USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 805 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 199 THR OG1 : rot -94:sc= 2.66 USER MOD Set 1.2: A 201 THR OG1 : rot 72:sc= 1.37 USER MOD Set 2.1: A 128 TYR OH : rot 132:sc= 0.336 USER MOD Set 2.2: A 162 TYR OH : rot 180:sc= 0 USER MOD Set 2.3: A 186 GLN : amide:sc= -0.461 K(o=-0.12,f=-1.5!) USER MOD Set 3.1: A 169 TYR OH : rot -164:sc= 1.22 USER MOD Set 3.2: A 172 GLN : amide:sc= 1.12 K(o=2.3,f=-2.5!) USER MOD Set 4.1: A 171 ASN : amide:sc= 1.17 K(o=1.3,f=-9.4!) USER MOD Set 4.2: A 174 ASN : amide:sc= 0.153 K(o=1.3,f=-0.004) USER MOD Single : A 129 MET CE :methyl 149:sc= -0.0242 (180deg=-0.473) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 134 MET CE :methyl -139:sc= -1.92 (180deg=-5.59!) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 138 MET CE :methyl 161:sc= -0.448 (180deg=-0.76) USER MOD Single : A 139 MET CE :methyl -156:sc= -0.814 (180deg=-2.18) USER MOD Single : A 140 HIS : no HE2:sc= 0.588 K(o=0.59,f=-5.6!) USER MOD Single : A 143 ASN : amide:sc= -0.143 K(o=-0.14,f=-3.2!) USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot -5:sc= -0.181 USER MOD Single : A 153 ASN : amide:sc= 0.974 K(o=0.97,f=-0.28) USER MOD Single : A 154 MET CE :methyl -179:sc= 0 (180deg=-8.32e-05) USER MOD Single : A 155 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 TYR OH : rot 1:sc= 0.812 USER MOD Single : A 159 ASN : amide:sc= -0.471 X(o=-0.47,f=-0.035) USER MOD Single : A 160 GLN : amide:sc= -2.36 K(o=-2.4,f=-0.0062) USER MOD Single : A 163 TYR OH : rot -144:sc= 1.12 USER MOD Single : A 168 GLN : amide:sc= 0.38 X(o=0.38,f=-0.0022) USER MOD Single : A 170 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 173 ASN : amide:sc= 0.157 K(o=0.16,f=-1.7!) USER MOD Single : A 177 HIS : no HD1:sc= 1.2 K(o=1.2,f=-3.8!) USER MOD Single : A 181 ASN : amide:sc= -0.166 K(o=-0.17,f=-2.4!) USER MOD Single : A 183 THR OG1 : rot 99:sc= 1.54 USER MOD Single : A 185 LYS NZ :NH3+ -168:sc= -0.0015 (180deg=-0.134) USER MOD Single : A 187 HIS : no HD1:sc= -0.253 X(o=-0.25,f=-0.25) USER MOD Single : A 188 THR OG1 : rot -84:sc= 1.23 USER MOD Single : A 190 THR OG1 : rot 72:sc= 1.34 USER MOD Single : A 191 THR OG1 : rot 180:sc= 0 USER MOD Single : A 192 THR OG1 : rot 46:sc= 1.18 USER MOD Single : A 193 THR OG1 : rot -81:sc= 1.29 USER MOD Single : A 194 LYS NZ :NH3+ 151:sc= 1.26 (180deg=-0.494) USER MOD Single : A 197 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 204 LYS NZ :NH3+ -120:sc= 0.243 (180deg=-0.0875) USER MOD Single : A 206 MET CE :methyl 170:sc= -2.06 (180deg=-2.12) USER MOD Single : A 212 GLN : amide:sc= -0.082 X(o=-0.082,f=-0.082) USER MOD Single : A 213 MET CE :methyl -161:sc= -0.341 (180deg=-0.935) USER MOD Single : A 215 THR OG1 : rot 180:sc= -0.0458 USER MOD Single : A 216 THR OG1 : rot 86:sc= 1.08 USER MOD Single : A 217 GLN : amide:sc= -0.0457 X(o=-0.046,f=0) USER MOD Single : A 218 TYR OH : rot -112:sc= 0.709 USER MOD Single : A 219 GLN : amide:sc= -0.515 X(o=-0.51,f=-0.9) USER MOD Single : A 220 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 222 SER OG : rot 93:sc= 1.23 USER MOD Single : A 223 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 225 TYR OH : rot -170:sc= 1.08 USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 125 11.793 -12.956 -5.118 1.00 0.00 N ATOM 2 CA LEU A 125 10.912 -12.311 -6.103 1.00 0.00 C ATOM 3 C LEU A 125 11.594 -11.904 -7.419 1.00 0.00 C ATOM 4 O LEU A 125 11.144 -12.274 -8.509 1.00 0.00 O ATOM 5 CB LEU A 125 10.280 -11.078 -5.464 1.00 0.00 C ATOM 6 CG LEU A 125 9.457 -11.264 -4.182 1.00 0.00 C ATOM 7 CD1 LEU A 125 8.208 -10.412 -4.339 1.00 0.00 C ATOM 8 CD2 LEU A 125 9.021 -12.658 -3.767 1.00 0.00 C ATOM 0 HA LEU A 125 10.169 -13.060 -6.378 1.00 0.00 H new ATOM 0 HB2 LEU A 125 11.079 -10.370 -5.246 1.00 0.00 H new ATOM 0 HB3 LEU A 125 9.635 -10.611 -6.208 1.00 0.00 H new ATOM 0 HG LEU A 125 10.144 -10.981 -3.384 1.00 0.00 H new ATOM 0 HD11 LEU A 125 7.586 -10.510 -3.449 1.00 0.00 H new ATOM 0 HD12 LEU A 125 8.494 -9.368 -4.469 1.00 0.00 H new ATOM 0 HD13 LEU A 125 7.647 -10.746 -5.212 1.00 0.00 H new ATOM 0 HD21 LEU A 125 8.450 -12.600 -2.840 1.00 0.00 H new ATOM 0 HD22 LEU A 125 8.399 -13.093 -4.549 1.00 0.00 H new ATOM 0 HD23 LEU A 125 9.900 -13.284 -3.613 1.00 0.00 H new ATOM 20 N GLY A 126 12.637 -11.082 -7.287 1.00 0.00 N ATOM 21 CA GLY A 126 13.434 -10.465 -8.351 1.00 0.00 C ATOM 22 C GLY A 126 13.930 -9.046 -8.019 1.00 0.00 C ATOM 23 O GLY A 126 14.945 -8.601 -8.562 1.00 0.00 O ATOM 0 H GLY A 126 12.973 -10.809 -6.363 1.00 0.00 H new ATOM 0 HA2 GLY A 126 14.295 -11.100 -8.561 1.00 0.00 H new ATOM 0 HA3 GLY A 126 12.837 -10.426 -9.262 1.00 0.00 H new ATOM 27 N GLY A 127 13.266 -8.338 -7.095 1.00 0.00 N ATOM 28 CA GLY A 127 13.745 -7.066 -6.570 1.00 0.00 C ATOM 29 C GLY A 127 12.657 -6.270 -5.865 1.00 0.00 C ATOM 30 O GLY A 127 12.217 -5.262 -6.410 1.00 0.00 O ATOM 0 H GLY A 127 12.378 -8.639 -6.693 1.00 0.00 H new ATOM 0 HA2 GLY A 127 14.562 -7.251 -5.873 1.00 0.00 H new ATOM 0 HA3 GLY A 127 14.152 -6.471 -7.388 1.00 0.00 H new ATOM 34 N TYR A 128 12.246 -6.703 -4.663 1.00 0.00 N ATOM 35 CA TYR A 128 11.436 -5.876 -3.789 1.00 0.00 C ATOM 36 C TYR A 128 12.087 -5.622 -2.430 1.00 0.00 C ATOM 37 O TYR A 128 13.014 -6.315 -2.006 1.00 0.00 O ATOM 38 CB TYR A 128 10.029 -6.446 -3.673 1.00 0.00 C ATOM 39 CG TYR A 128 9.758 -7.599 -2.706 1.00 0.00 C ATOM 40 CD1 TYR A 128 10.751 -8.480 -2.217 1.00 0.00 C ATOM 41 CD2 TYR A 128 8.423 -7.802 -2.320 1.00 0.00 C ATOM 42 CE1 TYR A 128 10.414 -9.503 -1.299 1.00 0.00 C ATOM 43 CE2 TYR A 128 8.077 -8.841 -1.445 1.00 0.00 C ATOM 44 CZ TYR A 128 9.064 -9.696 -0.926 1.00 0.00 C ATOM 45 OH TYR A 128 8.660 -10.730 -0.134 1.00 0.00 O ATOM 0 H TYR A 128 12.468 -7.624 -4.284 1.00 0.00 H new ATOM 0 HA TYR A 128 11.360 -4.891 -4.249 1.00 0.00 H new ATOM 0 HB2 TYR A 128 9.367 -5.626 -3.396 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.728 -6.777 -4.667 1.00 0.00 H new ATOM 0 HD1 TYR A 128 11.774 -8.371 -2.547 1.00 0.00 H new ATOM 0 HD2 TYR A 128 7.653 -7.149 -2.702 1.00 0.00 H new ATOM 0 HE1 TYR A 128 11.186 -10.134 -0.885 1.00 0.00 H new ATOM 0 HE2 TYR A 128 7.043 -8.986 -1.167 1.00 0.00 H new ATOM 0 HH TYR A 128 8.083 -10.388 0.581 1.00 0.00 H new ATOM 55 N MET A 129 11.582 -4.564 -1.797 1.00 0.00 N ATOM 56 CA MET A 129 12.095 -3.901 -0.600 1.00 0.00 C ATOM 57 C MET A 129 10.903 -3.286 0.125 1.00 0.00 C ATOM 58 O MET A 129 10.270 -2.377 -0.404 1.00 0.00 O ATOM 59 CB MET A 129 13.078 -2.784 -0.987 1.00 0.00 C ATOM 60 CG MET A 129 14.434 -3.353 -1.414 1.00 0.00 C ATOM 61 SD MET A 129 15.336 -4.296 -0.147 1.00 0.00 S ATOM 62 CE MET A 129 16.106 -5.520 -1.232 1.00 0.00 C ATOM 0 H MET A 129 10.733 -4.112 -2.137 1.00 0.00 H new ATOM 0 HA MET A 129 12.619 -4.619 0.032 1.00 0.00 H new ATOM 0 HB2 MET A 129 12.657 -2.194 -1.801 1.00 0.00 H new ATOM 0 HB3 MET A 129 13.215 -2.110 -0.142 1.00 0.00 H new ATOM 0 HG2 MET A 129 14.279 -3.999 -2.278 1.00 0.00 H new ATOM 0 HG3 MET A 129 15.065 -2.527 -1.742 1.00 0.00 H new ATOM 0 HE1 MET A 129 17.066 -5.823 -0.815 1.00 0.00 H new ATOM 0 HE2 MET A 129 15.456 -6.391 -1.317 1.00 0.00 H new ATOM 0 HE3 MET A 129 16.260 -5.085 -2.219 1.00 0.00 H new ATOM 72 N LEU A 130 10.550 -3.790 1.307 1.00 0.00 N ATOM 73 CA LEU A 130 9.556 -3.151 2.148 1.00 0.00 C ATOM 74 C LEU A 130 10.158 -1.872 2.746 1.00 0.00 C ATOM 75 O LEU A 130 11.291 -1.882 3.227 1.00 0.00 O ATOM 76 CB LEU A 130 9.084 -4.174 3.198 1.00 0.00 C ATOM 77 CG LEU A 130 7.608 -4.027 3.581 1.00 0.00 C ATOM 78 CD1 LEU A 130 7.119 -5.211 4.406 1.00 0.00 C ATOM 79 CD2 LEU A 130 7.388 -2.757 4.377 1.00 0.00 C ATOM 0 H LEU A 130 10.944 -4.645 1.700 1.00 0.00 H new ATOM 0 HA LEU A 130 8.675 -2.841 1.586 1.00 0.00 H new ATOM 0 HB2 LEU A 130 9.252 -5.180 2.813 1.00 0.00 H new ATOM 0 HB3 LEU A 130 9.695 -4.069 4.095 1.00 0.00 H new ATOM 0 HG LEU A 130 7.042 -3.987 2.651 1.00 0.00 H new ATOM 0 HD11 LEU A 130 6.068 -5.070 4.658 1.00 0.00 H new ATOM 0 HD12 LEU A 130 7.234 -6.129 3.829 1.00 0.00 H new ATOM 0 HD13 LEU A 130 7.705 -5.283 5.322 1.00 0.00 H new ATOM 0 HD21 LEU A 130 6.334 -2.670 4.640 1.00 0.00 H new ATOM 0 HD22 LEU A 130 7.987 -2.790 5.287 1.00 0.00 H new ATOM 0 HD23 LEU A 130 7.685 -1.896 3.778 1.00 0.00 H new ATOM 91 N GLY A 131 9.413 -0.766 2.710 1.00 