 1.00 41.42 N ATOM 0 H GLN A 172 11.785 -6.456 7.964 1.00 34.23 H new ATOM 0 HA GLN A 172 10.402 -5.204 5.743 1.00 3.35 H new ATOM 0 HB2 GLN A 172 11.289 -7.606 5.822 1.00 5.34 H new ATOM 0 HB3 GLN A 172 10.031 -7.954 6.991 1.00 5.34 H new ATOM 0 HG2 GLN A 172 8.286 -7.289 5.404 1.00 31.12 H new ATOM 0 HG3 GLN A 172 9.483 -6.724 4.256 1.00 31.12 H new ATOM 0 HE21 GLN A 172 7.448 -9.166 5.126 1.00 41.42 H new ATOM 0 HE22 GLN A 172 8.091 -10.456 4.105 1.00 41.42 H new ATOM 849 N ASN A 173 9.105 -5.076 8.620 1.00 2.21 N ATOM 850 CA ASN A 173 7.912 -4.637 9.319 1.00 11.15 C ATOM 851 C ASN A 173 8.014 -3.139 9.505 1.00 52.40 C ATOM 852 O ASN A 173 7.108 -2.425 9.098 1.00 41.20 O ATOM 853 CB ASN A 173 7.709 -5.460 10.598 1.00 5.34 C ATOM 854 CG ASN A 173 6.750 -6.645 10.416 1.00 53.20 C ATOM 855 OD1 ASN A 173 6.279 -7.191 11.409 1.00 30.44 O ATOM 856 ND2 ASN A 173 6.473 -7.082 9.190 1.00 74.10 N ATOM 0 H ASN A 173 9.957 -5.073 9.180 1.00 2.21 H new ATOM 0 HA ASN A 173 7.001 -4.819 8.748 1.00 11.15 H new ATOM 0 HB2 ASN A 173 8.675 -5.833 10.938 1.00 5.34 H new ATOM 0 HB3 ASN A 173 7.325 -4.809 11.383 1.00 5.34 H new ATOM 0 HD21 ASN A 173 5.858 -7.886 9.062 1.00 74.10 H new ATOM 0 HD22 ASN A 173 6.875 -6.613 8.378 1.00 74.10 H new ATOM 863 N ASN A 174 9.161 -2.646 9.970 1.00 21.41 N ATOM 864 CA ASN A 174 9.386 -1.217 10.199 1.00 31.23 C ATOM 865 C ASN A 174 9.034 -0.392 8.959 1.00 64.21 C ATOM 866 O ASN A 174 8.204 0.513 9.014 1.00 34.04 O ATOM 867 CB ASN A 174 10.862 -0.961 10.545 1.00 54.40 C ATOM 868 CG ASN A 174 11.257 -1.289 11.974 1.00 13.51 C ATOM 869 OD1 ASN A 174 10.460 -1.193 12.897 1.00 13.32 O ATOM 870 ND2 ASN A 174 12.501 -1.686 12.167 1.00 11.11 N ATOM 0 H ASN A 174 9.966 -3.229 10.200 1.00 21.41 H new ATOM 0 HA ASN A 174 8.743 -0.916 11.026 1.00 31.23 H new ATOM 0 HB2 ASN A 174 11.484 -1.548 9.869 1.00 54.40 H new ATOM 0 HB3 ASN A 174 11.087 0.088 10.355 1.00 54.40 H new ATOM 0 HD21 ASN A 174 12.821 -1.923 13.106 1.00 11.11 H new ATOM 0 HD22 ASN A 174 13.142 -1.756 11.377 1.00 11.11 H new ATOM 877 N PHE A 175 9.666 -0.722 7.825 1.00 51.10 N ATOM 878 CA PHE A 175 9.442 -0.035 6.556 1.00 1.15 C ATOM 879 C PHE A 175 7.968 -0.099 6.163 1.00 62.30 C ATOM 880 O PHE A 175 7.441 0.886 5.644 1.00 64.12 O ATOM 881 CB PHE A 175 10.365 -0.649 5.488 1.00 60.10 C ATOM 882 CG PHE A 175 9.967 -0.471 4.030 1.00 65.22 C ATOM 883 CD1 PHE A 175 8.915 -1.228 3.479 1.00 5.42 C ATOM 884 CD2 PHE A 175 10.719 0.360 3.182 1.00 54.11 C ATOM 885 CE1 PHE A 175 8.606 -1.151 2.112 1.00 22.23 C ATOM 886 CE2 PHE A 175 10.460 0.371 1.799 1.00 41.50 C ATOM 887 CZ PHE A 175 9.397 -0.369 1.261 1.00 74.20 C ATOM 0 H PHE A 175 10.349 -1.477 7.767 1.00 51.10 H new ATOM 0 HA PHE A 175 9.688 1.022 6.651 1.00 1.15 H new ATOM 0 HB2 PHE A 175 11.360 -0.225 5.619 1.00 60.10 H new ATOM 0 HB3 PHE A 175 10.445 -1.718 5.687 1.00 60.10 H new ATOM 0 HD1 PHE A 175 8.337 -1.878 4.119 1.00 5.42 H new ATOM 0 HD2 PHE A 175 11.495 0.990 3.592 1.00 54.11 H new ATOM 0 HE1 PHE A 175 7.760 -1.694 1.717 1.00 22.23 H new ATOM 0 HE2 PHE A 175 11.088 0.957 1.144 1.00 41.50 H new ATOM 0 HZ PHE A 175 9.191 -0.336 0.201 1.00 74.20 H new ATOM 897 N VAL A 176 7.315 -1.246 6.385 1.00 50.13 N ATOM 898 CA VAL A 176 5.937 -1.451 5.976 1.00 3.45 C ATOM 899 C VAL A 176 5.018 -0.572 6.826 1.00 44.32 C ATOM 900 O VAL A 176 4.163 0.110 6.266 1.00 75.41 O ATOM 901 CB VAL A 176 5.555 -2.947 5.976 1.00 74.22 C ATOM 902 CG1 VAL A 176 4.064 -3.096 5.649 1.00 50.14 C ATOM 903 CG2 VAL A 176 6.352 -3.732 4.917 1.00 72.40 C ATOM 0 H VAL A 176 7.733 -2.050 6.852 1.00 50.13 H new ATOM 0 HA VAL A 176 5.812 -1.138 4.939 1.00 3.45 H new ATOM 0 HB VAL A 176 5.783 -3.345 6.965 1.00 74.22 H new ATOM 0 HG11 VAL A 176 3.795 -4.152 5.649 1.00 50.14 H new ATOM 0 HG12 VAL A 176 3.473 -2.571 6.399 1.00 50.14 H new ATOM 0 HG13 VAL A 176 3.863 -2.671 4.666 1.00 50.14 H new ATOM 0 HG21 VAL A 176 6.058 -4.781 4.944 1.00 72.40 H new ATOM 0 HG22 VAL A 176 6.144 -3.323 3.928 1.00 72.40 H new ATOM 0 HG23 VAL A 176 7.418 -3.648 5.128 1.00 72.40 H new ATOM 913 N HIS A 177 5.195 -0.535 8.148 1.00 13.44 N ATOM 914 CA HIS A 177 4.366 0.290 9.018 1.00 33.43 C ATOM 915 C HIS A 177 4.514 1.774 8.698 1.00 12.14 C ATOM 916 O HIS A 177 3.534 2.506 8.844 1.00 11.43 O ATOM 917 CB HIS A 177 4.661 0.000 10.492 1.00 3.42 C ATOM 918 CG HIS A 177 3.946 -1.227 10.998 1.00 2.15 C ATOM 919 ND1 HIS A 177 2.750 -1.249 11.681 1.00 43.41 N ATOM 920 CD2 HIS A 177 4.348 -2.522 10.839 1.00 11.15 C ATOM 921 CE1 HIS A 177 2.447 -2.530 11.945 1.00 40.11 C ATOM 922 NE2 HIS A 177 3.401 -3.340 11.455 1.00 62.32 N ATOM 0 H HIS A 177 5.910 -1.072 8.638 1.00 13.44 H new ATOM 0 HA HIS A 177 3.325 0.026 8.829 1.00 33.43 H new ATOM 0 HB2 HIS A 177 5.735 -0.130 10.625 1.00 3.42 H new ATOM 0 HB3 HIS A 177 4.367 0.860 11.093 1.00 3.42 H new ATOM 0 HD2 HIS A 177 5.240 -2.854 10.328 1.00 11.15 H new ATOM 0 HE1 HIS A 177 1.565 -2.861 12.474 1.00 40.11 H new ATOM 0 HE2 HIS A 177 3.427 -4.358 11.521 1.00 62.32 H new ATOM 930 N ASP A 178 5.681 2.229 8.229 1.00 72.30 N ATOM 931 CA ASP A 178 5.806 3.590 7.713 1.00 20.03 C ATOM 932 C ASP A 178 5.034 3.711 6.396 1.00 13.22 C ATOM 933 O ASP A 178 4.189 4.585 6.266 1.00 54.33 O ATOM 934 CB ASP A 178 7.281 4.022 7.574 1.00 74.33 C ATOM 935 CG ASP A 178 7.497 5.542 7.408 1.00 33.12 C ATOM 936 OD1 ASP A 178 6.547 6.312 7.153 1.00 14.15 O ATOM 937 OD2 ASP A 178 8.659 5.990 7.567 1.00 43.34 O ATOM 0 H ASP A 178 6.540 1.680 8.197 1.00 72.30 H new ATOM 0 HA ASP A 178 5.365 4.280 8.432 1.00 20.03 H new ATOM 0 HB2 ASP A 178 7.828 3.685 8.455 1.00 74.33 H new ATOM 0 HB3 ASP A 178 7.715 3.511 6.714 1.00 74.33 H new ATOM 942 N CYS A 179 5.240 2.831 5.413 1.00 35.41 N ATOM 943 CA CYS A 179 4.740 3.077 4.060 1.00 14.33 C ATOM 944 C CYS A 179 3.236 2.835 3.911 1.00 51.31 C ATOM 945 O CYS A 179 2.595 3.489 3.083 1.00 35.13 O ATOM 946 CB CYS A 179 5.553 2.305 3.029 1.00 71.11 C ATOM 947 SG CYS A 179 5.498 0.520 3.065 1.00 22.23 S ATOM 0 H CYS A 179 5.744 1.951 5.527 1.00 35.41 H new ATOM 0 HA CYS A 179 4.877 4.141 3.868 1.00 14.33 H new ATOM 0 HB2 CYS A 179 5.226 2.627 2.040 1.00 71.11 H new ATOM 0 HB3 CYS A 179 6.595 2.607 3.134 1.00 71.11 H new ATOM 0 HG CYS A 179 4.290 0.118 2.801 1.00 