0.00 N ATOM 92 CA GLY A 131 9.759 0.443 3.453 1.00 0.00 C ATOM 93 C GLY A 131 9.680 0.196 4.962 1.00 0.00 C ATOM 94 O GLY A 131 10.635 -0.262 5.601 1.00 0.00 O ATOM 0 H GLY A 131 8.554 -0.685 2.165 1.00 0.00 H new ATOM 0 HA2 GLY A 131 10.765 0.764 3.185 1.00 0.00 H new ATOM 0 HA3 GLY A 131 9.082 1.251 3.176 1.00 0.00 H new ATOM 98 N SER A 132 8.511 0.482 5.527 1.00 0.00 N ATOM 99 CA SER A 132 8.185 0.424 6.941 1.00 0.00 C ATOM 100 C SER A 132 6.680 0.675 7.064 1.00 0.00 C ATOM 101 O SER A 132 6.016 1.065 6.101 1.00 0.00 O ATOM 102 CB SER A 132 8.999 1.457 7.750 1.00 0.00 C ATOM 103 OG SER A 132 9.497 2.549 6.989 1.00 0.00 O ATOM 0 H SER A 132 7.713 0.781 4.966 1.00 0.00 H new ATOM 0 HA SER A 132 8.444 -0.551 7.354 1.00 0.00 H new ATOM 0 HB2 SER A 132 8.371 1.847 8.551 1.00 0.00 H new ATOM 0 HB3 SER A 132 9.839 0.948 8.222 1.00 0.00 H new ATOM 0 HG SER A 132 9.997 3.155 7.575 1.00 0.00 H new ATOM 109 N ALA A 133 6.130 0.386 8.237 1.00 0.00 N ATOM 110 CA ALA A 133 4.709 0.526 8.507 1.00 0.00 C ATOM 111 C ALA A 133 4.237 1.989 8.621 1.00 0.00 C ATOM 112 O ALA A 133 5.024 2.928 8.795 1.00 0.00 O ATOM 113 CB ALA A 133 4.400 -0.281 9.774 1.00 0.00 C ATOM 0 H ALA A 133 6.666 0.044 9.035 1.00 0.00 H new ATOM 0 HA ALA A 133 4.149 0.137 7.656 1.00 0.00 H new ATOM 0 HB1 ALA A 133 3.339 -0.199 10.008 1.00 0.00 H new ATOM 0 HB2 ALA A 133 4.655 -1.328 9.610 1.00 0.00 H new ATOM 0 HB3 ALA A 133 4.986 0.109 10.606 1.00 0.00 H new ATOM 119 N MET A 134 2.915 2.154 8.572 1.00 0.00 N ATOM 120 CA MET A 134 2.170 3.392 8.780 1.00 0.00 C ATOM 121 C MET A 134 1.127 3.251 9.896 1.00 0.00 C ATOM 122 O MET A 134 0.401 2.250 9.991 1.00 0.00 O ATOM 123 CB MET A 134 1.472 3.810 7.478 1.00 0.00 C ATOM 124 CG MET A 134 0.794 2.642 6.758 1.00 0.00 C ATOM 125 SD MET A 134 -0.378 3.087 5.463 1.00 0.00 S ATOM 126 CE MET A 134 -0.298 1.583 4.450 1.00 0.00 C ATOM 0 H MET A 134 2.295 1.370 8.372 1.00 0.00 H new ATOM 0 HA MET A 134 2.885 4.157 9.081 1.00 0.00 H new ATOM 0 HB2 MET A 134 0.727 4.573 7.701 1.00 0.00 H new ATOM 0 HB3 MET A 134 2.204 4.265 6.810 1.00 0.00 H new ATOM 0 HG2 MET A 134 1.568 2.012 6.319 1.00 0.00 H new ATOM 0 HG3 MET A 134 0.273 2.037 7.500 1.00 0.00 H new ATOM 0 HE1 MET A 134 -0.298 1.855 3.394 1.00 0.00 H new ATOM 0 HE2 MET A 134 0.615 1.035 4.684 1.00 0.00 H new ATOM 0 HE3 MET A 134 -1.163 0.955 4.663 1.00 0.00 H new ATOM 136 N SER A 135 1.077 4.266 10.763 1.00 0.00 N ATOM 137 CA SER A 135 0.095 4.417 11.832 1.00 0.00 C ATOM 138 C SER A 135 -1.223 4.966 11.288 1.00 0.00 C ATOM 139 O SER A 135 -1.304 6.156 10.943 1.00 0.00 O ATOM 140 CB SER A 135 0.629 5.351 12.908 1.00 0.00 C ATOM 141 OG SER A 135 -0.206 5.239 14.040 1.00 0.00 O ATOM 0 H SER A 135 1.748 5.034 10.735 1.00 0.00 H new ATOM 0 HA SER A 135 -0.087 3.433 12.264 1.00 0.00 H new ATOM 0 HB2 SER A 135 1.655 5.088 13.165 1.00 0.00 H new ATOM 0 HB3 SER A 135 0.644 6.379 12.546 1.00 0.00 H new ATOM 0 HG SER A 135 0.121 5.832 14.748 1.00 0.00 H new ATOM 147 N ARG A 136 -2.219 4.075 11.188 1.00 0.00 N ATOM 148 CA ARG A 136 -3.553 4.229 10.601 1.00 0.00 C ATOM 149 C ARG A 136 -3.850 5.579 9.912 1.00 0.00 C ATOM 150 O ARG A 136 -4.277 6.526 10.586 1.00 0.00 O ATOM 151 CB ARG A 136 -4.660 3.810 11.577 1.00 0.00 C ATOM 152 CG ARG A 136 -4.554 4.347 12.998 1.00 0.00 C ATOM 153 CD ARG A 136 -3.903 3.268 13.867 1.00 0.00 C ATOM 154 NE ARG A 136 -3.556 3.853 15.145 1.00 0.00 N ATOM 155 CZ ARG A 136 -2.816 3.329 16.103 1.00 0.00 C ATOM 156 NH1 ARG A 136 -2.481 2.063 16.140 1.00 0.00 N ATOM 157 NH2 ARG A 136 -2.378 4.124 17.043 1.00 0.00 N ATOM 0 H ARG A 136 -2.095 3.131 11.555 1.00 0.00 H new ATOM 0 HA ARG A 136 -3.548 3.528 9.766 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -5.617 4.127 11.163 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -4.678 2.721 11.625 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -3.959 5.260 13.016 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -5.541 4.602 13.383 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -4.587 2.431 14.007 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -3.013 2.873 13.377 1.00 0.00 H new ATOM 0 HE ARG A 136 -3.930 4.785 15.327 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -2.795 1.431 15.404 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -1.906 1.710 16.905 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -2.611 5.117 17.021 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -1.803 3.752 17.799 1.00 0.00 H new ATOM 171 N PRO A 137 -3.660 5.675 8.579 1.00 0.00 N ATOM 172 CA PRO A 137 -3.900 6.859 7.760 1.00 0.00 C ATOM 173 C PRO A 137 -5.006 7.844 8.144 1.00 0.00 C ATOM 174 O PRO A 137 -4.742 9.052 8.174 1.00 0.00 O ATOM 175 CB PRO A 137 -4.179 6.293 6.379 1.00 0.00 C ATOM 176 CG PRO A 137 -3.340 5.033 6.292 1.00 0.00 C ATOM 177 CD PRO A 137 -2.979 4.697 7.726 1.00 0.00 C ATOM 0 HA PRO A 137 -3.024 7.497 7.875 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -5.238 6.071 6.251 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -3.905 7.004 5.599 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -3.897 4.220 5.825 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -2.447 5.195 5.689 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -3.292 3.683 7.975 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -1.900 4.742 7.873 1.00 0.00 H new ATOM 185 N MET A 138 -6.234 7.342 8.349 1.00 0.00 N ATOM 186 CA MET A 138 -7.485 8.116 8.497 1.00 0.00 C ATOM 187 C MET A 138 -7.562 9.221 7.430 1.00 0.00 C ATOM 188 O MET A 138 -7.764 10.408 7.688 1.00 0.00 O ATOM 189 CB MET A 138 -7.655 8.610 9.944 1.00 0.00 C ATOM 190 CG MET A 138 -7.679 7.450 10.948 1.00 0.00 C ATOM 191 SD MET A 138 -9.041 6.266 10.728 1.00 0.00 S ATOM 192 CE MET A 138 -8.516 4.999 11.915 1.00 0.00 C ATOM 0 H MET A 138 -6.393 6.337 8.420 1.00 0.00 H new ATOM 0 HA MET A 138 -8.343 7.470 8.313 1.00 0.00 H new ATOM 0 HB2 MET A 138 -6.839 9.289 10.194 1.00 0.00 H new ATOM 0 HB3 MET A 138 -8.580 9.180 10.026 1.00 0.00 H new ATOM 0 HG2 MET A 138 -6.735 6.910 10.878 1.00 0.00 H new ATOM 0 HG3 MET A 138 -7.737 7.863 11.955 1.00 0.00 H new ATOM 0 HE1 MET A 138 -9.366 4.367 12.173 1.00 0.00 H new ATOM 0 HE2 MET A 138 -7.731 4.387 11.471 1.00 0.00 H new ATOM 0 HE3 MET A 138 -8.135 5.480 12.816 1.00 0.00 H new ATOM 202 N MET A 139 -7.345 8.788 6.191 1.00 0.00 N ATOM 203 CA MET A 139 -7.093 9.549 4.980 1.00 0.00 C ATOM 204 C MET A 139 -8.355 9.817 4.159 1.00 0.00 C ATOM 205 O MET A 139 -8.282 10.009 2.943 1.00 0.00 O ATOM 206 CB MET A 139 -6.007 8.818 4.184 1.00 0.00 C ATOM 207 CG MET A 139 -6.357 7.403 3.744 1.00 0.00 C ATOM 208 SD MET A 139 -4.974 6.612 2.901 1.00 0.00 S ATOM 209 CE MET A 139 -5.080 7.404 1.285 1.00 0.00 C ATOM 0 H MET A 139 -7.342 7.787 5.995 1.00 0.00 H new ATOM 0 HA MET A 139 -6.743 10.546 5.249 1.00 0.00 H new ATOM 0 HB2 MET A 139 -5.772 9.408 3.298 1.00 0.00 H new ATOM 0 HB3 MET A 139 -5.102 8.778 4.790 1.00 0.00 H new ATOM 0 HG2 MET A 139 -6.641 6.810 4.613 1.00 0.00 H new ATOM 0 HG3 MET A 139 -7.221 7.431 3.080 1.00 0.00 H new ATOM 0 HE1 MET A 139 -4.613 6.765 0.535 1.00 0.00 H new ATOM 0 HE2 MET A 139 -6.127 7.563 1.026 1.00 0.00 H new ATOM 0 HE3 MET A 139 -4.564 8.364 1.316 1.00 0.00 H new ATOM 219 N HIS A 140 -9.489 9.878 4.864 1.00 0.00 N ATOM 220 CA HIS A 140 -10.873 9.875 4.401 1.00 0.00 C ATOM 221 C HIS A 140 -11.057 10.196 2.912 1.00 0.00 C ATOM 222 O HIS A 140 -10.840 11.322 2.447 1.00 0.00 O ATOM 223 CB HIS A 140 -11.562 10.941 5.257 1.00 0.00 C ATOM 224 CG HIS A 140 -11.460 10.686 6.745 1.00 0.00 C ATOM 225 ND1 HIS A 140 -12.065 9.643 7.408 1.00 0.00 N ATOM 226 CD2 HIS A 140 -10.699 11.373 7.651 1.00 0.00 C ATOM 227 CE1 HIS A 140 -11.684 9.681 8.696 1.00 0.00 C ATOM 228 NE2 HIS A 140 -10.852 10.729 8.868 1.00 0.00 N ATOM 0 H HIS A 140 -9.451 9.937 5.882 1.00 0.00 H new ATOM 0 HA HIS A 140 -11.291 8.874 4.505 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -11.123 11.913 5.033 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -12.614 10.994 4.978 1.00 0.00 H new ATOM 0 HD1 HIS A 140 -12.696 8.957 6.992 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -10.096 12.247 7.455 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -11.992 8.988 9.465 1.00 0.00 H new ATOM 237 N PHE A 141 -11.402 9.149 2.161 1.00 0.00 N ATOM 238 CA PHE A 141 -11.432 9.110 0.697 1.00 0.00 C ATOM 239 C PHE A 141 -12.430 10.110 0.119 1.00 0.00 C ATOM 240 O PHE A 141 -12.164 10.789 -0.877 1.00 0.00 O ATOM 241 CB PHE A 141 -11.756 7.676 0.250 1.00 0.00 C ATOM 242 CG PHE A 141 -11.026 6.603 1.035 1.00 0.00 C ATOM 243 CD1 PHE A 141 -9.619 6.588 1.051 1.00 0.00 C ATOM 244 CD2 PHE A 141 -11.750 5.677 1.813 1.00 0.00 C ATOM 245 CE1 PHE A 141 -8.931 5.645 1.833 1.00 0.00 C ATOM 246 CE2 PHE A 141 -11.057 4.759 2.621 1.00 0.00 C ATOM 247 CZ PHE A 141 -9.649 4.741 2.629 1.00 0.00 C ATOM 0 H PHE A 141 -11.682 8.261 2.577 1.00 0.00 H new ATOM 0 HA PHE A 141 -10.454 9.401 0.315 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -12.830 7.512 0.343 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -11.507 7.571 -0.806 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -9.066 7.304 0.460 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -12.830 5.673 1.788 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -7.851 5.616 1.821 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -11.607 4.064 3.239 1.00 0.00 H new ATOM 0 HZ PHE A 141 -9.122 4.031 3.249 1.00 0.00 H new ATOM 257 N GLY A 142 -13.553 10.242 0.816 1.00 0.00 N ATOM 258 CA GLY A 142 -14.623 11.217 0.579 1.00 0.00 C ATOM 259 C GLY A 142 -16.014 10.581 0.596 1.00 0.00 C ATOM 260 O GLY A 142 -17.028 11.270 0.693 1.00 0.00 O ATOM 0 H GLY A 142 -13.758 9.637 1.611 1.00 0.00 H new ATOM 0 HA2 GLY A 142 -14.575 11.996 1.340 1.00 0.00 H new ATOM 0 HA3 GLY A 142 -14.461 11.702 -0.384 1.00 0.00 H new ATOM 264 N ASN A 143 -16.020 9.252 0.557 1.00 0.00 N ATOM 265 CA ASN A 143 -17.098 8.306 0.699 1.00 0.00 C ATOM 266 C ASN A 143 -17.595 8.243 2.154 1.00 0.00 C ATOM 267 O ASN A 143 -17.179 8.993 3.044 1.00 0.00 O ATOM 268 CB ASN A 143 -16.488 6.960 0.278 1.00 0.00 C ATOM 269 CG ASN A 143 -15.835 6.963 -1.104 1.00 0.00 C ATOM 270 OD1 ASN A 143 -14.743 7.492 -1.324 1.00 0.00 O ATOM 271 ND2 ASN A 143 -16.448 6.330 -2.073 1.00 0.00 N ATOM 0 H ASN A 143 -15.142 8.757 0.403 1.00 0.00 H new ATOM 0 HA ASN A 143 -17.963 8.580 0.096 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -15.743 6.667 1.017 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -17.270 6.200 0.295 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -16.022 6.278 -2.998 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -17.352 5.889 -1.902 1.00 0.00 H new ATOM 278 N ASP A 144 -18.455 7.263 2.389 1.00 0.00 N ATOM 279 CA ASP A 144 -18.929 6.801 3.687 1.00 0.00 C ATOM 280 C ASP A 144 -18.649 5.314 3.836 1.00 0.00 C ATOM 281 O ASP A 144 -17.939 4.909 4.754 1.00 0.00 O ATOM 282 CB ASP A 144 -20.421 7.103 3.857 1.00 0.00 C ATOM 283 CG ASP A 144 -20.631 8.580 4.145 1.00 0.00 C ATOM 284 OD1 ASP A 144 -20.175 9.041 5.228 1.00 0.00 O ATOM 285 OD2 ASP A 144 -21.230 9.300 3.305 1.00 0.00 O ATOM 0 H ASP A 144 -18.870 6.731 1.624 1.00 0.00 H new ATOM 0 HA ASP A 144 -18.394 7.335 4.472 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -20.961 6.821 2.953 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -20.829 6.505 4.672 1.00 0.00 H new ATOM 290 N TRP A 145 -19.163 4.499 2.909 1.00 0.00 N ATOM 291 CA TRP A 145 -19.078 3.045 3.029 1.00 0.00 C ATOM 292 C TRP A 145 -17.645 2.572 2.785 1.00 0.00 C ATOM 293 O TRP A 145 -17.175 1.703 3.508 1.00 0.00 O ATOM 294 CB TRP A 145 -20.088 2.343 2.114 1.00 0.00 C ATOM 295 CG TRP A 145 -19.687 2.237 0.678 1.00 0.00 C ATOM 296 CD1 TRP A 145 -19.475 3.283 -0.146 1.00 0.00 C ATOM 297 CD2 TRP A 145 -19.410 1.039 -0.113 1.00 0.00 C ATOM 298 NE1 TRP A 145 -19.020 2.826 -1.357 1.00 0.00 N ATOM 299 CE2 TRP A 145 -18.990 1.450 -1.413 1.00 0.00 C ATOM 300 CE3 TRP A 145 -19.482 -0.350 0.126 1.00 0.00 C ATOM 301 CZ2 TRP A 145 -18.657 0.538 -2.425 1.00 0.00 C ATOM 302 CZ3 TRP A 145 -19.174 -1.278 -0.889 1.00 0.00 C ATOM 303 CH2 TRP A 145 -18.761 -0.838 -2.159 1.00 0.00 C ATOM 0 H TRP A 145 -19.641 4.824 2.069 1.00 0.00 H new ATOM 0 HA TRP A 145 -19.346 2.768 4.049 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -20.265 1.339 2.499 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -21.036 2.878 2.170 1.00 0.00 H new ATOM 0 HD1 TRP A 145 -19.638 4.320 0.108 1.00 0.00 H new ATOM 0 HE1 TRP A 145 -18.737 3.434 -2.126 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -19.778 -0.707 1.101 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 -18.326 0.887 -3.392 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -19.256 -2.336 -0.690 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -18.524 -1.557 -2.929 1.00 0.00 H new ATOM 314 N GLU A 146 -16.931 3.205 1.842 1.00 0.00 N ATOM 315 CA GLU A 146 -15.495 3.025 1.630 1.00 0.00 C ATOM 316 C GLU A 146 -14.706 3.497 2.858 1.00 0.00 C ATOM 317 O GLU A 146 -13.861 2.782 3.399 1.00 0.00 O ATOM 318 CB GLU A 146 -15.050 3.764 0.350 1.00 0.00 C ATOM 319 CG GLU A 146 -14.993 2.877 -0.914 1.00 0.00 C ATOM 320 CD GLU A 146 -14.364 3.592 -2.123 1.00 0.00 C ATOM 321 OE1 GLU A 146 -13.200 4.054 -2.010 1.00 0.00 O ATOM 322 OE2 GLU A 146 -14.984 3.682 -3.220 1.00 0.00 O ATOM 0 H GLU A 146 -17.350 3.871 1.193 1.00 0.00 H new ATOM 0 HA GLU A 146 -15.286 1.964 1.494 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -15.735 4.592 0.167 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -14.064 4.197 0.520 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -14.420 1.976 -0.693 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -16.003 2.558 -1.173 1.00 0.00 H new ATOM 329 N ASP A 147 -15.023 4.702 3.330 1.00 0.00 N ATOM 330 CA ASP A 147 -14.359 5.365 4.445 1.00 0.00 C ATOM 331 C ASP A 147 -14.402 4.523 5.726 1.00 0.00 C ATOM 332 O ASP A 147 -13.383 4.366 6.412 1.00 0.00 O ATOM 333 CB ASP A 147 -15.050 6.715 4.650 1.00 0.00 C ATOM 334 CG ASP A 147 -14.053 7.818 4.936 1.00 0.00 C ATOM 335 OD1 ASP A 147 -13.631 7.909 6.120 1.00 0.00 O ATOM 336 OD2 ASP A 147 -13.722 8.581 3.999 1.00 0.00 O ATOM 0 H ASP A 147 -15.777 5.261 2.930 1.00 0.00 H new ATOM 0 HA ASP A 147 -13.303 5.503 4.214 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -15.626 6.967 3.760 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -15.757 6.640 5.477 1.00 0.00 H new ATOM 341 N ARG A 148 -15.585 3.975 6.023 1.00 0.00 N ATOM 342 CA ARG A 148 -15.808 3.139 7.203 1.00 0.00 C ATOM 343 C ARG A 148 -15.266 1.716 7.031 1.00 0.00 C ATOM 344 O ARG A 148 -14.789 1.145 8.009 1.00 0.00 O ATOM 345 CB ARG A 148 -17.268 3.216 7.674 1.00 0.00 C ATOM 346 CG ARG A 148 -18.272 2.514 6.749 1.00 0.00 C ATOM 347 CD ARG A 148 -18.909 1.293 7.412 1.00 0.00 C ATOM 348 NE ARG A 148 -19.804 1.713 8.500 1.00 0.00 N ATOM 349 CZ ARG A 148 -20.210 1.014 9.545 1.00 0.00 C ATOM 350 NH1 ARG A 148 -19.866 -0.229 9.746 1.00 0.00 N ATOM 351 NH2 ARG A 148 -20.980 1.609 10.417 1.00 0.00 N ATOM 0 H ARG A 148 -16.418 4.101 5.447 1.00 0.00 H new ATOM 0 HA ARG A 148 -15.215 3.549 8.020 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -17.340 2.775 8.668 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -17.551 4.264 7.769 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -19.053 3.218 6.461 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -17.767 2.206 5.833 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -19.468 0.719 6.673 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -18.132 0.636 7.804 1.00 0.00 H new ATOM 0 HE ARG A 148 -20.157 2.668 8.440 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -19.257 -0.704 9.080 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -20.206 -0.726 10.569 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -21.249 2.583 10.279 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -21.312 1.099 11.236 1.00 0.00 H new ATOM 365 N TYR A 149 -15.222 1.186 5.800 1.00 0.00 N ATOM 366 CA TYR A 149 -14.583 -0.094 5.488 1.00 0.00 C ATOM 367 C TYR A 149 -13.108 -0.074 5.883 1.00 0.00 C ATOM 368 O TYR A 149 -12.643 -1.009 6.533 1.00 0.00 O ATOM 369 CB TYR A 149 -14.704 -0.417 3.988 1.00 0.00 C ATOM 370 CG TYR A 149 -15.316 -1.769 3.679 1.00 0.00 C ATOM 371 CD1 TYR A 149 -16.683 -2.003 3.922 1.00 0.00 C ATOM 372 CD2 TYR A 149 -14.519 -2.788 3.136 1.00 0.00 C ATOM 373 CE1 TYR A 149 -17.239 -3.275 3.665 1.00 0.00 C ATOM 374 CE2 TYR A 149 -15.063 -4.065 2.888 1.00 0.00 C ATOM 375 CZ TYR A 149 -16.426 -4.318 3.163 1.00 0.00 C ATOM 376 OH TYR A 149 -16.948 -5.562 2.969 1.00 0.00 O ATOM 0 H TYR A 149 -15.635 1.642 4.986 1.00 0.00 H new ATOM 0 HA