22.23 H new ATOM 952 N VAL A 180 2.655 1.976 4.746 1.00 14.11 N ATOM 953 CA VAL A 180 1.217 1.865 4.940 1.00 21.25 C ATOM 954 C VAL A 180 0.680 3.215 5.460 1.00 1.41 C ATOM 955 O VAL A 180 -0.344 3.698 4.981 1.00 44.24 O ATOM 956 CB VAL A 180 0.955 0.645 5.865 1.00 63.13 C ATOM 957 CG1 VAL A 180 -0.399 0.697 6.561 1.00 11.13 C ATOM 958 CG2 VAL A 180 1.058 -0.694 5.103 1.00 61.24 C ATOM 0 H VAL A 180 3.188 1.322 5.320 1.00 14.11 H new ATOM 0 HA VAL A 180 0.672 1.673 4.016 1.00 21.25 H new ATOM 0 HB VAL A 180 1.737 0.702 6.622 1.00 63.13 H new ATOM 0 HG11 VAL A 180 -0.518 -0.184 7.191 1.00 11.13 H new ATOM 0 HG12 VAL A 180 -0.457 1.594 7.177 1.00 11.13 H new ATOM 0 HG13 VAL A 180 -1.192 0.718 5.813 1.00 11.13 H new ATOM 0 HG21 VAL A 180 0.867 -1.519 5.790 1.00 61.24 H new ATOM 0 HG22 VAL A 180 0.322 -0.713 4.300 1.00 61.24 H new ATOM 0 HG23 VAL A 180 2.058 -0.797 4.681 1.00 61.24 H new ATOM 968 N ASN A 181 1.392 3.874 6.381 1.00 24.24 N ATOM 969 CA ASN A 181 1.083 5.187 6.936 1.00 2.32 C ATOM 970 C ASN A 181 1.088 6.199 5.803 1.00 41.43 C ATOM 971 O ASN A 181 0.158 6.979 5.681 1.00 51.12 O ATOM 972 CB ASN A 181 2.128 5.589 8.002 1.00 12.35 C ATOM 973 CG ASN A 181 1.530 6.234 9.237 1.00 22.12 C ATOM 974 OD1 ASN A 181 0.735 7.158 9.141 1.00 72.10 O ATOM 975 ND2 ASN A 181 1.920 5.779 10.418 1.00 33.11 N ATOM 0 H ASN A 181 2.245 3.480 6.778 1.00 24.24 H new ATOM 0 HA ASN A 181 0.105 5.158 7.416 1.00 2.32 H new ATOM 0 HB2 ASN A 181 2.686 4.702 8.302 1.00 12.35 H new ATOM 0 HB3 ASN A 181 2.843 6.279 7.554 1.00 12.35 H new ATOM 0 HD21 ASN A 181 1.556 6.201 11.273 1.00 33.11 H new ATOM 0 HD22 ASN A 181 2.584 5.007 10.473 1.00 33.11 H new ATOM 982 N ILE A 182 2.126 6.192 4.961 1.00 4.22 N ATOM 983 CA ILE A 182 2.278 7.136 3.855 1.00 31.34 C ATOM 984 C ILE A 182 1.151 6.972 2.851 1.00 22.34 C ATOM 985 O ILE A 182 0.573 7.973 2.433 1.00 61.32 O ATOM 986 CB ILE A 182 3.655 6.976 3.173 1.00 71.22 C ATOM 987 CG1 ILE A 182 4.808 7.120 4.178 1.00 73.04 C ATOM 988 CG2 ILE A 182 3.863 7.985 2.026 1.00 35.02 C ATOM 989 CD1 ILE A 182 4.697 8.334 5.107 1.00 44.23 C ATOM 0 H ILE A 182 2.892 5.522 5.031 1.00 4.22 H new ATOM 0 HA ILE A 182 2.225 8.145 4.263 1.00 31.34 H new ATOM 0 HB ILE A 182 3.662 5.969 2.757 1.00 71.22 H new ATOM 0 HG12 ILE A 182 4.857 6.217 4.786 1.00 73.04 H new ATOM 0 HG13 ILE A 182 5.746 7.185 3.627 1.00 73.04 H new ATOM 0 HG21 ILE A 182 4.845 7.831 1.580 1.00 35.02 H new ATOM 0 HG22 ILE A 182 3.093 7.838 1.268 1.00 35.02 H new ATOM 0 HG23 ILE A 182 3.798 9.000 2.418 1.00 35.02 H new ATOM 0 HD11 ILE A 182 5.553 8.355 5.782 1.00 44.23 H new ATOM 0 HD12 ILE A 182 4.681 9.247 4.512 1.00 44.23 H new ATOM 0 HD13 ILE A 182 3.778 8.264 5.689 1.00 44.23 H new ATOM 1001 N THR A 183 0.866 5.741 2.437 1.00 40.40 N ATOM 1002 CA THR A 183 -0.096 5.499 1.380 1.00 62.30 C ATOM 1003 C THR A 183 -1.498 5.870 1.846 1.00 53.13 C ATOM 1004 O THR A 183 -2.183 6.618 1.147 1.00 54.14 O ATOM 1005 CB THR A 183 0.027 4.051 0.886 1.00 20.11 C ATOM 1006 OG1 THR A 183 1.382 3.750 0.580 1.00 11.12 O ATOM 1007 CG2 THR A 183 -0.811 3.831 -0.375 1.00 20.23 C ATOM 0 H THR A 183 1.291 4.897 2.822 1.00 40.40 H new ATOM 0 HA THR A 183 0.116 6.139 0.523 1.00 62.30 H new ATOM 0 HB THR A 183 -0.334 3.399 1.682 1.00 20.11 H new ATOM 0 HG1 THR A 183 1.885 3.626 1.412 1.00 11.12 H new ATOM 0 HG21 THR A 183 -0.707 2.797 -0.705 1.00 20.23 H new ATOM 0 HG22 THR A 183 -1.859 4.038 -0.157 1.00 20.23 H new ATOM 0 HG23 THR A 183 -0.465 4.500 -1.163 1.00 20.23 H new ATOM 1015 N ILE A 184 -1.900 5.408 3.031 1.00 41.32 N ATOM 1016 CA ILE A 184 -3.198 5.741 3.588 1.00 51.03 C ATOM 1017 C ILE A 184 -3.240 7.237 3.874 1.00 34.21 C ATOM 1018 O ILE A 184 -4.202 7.856 3.429 1.00 71.10 O ATOM 1019 CB ILE A 184 -3.538 4.839 4.788 1.00 0.33 C ATOM 1020 CG1 ILE A 184 -3.500 3.356 4.348 1.00 22.45 C ATOM 1021 CG2 ILE A 184 -4.954 5.166 5.283 1.00 72.23 C ATOM 1022 CD1 ILE A 184 -3.708 2.393 5.512 1.00 42.23 C ATOM 0 H ILE A 184 -1.335 4.798 3.622 1.00 41.32 H new ATOM 0 HA ILE A 184 -3.992 5.536 2.870 1.00 51.03 H new ATOM 0 HB ILE A 184 -2.812 5.010 5.583 1.00 0.33 H new ATOM 0 HG12 ILE A 184 -4.271 3.184 3.597 1.00 22.45 H new ATOM 0 HG13 ILE A 184 -2.541 3.146 3.874 1.00 22.45 H new ATOM 0 HG21 ILE A 184 -5.198 4.529 6.133 1.00 72.23 H new ATOM 0 HG22 ILE A 184 -5.001 6.211 5.588 1.00 72.23 H new ATOM 0 HG23 ILE A 184 -5.670 4.990 4.480 1.00 72.23 H new ATOM 0 HD11 ILE A 184 -3.672 1.367 5.146 1.00 42.23 H new ATOM 0 HD12 ILE A 184 -2.922 2.542 6.252 1.00 42.23 H new ATOM 0 HD13 ILE A 184 -4.679 2.581 5.971 1.00 42.23 H new ATOM 1034 N LYS A 185 -2.214 7.854 4.486 1.00 11.05 N ATOM 1035 CA LYS A 185 -2.177 9.310 4.640 1.00 35.41 C ATOM 1036 C LYS A 185 -2.465 9.966 3.300 1.00 21.52 C ATOM 1037 O LYS A 185 -3.389 10.763 3.222 1.00 73.12 O ATOM 1038 CB LYS A 185 -0.816 9.754 5.188 1.00 40.13 C ATOM 1039 CG LYS A 185 -0.560 11.270 5.110 1.00 64.42 C ATOM 1040 CD LYS A 185 0.926 11.584 4.901 1.00 11.12 C ATOM 1041 CE LYS A 185 1.662 11.172 6.167 1.00 55.13 C ATOM 1042 NZ LYS A 185 3.118 11.373 6.075 1.00 62.41 N ATOM 0 H LYS A 185 -1.408 7.367 4.878 1.00 11.05 H new ATOM 0 HA LYS A 185 -2.940 9.619 5.354 1.00 35.41 H new ATOM 0 HB2 LYS A 185 -0.737 9.438 6.228 1.00 40.13 H new ATOM 0 HB3 LYS A 185 -0.030 9.237 4.637 1.00 40.13 H new ATOM 0 HG2 LYS A 185 -1.140 11.695 4.291 1.00 64.42 H new ATOM 0 HG3 LYS A 185 -0.907 11.745 6.027 1.00 64.42 H new ATOM 0 HD2 LYS A 185 1.315 11.043 4.038 1.00 11.12 H new ATOM 0 HD3 LYS A 185 1.069 12.646 4.702 1.00 11.12 H new ATOM 0 HE2 LYS A 185 1.274 11.745 7.009 1.00 55.13 H new ATOM 0 HE3 LYS A 185 1.458 10.122 6.374 1.00 55.13 H new ATOM 0 HZ1 LYS A 185 3.578 10.967 6.915 1.00 62.41 H new ATOM 0 HZ2 LYS A 185 3.480 10.903 5.221 1.00 62.41 H new ATOM 0 HZ3 LYS A 185 3.325 12.391 6.024 1.00 62.41 H new ATOM 1056 N GLN A 186 -1.663 9.682 2.270 1.00 43.42 N ATOM 1057 CA GLN A 186 -1.798 10.302 0.962 1.00 32.45 C ATOM 1058 C GLN A 186 -3.243 10.187 0.518 1.00 53.01 C ATOM 1059 O GLN A 186 -3.898 11.196 0.305 1.00 12.32 O ATOM 1060 CB GLN A 186 -0.819 9.683 -0.049 1.00 22.24 C ATOM 1061 CG GLN A 186 0.552 10.365 0.030 1.00 41.41 C ATOM 1062 CD GLN A 186 0.487 11.792 -0.523 1.00 75.03 C ATOM 1063 