TYR A 149 -15.097 -0.866 6.061 1.00 0.00 H new ATOM 0 HB2 TYR A 149 -15.306 0.357 3.511 1.00 0.00 H new ATOM 0 HB3 TYR A 149 -13.712 -0.371 3.539 1.00 0.00 H new ATOM 0 HD1 TYR A 149 -17.307 -1.209 4.305 1.00 0.00 H new ATOM 0 HD2 TYR A 149 -13.482 -2.593 2.906 1.00 0.00 H new ATOM 0 HE1 TYR A 149 -18.288 -3.452 3.852 1.00 0.00 H new ATOM 0 HE2 TYR A 149 -14.438 -4.850 2.488 1.00 0.00 H new ATOM 0 HH TYR A 149 -16.253 -6.157 2.619 1.00 0.00 H new ATOM 386 N TYR A 150 -12.392 1.005 5.541 1.00 0.00 N ATOM 387 CA TYR A 150 -11.013 1.193 5.987 1.00 0.00 C ATOM 388 C TYR A 150 -10.907 1.024 7.497 1.00 0.00 C ATOM 389 O TYR A 150 -10.265 0.084 7.968 1.00 0.00 O ATOM 390 CB TYR A 150 -10.442 2.550 5.545 1.00 0.00 C ATOM 391 CG TYR A 150 -9.093 2.827 6.186 1.00 0.00 C ATOM 392 CD1 TYR A 150 -7.985 2.016 5.866 1.00 0.00 C ATOM 393 CD2 TYR A 150 -8.994 3.778 7.221 1.00 0.00 C ATOM 394 CE1 TYR A 150 -6.795 2.115 6.610 1.00 0.00 C ATOM 395 CE2 TYR A 150 -7.808 3.878 7.970 1.00 0.00 C ATOM 396 CZ TYR A 150 -6.719 3.030 7.682 1.00 0.00 C ATOM 397 OH TYR A 150 -5.622 3.078 8.477 1.00 0.00 O ATOM 0 H TYR A 150 -12.749 1.760 4.956 1.00 0.00 H new ATOM 0 HA TYR A 150 -10.410 0.421 5.509 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -10.340 2.566 4.460 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -11.141 3.343 5.811 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -8.050 1.316 5.046 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -9.828 4.429 7.439 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -5.946 1.495 6.363 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -7.731 4.604 8.766 1.00 0.00 H new ATOM 0 HH TYR A 150 -5.005 2.359 8.227 1.00 0.00 H new ATOM 407 N ARG A 151 -11.551 1.907 8.264 1.00 0.00 N ATOM 408 CA ARG A 151 -11.358 1.907 9.715 1.00 0.00 C ATOM 409 C ARG A 151 -11.924 0.676 10.429 1.00 0.00 C ATOM 410 O ARG A 151 -11.490 0.390 11.544 1.00 0.00 O ATOM 411 CB ARG A 151 -11.838 3.212 10.325 1.00 0.00 C ATOM 412 CG ARG A 151 -13.283 3.523 9.956 1.00 0.00 C ATOM 413 CD ARG A 151 -13.707 4.682 10.830 1.00 0.00 C ATOM 414 NE ARG A 151 -15.094 5.099 10.612 1.00 0.00 N ATOM 415 CZ ARG A 151 -16.192 4.445 10.957 1.00 0.00 C ATOM 416 NH1 ARG A 151 -16.206 3.301 11.588 1.00 0.00 N ATOM 417 NH2 ARG A 151 -17.368 4.933 10.692 1.00 0.00 N ATOM 0 H ARG A 151 -12.196 2.616 7.915 1.00 0.00 H new ATOM 0 HA ARG A 151 -10.283 1.834 9.877 1.00 0.00 H new ATOM 0 HB2 ARG A 151 -11.745 3.160 11.410 1.00 0.00 H new ATOM 0 HB3 ARG A 151 -11.196 4.026 9.989 1.00 0.00 H new ATOM 0 HG2 ARG A 151 -13.367 3.781 8.900 1.00 0.00 H new ATOM 0 HG3 ARG A 151 -13.922 2.656 10.124 1.00 0.00 H new ATOM 0 HD2 ARG A 151 -13.579 4.404 11.876 1.00 0.00 H new ATOM 0 HD3 ARG A 151 -13.047 5.529 10.642 1.00 0.00 H new ATOM 0 HE ARG A 151 -15.229 5.994 10.141 1.00 0.00 H new ATOM 0 HH11 ARG A 151 -15.328 2.852 11.849 1.00 0.00 H new ATOM 0 HH12 ARG A 151 -17.095 2.857 11.820 1.00 0.00 H new ATOM 0 HH21 ARG A 151 -17.452 5.830 10.213 1.00 0.00 H new ATOM 0 HH22 ARG A 151 -18.206 4.419 10.963 1.00 0.00 H new ATOM 431 N GLU A 152 -12.832 -0.090 9.814 1.00 0.00 N ATOM 432 CA GLU A 152 -13.303 -1.351 10.363 1.00 0.00 C ATOM 433 C GLU A 152 -12.416 -2.532 9.968 1.00 0.00 C ATOM 434 O GLU A 152 -12.618 -3.618 10.514 1.00 0.00 O ATOM 435 CB GLU A 152 -14.751 -1.596 9.928 1.00 0.00 C ATOM 436 CG GLU A 152 -15.724 -0.776 10.788 1.00 0.00 C ATOM 437 CD GLU A 152 -15.932 -1.312 12.219 1.00 0.00 C ATOM 438 OE1 GLU A 152 -15.952 -2.559 12.454 1.00 0.00 O ATOM 439 OE2 GLU A 152 -16.081 -0.459 13.139 1.00 0.00 O ATOM 0 H GLU A 152 -13.257 0.154 8.920 1.00 0.00 H new ATOM 0 HA GLU A 152 -13.254 -1.274 11.449 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -14.871 -1.327 8.878 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -14.987 -2.657 10.014 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -15.358 0.249 10.849 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -16.690 -0.740 10.285 1.00 0.00 H new ATOM 446 N ASN A 153 -11.440 -2.380 9.061 1.00 0.00 N ATOM 447 CA ASN A 153 -10.616 -3.509 8.620 1.00 0.00 C ATOM 448 C ASN A 153 -9.100 -3.234 8.541 1.00 0.00 C ATOM 449 O ASN A 153 -8.334 -4.169 8.347 1.00 0.00 O ATOM 450 CB ASN A 153 -11.171 -4.062 7.307 1.00 0.00 C ATOM 451 CG ASN A 153 -12.638 -4.447 7.370 1.00 0.00 C ATOM 452 OD1 ASN A 153 -13.014 -5.591 7.603 1.00 0.00 O ATOM 453 ND2 ASN A 153 -13.520 -3.506 7.131 1.00 0.00 N ATOM 0 H ASN A 153 -11.205 -1.490 8.622 1.00 0.00 H new ATOM 0 HA ASN A 153 -10.690 -4.264 9.403 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -11.035 -3.316 6.524 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -10.588 -4.937 7.018 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -14.516 -3.726 7.139 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -13.210 -2.554 6.937 1.00 0.00 H new ATOM 460 N MET A 154 -8.646 -2.003 8.789 1.00 0.00 N ATOM 461 CA MET A 154 -7.275 -1.495 8.821 1.00 0.00 C ATOM 462 C MET A 154 -6.261 -2.345 9.598 1.00 0.00 C ATOM 463 O MET A 154 -5.059 -2.275 9.324 1.00 0.00 O ATOM 464 CB MET A 154 -7.312 -0.075 9.407 1.00 0.00 C ATOM 465 CG MET A 154 -7.828 -0.086 10.849 1.00 0.00 C ATOM 466 SD MET A 154 -7.977 1.554 11.599 1.00 0.00 S ATOM 467 CE MET A 154 -8.558 1.070 13.246 1.00 0.00 C ATOM 0 H MET A 154 -9.307 -1.254 8.996 1.00 0.00 H new ATOM 0 HA MET A 154 -6.918 -1.522 7.792 1.00 0.00 H new ATOM 0 HB2 MET A 154 -6.313 0.359 9.379 1.00 0.00 H new ATOM 0 HB3 MET A 154 -7.953 0.558 8.793 1.00 0.00 H new ATOM 0 HG2 MET A 154 -8.803 -0.572 10.870 1.00 0.00 H new ATOM 0 HG3 MET A 154 -7.157 -0.692 11.458 1.00 0.00 H new ATOM 0 HE1 MET A 154 -8.724 1.962 13.850 1.00 0.00 H new ATOM 0 HE2 MET A 154 -9.492 0.515 13.154 1.00 0.00 H new ATOM 0 HE3 MET A 154 -7.808 0.441 13.726 1.00 0.00 H new ATOM 477 N ASN A 155 -6.731 -3.108 10.591 1.00 0.00 N ATOM 478 CA ASN A 155 -5.945 -4.058 11.358 1.00 0.00 C ATOM 479 C ASN A 155 -5.644 -5.312 10.518 1.00 0.00 C ATOM 480 O ASN A 155 -4.512 -5.794 10.486 1.00 0.00 O ATOM 481 CB ASN A 155 -6.733 -4.378 12.642 1.00 0.00 C ATOM 482 CG ASN A 155 -6.346 -5.712 13.259 1.00 0.00 C ATOM 483 OD1 ASN A 155 -5.214 -5.963 13.658 1.00 0.00 O ATOM 484 ND2 ASN A 155 -7.282 -6.625 13.324 1.00 0.00 N ATOM 0 H ASN A 155 -7.706 -3.073 10.887 1.00 0.00 H new ATOM 0 HA ASN A 155 -4.975 -3.641 11.630 1.00 0.00 H new ATOM 0 HB2 ASN A 155 -6.567 -3.585 13.371 1.00 0.00 H new ATOM 0 HB3 ASN A 155 -7.799 -4.384 12.415 1.00 0.00 H new ATOM 0 HD21 ASN A 155 -7.070 -7.546 13.707 1.00 0.00 H new ATOM 0 HD22 ASN A 155 -8.223 -6.415 12.992 1.00 0.00 H new ATOM 491 N ARG A 156 -6.667 -5.826 9.821 1.00 0.00 N ATOM 492 CA ARG A 156 -6.605 -6.963 8.899 1.00 0.00 C ATOM 493 C ARG A 156 -5.873 -6.574 7.619 1.00 0.00 C ATOM 494 O ARG A 156 -5.204 -7.402 7.000 1.00 0.00 O ATOM 495 CB ARG A 156 -8.021 -7.470 8.543 1.00 0.00 C ATOM 496 CG ARG A 156 -9.017 -7.494 9.711 1.00 0.00 C ATOM 497 CD ARG A 156 -8.604 -8.412 10.863 1.00 0.00 C ATOM 498 NE ARG A 156 -9.048 -9.790 10.622 1.00 0.00 N ATOM 499 CZ ARG A 156 -8.974 -10.785 11.491 1.00 0.00 C ATOM 500 NH1 ARG A 156 -8.265 -10.729 12.585 1.00 0.00 N ATOM 501 NH2 ARG A 156 -9.655 -11.877 11.284 1.00 0.00 N ATOM 0 H ARG A 156 -7.608 -5.438 9.891 1.00 0.00 H new ATOM 0 HA ARG A 156 -6.060 -7.763 9.400 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -8.428 -6.840 7.752 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -7.938 -8.478 8.136 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -9.137 -6.480 10.093 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -9.991 -7.812 9.338 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -7.520 -8.390 10.980 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -9.032 -8.046 11.796 1.00 0.00 H new ATOM 0 HE ARG A 156 -9.448 -9.998 9.707 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -7.732 -9.888 12.805 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -8.244 -11.527 13.220 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -10.242 -11.962 10.454 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -9.601 -12.646 11.952 1.00 0.00 H new ATOM 515 N TYR A 157 -6.011 -5.311 7.211 1.00 0.00 N ATOM 516 CA TYR A 157 -5.446 -4.787 5.978 1.00 0.00 C ATOM 517 C TYR A 157 -3.941 -4.554 6.142 1.00 0.00 C ATOM 518 O TYR A 157 -3.491 -4.253 7.257 1.00 0.00 O ATOM 519 CB TYR A 157 -6.177 -3.468 5.682 1.00 0.00 C ATOM 520 CG TYR A 157 -7.607 -3.568 5.176 1.00 0.00 C ATOM 521 CD1 TYR A 157 -8.281 -4.804 5.069 1.00 0.00 C ATOM 522 CD2 TYR A 157 -8.272 -2.382 4.809 1.00 0.00 C ATOM 523 CE1 TYR A 157 -9.579 -4.869 4.542 1.00 0.00 C ATOM 524 CE2 TYR A 157 -9.592 -2.438 4.327 1.00 0.00 C ATOM 525 CZ TYR A 157 -10.238 -3.679 4.176 1.00 0.00 C ATOM 526 OH TYR A 157 -11.532 -3.710 3.782 1.00 0.00 O ATOM 0 H TYR A 157 -6.531 -4.614 7.744 1.00 0.00 H new ATOM 0 HA TYR A 157 -5.574 -5.489 5.154 1.00 0.00 H new ATOM 0 HB2 TYR A 157 -6.182 -2.872 6.594 1.00 0.00 H new ATOM 0 HB3 TYR A 157 -5.595 -2.917 4.944 1.00 0.00 H new ATOM 0 HD1 TYR A 157 -7.792 -5.709 5.397 1.00 0.00 H new ATOM 0 HD2 TYR A 157 -7.769 -1.431 4.898 1.00 0.00 H new ATOM 0 HE1 TYR A 157 -10.069 -5.823 4.418 1.00 0.00 H new ATOM 0 HE2 TYR A 157 -10.111 -1.526 4.072 1.00 0.00 H new ATOM 0 HH TYR A 157 -11.864 -4.631 3.822 1.00 0.00 H new ATOM 536 N PRO A 158 -3.144 -4.607 5.055 1.00 0.00 N ATOM 537 CA PRO A 158 -1.765 -4.161 5.102 1.00 0.00 C ATOM 538 C PRO A 158 -1.725 -2.716 5.580 1.00 0.00 C ATOM 539 O PRO A 158 -2.591 -1.886 5.289 1.00 0.00 O ATOM 540 CB PRO A 158 -1.190 -4.322 3.697 1.00 0.00 C ATOM 541 CG PRO A 158 -2.429 -4.242 2.829 1.00 0.00 C ATOM 542 CD PRO A 158 -3.493 -4.935 3.687 1.00 0.00 C ATOM 0 HA PRO A 158 -1.166 -4.747 5.800 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -0.475 -3.535 3.458 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -0.670 -5.273 3.577 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.700 -3.210 2.605 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -2.287 -4.749 1.874 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -4.493 -4.580 3.439 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -3.489 -6.013 3.526 1.00 0.00 H new ATOM 550 N ASN A 159 -0.697 -2.445 6.362 1.00 0.00 N ATOM 551 CA ASN A 159 -0.316 -1.141 6.848 1.00 0.00 C ATOM 552 C ASN A 159 1.184 -0.947 6.652 1.00 0.00 C ATOM 553 O ASN A 159 1.823 -0.248 7.436 1.00 0.00 O ATOM 554 CB ASN A 159 -0.843 -0.910 8.268 1.00 0.00 C ATOM 555 CG ASN A 159 -0.376 -1.847 9.354 1.00 0.00 C ATOM 556 OD1 ASN A 159 -1.192 -2.425 10.079 1.00 0.00 O ATOM 557 ND2 ASN A 159 0.917 -1.987 9.502 1.00 0.00 N ATOM 0 H ASN A 159 -0.070 -3.178 6.693 1.00 0.00 H new ATOM 0 HA ASN A 159 -0.790 -0.351 6.265 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -0.575 0.104 8.563 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -1.931 -0.955 8.232 1.00 0.00 H new ATOM 0 HD21 ASN A 159 1.284 -2.591 10.237 1.00 0.00 H new ATOM 0 HD22 ASN A 159 1.558 -1.492 8.882 1.00 0.00 H new ATOM 564 N GLN A 160 1.743 -1.638 5.650 1.00 0.00 N ATOM 565 CA GLN A 160 3.069 -1.426 5.128 1.00 0.00 C ATOM 566 C GLN A 160 3.087 -1.680 3.613 1.00 0.00 C ATOM 567 O GLN A 160 2.053 -2.065 3.064 1.00 0.00 O ATOM 568 CB GLN A 160 4.093 -2.318 5.807 1.00 0.00 C ATOM 569 CG GLN A 160 3.858 -2.900 7.207 1.00 0.00 C ATOM 570 CD GLN A 160 5.033 -3.767 7.663 1.00 0.00 C ATOM 571 OE1 GLN A 160 4.870 -4.710 8.441 1.00 0.00 O ATOM 572 NE2 GLN A 160 6.229 -3.475 7.181 1.00 0.00 N ATOM 0 H GLN A 160 1.248 -2.390 5.170 1.00 0.00 H new ATOM 0 HA GLN A 160 3.339 -0.390 5.331 1.00 0.00 H new ATOM 0 HB2 GLN A 160 4.267 -3.162 5.140 1.00 0.00 H new ATOM 0 HB3 GLN A 160 5.023 -1.751 5.853 1.00 0.00 H new ATOM 0 HG2 GLN A 160 3.707 -2.088 7.918 1.00 0.00 H new ATOM 0 HG3 GLN A 160 2.945 -3.496 7.205 1.00 0.00 H new ATOM 0 HE21 GLN A 160 6.342 -2.691 6.539 1.00 0.00 H new ATOM 0 HE22 GLN A 160 7.038 -4.034 7.451 1.00 0.00 H new ATOM 581 N VAL A 161 4.230 -1.467 2.936 1.00 0.00 N ATOM 582 CA VAL A 161 4.321 -1.552 1.467 1.00 0.00 C ATOM 583 C VAL A 161 5.715 -2.028 1.004 1.00 0.00 C ATOM 584 O VAL A 161 6.742 -1.509 1.448 1.00 0.00 O ATOM 585 CB VAL A 161 3.846 -0.231 0.784 1.00 0.00 C ATOM 586 CG1 VAL A 161 3.176 0.787 1.720 1.00 0.00 C ATOM 587 CG2 VAL A 161 4.949 0.554 0.074 1.00 0.00 C ATOM 0 H VAL A 161 5.113 -1.232 3.389 1.00 0.00 H new ATOM 0 HA VAL A 161 3.627 -2.322 1.132 1.00 0.00 H new ATOM 0 HB VAL A 161 3.125 -0.634 0.073 1.00 0.00 H new ATOM 0 HG11 VAL A 161 2.883 1.668 1.149 1.00 0.00 H new ATOM 0 HG12 VAL A 161 2.292 0.338 2.173 1.00 0.00 H new ATOM 0 HG13 VAL A 161 3.877 1.078 2.502 1.00 0.00 H new ATOM 0 HG21 VAL A 161 4.526 1.455 -0.370 1.00 0.00 H new ATOM 0 HG22 VAL A 161 5.719 0.831 0.794 1.00 0.00 H new ATOM 0 HG23 VAL A 161 5.389 -0.064 -0.709 1.00 0.00 H new ATOM 597 N TYR A 162 5.733 -3.023 0.108 1.00 0.00 N ATOM 598 CA TYR A 162 6.863 -3.547 -0.667 1.00 0.00 C ATOM 599 C TYR A 162 7.031 -2.726 -1.945 1.00 0.00 C ATOM 600 O TYR A 162 6.041 -2.482 -2.630 1.00 0.00 O ATOM 601 CB TYR A 162 6.523 -4.971 -1.108 1.00 0.00 C ATOM 602 CG TYR A 162 6.650 -6.075 -0.082 1.00 0.00 C ATOM 603 CD1 TYR A 162 7.843 -6.251 0.643 1.00 0.00 C ATOM 604 CD2 TYR A 162 5.603 -7.004 0.063 1.00 0.00 C ATOM 605 CE1 TYR A 162 7.975 -7.334 1.532 1.00 0.00 C ATOM 606 CE2 TYR A 162 5.723 -8.078 0.959 1.00 0.00 C ATOM 607 CZ TYR A 162 6.920 -8.255 1.687 1.00 0.00 C ATOM 608 OH TYR A 162 7.087 -9.334 2.497 1.00 0.00 O ATOM 0 H TYR A 162 4.875 -3.529 -0.113 1.00 0.00 H new ATOM 0 HA TYR A 162 7.766 -3.509 -0.057 1.00 0.00 H new ATOM 0 HB2 TYR A 162 5.497 -4.972 -1.476 1.00 0.00 H new ATOM 0 HB3 TYR A 162 7.165 -5.223 -1.952 1.00 0.00 H new ATOM 0 HD1 TYR A 162 8.658 -5.554 0.517 1.00 0.00 H new ATOM 0 HD2 TYR A 162 4.701 -6.890 -0.519 1.00 0.00 H new ATOM 0 HE1 TYR A 162 8.887 -7.459 2.097 1.00 0.00 H new ATOM 0 HE2 TYR A 162 4.902 -8.767 1.091 1.00 0.00 H new ATOM 0 HH TYR A 162 6.268 -9.872 2.498 1.00 0.00 H new ATOM 618 N TYR A 163 8.260 -2.372 -2.331 1.00 0.00 N ATOM 619 CA TYR A 163 8.501 -1.689 -3.602 1.00 0.00 C ATOM 620 C TYR A 163 9.798 -2.069 -4.303 1.00 0.00 C ATOM 621 O TYR A 163 10.709 -2.647 -3.712 1.00 0.00 O ATOM 622 CB TYR A 163 8.479 -0.174 -3.386 1.00 0.00 C ATOM 623 CG TYR A 163 9.233 0.394 -2.203 1.00 0.00 C ATOM 624 CD1 TYR A 163 8.558 0.544 -0.977 1.00 0.00 C ATOM 625 CD2 TYR A 163 10.550 0.874 -2.349 1.00 0.00 C ATOM 626 CE1 TYR A 163 9.180 1.210 0.089 1.00 0.00 C ATOM 627 CE2 TYR A 163 11.190 1.510 -1.268 1.00 0.00 C ATOM 628 CZ TYR A 163 10.498 1.694 -0.048 1.00 0.00 C ATOM 629 OH TYR A 163 11.074 2.344 0.999 1.00 0.00 O ATOM 0 H TYR A 163 9.101 -2.547 -1.782 1.00 0.00 H new ATOM 0 HA TYR A 163 7.696 -2.016 -4.260 1.00 0.00 H new ATOM 0 HB2 TYR A 163 8.872 0.296 -4.287 1.00 0.00 H new ATOM 0 HB3 TYR A 163 7.437 0.134 -3.295 1.00 0.00 H new ATOM 0 HD1 TYR A 163 7.561 0.146 -0.857 1.00 0.00 H new ATOM 0 HD2 TYR A 163 11.068 0.754 -3.289 1.00 0.00 H new ATOM 0 HE1 TYR A 163 8.648 1.353 1.018 1.00 0.00 H new ATOM 0 HE2 TYR A 163 12.208 1.857 -1.370 1.00 0.00 H new ATOM 0 HH TYR A 163 11.648 3.063 0.662 1.00 0.00 H new ATOM 639 N ARG A 164 9.861 -1.689 -5.585 1.00 0.00 N ATOM 640 CA ARG A 164 11.067 -1.680 -6.405 1.00 0.00 C ATOM 641 C ARG A 164 11.759 -0.316 -6.217 1.00 0.00 C ATOM 642 O ARG A 164 11.049 0.695 -6.258 1.00 0.00 O ATOM 643 CB ARG A 164 10.703 -1.874 -7.880 1.00 0.00 C ATOM 644 CG ARG A 164 9.986 -3.213 -8.119 1.00 0.00 C ATOM 645 CD ARG A 164 10.130 -3.678 -9.566 1.00 0.00 C ATOM 646 NE ARG A 164 11.536 -3.961 -9.913 1.00 0.00 N ATOM 647 CZ ARG A 164 12.002 -4.139 -11.139 1.00 0.00 C ATOM 648 NH1 ARG A 164 11.200 -4.211 -12.167 1.00 0.00 N ATOM 649 NH2 ARG A 164 13.287 -4.236 -11.357 1.00 0.00 N ATOM 0 H ARG A 164 9.038 -1.368 -6.095 1.00 0.00 H new ATOM 0 HA ARG A 164 11.730 -2.491 -6.104 1.00 0.00 H new ATOM 0 HB2 ARG A 164 10.062 -1.055 -8.207 1.00 0.00 H new ATOM 0 HB3 ARG A 164 11.608 -1.833 -8.486 1.00 0.00 H new ATOM 0 HG2 ARG A 164 10.396 -3.970 -7.451 1.00 0.00 H new ATOM 0 HG3 ARG A 164 8.929 -3.109 -7.873 1.00 0.00 H new ATOM 0 HD2 ARG A 164 9.530 -4.575 -9.721 1.00 0.00 H new ATOM 0 HD3 ARG A 164 9.738 -2.912 -10.235 1.00 0.00 H new ATOM 0 HE ARG A 164 12.204 -4.025 -9.145 1.00 0.00 H new ATOM 0 HH11 ARG A 164 10.192 -4.130 -12.034 1.00 0.00 H new ATOM 0 HH12 ARG A 164 11.582 -4.349 -13.103 1.00 0.00 H new ATOM 0 HH21 ARG A 164 13.943 -4.175 -10.578 1.00 0.00 H new ATOM 0 HH22 ARG A 164 13.634 -4.373 -12.306 1.00 0.00 H new ATOM 663 N PRO A 165 13.086 -0.257 -5.998 1.00 0.00 N ATOM 664 CA PRO A 165 13.803 0.977 -5.674 1.00 0.00 C ATOM 665 C PRO A 165 13.603 2.154 -6.635 1.00 0.00 C ATOM 666 O PRO A 165 13.582 