OE1 GLN A 186 0.082 12.031 -1.655 1.00 42.23 O ATOM 1064 NE2 GLN A 186 0.826 12.788 0.274 1.00 62.30 N ATOM 0 H GLN A 186 -0.898 9.010 2.327 1.00 43.42 H new ATOM 0 HA GLN A 186 -1.537 11.359 1.021 1.00 32.45 H new ATOM 0 HB2 GLN A 186 -0.711 8.617 0.149 1.00 22.24 H new ATOM 0 HB3 GLN A 186 -1.221 9.781 -1.057 1.00 22.24 H new ATOM 0 HG2 GLN A 186 0.892 10.387 1.065 1.00 41.41 H new ATOM 0 HG3 GLN A 186 1.284 9.786 -0.533 1.00 41.41 H new ATOM 0 HE21 GLN A 186 1.164 12.594 1.217 1.00 62.30 H new ATOM 0 HE22 GLN A 186 0.750 13.751 -0.053 1.00 62.30 H new ATOM 1073 N HIS A 187 -3.790 8.988 0.456 1.00 64.53 N ATOM 1074 CA HIS A 187 -5.155 8.790 0.014 1.00 60.44 C ATOM 1075 C HIS A 187 -6.226 9.445 0.911 1.00 63.13 C ATOM 1076 O HIS A 187 -7.371 9.580 0.480 1.00 11.44 O ATOM 1077 CB HIS A 187 -5.353 7.299 -0.273 1.00 43.02 C ATOM 1078 CG HIS A 187 -4.794 6.995 -1.645 1.00 64.12 C ATOM 1079 ND1 HIS A 187 -5.534 6.852 -2.795 1.00 42.00 N ATOM 1080 CD2 HIS A 187 -3.476 7.076 -2.016 1.00 62.13 C ATOM 1081 CE1 HIS A 187 -4.689 6.864 -3.837 1.00 44.10 C ATOM 1082 NE2 HIS A 187 -3.416 6.995 -3.412 1.00 4.15 N ATOM 0 H HIS A 187 -3.303 8.128 0.709 1.00 64.53 H new ATOM 0 HA HIS A 187 -5.313 9.338 -0.915 1.00 60.44 H new ATOM 0 HB2 HIS A 187 -4.848 6.698 0.483 1.00 43.02 H new ATOM 0 HB3 HIS A 187 -6.412 7.042 -0.230 1.00 43.02 H new ATOM 0 HD2 HIS A 187 -2.633 7.183 -1.349 1.00 62.13 H new ATOM 0 HE1 HIS A 187 -4.987 6.780 -4.872 1.00 44.10 H new ATOM 0 HE2 HIS A 187 -2.577 7.028 -3.992 1.00 4.15 H new ATOM 1090 N THR A 188 -5.873 9.950 2.092 1.00 73.33 N ATOM 1091 CA THR A 188 -6.768 10.509 3.101 1.00 64.50 C ATOM 1092 C THR A 188 -6.485 12.020 3.261 1.00 12.13 C ATOM 1093 O THR A 188 -7.094 12.697 4.095 1.00 64.14 O ATOM 1094 CB THR A 188 -6.594 9.653 4.367 1.00 74.23 C ATOM 1095 OG1 THR A 188 -6.684 8.294 3.994 1.00 11.22 O ATOM 1096 CG2 THR A 188 -7.661 9.823 5.428 1.00 15.44 C ATOM 0 H THR A 188 -4.897 9.981 2.386 1.00 73.33 H new ATOM 0 HA THR A 188 -7.822 10.465 2.828 1.00 64.50 H new ATOM 0 HB THR A 188 -5.639 9.971 4.786 1.00 74.23 H new ATOM 0 HG1 THR A 188 -5.804 7.872 4.081 1.00 11.22 H new ATOM 0 HG21 THR A 188 -7.439 9.173 6.275 1.00 15.44 H new ATOM 0 HG22 THR A 188 -7.680 10.860 5.762 1.00 15.44 H new ATOM 0 HG23 THR A 188 -8.633 9.558 5.012 1.00 15.44 H new ATOM 1104 N VAL A 189 -5.597 12.562 2.414 1.00 63.22 N ATOM 1105 CA VAL A 189 -5.296 13.974 2.242 1.00 60.32 C ATOM 1106 C VAL A 189 -5.364 14.334 0.746 1.00 75.13 C ATOM 1107 O VAL A 189 -6.280 15.041 0.335 1.00 35.44 O ATOM 1108 CB VAL A 189 -4.024 14.383 3.030 1.00 60.32 C ATOM 1109 CG1 VAL A 189 -3.978 13.885 4.491 1.00 41.41 C ATOM 1110 CG2 VAL A 189 -2.706 13.989 2.367 1.00 52.00 C ATOM 0 H VAL A 189 -5.037 11.978 1.793 1.00 63.22 H new ATOM 0 HA VAL A 189 -6.055 14.606 2.702 1.00 60.32 H new ATOM 0 HB VAL A 189 -4.118 15.469 3.025 1.00 60.32 H new ATOM 0 HG11 VAL A 189 -3.053 14.220 4.960 1.00 41.41 H new ATOM 0 HG12 VAL A 189 -4.830 14.288 5.040 1.00 41.41 H new ATOM 0 HG13 VAL A 189 -4.019 12.796 4.506 1.00 41.41 H new ATOM 0 HG21 VAL A 189 -1.873 14.316 2.990 1.00 52.00 H new ATOM 0 HG22 VAL A 189 -2.668 12.906 2.249 1.00 52.00 H new ATOM 0 HG23 VAL A 189 -2.635 14.463 1.388 1.00 52.00 H new ATOM 1120 N THR A 190 -4.467 13.800 -0.087 1.00 64.13 N ATOM 1121 CA THR A 190 -4.316 14.044 -1.517 1.00 33.35 C ATOM 1122 C THR A 190 -5.646 13.894 -2.254 1.00 40.23 C ATOM 1123 O THR A 190 -6.097 14.871 -2.839 1.00 52.02 O ATOM 1124 CB THR A 190 -3.177 13.153 -2.076 1.00 72.50 C ATOM 1125 OG1 THR A 190 -1.936 13.802 -1.874 1.00 62.30 O ATOM 1126 CG2 THR A 190 -3.292 12.776 -3.553 1.00 72.54 C ATOM 0 H THR A 190 -3.774 13.133 0.252 1.00 64.13 H new ATOM 0 HA THR A 190 -4.021 15.080 -1.687 1.00 33.35 H new ATOM 0 HB THR A 190 -3.257 12.216 -1.525 1.00 72.50 H new ATOM 0 HG1 THR A 190 -1.207 13.160 -2.003 1.00 62.30 H new ATOM 0 HG21 THR A 190 -2.444 12.153 -3.837 1.00 72.54 H new ATOM 0 HG22 THR A 190 -4.218 12.225 -3.717 1.00 72.54 H new ATOM 0 HG23 THR A 190 -3.296 13.681 -4.160 1.00 72.54 H new ATOM 1134 N THR A 191 -6.256 12.706 -2.302 1.00 73.14 N ATOM 1135 CA THR A 191 -7.467 12.525 -3.088 1.00 4.43 C ATOM 1136 C THR A 191 -8.669 13.122 -2.365 1.00 52.00 C ATOM 1137 O THR A 191 -9.583 13.631 -3.004 1.00 32.42 O ATOM 1138 CB THR A 191 -7.561 11.136 -3.731 1.00 12.11 C ATOM 1139 OG1 THR A 191 -8.567 10.965 -4.696 1.00 12.11 O ATOM 1140 CG2 THR A 191 -7.481 10.064 -2.685 1.00 13.32 C ATOM 0 H THR A 191 -5.933 11.871 -1.813 1.00 73.14 H new ATOM 0 HA THR A 191 -7.440 13.122 -4.000 1.00 4.43 H new ATOM 0 HB THR A 191 -6.678 11.034 -4.362 1.00 12.11 H new ATOM 0 HG1 THR A 191 -8.537 10.048 -5.041 1.00 12.11 H new ATOM 0 HG21 THR A 191 -7.549 9.086 -3.161 1.00 13.32 H new ATOM 0 HG22 THR A 191 -6.532 10.144 -2.154 1.00 13.32 H new ATOM 0 HG23 THR A 191 -8.303 10.182 -1.979 1.00 13.32 H new ATOM 1148 N THR A 192 -8.638 13.199 -1.037 1.00 24.12 N ATOM 1149 CA THR A 192 -9.722 13.749 -0.252 1.00 40.40 C ATOM 1150 C THR A 192 -9.963 15.212 -0.591 1.00 72.51 C ATOM 1151 O THR A 192 -11.086 15.621 -0.885 1.00 22.25 O ATOM 1152 CB THR A 192 -9.438 13.555 1.234 1.00 24.35 C ATOM 1153 OG1 THR A 192 -8.753 12.338 1.436 1.00 12.15 O ATOM 1154 CG2 THR A 192 -10.759 13.515 1.987 1.00 0.13 C ATOM 0 H THR A 192 -7.849 12.876 -0.477 1.00 24.12 H new ATOM 0 HA THR A 192 -10.638 13.213 -0.498 1.00 40.40 H new ATOM 0 HB THR A 192 -8.823 14.378 1.597 1.00 24.35 H new ATOM 0 HG1 THR A 192 -9.345 11.700 1.886 1.00 12.15 H new ATOM 0 HG21 THR A 192 -10.567 13.377 3.051 1.00 0.13 H new ATOM 0 HG22 THR A 192 -11.294 14.452 1.834 1.00 0.13 H new ATOM 0 HG23 THR A 192 -11.364 12.687 1.617 1.00 0.13 H new ATOM 1162 N THR A 193 -8.885 15.986 -0.631 1.00 42.32 N ATOM 1163 CA THR A 193 -8.924 17.375 -1.036 1.00 64.20 C ATOM 1164 C THR A 193 -9.445 17.510 -2.483 1.00 22.41 C ATOM 1165 O THR A 193 -9.907 18.586 -2.859 1.00 21.23 O ATOM 1166 CB THR A 193 -7.523 17.968 -0.760 1.00 4.13 C ATOM 1167 OG1 THR A 193 -7.631 19.151 0.004 1.00 64.54 O ATOM 1168 CG2 THR A 193 -6.680 18.248 -2.008 1.00 71.13 C ATOM 0 H THR A 193 -7.952 15.658 -0.379 1.00 42.32 H new ATOM 0 HA THR A 193 -9.640 17.962 -0.461 1.00 64.20 H new ATOM 0 HB THR A 193 -6.995 17.190 -0.208 1.00 4.13 H new ATOM 0 HG1 THR A 193 -6.737 19.514 0.173 1.00 64.54 H new ATOM 0 HG21 THR A 193 -5.716 18.662 -1.711 1.00 71.13 H new ATOM 0 HG22 THR A 193 -6.523 17.319 -2.557 1.00 71.13 H new ATOM 0 HG23 THR A 193 -7.200 18.962 -2.646 1.00 71.13 H new ATOM 1176 N LYS A 194 -9.435 16.439 -3.292 1.00 43.02 N ATOM 1177 CA LYS A 194 -9.892 16.454 -4.680 1.00 1.21 C ATOM 1178 C LYS A 194 -11.322 15.970 -4.866 1.00 60.54 C ATOM 1179 O LYS A 194 -11.806 15.959 -5.998 1.00 75.32 O ATOM 1180 CB LYS A 194 -8.941 15.634 -5.545 1.00 20.33 C ATOM 1181 CG LYS A 194 -7.548 16.235 -5.469 1.00 64.21 C ATOM 1182 CD LYS A 194 -6.576 15.404 -6.287 1.00 60.50 C ATOM 1183 CE LYS A 194 -5.194 15.938 -5.957 1.00 43.11 C ATOM 1184 NZ LYS A 194 -4.344 16.025 -7.166 1.00 60.50 N ATOM 0 H LYS A 194 -9.102 15.524 -2.989 1.00 43.02 H new ATOM 0 HA LYS A 194 -9.888 17.498 -4.994 1.00 1.21 H new ATOM 0 HB2 LYS A 194 -8.922 14.599 -5.204 1.00 20.33 H new ATOM 0 HB3 LYS A 194 -9.289 15.623 -6.578 1.00 20.33 H new ATOM 0 HG2 LYS A 194 -7.565 17.260 -5.841 1.00 64.21 H new ATOM 0 HG3 LYS A 194 -7.218 16.278 -4.431 1.00 64.21 H new ATOM 0 HD2 LYS A 194 -6.657 14.347 -6.034 1.00 60.50 H new ATOM 0 HD3 LYS A 194 -6.786 15.494 -7.353 1.00 60.50 H new ATOM 0 HE2 LYS A 194 -5.283 16.924 -5.502 1.00 43.11 H new ATOM 0 HE3 LYS A 194 -4.718 15.289 -5.222 1.00 43.11 H new ATOM 0 HZ1 LYS A 194 -3.407 16.393 -6.906 1.00 60.50 H new ATOM 0 HZ2 LYS A 194 -4.240 15.079 -7.586 1.00 60.50 H new ATOM 0 HZ3 LYS A 194 -4.787 16.664 -7.857 1.00 60.50 H new ATOM 1198 N GLY A 195 -11.999 15.595 -3.792 1.00 35.55 N ATOM 1199 CA GLY A 195 -13.360 15.069 -3.834 1.00 23.41 C ATOM 1200 C GLY A 195 -13.458 13.579 -3.491 1.00 13.24 C ATOM 1201 O GLY A 195 -14.545 12.995 -3.550 1.00 72.31 O ATOM 0 H GLY A 195 -11.614 15.647 -2.849 1.00 35.55 H new ATOM 0 HA2 GLY A 195 -13.980 15.634 -3.138 1.00 23.41 H new ATOM 0 HA3 GLY A 195 -13.771 15.231 -4.830 1.00 23.41 H new ATOM 1205 N GLU A 196 -12.355 12.918 -3.135 1.00 34.25 N ATOM 1206 CA GLU A 196 -12.420 11.598 -2.516 1.00 51.31 C ATOM 1207 C GLU A 196 -12.966 11.750 -1.104 1.00 62.52 C ATOM 1208 O GLU A 196 -12.819 12.797 -0.474 1.00 75.40 O ATOM 1209 CB GLU A 196 -11.028 10.931 -2.530 1.00 44.40 C ATOM 1210 CG GLU A 196 -10.943 9.412 -2.460 1.00 73.23 C ATOM 1211 CD GLU A 196 -12.067 8.665 -3.183 1.00 31.34 C ATOM 1212 OE1 GLU A 196 -13.203 8.643 -2.653 1.00 43.20 O ATOM 1213 OE2 GLU A 196 -11.815 8.093 -4.264 1.00 62.23 O ATOM 0 H GLU A 196 -11.409 13.276 -3.265 1.00 34.25 H new ATOM 0 HA GLU A 196 -13.089 10.947 -3.079 1.00 51.31 H new ATOM 0 HB2 GLU A 196 -10.519 11.249 -3.440 1.00 44.40 H new ATOM 0 HB3 GLU A 196 -10.461 11.333 -1.690 1.00 44.40 H new ATOM 0 HG2 GLU A 196 -9.989 9.097 -2.882 1.00 73.23 H new ATOM 0 HG3 GLU A 196 -10.943 9.111 -1.412 1.00 73.23 H new ATOM 1220 N ASN A 197 -13.612 10.706 -0.603 1.00 0.44 N ATOM 1221 CA ASN A 197 -13.916 10.497 0.792 1.00 21.51 C ATOM 1222 C ASN A 197 -14.443 9.082 0.899 1.00 4.31 C ATOM 1223 O ASN A 197 -15.401 8.723 0.204 1.00 42.20 O ATOM 1224 CB ASN A 197 -14.984 11.456 1.303 1.00 35.53 C ATOM 1225 CG ASN A 197 -14.955 11.464 2.829 1.00 72.44 C ATOM 1226 OD1 ASN A 197 -14.290 12.300 3.439 1.00 60.33 O ATOM 1227 ND2 ASN A 197 -15.581 10.505 3.488 1.00 12.22 N ATOM 0 H ASN A 197 -13.952 9.948 -1.195 1.00 0.44 H new ATOM 0 HA ASN A 197 -13.021 10.668 1.390 1.00 21.51 H new ATOM 0 HB2 ASN A 197 -14.804 12.460 0.918 1.00 35.53 H new ATOM 0 HB3 ASN A 197 -15.967 11.149 0.947 1.00 35.53 H new ATOM 0 HD21 ASN A 197 -15.513 10.457 4.505 1.00 12.22 H new ATOM 0 HD22 ASN A 197 -16.132 9.813 2.980 1.00 12.22 H new ATOM 1234 N PHE A 198 -13.835 8.283 1.758 1.00 51.33 N ATOM 1235 CA PHE A 198 -14.262 6.932 2.060 1.00 53.34 C ATOM 1236 C PHE A 198 -14.606 6.750 3.530 1.00 73.14 C ATOM 1237 O PHE A 198 -14.131 7.467 4.413 1.00 0.45 O ATOM 1238 CB PHE A 198 -13.204 5.923 1.613 1.00 11.24 C ATOM 1239 CG PHE A 198 -11.757 6.343 1.602 1.00 31.35 C ATOM 1240 CD1 PHE A 198 -11.215 7.101 2.654 1.00 72.51 C ATOM 1241 CD2 PHE A 198 -10.954 5.967 0.512 1.00 2.13 C ATOM 1242 CE1 PHE A 198 -9.894 7.552 2.582 1.00 62.33 C ATOM 1243 CE2 PHE A 198 -9.635 6.431 0.434 1.00 1.03 C ATOM 1244 CZ PHE A 198 -9.110 7.215 1.472 1.00 34.51 C ATOM 0 H PHE A 198 -13.006 8.567 2.279 1.00 51.33 H new ATOM 0 HA PHE A 198 -15.178 6.748 1.499 1.00 53.34 H new ATOM 0 HB2 PHE A 198 -13.289 5.049 2.258 1.00 11.24 H new ATOM 0 HB3 PHE A 198 -13.461 5.600 0.604 1.00 11.24 H new ATOM 0 HD1 PHE A 198 -11.819 7.335 3.518 1.00 72.51 H new ATOM 0 HD2 PHE A 198 -11.351 5.325 -0.260 1.00 2.13 H new ATOM 0 HE1 PHE A 198 -9.481 8.156 3.377 1.00 62.33 H new ATOM 0 HE2 PHE A 198 -9.024 6.186 -0.422 1.00 1.03 H new ATOM 0 HZ PHE A 198 -8.089 7.563 1.414 1.00 34.51 H new ATOM 1254 N THR A 199 -15.412 5.724 3.759 1.00 55.20 N ATOM 1255 CA THR A 199 -15.852 5.233 5.044 1.00 74.50 C ATOM 1256 C THR A 199 -14.760 4.431 5.719 1.00 41.21 C ATOM 1257 O THR A 199 -13.956 3.812 5.034 1.00 33.53 O ATOM 1258 CB THR A 199 -17.078 4.342 4.802 1.00 12.14 C ATOM 1259 OG1 THR A 199 -17.066 3.660 3.550 1.00 1.35 O ATOM 1260 CG2 THR A 199 -18.283 5.259 4.792 1.00 43.02 C ATOM 0 H THR A 199 -15.801 5.177 2.991 1.00 55.20 H new ATOM 0 HA THR A 199 -16.099 6.070 5.697 1.00 74.50 H new ATOM 0 HB THR A 199 -17.090 3.582 5.583 1.00 12.14 H new ATOM 0 HG1 THR A 199 -16.996 2.695 3.704 1.00 1.35 H new ATOM 0 HG21 THR A 199 -19.186 4.672 4.623 1.00 43.02 H new ATOM 0 HG22 THR A 199 -18.358 5.771 5.751 1.00 43.02 H new ATOM 0 HG23 THR A 199 -18.174 5.995 3.995 1.00 43.02 H new ATOM 1268 N GLU A 200 -14.796 4.341 7.044 1.00 41.44 N ATOM 1269 CA GLU A 200 -13.847 3.580 7.844 1.00 51.44 C ATOM 1270 C GLU A 200 -13.735 2.131 7.373 1.00 22.41 C ATOM 1271 O GLU A 200 -12.638 1.595 7.330 1.00 74.34 O ATOM 1272 CB GLU A 200 -14.189 3.705 9.328 1.00 23.13 C ATOM 1273 CG GLU A 200 -15.554 3.098 9.641 1.00 22.22 C ATOM 1274 CD GLU A 200 -16.124 3.625 10.952 1.00 14.41 C ATOM 1275 OE1 GLU A 200 -15.469 3.445 12.008 1.00 62.31 O ATOM 1276 OE2 GLU A 200 -17.216 4.237 10.885 1.00 21.31 O ATOM 0 H GLU A 200 -15.507 4.809 7.606 1.00 41.44 H new ATOM 0 HA GLU A 200 -12.854 4.006 7.704 1.00 51.44 H new ATOM 0 HB2 GLU A 200 -13.423 3.206 9.922 1.00 23.13 H new ATOM 0 HB3 GLU A 200 -14.182 4.756 9.617 1.00 23.13 H new ATOM 0 HG2 GLU A 200 -16.246 3.322 8.829 1.00 22.22 H new ATOM 0 HG3 GLU A 200 -15.465 2.013 9.694 1.00 22.22 H new ATOM 1283 N THR A 201 -14.830 1.507 6.942 1.00 35.22 N ATOM 1284 CA THR A 201 -14.803 0.141 6.437 1.00 73.33 C ATOM 1285 C THR A 201 -14.040 0.025 5.104 1.00 13.04 C ATOM 1286 O THR A 201 -13.478 -1.028 4.816 1.00 50.03 O ATOM 1287 CB THR A 201 -16.261 -0.336 6.364 1.00 62.10 C ATOM 1288 OG1 THR A 201 -16.800 -0.316 7.678 1.00 21.55 O ATOM 1289 CG2 THR A 201 -16.508 -1.729 5.797 1.00 13.04 C ATOM 0 H THR A 201 -15.756 1.935 6.934 1.00 35.22 H new ATOM 0 HA THR A 201 -14.244 -0.512 7.107 1.00 73.33 H new ATOM 0 HB THR A 201 -16.736 0.351 5.664 1.00 62.10 H new ATOM 0 HG1 THR A 201 -17.733 -0.616 7.654 1.00 21.55 H new ATOM 0 HG21 THR A 201 -17.577 -1.940 5.802 1.00 13.04 H new ATOM 0 HG22 THR A 201 -16.134 -1.777 4.774 1.00 13.04 H new ATOM 0 HG23 THR A 201 -15.990 -2.468 6.408 1.00 13.04 H new ATOM 1297 N ASP A 202 -13.971 1.100 4.320 1.00 4.23 N ATOM 1298 CA ASP A 202 -13.294 1.173 3.025 1.00 33.23 C ATOM 1299 C ASP A 202 -11.838 1.598 3.232 1.00 51.24 C ATOM 1300 O ASP A 202 -10.941 1.028 2.617 1.00 0.35 O ATOM 1301 CB ASP A 202 -14.057 2.163 2.139 1.00 4.14 C ATOM 1302 CG ASP A 202 -13.731 2.062 0.650 1.00 63.20 C ATOM 1303 OD1 ASP A 202 -14.156 1.055 0.042 1.00 72.11 O ATOM 1304 OD2 ASP A 202 -13.261 3.046 0.047 1.00 51.23 O ATOM 0 H ASP A 202 -14.405 1.985 4.582 1.00 4.23 H new ATOM 0 HA ASP A 202 -13.283 0.200 2.533 1.00 33.23 H new ATOM 0 HB2 ASP A 202 -15.127 2.004 2.275 1.00 4.14 H new ATOM 0 HB3 ASP A 202 -13.840 3.176 2.478 1.00 4.14 H new ATOM 1309 N VAL A 203 -11.581 2.502 4.186 1.00 71.23 N ATOM 1310 CA VAL A 203 -10.256 2.794 4.733 1.00 73.41 C ATOM 1311 C VAL A 203 -9.617 1.481 5.223 1.00 74.41 C ATOM 1312 O VAL A 203 -8.493 1.159 4.842 1.00 64.43 O ATOM 1313 CB VAL A 203 -10.376 3.860 5.851 1.00 32.51 C ATOM 1314 CG1 VAL A 203 -9.042 4.114 6.568 1.00 35.21 C ATOM 1315 CG2 VAL A 203 -10.919 5.193 5.300 1.00 14.14 C ATOM 0 H VAL A 203 -12.316 3.067 4.610 1.00 71.23 H new ATOM 0 HA VAL A 203 -9.603 3.213 3.968 1.00 73.41 H new ATOM 0 HB VAL A 203 -11.080 3.454 6.577 1.00 32.51 H new ATOM 0 HG11 VAL A 203 -9.183 4.869 7.341 1.00 35.21 H new ATOM 0 HG12 VAL A 203 -8.692 3.188 7.024 1.00 35.21 H new ATOM 0 HG13 VAL A 203 -8.303 4.466 5.848 1.00 35.21 H new ATOM 0 HG21 VAL A 203 -10.991 5.919 6.110 1.00 14.14 H new ATOM 0 HG22 VAL A 203 -10.244 5.571 4.532 1.00 14.14 H new ATOM 0 HG23 VAL A 203 -11.907 5.033 4.868 1.00 14.14 H new ATOM 1325 N LYS A 204 -10.342 0.681 6.017 1.00 64.14 N ATOM 1326 CA LYS A 204 -9.914 -0.624 6.494 1.00 43.22 C ATOM 1327 C LYS A 204 -9.586 -1.548 5.333 1.00 11.32 C ATOM 1328 O LYS A 204 -8.594 -2.261 5.417 1.00 71.53 O ATOM 1329 CB LYS A 204 -11.015 -1.226 7.379 1.00 75.53 C ATOM 1330 CG LYS A 204 -11.016 -0.665 8.808 1.00 31.15 C ATOM 1331 CD LYS A 204 -12.313 -0.986 9.557 1.00 73.42 C ATOM 1332 CE LYS A 204 -12.272 -0.418 10.978 1.00 62.44 C ATOM 1333 NZ LYS A 204 -11.515 -1.278 11.908 1.00 53.32 N ATOM 0 H LYS A 204 -11.270 0.940 6.351 1.00 64.14 H new ATOM 0 HA LYS A 204 -9.005 -0.507 7.083 1.00 43.22 H new ATOM 0 HB2 LYS A 204 -11.985 -1.036 6.920 1.00 75.53 H new ATOM 0 HB3 LYS A 204 -10.888 -2.308 7.420 1.00 75.53 H new ATOM 0 HG2 LYS A 204 -10.170 -1.077 9.358 1.00 31.15 H new ATOM 0 HG3 LYS A 204 -10.878 0.416 8.772 1.00 31.15 H new ATOM 0 HD2 LYS A 204 -13.163 -0.569 9.018 1.00 73.42 H new ATOM 0 HD3 LYS A 204 -12.459 -2.066 9.596 1.00 73.42 H new ATOM 0 HE2 LYS A 204 -11.821 0.574 10.957 1.00 62.44 H new ATOM 0 HE3 LYS A 204 -13.290 -0.297 11.347 1.00 62.44 H new ATOM 0 HZ1 LYS A 204 -11.517 -0.850 12.856 1.00 53.32 H new ATOM 0 HZ2 LYS A 204 -11.959 -2.217 11.951 1.00 53.32 H new ATOM 0 HZ3 LYS A 204 -10.535 -1.373 11.573 1.00 53.32 H new ATOM 1347 N MET A 205 -10.366 -1.549 4.248 1.00 52.04 N ATOM 1348 CA MET A 205 -10.042 -2.372 3.094 1.00 11.15 C ATOM 1349 C MET A 205 -8.703 -1.908 2.528 1.00 44.11 C ATOM 1350 O MET A 205 -7.818 -2.722 2.254 1.00 22.22 O ATOM 1351 CB MET A 205 -11.175 -2.283 2.064 1.00 42.10 C ATOM 1352 CG MET A 205 -12.484 -2.844 2.612 1.00 12.43 C ATOM 1353 SD MET A 205 -13.111 -4.248 1.691 1.00 65.40 S ATOM 1354 CE MET A 205 -13.881 -5.138 3.051 1.00 61.10 C ATOM 0 H MET A 205 -11.216 -0.993 4.151 1.00 52.04 H new ATOM 0 HA MET A 205 -9.947 -3.421 3.375 1.00 11.15 H new ATOM 0 HB2 MET A 205 -11.319 -1.243 1.771 1.00 42.10 H new ATOM 0 HB3 MET A 205 -10.893 -2.831 1.165 1.00 42.10 H new ATOM 0 HG2 MET A 205 -12.335 -3.140 3.651 1.00 12.43 H new ATOM 0 HG3 MET A 205 -13.236 -2.055 2.610 1.00 12.43 H new ATOM 0 HE1 MET A 205 -14.410 -6.009 2.663 1.00 61.10 H new ATOM 0 HE2 MET A 205 -13.114 -5.463 3.754 1.00 61.10 H new ATOM 0 HE3 MET A 205 -14.587 -4.483 3.561 1.00 61.10 H new ATOM 1364 N MET A 206 -8.523 -0.596 2.352 1.00 54.11 N ATOM 1365 CA MET A 206 -7.280 -0.050 1.833 1.00 34.45 C ATOM 1366 C MET A 206 -6.079 -0.451 2.690 1.00 51.12 C ATOM 1367 O MET A 206 -5.004 -0.677 2.147 1.00 22.53 O ATOM 1368 CB MET A 206 -7.367 1.463 1.686 1.00 4.31 C ATOM 1369 CG MET A 206 -6.147 1.975 0.905 1.00 53.41 C ATOM 1370 SD MET A 206 -6.387 3.533 0.024 1.00 43.31 S ATOM 1371 CE MET A 206 -7.094 4.473 1.386 1.00 12.13 C ATOM 0 H MET A 206 -9.231 0.106 2.565 1.00 54.11 H new ATOM 0 HA MET A 206 -7.127 -0.479 0.843 1.00 34.45 H new ATOM 0 HB2 MET A 206 -8.285 1.736 1.166 1.00 4.31 H new ATOM 0 HB3 MET A 206 -7.406 1.933 2.669 1.00 4.31 H new ATOM 0 HG2 MET A 206 -5.316 2.095 1.600 1.00 53.41 H new ATOM 0 HG3 MET A 206 -5.852 1.212 0.185 1.00 53.41 H new ATOM 0 HE1 MET A 206 -6.946 5.538 1.208 1.00 12.13 H new ATOM 0 HE2 MET A 206 -8.161 4.262 1.458 1.00 12.13 H new ATOM 0 HE3 MET A 206 -6.604 4.189 2.317 1.00 12.13 H new ATOM 1381 N GLU A 207 -6.246 -0.582 4.002 1.00 2.35 N ATOM 1382 CA GLU A 207 -5.180 -1.016 4.888 1.00 52.41 C ATOM 1383 C GLU A 207 -4.613 -2.368 4.449 1.00 12.22 C ATOM 1384 O GLU A 207 -3.398 -2.511 4.317 1.00 61.30 O ATOM 1385 CB GLU A 207 -5.669 -1.036 6.348 1.00 20.54 C ATOM 1386 CG GLU A 207 -4.645 -0.371 7.274 1.00 52.31 C ATOM 1387 CD GLU A 207 -4.707 -0.932 8.690 1.00 44.10 C