1.996 -7.858 1.00 0.00 O ATOM 667 CB PRO A 165 15.279 0.589 -5.639 1.00 0.00 C ATOM 668 CG PRO A 165 15.230 -0.860 -5.187 1.00 0.00 C ATOM 669 CD PRO A 165 13.982 -1.397 -5.875 1.00 0.00 C ATOM 0 HA PRO A 165 13.407 1.353 -4.731 1.00 0.00 H new ATOM 0 HB2 PRO A 165 15.749 0.693 -6.617 1.00 0.00 H new ATOM 0 HB3 PRO A 165 15.845 1.211 -4.946 1.00 0.00 H new ATOM 0 HG2 PRO A 165 16.123 -1.407 -5.489 1.00 0.00 H new ATOM 0 HG3 PRO A 165 15.158 -0.941 -4.102 1.00 0.00 H new ATOM 0 HD2 PRO A 165 14.222 -1.815 -6.853 1.00 0.00 H new ATOM 0 HD3 PRO A 165 13.524 -2.195 -5.291 1.00 0.00 H new ATOM 677 N VAL A 166 13.612 3.356 -6.048 1.00 0.00 N ATOM 678 CA VAL A 166 13.665 4.678 -6.699 1.00 0.00 C ATOM 679 C VAL A 166 15.002 4.934 -7.416 1.00 0.00 C ATOM 680 O VAL A 166 15.224 5.935 -8.098 1.00 0.00 O ATOM 681 CB VAL A 166 13.301 5.759 -5.657 1.00 0.00 C ATOM 682 CG1 VAL A 166 14.469 6.616 -5.145 1.00 0.00 C ATOM 683 CG2 VAL A 166 12.212 6.664 -6.218 1.00 0.00 C ATOM 0 H VAL A 166 13.580 3.441 -5.032 1.00 0.00 H new ATOM 0 HA VAL A 166 12.928 4.716 -7.501 1.00 0.00 H new ATOM 0 HB VAL A 166 12.956 5.203 -4.785 1.00 0.00 H new ATOM 0 HG11 VAL A 166 14.098 7.340 -4.420 1.00 0.00 H new ATOM 0 HG12 VAL A 166 15.211 5.974 -4.670 1.00 0.00 H new ATOM 0 HG13 VAL A 166 14.928 7.143 -5.982 1.00 0.00 H new ATOM 0 HG21 VAL A 166 11.957 7.426 -5.481 1.00 0.00 H new ATOM 0 HG22 VAL A 166 12.571 7.145 -7.128 1.00 0.00 H new ATOM 0 HG23 VAL A 166 11.327 6.070 -6.447 1.00 0.00 H new ATOM 693 N ASP A 167 15.921 3.991 -7.267 1.00 0.00 N ATOM 694 CA ASP A 167 17.125 3.883 -8.061 1.00 0.00 C ATOM 695 C ASP A 167 16.856 3.364 -9.485 1.00 0.00 C ATOM 696 O ASP A 167 17.296 3.978 -10.461 1.00 0.00 O ATOM 697 CB ASP A 167 18.075 2.964 -7.296 1.00 0.00 C ATOM 698 CG ASP A 167 19.387 2.827 -8.034 1.00 0.00 C ATOM 699 OD1 ASP A 167 20.185 3.790 -7.945 1.00 0.00 O ATOM 700 OD2 ASP A 167 19.583 1.791 -8.722 1.00 0.00 O ATOM 0 H ASP A 167 15.841 3.257 -6.564 1.00 0.00 H new ATOM 0 HA ASP A 167 17.565 4.870 -8.204 1.00 0.00 H new ATOM 0 HB2 ASP A 167 18.252 3.364 -6.298 1.00 0.00 H new ATOM 0 HB3 ASP A 167 17.618 1.983 -7.169 1.00 0.00 H new ATOM 705 N GLN A 168 16.134 2.248 -9.640 1.00 0.00 N ATOM 706 CA GLN A 168 15.997 1.522 -10.912 1.00 0.00 C ATOM 707 C GLN A 168 14.962 2.143 -11.854 1.00 0.00 C ATOM 708 O GLN A 168 14.929 1.844 -13.053 1.00 0.00 O ATOM 709 CB GLN A 168 15.622 0.056 -10.623 1.00 0.00 C ATOM 710 CG GLN A 168 16.858 -0.824 -10.390 1.00 0.00 C ATOM 711 CD GLN A 168 17.112 -1.190 -8.936 1.00 0.00 C ATOM 712 OE1 GLN A 168 16.757 -2.276 -8.473 1.00 0.00 O ATOM 713 NE2 GLN A 168 17.804 -0.341 -8.204 1.00 0.00 N ATOM 0 H GLN A 168 15.619 1.815 -8.873 1.00 0.00 H new ATOM 0 HA GLN A 168 16.959 1.583 -11.421 1.00 0.00 H new ATOM 0 HB2 GLN A 168 14.978 0.014 -9.745 1.00 0.00 H new ATOM 0 HB3 GLN A 168 15.047 -0.342 -11.459 1.00 0.00 H new ATOM 0 HG2 GLN A 168 16.748 -1.742 -10.968 1.00 0.00 H new ATOM 0 HG3 GLN A 168 17.735 -0.306 -10.779 1.00 0.00 H new ATOM 0 HE21 GLN A 168 18.092 0.555 -8.598 1.00 0.00 H new ATOM 0 HE22 GLN A 168 18.051 -0.579 -7.244 1.00 0.00 H new ATOM 722 N TYR A 169 14.139 3.010 -11.275 1.00 0.00 N ATOM 723 CA TYR A 169 12.919 3.583 -11.798 1.00 0.00 C ATOM 724 C TYR A 169 13.145 4.854 -12.625 1.00 0.00 C ATOM 725 O TYR A 169 14.232 5.440 -12.647 1.00 0.00 O ATOM 726 CB TYR A 169 11.956 3.820 -10.612 1.00 0.00 C ATOM 727 CG TYR A 169 11.863 5.235 -10.073 1.00 0.00 C ATOM 728 CD1 TYR A 169 13.002 6.044 -9.935 1.00 0.00 C ATOM 729 CD2 TYR A 169 10.611 5.744 -9.711 1.00 0.00 C ATOM 730 CE1 TYR A 169 12.880 7.391 -9.538 1.00 0.00 C ATOM 731 CE2 TYR A 169 10.484 7.076 -9.290 1.00 0.00 C ATOM 732 CZ TYR A 169 11.610 7.913 -9.203 1.00 0.00 C ATOM 733 OH TYR A 169 11.462 9.166 -8.684 1.00 0.00 O ATOM 0 H TYR A 169 14.335 3.358 -10.337 1.00 0.00 H new ATOM 0 HA TYR A 169 12.477 2.880 -12.505 1.00 0.00 H new ATOM 0 HB2 TYR A 169 10.958 3.508 -10.919 1.00 0.00 H new ATOM 0 HB3 TYR A 169 12.258 3.165 -9.795 1.00 0.00 H new ATOM 0 HD1 TYR A 169 13.980 5.631 -10.135 1.00 0.00 H new ATOM 0 HD2 TYR A 169 9.739 5.109 -9.756 1.00 0.00 H new ATOM 0 HE1 TYR A 169 13.755 8.023 -9.490 1.00 0.00 H new ATOM 0 HE2 TYR A 169 9.510 7.463 -9.030 1.00 0.00 H new ATOM 0 HH TYR A 169 10.570 9.252 -8.287 1.00 0.00 H new ATOM 743 N ASN A 170 12.052 5.263 -13.266 1.00 0.00 N ATOM 744 CA ASN A 170 12.027 6.309 -14.284 1.00 0.00 C ATOM 745 C ASN A 170 10.829 7.271 -14.120 1.00 0.00 C ATOM 746 O ASN A 170 10.763 8.318 -14.764 1.00 0.00 O ATOM 747 CB ASN A 170 12.006 5.578 -15.635 1.00 0.00 C ATOM 748 CG ASN A 170 10.622 5.221 -16.138 1.00 0.00 C ATOM 749 OD1 ASN A 170 10.146 5.782 -17.120 1.00 0.00 O ATOM 750 ND2 ASN A 170 9.914 4.323 -15.492 1.00 0.00 N ATOM 0 H ASN A 170 11.131 4.863 -13.085 1.00 0.00 H new ATOM 0 HA ASN A 170 12.901 6.954 -14.198 1.00 0.00 H new ATOM 0 HB2 ASN A 170 12.499 6.204 -16.379 1.00 0.00 H new ATOM 0 HB3 ASN A 170 12.593 4.664 -15.548 1.00 0.00 H new ATOM 0 HD21 ASN A 170 8.971 4.094 -15.807 1.00 0.00 H new ATOM 0 HD22 ASN A 170 10.307 3.855 -14.675 1.00 0.00 H new ATOM 757 N ASN A 171 9.851 6.863 -13.299 1.00 0.00 N ATOM 758 CA ASN A 171 8.712 7.586 -12.776 1.00 0.00 C ATOM 759 C ASN A 171 8.146 6.802 -11.593 1.00 0.00 C ATOM 760 O ASN A 171 8.278 5.579 -11.543 1.00 0.00 O ATOM 761 CB ASN A 171 7.625 7.805 -13.835 1.00 0.00 C ATOM 762 CG ASN A 171 7.100 6.524 -14.449 1.00 0.00 C ATOM 763 OD1 ASN A 171 6.469 5.709 -13.783 1.00 0.00 O ATOM 764 ND2 ASN A 171 7.339 6.330 -15.724 1.00 0.00 N ATOM 0 H ASN A 171 9.852 5.904 -12.953 1.00 0.00 H new ATOM 0 HA ASN A 171 9.044 8.575 -12.460 1.00 0.00 H new ATOM 0 HB2 ASN A 171 6.794 8.347 -13.382 1.00 0.00 H new ATOM 0 HB3 ASN A 171 8.025 8.439 -14.627 1.00 0.00 H new ATOM 0 HD21 ASN A 171 6.998 5.486 -16.184 1.00 0.00 H new ATOM 0 HD22 ASN A 171 7.866 7.023 -16.255 1.00 0.00 H new ATOM 771 N GLN A 172 7.486 7.497 -10.665 1.00 0.00 N ATOM 772 CA GLN A 172 6.891 6.923 -9.473 1.00 0.00 C ATOM 773 C GLN A 172 5.842 5.894 -9.874 1.00 0.00 C ATOM 774 O GLN A 172 5.968 4.721 -9.547 1.00 0.00 O ATOM 775 CB GLN A 172 6.295 8.063 -8.622 1.00 0.00 C ATOM 776 CG GLN A 172 6.889 8.138 -7.216 1.00 0.00 C ATOM 777 CD GLN A 172 7.914 9.254 -7.027 1.00 0.00 C ATOM 778 OE1 GLN A 172 9.027 9.242 -7.548 1.00 0.00 O ATOM 779 NE2 GLN A 172 7.558 10.246 -6.241 1.00 0.00 N ATOM 0 H GLN A 172 7.351 8.506 -10.731 1.00 0.00 H new ATOM 0 HA GLN A 172 7.640 6.406 -8.873 1.00 0.00 H new ATOM 0 HB2 GLN A 172 6.461 9.013 -9.131 1.00 0.00 H new ATOM 0 HB3 GLN A 172 5.216 7.926 -8.547 1.00 0.00 H new ATOM 0 HG2 GLN A 172 6.080 8.278 -6.499 1.00 0.00 H new ATOM 0 HG3 GLN A 172 7.361 7.184 -6.982 1.00 0.00 H new ATOM 0 HE21 GLN A 172 6.633 10.250 -5.812 1.00 0.00 H new ATOM 0 HE22 GLN A 172 8.207 11.012 -6.060 1.00 0.00 H new ATOM 788 N ASN A 173 4.849 6.342 -10.643 1.00 0.00 N ATOM 789 CA ASN A 173 3.615 5.664 -10.991 1.00 0.00 C ATOM 790 C ASN A 173 3.796 4.208 -11.416 1.00 0.00 C ATOM 791 O ASN A 173 3.120 3.334 -10.876 1.00 0.00 O ATOM 792 CB ASN A 173 2.844 6.516 -12.013 1.00 0.00 C ATOM 793 CG ASN A 173 3.648 7.532 -12.813 1.00 0.00 C ATOM 794 OD1 ASN A 173 4.062 8.570 -12.299 1.00 0.00 O ATOM 795 ND2 ASN A 173 3.901 7.288 -14.077 1.00 0.00 N ATOM 0 H ASN A 173 4.899 7.267 -11.071 1.00 0.00 H new ATOM 0 HA ASN A 173 3.013 5.576 -10.087 1.00 0.00 H new ATOM 0 HB2 ASN A 173 2.355 5.842 -12.716 1.00 0.00 H new ATOM 0 HB3 ASN A 173 2.055 7.050 -11.483 1.00 0.00 H new ATOM 0 HD21 ASN A 173 4.438 7.957 -14.628 1.00 0.00 H new ATOM 0 HD22 ASN A 173 3.560 6.429 -14.509 1.00 0.00 H new ATOM 802 N ASN A 174 4.701 3.927 -12.353 1.00 0.00 N ATOM 803 CA ASN A 174 4.855 2.582 -12.885 1.00 0.00 C ATOM 804 C ASN A 174 5.334 1.556 -11.840 1.00 0.00 C ATOM 805 O ASN A 174 4.747 0.481 -11.691 1.00 0.00 O ATOM 806 CB ASN A 174 5.734 2.617 -14.143 1.00 0.00 C ATOM 807 CG ASN A 174 7.223 2.440 -13.924 1.00 0.00 C ATOM 808 OD1 ASN A 174 7.822 1.431 -14.293 1.00 0.00 O ATOM 809 ND2 ASN A 174 7.875 3.368 -13.273 1.00 0.00 N ATOM 0 H ASN A 174 5.336 4.615 -12.756 1.00 0.00 H new ATOM 0 HA ASN A 174 3.866 2.224 -13.170 1.00 0.00 H new ATOM 0 HB2 ASN A 174 5.392 1.835 -14.822 1.00 0.00 H new ATOM 0 HB3 ASN A 174 5.573 3.570 -14.647 1.00 0.00 H new ATOM 0 HD21 ASN A 174 8.869 3.251 -13.077 1.00 0.00 H new ATOM 0 HD22 ASN A 174 