ATOM 1388 OE1 GLU A 207 -5.500 -0.428 9.513 1.00 24.23 O ATOM 1389 OE2 GLU A 207 -4.038 -1.948 8.987 1.00 41.10 O ATOM 0 H GLU A 207 -7.127 -0.389 4.478 1.00 2.35 H new ATOM 0 HA GLU A 207 -4.362 -0.298 4.826 1.00 52.41 H new ATOM 0 HB2 GLU A 207 -6.625 -0.517 6.423 1.00 20.54 H new ATOM 0 HB3 GLU A 207 -5.839 -2.065 6.665 1.00 20.54 H new ATOM 0 HG2 GLU A 207 -3.643 -0.516 6.870 1.00 52.31 H new ATOM 0 HG3 GLU A 207 -4.825 0.704 7.302 1.00 52.31 H new ATOM 1396 N ARG A 208 -5.483 -3.348 4.181 1.00 32.24 N ATOM 1397 CA ARG A 208 -5.079 -4.688 3.806 1.00 41.02 C ATOM 1398 C ARG A 208 -4.330 -4.672 2.486 1.00 70.52 C ATOM 1399 O ARG A 208 -3.200 -5.151 2.429 1.00 44.43 O ATOM 1400 CB ARG A 208 -6.299 -5.609 3.740 1.00 1.11 C ATOM 1401 CG ARG A 208 -6.786 -6.057 5.114 1.00 62.44 C ATOM 1402 CD ARG A 208 -7.633 -5.033 5.860 1.00 5.05 C ATOM 1403 NE ARG A 208 -7.743 -5.324 7.296 1.00 22.55 N ATOM 1404 CZ ARG A 208 -8.736 -5.931 7.952 1.00 23.23 C ATOM 1405 NH1 ARG A 208 -9.846 -6.321 7.326 1.00 1.25 N ATOM 1406 NH2 ARG A 208 -8.587 -6.149 9.252 1.00 30.31 N ATOM 0 H ARG A 208 -6.494 -3.222 4.222 1.00 32.24 H new ATOM 0 HA ARG A 208 -4.401 -5.076 4.567 1.00 41.02 H new ATOM 0 HB2 ARG A 208 -7.109 -5.093 3.225 1.00 1.11 H new ATOM 0 HB3 ARG A 208 -6.051 -6.488 3.145 1.00 1.11 H new ATOM 0 HG2 ARG A 208 -7.367 -6.972 4.997 1.00 62.44 H new ATOM 0 HG3 ARG A 208 -5.920 -6.306 5.727 1.00 62.44 H new ATOM 0 HD2 ARG A 208 -7.198 -4.042 5.727 1.00 5.05 H new ATOM 0 HD3 ARG A 208 -8.631 -5.005 5.422 1.00 5.05 H new ATOM 0 HE ARG A 208 -6.955 -5.022 7.869 1.00 22.55 H new ATOM 0 HH11 ARG A 208 -9.951 -6.158 6.325 1.00 1.25 H new ATOM 0 HH12 ARG A 208 -10.591 -6.783 7.848 1.00 1.25 H new ATOM 0 HH21 ARG A 208 -7.732 -5.855 9.724 1.00 30.31 H new ATOM 0 HH22 ARG A 208 -9.328 -6.610 9.780 1.00 30.31 H new ATOM 1420 N VAL A 209 -4.939 -4.160 1.417 1.00 24.33 N ATOM 1421 CA VAL A 209 -4.304 -4.170 0.097 1.00 5.15 C ATOM 1422 C VAL A 209 -2.939 -3.490 0.142 1.00 65.40 C ATOM 1423 O VAL A 209 -1.968 -4.044 -0.371 1.00 61.14 O ATOM 1424 CB VAL A 209 -5.242 -3.543 -0.940 1.00 2.22 C ATOM 1425 CG1 VAL A 209 -6.550 -4.277 -1.009 1.00 11.24 C ATOM 1426 CG2 VAL A 209 -5.494 -2.064 -0.713 1.00 32.25 C ATOM 0 H VAL A 209 -5.866 -3.735 1.437 1.00 24.33 H new ATOM 0 HA VAL A 209 -4.123 -5.201 -0.207 1.00 5.15 H new ATOM 0 HB VAL A 209 -4.722 -3.637 -1.894 1.00 2.22 H new ATOM 0 HG11 VAL A 209 -7.192 -3.807 -1.754 1.00 11.24 H new ATOM 0 HG12 VAL A 209 -6.370 -5.315 -1.288 1.00 11.24 H new ATOM 0 HG13 VAL A 209 -7.038 -4.242 -0.035 1.00 11.24 H new ATOM 0 HG21 VAL A 209 -6.166 -1.687 -1.484 1.00 32.25 H new ATOM 0 HG22 VAL A 209 -5.948 -1.919 0.267 1.00 32.25 H new ATOM 0 HG23 VAL A 209 -4.549 -1.523 -0.759 1.00 32.25 H new ATOM 1436 N VAL A 210 -2.862 -2.321 0.777 1.00 10.03 N ATOM 1437 CA VAL A 210 -1.651 -1.540 0.905 1.00 70.10 C ATOM 1438 C VAL A 210 -0.626 -2.387 1.654 1.00 62.20 C ATOM 1439 O VAL A 210 0.489 -2.454 1.154 1.00 42.21 O ATOM 1440 CB VAL A 210 -1.952 -0.175 1.569 1.00 71.13 C ATOM 1441 CG1 VAL A 210 -0.690 0.628 1.899 1.00 22.45 C ATOM 1442 CG2 VAL A 210 -2.803 0.756 0.686 1.00 41.32 C ATOM 0 H VAL A 210 -3.668 -1.886 1.226 1.00 10.03 H new ATOM 0 HA VAL A 210 -1.229 -1.291 -0.069 1.00 70.10 H new ATOM 0 HB VAL A 210 -2.488 -0.459 2.475 1.00 71.13 H new ATOM 0 HG11 VAL A 210 -0.971 1.574 2.362 1.00 22.45 H new ATOM 0 HG12 VAL A 210 -0.066 0.058 2.587 1.00 22.45 H new ATOM 0 HG13 VAL A 210 -0.134 0.824 0.983 1.00 22.45 H new ATOM 0 HG21 VAL A 210 -2.978 1.695 1.210 1.00 41.32 H new ATOM 0 HG22 VAL A 210 -2.276 0.954 -0.247 1.00 41.32 H new ATOM 0 HG23 VAL A 210 -3.759 0.279 0.469 1.00 41.32 H new ATOM 1452 N GLU A 211 -0.955 -3.090 2.751 1.00 50.10 N ATOM 1453 CA GLU A 211 -0.029 -3.982 3.417 1.00 2.13 C ATOM 1454 C GLU A 211 0.499 -4.989 2.390 1.00 64.10 C ATOM 1455 O GLU A 211 1.716 -5.163 2.282 1.00 32.13 O ATOM 1456 CB GLU A 211 -0.702 -4.637 4.651 1.00 71.23 C ATOM 1457 CG GLU A 211 -0.027 -5.976 4.957 1.00 3.42 C ATOM 1458 CD GLU A 211 -0.540 -6.760 6.166 1.00 64.31 C ATOM 1459 OE1 GLU A 211 -0.908 -6.138 7.182 1.00 33.34 O ATOM 1460 OE2 GLU A 211 -0.475 -8.019 6.125 1.00 31.32 O ATOM 0 H GLU A 211 -1.874 -3.046 3.191 1.00 50.10 H new ATOM 0 HA GLU A 211 0.829 -3.436 3.811 1.00 2.13 H new ATOM 0 HB2 GLU A 211 -0.625 -3.975 5.513 1.00 71.23 H new ATOM 0 HB3 GLU A 211 -1.764 -4.790 4.460 1.00 71.23 H new ATOM 0 HG2 GLU A 211 -0.124 -6.612 4.077 1.00 3.42 H new ATOM 0 HG3 GLU A 211 1.038 -5.792 5.101 1.00 3.42 H new ATOM 1467 N GLN A 212 -0.391 -5.667 1.650 1.00 42.30 N ATOM 1468 CA GLN A 212 0.043 -6.808 0.843 1.00 22.25 C ATOM 1469 C GLN A 212 0.960 -6.331 -0.281 1.00 32.02 C ATOM 1470 O GLN A 212 1.918 -7.012 -0.649 1.00 51.44 O ATOM 1471 CB GLN A 212 -1.140 -7.600 0.271 1.00 11.31 C ATOM 1472 CG GLN A 212 -2.049 -8.196 1.371 1.00 23.31 C ATOM 1473 CD GLN A 212 -2.973 -9.311 0.885 1.00 53.24 C ATOM 1474 OE1 GLN A 212 -2.782 -9.902 -0.173 1.00 21.34 O ATOM 1475 NE2 GLN A 212 -3.965 -9.699 1.662 1.00 63.40 N ATOM 0 H GLN A 212 -1.386 -5.451 1.595 1.00 42.30 H new ATOM 0 HA GLN A 212 0.592 -7.485 1.498 1.00 22.25 H new ATOM 0 HB2 GLN A 212 -1.733 -6.947 -0.370 1.00 11.31 H new ATOM 0 HB3 GLN A 212 -0.762 -8.406 -0.358 1.00 11.31 H new ATOM 0 HG2 GLN A 212 -1.422 -8.583 2.174 1.00 23.31 H new ATOM 0 HG3 GLN A 212 -2.656 -7.397 1.797 1.00 23.31 H new ATOM 0 HE21 GLN A 212 -4.139 -9.219 2.545 1.00 63.40 H new ATOM 0 HE22 GLN A 212 -4.559 -10.479 1.380 1.00 63.40 H new ATOM 1484 N MET A 213 0.684 -5.148 -0.825 1.00 10.51 N ATOM 1485 CA MET A 213 1.563 -4.529 -1.803 1.00 21.25 C ATOM 1486 C MET A 213 2.878 -4.045 -1.170 1.00 3.24 C ATOM 1487 O MET A 213 3.949 -4.264 -1.734 1.00 52.34 O ATOM 1488 CB MET A 213 0.781 -3.412 -2.491 1.00 4.32 C ATOM 1489 CG MET A 213 -0.426 -3.994 -3.250 1.00 12.12 C ATOM 1490 SD MET A 213 -0.796 -3.143 -4.801 1.00 73.43 S ATOM 1491 CE MET A 213 -1.277 -1.573 -4.052 1.00 42.50 C ATOM 0 H MET A 213 -0.147 -4.600 -0.601 1.00 10.51 H new ATOM 0 HA MET A 213 1.871 -5.260 -2.550 1.00 21.25 H new ATOM 0 HB2 MET A 213 0.439 -2.689 -1.751 1.00 4.32 H new ATOM 0 HB3 MET A 213 1.431 -2.877 -3.183 1.00 4.32 H new ATOM 0 HG2 MET A 213 -0.237 -5.047 -3.461 1.00 12.12 H new ATOM 0 HG3 MET A 213 -1.304 -3.951 -2.605 1.00 12.12 H new ATOM 0 HE1 MET A 213 -1.738 -0.936 -4.807 1.00 42.50 H new ATOM 0 HE2 MET A 213 -1.989 -1.757 -3.248 1.00 42.50 H new ATOM 0 HE3 MET A 213 -0.394 -1.077 -3.649 1.00 42.50 H new ATOM 1501 N CYS A 214 2.823 -3.421 0.004 1.00 51.32 N ATOM 1502 CA CYS A 214 3.969 -2.830 0.693 1.00 53.21 C ATOM 1503 C CYS A 214 4.996 -3.877 1.114 1.00 51.44 C ATOM 1504 O CYS A 214 6.198 -3.648 0.986 1.00 21.41 O ATOM 1505 CB CYS A 214 3.502 -2.075 1.944 1.00 45.21 C ATOM 1506 SG CYS A 214 2.726 -0.471 1.635 1.00 25.03 S ATOM 0 H CYS A 214 1.950 -3.309 0.520 1.00 51.32 H new ATOM 0 HA CYS A 214 4.442 -2.148 -0.014 1.00 53.21 H new ATOM 0 HB2 CYS A 214 2.795 -2.704 2.485 1.00 45.21 H new ATOM 0 HB3 CYS A 214 4.360 -1.925 2.599 1.00 45.21 H new ATOM 0 HG CYS A 214 1.520 -0.652 1.186 1.00 25.03 H new ATOM 1511 N VAL A 215 4.549 -5.027 1.615 1.00 44.43 N ATOM 1512 CA VAL A 215 5.438 -6.099 2.058 1.00 44.20 C ATOM 1513 C VAL A 215 6.309 -6.579 0.892 1.00 1.22 C ATOM 1514 O VAL A 215 7.477 -6.935 1.043 1.00 72.44 O ATOM 1515 CB VAL A 215 4.563 -7.218 2.662 1.00 50.13 C ATOM 1516 CG1 VAL A 215 4.206 -8.337 1.677 1.00 54.11 C ATOM 1517 CG2 VAL A 215 5.216 -7.780 3.930 1.00 65.14 C ATOM 0 H VAL A 215 3.558 -5.242 1.725 1.00 44.43 H new ATOM 0 HA VAL A 215 6.130 -5.752 2.825 1.00 44.20 H new ATOM 0 HB VAL A 215 3.612 -6.753 2.921 1.00 50.13 H new ATOM 0 HG11 VAL A 215 3.590 -9.082 2.181 1.00 54.11 H new ATOM 0 HG12 VAL A 215 3.654 -7.919 0.836 1.00 54.11 H new ATOM 0 HG13 VAL A 215 5.120 -8.807 1.314 1.00 54.11 H new ATOM 0 HG21 VAL A 215 4.587 -8.568 4.344 1.00 65.14 H new ATOM 0 HG22 VAL A 215 6.196 -8.189 3.684 1.00 65.14 H new ATOM 0 HG23 VAL A 215 5.330 -6.983 4.665 1.00 65.14 H new ATOM 1527 N THR A 216 5.706 -6.618 -0.287 1.00 53.44 N ATOM 1528 CA THR A 216 6.307 -6.994 -1.541 1.00 34.33 C ATOM 1529 C THR A 216 7.239 -5.857 -1.983 1.00 22.25 C ATOM 1530 O THR A 216 8.330 -6.137 -2.475 1.00 12.43 O ATOM 1531 CB THR A 216 5.099 -7.243 -2.474 1.00 41.13 C ATOM 1532 OG1 THR A 216 4.663 -8.588 -2.420 1.00 64.03 O ATOM 1533 CG2 THR A 216 5.341 -6.912 -3.946 1.00 64.32 C ATOM 0 H THR A 216 4.722 -6.371 -0.391 1.00 53.44 H new ATOM 0 HA THR A 216 6.934 -7.885 -1.519 1.00 34.33 H new ATOM 0 HB THR A 216 4.344 -6.558 -2.089 1.00 41.13 H new ATOM 0 HG1 THR A 216 3.898 -8.708 -3.020 1.00 64.03 H new ATOM 0 HG21 THR A 216 4.437 -7.120 -4.519 1.00 64.32 H new ATOM 0 HG22 THR A 216 5.599 -5.857 -4.044 1.00 64.32 H new ATOM 0 HG23 THR A 216 6.160 -7.523 -4.326 1.00 64.32 H new ATOM 1541 N GLN A 217 6.861 -4.589 -1.786 1.00 12.53 N ATOM 1542 CA GLN A 217 7.703 -3.460 -2.147 1.00 42.21 C ATOM 1543 C GLN A 217 9.015 -3.487 -1.359 1.00 51.32 C ATOM 1544 O GLN A 217 10.061 -3.330 -1.974 1.00 12.14 O ATOM 1545 CB GLN A 217 6.957 -2.134 -1.949 1.00 34.23 C ATOM 1546 CG GLN A 217 7.628 -0.964 -2.684 1.00 53.40 C ATOM 1547 CD GLN A 217 7.428 -1.042 -4.196 1.00 3.13 C ATOM 1548 OE1 GLN A 217 6.375 -0.672 -4.707 1.00 61.22 O ATOM 1549 NE2 GLN A 217 8.399 -1.538 -4.950 1.00 61.41 N ATOM 0 H GLN A 217 5.966 -4.325 -1.374 1.00 12.53 H new ATOM 0 HA GLN A 217 7.950 -3.543 -3.205 1.00 42.21 H new ATOM 0 HB2 GLN A 217 5.932 -2.241 -2.304 1.00 34.23 H new ATOM 0 HB3 GLN A 217 6.904 -1.907 -0.884 1.00 34.23 H new ATOM 0 HG2 GLN A 217 7.221 -0.023 -2.313 1.00 53.40 H new ATOM 0 HG3 GLN A 217 8.695 -0.960 -2.460 1.00 53.40 H new ATOM 0 HE21 GLN A 217 9.272 -1.844 -4.521 1.00 61.41 H new ATOM 0 HE22 GLN A 217 8.273 -1.613 -5.959 1.00 61.41 H new ATOM 1558 N TYR A 218 9.001 -3.746 -0.045 1.00 24.34 N ATOM 1559 CA TYR A 218 10.217 -3.960 0.738 1.00 63.01 C ATOM 1560 C TYR A 218 11.068 -5.021 0.050 1.00 24.44 C ATOM 1561 O TYR A 218 12.247 -4.779 -0.166 1.00 33.15 O ATOM 1562 CB TYR A 218 9.806 -4.434 2.126 1.00 24.44 C ATOM 1563 CG TYR A 218 11.008 -4.823 2.933 1.00 25.35 C ATOM 1564 CD1 TYR A 218 11.786 -3.836 3.552 1.00 61.42 C ATOM 1565 CD2 TYR A 218 11.393 -6.170 2.969 1.00 73.00 C ATOM 1566 CE1 TYR A 218 12.953 -4.217 4.240 1.00 50.33 C ATOM 1567 CE2 TYR A 218 12.523 -6.560 3.696 1.00 65.23 C ATOM 1568 CZ TYR A 218 13.327 -5.578 4.317 1.00 22.45 C ATOM 1569 OH TYR A 218 14.459 -5.928 4.986 1.00 12.15 O ATOM 0 H TYR A 218 8.143 -3.812 0.502 1.00 24.34 H new ATOM 0 HA TYR A 218 10.797 -3.041 0.819 1.00 63.01 H new ATOM 0 HB2 TYR A 218 9.259 -3.643 2.638 1.00 24.44 H new ATOM 0 HB3 TYR A 218 9.130 -5.284 2.039 1.00 24.44 H new ATOM 0 HD1 TYR A 218 11.494 -2.797 3.502 1.00 61.42 H new ATOM 0 HD2 TYR A 218 10.816 -6.909 2.434 1.00 73.00 H new ATOM 0 HE1 TYR A 218 13.567 -3.464 4.712 1.00 50.33 H new ATOM 0 HE2 TYR A 218 12.779 -7.606 3.782 1.00 65.23 H new ATOM 0 HH TYR A 218 14.574 -6.900 4.947 1.00 12.15 H new ATOM 1579 N GLN A 219 10.511 -6.186 -0.293 1.00 1.15 N ATOM 1580 CA GLN A 219 11.291 -7.282 -0.866 1.00 12.35 C ATOM 1581 C GLN A 219 11.911 -6.881 -2.207 1.00 13.41 C ATOM 1582 O GLN A 219 13.058 -7.237 -2.476 1.00 11.34 O ATOM 1583 CB GLN A 219 10.402 -8.528 -1.013 1.00 71.00 C ATOM 1584 CG GLN A 219 10.025 -9.094 0.362 1.00 42.24 C ATOM 1585 CD GLN A 219 8.972 -10.185 0.290 1.00 25.35 C ATOM 1586 OE1 GLN A 219 9.266 -11.355 0.036 1.00 41.34 O ATOM 1587 NE2 GLN A 219 7.729 -9.804 0.512 1.00 74.33 N ATOM 0 H GLN A 219 9.518 -6.393 -0.182 1.00 1.15 H new ATOM 0 HA GLN A 219 12.114 -7.516 -0.191 1.00 12.35 H new ATOM 0 HB2 GLN A 219 9.498 -8.272 -1.566 1.00 71.00 H new ATOM 0 HB3 GLN A 219 10.926 -9.288 -1.593 1.00 71.00 H new ATOM 0 HG2 GLN A 219 10.919 -9.492 0.842 1.00 42.24 H new ATOM 0 HG3 GLN A 219 9.658 -8.285 0.993 1.00 42.24 H new ATOM 0 HE21 GLN A 219 7.525 -8.826 0.719 1.00 74.33 H new ATOM 0 HE22 GLN A 219 6.972 -10.487 0.476 1.00 74.33 H new ATOM 1596 N LYS A 220 11.186 -6.132 -3.042 1.00 74.42 N ATOM 1597 CA LYS A 220 11.709 -5.608 -4.298 1.00 50.21 C ATOM 1598 C LYS A 220 12.842 -4.638 -4.027 1.00 2.14 C ATOM 1599 O LYS A 220 13.969 -4.880 -4.440 1.00 2.43 O ATOM 1600 CB LYS A 220 10.591 -4.960 -5.134 1.00 2.21 C ATOM 1601 CG LYS A 220 9.737 -6.076 -5.738 1.00 33.03 C ATOM 1602 CD LYS A 220 8.690 -5.580 -6.733 1.00 51.11 C ATOM 1603 CE LYS A 220 7.903 -6.749 -7.350 1.00 50.43 C ATOM 1604 NZ LYS A 220 8.777 -7.766 -7.988 1.00 70.41 N ATOM 0 H LYS A 220 10.216 -5.873 -2.861 1.00 74.42 H new ATOM 0 HA LYS A 220 12.108 -6.436 -4.885 1.00 50.21 H new ATOM 0 HB2 LYS A 220 9.979 -4.309 -4.510 1.00 2.21 H new ATOM 0 HB3 LYS A 220 11.017 -4.339 -5.922 1.00 2.21 H new ATOM 0 HG2 LYS A 220 10.390 -6.791 -6.238 1.00 33.03 H new ATOM 0 HG3 LYS A 220 9.235 -6.613 -4.933 1.00 33.03 H new ATOM 0 HD2 LYS A 220 8.001 -4.901 -6.230 1.00 51.11 H new ATOM 0 HD3 LYS A 220 9.178 -5.011 -7.524 1.00 51.11 H new ATOM 0 HE2 LYS A 220 7.306 -7.227 -6.574 1.00 50.43 H new ATOM 0 HE3 LYS A 220 7.207 -6.359 -8.093 1.00 50.43 H new ATOM 0 HZ1 LYS A 220 8.203 -8.384 -8.597 1.00 70.41 H new ATOM 0 HZ2 LYS A 220 9.501 -7.290 -8.563 1.00 70.41 H new ATOM 0 HZ3 LYS A 220 9.239 -8.337 -7.252 1.00 70.41 H new ATOM 1618 N GLU A 221 12.560 -3.561 -3.310 1.00 73.04 N ATOM 1619 CA GLU A 221 13.472 -2.438 -3.187 1.00 24.31 C ATOM 1620 C GLU A 221 14.645 -2.769 -2.257 1.00 73.02 C ATOM 1621 O GLU A 221 15.694 -2.131 -2.338 1.00 62.01 O ATOM 1622 CB GLU A 221 12.686 -1.219 -2.700 1.00 54.10 C ATOM 1623 CG GLU A 221 11.459 -0.911 -3.574 1.00 10.34 C ATOM 1624 CD GLU A 221 11.795 -0.619 -5.032 1.00 1.51 C ATOM 1625 OE1 GLU A 221 12.425 0.426 -5.313 1.00 2.22 O ATOM 1626 OE2 GLU A 221 11.362 -1.416 -5.893 1.00 71.41 O ATOM 0 H GLU A 221 11.687 -3.442 -2.795 1.00 73.04 H new ATOM 0 HA GLU A 221 13.909 -2.215 -4.161 1.00 24.31 H new ATOM 0 HB2 GLU A 221 12.361 -1.389 -1.673 1.00 54.10 H new ATOM 0 HB3 GLU A 221 13.344 -0.350 -2.687 1.00 54.10 H new ATOM 0 HG2 GLU A 221 10.774 -1.758 -3.532 1.00 10.34 H new ATOM 0 HG3 GLU A 221 10.932 -0.054 -3.154 1.00 10.34 H new ATOM 1633 N SER A 222 14.511 -3.802 -1.417 1.00 41.34 N ATOM 1634 CA SER A 222 15.612 -4.429 -0.703 1.00 74.23 C ATOM 1635 C SER A 222 16.642 -4.915 -1.711 1.00 41.12 C ATOM 1636 O SER A 222 17.818 -4.573 -1.589 1.00 30.23 O ATOM 1637 CB SER A 222 15.110 -5.572 0.189 1.00 53.30 C ATOM 1638 OG SER A 222 14.436 -5.023 1.296 1.00 71.24 O ATOM 0 H SER A 222 13.608 -4.231 -1.215 1.00 41.34 H new ATOM 0 HA SER A 222 16.081 -3.699 -0.043 1.00 74.23 H new ATOM 0 HB2 SER A 222 14.442 -6.224 -0.374 1.00 53.30 H new ATOM 0 HB3 SER A 222 15.947 -6.185 0.523 1.00 53.30 H new ATOM 0 HG SER A 222 13.546 -4.720 1.020 1.00 71.24 H new ATOM 1644 N GLN A 223 16.206 -5.647 -2.736 1.00 51.40 N ATOM 1645 CA GLN A 223 17.047 -6.101 -3.834 1.00 70.42 C ATOM 1646 C GLN A 223 17.476 -4.944 -4.767 1.00 45.23 C ATOM 1647 O GLN A 223 17.994 -5.217 -5.852 1.00 1.43 O ATOM 1648 CB GLN A 223 16.321 -7.199 -4.624 1.00 74.34 C ATOM 1649 CG GLN A 223 15.953 -8.460 -3.834 1.00 62.34 C ATOM 1650 CD GLN A 223 15.003 -9.334 -4.650 1.00 73.03 C ATOM 1651 OE1 GLN A 223 15.422 -10.132 -5.484 1.00 74.21 O ATOM 1652 NE2 GLN A 223 13.703 -9.200 -4.447 1.00 70.21 N ATOM 0 H GLN A 223 15.235 -5.946 -2.824 1.00 51.40 H new ATOM 0 HA GLN A 223 17.962 -6.509 -3.404 1.00 70.42 H new ATOM 0 HB2 GLN A 223 15.407 -6.776 -5.041 1.00 74.34 H new ATOM 0 HB3 GLN A 223 16.950 -7.491 -5.465 1.00 74.34 H new ATOM 0 HG2 GLN A 223 16.855 -9.021 -3.589 1.00 62.34 H new ATOM 0 HG3 GLN A 223 15.484 -8.183 -2.890 1.00 62.34 H new ATOM 0 HE21 GLN A 223 13.361 -8.535 -3.753 1.00 70.21 H new ATOM 0 HE22 GLN A 223 13.042 -9.761 -4.985 1.00 70.21 H new ATOM 1661 N ALA A 224 17.289 -3.682 -4.364 1.00 5.55 N ATOM 1662 CA ALA A 224 17.862 -2.482 -4.966 1.00 71.03 C ATOM 1663 C ALA A 224 18.604 -1.617 -3.924 1.00 24.32 C ATOM 1664 O ALA A 224 18.966 -0.477 -4.216 1.00 42.23 O ATOM 1665 CB ALA A 224 16.743 -1.692 -5.652 1.00 23.12 C ATOM 0 H ALA A 224 16.698 -3.463 -3.562 1.00 5.55 H new ATOM 0 HA ALA A 224 18.606 -2.776 -5.706 1.00 71.03 H new ATOM 0 HB1 ALA A 224 17.158 -0.792 -6.106 1.00 23.12 H new ATOM 0 HB2 ALA A 224 16.283 -2.309 -6.424 1.00 23.12 H new ATOM 0 HB3 ALA A 224 15.991 -1.412 -4.915 1.00 23.12 H new ATOM 1671 N TYR A 225 18.806 -2.117 -2.699 1.00 73.33 N ATOM 1672 CA TYR A 225 19.535 -1.466 -1.618 1.00 3.25 C ATOM 1673 C TYR A 225 20.685 -2.382 -1.210 1.00 23.15 C ATOM 1674 O TYR A 225 21.849 -2.010 -1.360 1.00 52.20 O ATOM 1675 CB TYR A 225 18.575 -1.117 -0.462 1.00 5.23 C ATOM 1676 CG TYR A 225 19.027 -1.487 0.943 1.00 64.40 C ATOM 1677 CD1 TYR A 225 20.025 -0.764 1.623 1.00 25.43 C ATOM 1678 CD2 TYR A 225 18.438 -2.598 1.566 1.00 11.53 C ATOM 1679 CE1 TYR A 225 20.418 -1.146 2.926 1.00 52.21 C ATOM 1680 CE2 TYR A 225 18.851 -3.010 2.838 1.00 34.34 C ATOM 1681 CZ TYR A 225 19.865 -2.300 3.520 1.00 42.24 C ATOM 1682 OH TYR A 225 20.320 -2.731 4.728 1.00 3.24 O ATOM 0 H TYR A 225 18.445 -3.032 -2.427 1.00 73.33 H new ATOM 0 HA TYR A 225 19.962 -0.515 -1.937 1.00 3.25 H new ATOM 0 HB2 TYR A 225 18.390 -0.043 -0.487 1.00 5.23 H new ATOM 0 HB3 TYR A 225 17.621 -1.609 -0.652 1.00 5.23 H new ATOM 0 HD1 TYR A 225 20.492 0.086 1.148 1.00 25.43 H new ATOM 0 HD2 TYR A 225 17.656 -3.142 1.057 1.00 11.53 H new ATOM 0 HE1 TYR A 225 21.142 -0.554 3.467 1.00 52.21 H new ATOM 0 HE2 TYR A 225 18.394 -3.873 3.300 1.00 34.34 H new ATOM 0 HH TYR A 225 20.631 -1.964 5.253 1.00 3.24 H new ATOM 1692 N TYR A 226 20.388 -3.593 -0.728 1.00 11.31 N ATOM 1693 CA TYR A 226 21.409 -4.491 -0.205 1.00 14.11 C ATOM 1694 C TYR A 226 22.088 -5.262 -1.322 1.00 14.13 C ATOM 1695 O TYR A 226 23.152 -5.844 -1.137 1.00 51.23 O ATOM 1696 CB TYR A 226 20.798 -5.462 0.815 1.00 22.34 C ATOM 1697 CG TYR A 226 20.095 -6.696 0.256 1.00 51.41 C ATOM 1698 CD1 TYR A 226 20.856 -7.792 -0.191 1.00 44.54 C ATOM 1699 CD2 TYR A 226 18.693 -6.751 0.146 1.00 50.13 C ATOM 1700 CE1 TYR A 226 20.248 -8.900 -0.791 1.00 54.10 C ATOM 1701 CE2 TYR A 226 18.064 -7.868 -0.434 1.00 21.13 C ATOM 1702 CZ TYR A 226 18.845 -8.934 -0.933 1.00 42.31 C ATOM 1703 OH TYR A 226 18.252 -9.958 -1.599 1.00 53.40 O ATOM 0 H TYR A 226 19.441 -3.971 -0.692 1.00 11.31 H new ATOM 0 HA TYR A 226 22.164 -3.884 0.294 1.00 14.11 H new ATOM 0 HB2 TYR A 226 21.592 -5.797 1.483 1.00 22.34 H new ATOM 0 HB3 TYR A 226 20.082 -4.909 1.423 1.00 22.34 H new ATOM 0 HD1 TYR A 226 21.929 -7.778 -0.069 1.00 44.54 H new ATOM 0 HD2 TYR A 226 18.095 -5.929 0.510 1.00 50.13 H new ATOM 0 HE1 TYR A 226 20.850 -9.725 -1.144 1.00 54.10 H new ATOM 0 HE2 TYR A 226 16.987 -7.910 -0.498 1.00 21.13 H new ATOM 0 HH TYR A 226 17.281 -9.827 -1.603 1.00 53.40 H new