7.390 4.209 -12.962 1.00 0.00 H new ATOM 816 N PHE A 175 6.390 1.890 -11.095 1.00 0.00 N ATOM 817 CA PHE A 175 6.902 1.036 -10.029 1.00 0.00 C ATOM 818 C PHE A 175 6.069 1.172 -8.746 1.00 0.00 C ATOM 819 O PHE A 175 6.025 0.238 -7.956 1.00 0.00 O ATOM 820 CB PHE A 175 8.386 1.319 -9.807 1.00 0.00 C ATOM 821 CG PHE A 175 9.395 0.632 -10.720 1.00 0.00 C ATOM 822 CD1 PHE A 175 9.023 -0.124 -11.853 1.00 0.00 C ATOM 823 CD2 PHE A 175 10.755 0.690 -10.356 1.00 0.00 C ATOM 824 CE1 PHE A 175 10.000 -0.794 -12.613 1.00 0.00 C ATOM 825 CE2 PHE A 175 11.730 0.032 -11.122 1.00 0.00 C ATOM 826 CZ PHE A 175 11.355 -0.711 -12.253 1.00 0.00 C ATOM 0 H PHE A 175 6.911 2.759 -11.216 1.00 0.00 H new ATOM 0 HA PHE A 175 6.807 -0.007 -10.332 1.00 0.00 H new ATOM 0 HB2 PHE A 175 8.536 2.395 -9.895 1.00 0.00 H new ATOM 0 HB3 PHE A 175 8.627 1.046 -8.780 1.00 0.00 H new ATOM 0 HD1 PHE A 175 7.983 -0.188 -12.138 1.00 0.00 H new ATOM 0 HD2 PHE A 175 11.050 1.246 -9.479 1.00 0.00 H new ATOM 0 HE1 PHE A 175 9.707 -1.374 -13.476 1.00 0.00 H new ATOM 0 HE2 PHE A 175 12.771 0.097 -10.841 1.00 0.00 H new ATOM 0 HZ PHE A 175 12.105 -1.216 -12.843 1.00 0.00 H new ATOM 836 N VAL A 176 5.316 2.261 -8.569 1.00 0.00 N ATOM 837 CA VAL A 176 4.290 2.385 -7.526 1.00 0.00 C ATOM 838 C VAL A 176 3.115 1.446 -7.805 1.00 0.00 C ATOM 839 O VAL A 176 2.504 0.924 -6.872 1.00 0.00 O ATOM 840 CB VAL A 176 3.840 3.845 -7.360 1.00 0.00 C ATOM 841 CG1 VAL A 176 2.445 4.038 -6.764 1.00 0.00 C ATOM 842 CG2 VAL A 176 4.898 4.534 -6.507 1.00 0.00 C ATOM 0 H VAL A 176 5.402 3.093 -9.153 1.00 0.00 H new ATOM 0 HA VAL A 176 4.729 2.080 -6.576 1.00 0.00 H new ATOM 0 HB VAL A 176 3.751 4.284 -8.354 1.00 0.00 H new ATOM 0 HG11 VAL A 176 2.225 5.103 -6.690 1.00 0.00 H new ATOM 0 HG12 VAL A 176 1.706 3.559 -7.406 1.00 0.00 H new ATOM 0 HG13 VAL A 176 2.408 3.590 -5.771 1.00 0.00 H new ATOM 0 HG21 VAL A 176 4.623 5.578 -6.360 1.00 0.00 H new ATOM 0 HG22 VAL A 176 4.966 4.037 -5.539 1.00 0.00 H new ATOM 0 HG23 VAL A 176 5.863 4.481 -7.011 1.00 0.00 H new ATOM 852 N HIS A 177 2.829 1.168 -9.079 1.00 0.00 N ATOM 853 CA HIS A 177 1.823 0.173 -9.449 1.00 0.00 C ATOM 854 C HIS A 177 2.318 -1.252 -9.196 1.00 0.00 C ATOM 855 O HIS A 177 1.531 -2.078 -8.724 1.00 0.00 O ATOM 856 CB HIS A 177 1.274 0.472 -10.844 1.00 0.00 C ATOM 857 CG HIS A 177 0.057 1.354 -10.693 1.00 0.00 C ATOM 858 ND1 HIS A 177 -1.251 0.932 -10.818 1.00 0.00 N ATOM 859 CD2 HIS A 177 0.049 2.592 -10.110 1.00 0.00 C ATOM 860 CE1 HIS A 177 -2.038 1.895 -10.295 1.00 0.00 C ATOM 861 NE2 HIS A 177 -1.270 2.921 -9.866 1.00 0.00 N ATOM 0 H HIS A 177 3.282 1.620 -9.873 1.00 0.00 H new ATOM 0 HA HIS A 177 0.956 0.247 -8.792 1.00 0.00 H new ATOM 0 HB2 HIS A 177 2.030 0.969 -11.452 1.00 0.00 H new ATOM 0 HB3 HIS A 177 1.011 -0.454 -11.356 1.00 0.00 H new ATOM 0 HD2 HIS A 177 0.913 3.199 -9.883 1.00 0.00 H new ATOM 0 HE1 HIS A 177 -3.115 1.853 -10.229 1.00 0.00 H new ATOM 0 HE2 HIS A 177 -1.605 3.784 -9.438 1.00 0.00 H new ATOM 870 N ASP A 178 3.622 -1.497 -9.383 1.00 0.00 N ATOM 871 CA ASP A 178 4.280 -2.712 -8.904 1.00 0.00 C ATOM 872 C ASP A 178 4.267 -2.793 -7.382 1.00 0.00 C ATOM 873 O ASP A 178 4.133 -3.893 -6.850 1.00 0.00 O ATOM 874 CB ASP A 178 5.758 -2.774 -9.302 1.00 0.00 C ATOM 875 CG ASP A 178 5.967 -3.561 -10.580 1.00 0.00 C ATOM 876 OD1 ASP A 178 5.699 -4.793 -10.533 1.00 0.00 O ATOM 877 OD2 ASP A 178 6.382 -2.969 -11.609 1.00 0.00 O ATOM 0 H ASP A 178 4.247 -0.856 -9.871 1.00 0.00 H new ATOM 0 HA ASP A 178 3.719 -3.528 -9.359 1.00 0.00 H new ATOM 0 HB2 ASP A 178 6.142 -1.762 -9.432 1.00 0.00 H new ATOM 0 HB3 ASP A 178 6.332 -3.231 -8.496 1.00 0.00 H new ATOM 882 N CYS A 179 4.476 -1.650 -6.721 1.00 0.00 N ATOM 883 CA CYS A 179 4.612 -1.494 -5.286 1.00 0.00 C ATOM 884 C CYS A 179 3.335 -1.944 -4.573 1.00 0.00 C ATOM 885 O CYS A 179 3.352 -2.870 -3.752 1.00 0.00 O ATOM 886 CB CYS A 179 4.949 -0.043 -4.951 1.00 0.00 C ATOM 887 SG CYS A 179 4.883 0.409 -3.213 1.00 0.00 S ATOM 0 H CYS A 179 4.558 -0.760 -7.212 1.00 0.00 H new ATOM 0 HA CYS A 179 5.428 -2.126 -4.935 1.00 0.00 H new ATOM 0 HB2 CYS A 179 5.952 0.170 -5.322 1.00 0.00 H new ATOM 0 HB3 CYS A 179 4.263 0.603 -5.499 1.00 0.00 H new ATOM 892 N VAL A 180 2.208 -1.300 -4.917 1.00 0.00 N ATOM 893 CA VAL A 180 0.907 -1.651 -4.348 1.00 0.00 C ATOM 894 C VAL A 180 0.559 -3.096 -4.643 1.00 0.00 C ATOM 895 O VAL A 180 0.097 -3.806 -3.754 1.00 0.00 O ATOM 896 CB VAL A 180 -0.241 -0.764 -4.856 1.00 0.00 C ATOM 897 CG1 VAL A 180 -0.038 0.657 -4.385 1.00 0.00 C ATOM 898 CG2 VAL A 180 -0.487 -0.703 -6.360 1.00 0.00 C ATOM 0 H VAL A 180 2.177 -0.533 -5.588 1.00 0.00 H new ATOM 0 HA VAL A 180 1.009 -1.491 -3.275 1.00 0.00 H new ATOM 0 HB VAL A 180 -1.119 -1.256 -4.437 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -0.855 1.281 -4.748 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -0.021 0.680 -3.295 1.00 0.00 H new ATOM 0 HG13 VAL A 180 0.908 1.037 -4.771 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -1.327 -0.039 -6.565 1.00 0.00 H new ATOM 0 HG22 VAL A 180 0.405 -0.325 -6.860 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -0.715 -1.702 -6.732 1.00 0.00 H new ATOM 908 N ASN A 181 0.848 -3.526 -5.876 1.00 0.00 N ATOM 909 CA ASN A 181 0.670 -4.885 -6.325 1.00 0.00 C ATOM 910 C ASN A 181 1.380 -5.858 -5.395 1.00 0.00 C ATOM 911 O ASN A 181 0.704 -6.633 -4.727 1.00 0.00 O ATOM 912 CB ASN A 181 1.102 -4.999 -7.784 1.00 0.00 C ATOM 913 CG ASN A 181 1.037 -6.421 -8.271 1.00 0.00 C ATOM 914 OD1 ASN A 181 -0.019 -6.922 -8.632 1.00 0.00 O ATOM 915 ND2 ASN A 181 2.162 -7.088 -8.266 1.00 0.00 N ATOM 0 H ASN A 181 1.222 -2.911 -6.599 1.00 0.00 H new ATOM 0 HA ASN A 181 -0.384 -5.160 -6.284 1.00 0.00 H new ATOM 0 HB2 ASN A 181 0.461 -4.372 -8.404 1.00 0.00 H new ATOM 0 HB3 ASN A 181 2.119 -4.622 -7.894 1.00 0.00 H new ATOM 0 HD21 ASN A 181 2.179 -8.061 -8.570 1.00 0.00 H new ATOM 0 HD22 ASN A 181 3.022 -6.635 -7.958 1.00 0.00 H new ATOM 922 N ILE A 182 2.717 -5.830 -5.323 1.00 0.00 N ATOM 923 CA ILE A 182 3.425 -6.869 -4.593 1.00 0.00 C ATOM 924 C ILE A 182 3.211 -6.775 -3.075 1.00 0.00 C ATOM 925 O ILE A 182 3.177 -7.814 -2.413 1.00 0.00 O ATOM 926 CB ILE A 182 4.892 -6.971 -5.052 1.00 0.00 C ATOM 927 CG1 ILE A 182 5.552 -8.256 -4.541 1.00 0.00 C ATOM 928 CG2 ILE A 182 5.749 -5.771 -4.628 1.00 0.00 C ATOM 929 CD1 ILE A 182 4.928 -9.549 -5.081 1.00 0.00 C ATOM 0 H ILE A 182 3.309 -5.118 -5.750 1.00 0.00 H new ATOM 0 HA ILE A 182 2.983 -7.832 -4.848 1.00 0.00 H new ATOM 0 HB ILE A 182 4.848 -6.983 -6.141 1.00 0.00 H new ATOM 0 HG12 ILE A 182 6.609 -8.238 -4.808 1.00 0.00 H new ATOM 0 HG13 ILE A 182 5.499 -8.269 -3.452 1.00 0.00 H new ATOM 0 HG21 ILE A 182 6.770 -5.909 -4.984 1.00 0.00 H new ATOM 0 HG22 ILE A 182 5.335 -4.859 -5.057 1.00 0.00 H new ATOM 0 HG23 ILE A 182 5.752 -5.692 -3.541 1.00 0.00 H new ATOM 0 HD11 ILE A 182 5.457 -10.408 -4.668 1.00 0.00 H new ATOM 0 HD12 ILE A 182 3.878 -9.595 -4.791 1.00 0.00 H new ATOM 0 HD13 ILE A 182 5.005 -9.564 -6.168 1.00 0.00 H new ATOM 941 N THR A 183 2.967 -5.561 -2.546 1.00 0.00 N ATOM 942 CA THR A 183 2.478 -5.315 -1.189 1.00 0.00 C ATOM 943 C THR A 183 1.253 -6.183 -0.954 1.00 0.00 C ATOM 944 O THR A 183 1.288 -7.143 -0.188 1.00 0.00 O ATOM 945 CB THR A 183 2.136 -3.829 -0.990 1.00 0.00 C ATOM 946 OG1 THR A 183 3.282 -3.048 -1.181 1.00 0.00 O ATOM 947 CG2 THR A 183 1.521 -3.573 0.382 1.00 0.00 C ATOM 0 H THR A 183 3.112 -4.701 -3.074 1.00 0.00 H new ATOM 0 HA THR A 183 3.255 -5.569 -0.469 1.00 0.00 H new ATOM 0 HB THR A 183 1.389 -3.547 -1.732 1.00 0.00 H new ATOM 0 HG1 THR A 183 3.279 -2.680 -2.089 1.00 0.00 H new ATOM 0 HG21 THR A 183 1.293 -2.512 0.486 1.00 0.00 H new ATOM 0 HG22 THR A 183 0.604 -4.153 0.484 1.00 0.00 H new ATOM 0 HG23 THR A 183 2.226 -3.870 1.158 1.00 0.00 H new ATOM 955 N ILE A 184 0.177 -5.846 -1.660 1.00 0.00 N ATOM 956 CA ILE A 184 -1.127 -6.485 -1.533 1.00 0.00 C ATOM 957 C ILE A 184 -1.032 -7.981 -1.810 1.00 0.00 C ATOM 958 O ILE A 184 -1.443 -8.766 -0.951 1.00 0.00 O ATOM 959 CB ILE A 184 -2.138 -5.776 -2.459 1.00 0.00 C ATOM 960 CG1 ILE A 184 -2.418 -4.376 -1.864 1.00 0.00 C ATOM 961 CG2 ILE A 184 -3.428 -6.595 -2.657 1.00 0.00 C ATOM 962 CD1 ILE A 184 -3.266 -3.492 -2.772 1.00 0.00 C ATOM 0 H ILE A 184 0.190 -5.100 -2.355 1.00 0.00 H new ATOM 0 HA ILE A 184 -1.483 -6.386 -0.508 1.00 0.00 H new ATOM 0 HB ILE A 184 -1.714 -5.676 -3.458 1.00 0.00 H new ATOM 0 HG12 ILE A 184 -2.924 -4.491 -0.905 1.00 0.00 H new ATOM 0 HG13 ILE A 184 -1.469 -3.877 -1.666 1.00 0.00 H new ATOM 0 HG21 ILE A 184 -4.106 -6.053 -3.316 1.00 0.00 H new ATOM 0 HG22 ILE A 184 -3.182 -7.559 -3.103 1.00 0.00 H new ATOM 0 HG23 ILE A 184 -3.910 -6.754 -1.692 1.00 0.00 H new ATOM 0 HD11 ILE A 184 -3.424 -2.525 -2.294 1.00 0.00 H new ATOM 0 HD12 ILE A 184 -2.752 -3.347 -3.722 1.00 0.00 H new ATOM 0 HD13 ILE A 184 -4.229 -3.971 -2.950 1.00 0.00 H new ATOM 974 N LYS A 185 -0.486 -8.385 -2.965 1.00 0.00 N ATOM 975 CA LYS A 185 -0.398 -9.774 -3.426 1.00 0.00 C ATOM 976 C LYS A 185 0.050 -10.684 -2.304 1.00 0.00 C ATOM 977 O LYS A 185 -0.683 -11.576 -1.895 1.00 0.00 O ATOM 978 CB LYS A 185 0.560 -9.889 -4.610 1.00 0.00 C ATOM 979 CG LYS A 185 -0.096 -9.337 -5.873 1.00 0.00 C ATOM 980 CD LYS A 185 -0.755 -10.432 -6.722 1.00 0.00 C ATOM 981 CE LYS A 185 -1.527 -9.851 -7.909 1.00 0.00 C ATOM 982 NZ LYS A 185 -2.713 -9.089 -7.465 1.00 0.00 N ATOM 0 H LYS A 185 -0.078 -7.726 -3.628 1.00 0.00 H new ATOM 0 HA LYS A 185 -1.391 -10.085 -3.749 1.00 0.00 H new ATOM 0 HB2 LYS A 185 1.478 -9.341 -4.399 1.00 0.00 H new ATOM 0 HB3 LYS A 185 0.839 -10.932 -4.762 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -0.847 -8.597 -5.595 1.00 0.00 H new ATOM 0 HG3 LYS A 185 0.654 -8.820 -6.472 1.00 0.00 H new ATOM 0 HD2 LYS A 185 0.010 -11.117 -7.088 1.00 0.00 H new ATOM 0 HD3 LYS A 185 -1.433 -11.015 -6.099 1.00 0.00 H new ATOM 0 HE2 LYS A 185 -0.871 -9.200 -8.487 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -1.839 -10.658 -8.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 -3.320 -8.884 -8.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 -3.246 -9.650 -6.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 -2.408 -8.196 -7.028 1.00 0.00 H new ATOM 996 N GLN A 186 1.227 -10.419 -1.744 1.00 0.00 N ATOM 997 CA GLN A 186 1.788 -11.323 -0.756 1.00 0.00 C ATOM 998 C GLN A 186 1.213 -11.151 0.643 1.00 0.00 C ATOM 999 O GLN A 186 1.246 -12.107 1.417 1.00 0.00 O ATOM 1000 CB GLN A 186 3.288 -11.154 -0.720 1.00 0.00 C ATOM 1001 CG GLN A 186 3.863 -11.543 -2.095 1.00 0.00 C ATOM 1002 CD GLN A 186 5.342 -11.883 -2.081 1.00 0.00 C ATOM 1003 OE1 GLN A 186 5.862 -12.449 -3.036 1.00 0.00 O ATOM 1004 NE2 GLN A 186 6.035 -11.531 -1.016 1.00 0.00 N ATOM 0 H GLN A 186 1.798 -9.601 -1.955 1.00 0.00 H new ATOM 0 HA GLN A 186 1.515 -12.331 -1.068 1.00 0.00 H new ATOM 0 HB2 GLN A 186 3.546 -10.122 -0.481 1.00 0.00 H new ATOM 0 HB3 GLN A 186 3.720 -11.780 0.061 1.00 0.00 H new ATOM 0 HG2 GLN A 186 3.309 -12.400 -2.478 1.00 0.00 H new ATOM 0 HG3 GLN A 186 3.698 -10.720 -2.791 1.00 0.00 H new ATOM 0 HE21 GLN A 186 5.571 -11.061 -0.238 1.00 0.00 H new ATOM 0 HE22 GLN A 186 7.035 -11.728 -0.970 1.00 0.00 H new ATOM 1013 N HIS A 187 0.647 -9.985 0.970 1.00 0.00 N ATOM 1014 CA HIS A 187 0.064 -9.739 2.281 1.00 0.00 C ATOM 1015 C HIS A 187 -1.252 -10.497 2.384 1.00 0.00 C ATOM 1016 O HIS A 187 -1.537 -11.136 3.399 1.00 0.00 O ATOM 1017 CB HIS A 187 -0.172 -8.232 2.500 1.00 0.00 C ATOM 1018 CG HIS A 187 -0.044 -7.883 3.952 1.00 0.00 C ATOM 1019 ND1 HIS A 187 1.136 -7.591 4.611 1.00 0.00 N ATOM 1020 CD2 HIS A 187 -1.062 -7.894 4.861 1.00 0.00 C ATOM 1021 CE1 HIS A 187 0.827 -7.379 5.901 1.00 0.00 C ATOM 1022 NE2 HIS A 187 -0.493 -7.580 6.076 1.00 0.00 N ATOM 0 H HIS A 187 0.583 -9.192 0.332 1.00 0.00 H new ATOM 0 HA HIS A 187 0.752 -10.086 3.052 1.00 0.00 H new ATOM 0 HB2 HIS A 187 0.548 -7.657 1.918 1.00 0.00 H new ATOM 0 HB3 HIS A 187 -1.164 -7.958 2.141 1.00 0.00 H new ATOM 0 HD2 HIS A 187 -2.103 -8.106 4.667 1.00 0.00 H new ATOM 0 HE1 HIS A 187 1.525 -7.093 6.674 1.00 0.00 H new ATOM 0 HE2 HIS A 187 -0.991 -7.511 6.964 1.00 0.00 H new ATOM 1031 N THR A 188 -2.010 -10.417 1.285 1.00 0.00 N ATOM 1032 CA THR A 188 -3.305 -11.039 1.051 1.00 0.00 C ATOM 1033 C THR A 188 -3.165 -12.529 0.803 1.00 0.00 C ATOM 1034 O THR A 188 -3.887 -13.275 1.446 1.00 0.00 O ATOM 1035 CB THR A 188 -4.067 -10.401 -0.111 1.00 0.00 C ATOM 1036 OG1 THR A 188 -3.341 -10.421 -1.314 1.00 0.00 O ATOM 1037 CG2 THR A 188 -4.474 -8.967 0.186 1.00 0.00 C ATOM 0 H THR A 188 -1.705 -9.873 0.478 1.00 0.00 H new ATOM 0 HA THR A 188 -3.882 -10.875 1.961 1.00 0.00 H new ATOM 0 HB THR A 188 -4.961 -11.013 -0.230 1.00 0.00 H new ATOM 0 HG1 THR A 188 -2.731 -9.654 -1.341 1.00 0.00 H new ATOM 0 HG21 THR A 188 -5.012 -8.557 -0.669 1.00 0.00 H new ATOM 0 HG22 THR A 188 -5.119 -8.946 1.065 1.00 0.00 H new ATOM 0 HG23 THR A 188 -3.583 -8.368 0.375 1.00 0.00 H new ATOM 1045 N VAL A 189 -2.256 -13.001 -0.058 1.00 0.00 N ATOM 1046 CA VAL A 189 -2.013 -14.445 -0.261 1.00 0.00 C ATOM 1047 C VAL A 189 -1.537 -15.134 1.019 1.00 0.00 C ATOM 1048 O VAL A 189 -2.013 -16.225 1.353 1.00 0.00 O ATOM 1049 CB VAL A 189 -1.054 -14.700 -1.435 1.00 0.00 C ATOM 1050 CG1 VAL A 189 -0.542 -16.147 -1.521 1.00 0.00 C ATOM 1051 CG2 VAL A 189 -1.744 -14.388 -2.772 1.00 0.00 C ATOM 0 H VAL A 189 -1.667 -12.400 -0.635 1.00 0.00 H new ATOM 0 HA VAL A 189 -2.971 -14.893 -0.523 1.00 0.00 H new ATOM 0 HB VAL A 189 -0.205 -14.043 -1.249 1.00 0.00 H new ATOM 0 HG11 VAL A 189 0.128 -16.246 -2.375 1.00 0.00 H new ATOM 0 HG12 VAL A 189 -0.004 -16.398 -0.607 1.00 0.00 H new ATOM 0 HG13 VAL A 189 -1.387 -16.825 -1.643 1.00 0.00 H new ATOM 0 HG21 VAL A 189 -1.050 -14.574 -3.592 1.00 0.00 H new ATOM 0 HG22 VAL A 189 -2.621 -15.026 -2.887 1.00 0.00 H new ATOM 0 HG23 VAL A 189 -2.052 -13.342 -2.787 1.00 0.00 H new ATOM 1061 N THR A 190 -0.644 -14.478 1.770 1.00 0.00 N ATOM 1062 CA THR A 190 -0.134 -15.012 3.046 1.00 0.00 C ATOM 1063 C THR A 190 -1.269 -15.284 4.038 1.00 0.00 C ATOM 1064 O THR A 190 -1.184 -16.243 4.792 1.00 0.00 O ATOM 1065 CB THR A 190 0.941 -14.105 3.672 1.00 0.00 C ATOM 1066 OG1 THR A 190 2.059 -14.044 2.813 1.00 0.00 O ATOM 1067 CG2 THR A 190 1.457 -14.605 5.019 1.00 0.00 C ATOM 0 H THR A 190 -0.255 -13.570 1.516 1.00 0.00 H new ATOM 0 HA THR A 190 0.344 -15.964 2.814 1.00 0.00 H new ATOM 0 HB THR A 190 0.462 -13.137 3.819 1.00 0.00 H new ATOM 0 HG1 THR A 190 1.835 -13.512 2.021 1.00 0.00 H new ATOM 0 HG21 THR A 190 2.211 -13.915 5.398 1.00 0.00 H new ATOM 0 HG22 THR A 190 0.630 -14.663 5.727 1.00 0.00 H new ATOM 0 HG23 THR A 190 1.899 -15.594 4.895 1.00 0.00 H new ATOM 1075 N THR A 191 -2.345 -14.488 4.033 1.00 0.00 N ATOM 1076 CA THR A 191 -3.514 -14.674 4.896 1.00 0.00 C ATOM 1077 C THR A 191 -4.674 -15.427 4.220 1.00 0.00 C ATOM 1078 O THR A 191 -5.412 -16.174 4.861 1.00 0.00 O ATOM 1079 CB THR A 191 -3.903 -13.312 5.471 1.00 0.00 C ATOM 1080 OG1 THR A 191 -4.758 -13.435 6.584 1.00 0.00 O ATOM 1081 CG2 THR A 191 -4.475 -12.319 4.465 1.00 0.00 C ATOM 0 H THR A 191 -2.427 -13.680 3.416 1.00 0.00 H new ATOM 0 HA THR A 191 -3.249 -15.340 5.717 1.00 0.00 H new ATOM 0 HB THR A 191 -2.953 -12.885 5.792 1.00 0.00 H new ATOM 0 HG1 THR A 191 -4.983 -12.544 6.924 1.00 0.00 H new ATOM 0 HG21 THR A 191 -4.718 -11.386 4.973 1.00 0.00 H new ATOM 0 HG22 THR A 191 -3.738 -12.126 3.685 1.00 0.00 H new ATOM 0 HG23 THR A 191 -5.378 -12.734 4.017 1.00 0.00 H new ATOM 1089 N THR A 192 -4.788 -15.332 2.893 1.00 0.00 N ATOM 1090 CA THR A 192 -5.743 -16.077 2.060 1.00 0.00 C ATOM 1091 C THR A 192 -5.499 -17.579 2.223 1.00 0.00 C ATOM 1092 O THR A 192 -6.429 -18.342 2.478 1.00 0.00 O ATOM 1093 CB THR A 192 -5.669 -15.675 0.568 1.00 0.00 C ATOM 1094 OG1 THR A 192 -5.949 -14.298 0.402 1.00 0.00 O ATOM 1095 CG2 THR A 192 -6.636 -16.423 -0.350 1.00 0.00 C ATOM 0 H THR A 192 -4.195 -14.709 2.345 1.00 0.00 H new ATOM 0 HA THR A 192 -6.747 -15.825 2.401 1.00 0.00 H new ATOM 0 HB THR A 192 -4.650 -15.935 0.282 1.00 0.00 H new ATOM 0 HG1 THR A 192 -5.455 -13.781 1.072 1.00 0.00 H new ATOM 0 HG21 THR A 192 -6.510 -16.073 -1.374 1.00 0.00 H new ATOM 0 HG22 THR A 192 -6.428 -17.492 -0.304 1.00 0.00 H new ATOM 0 HG23 THR A 192 -7.661 -16.238 -0.027 1.00 0.00 H new ATOM 1103 N THR A 193 -4.225 -17.987 2.158 1.00 0.00 N ATOM 1104 CA THR A 193 -3.744 -19.360 2.384 1.00 0.00 C ATOM 1105 C THR A 193 -3.929 -19.866 3.818 1.00 0.00 C ATOM 1106 O THR A 193 -3.770 -21.061 4.078 1.00 0.00 O ATOM 1107 CB THR A 193 -2.271 -19.498 1.959 1.00 0.00 C ATOM 1108 OG1 THR A 193 -1.434 -18.495 2.506 1.00 0.00 O ATOM 1109 CG2 THR A 193 -2.184 -19.374 0.446 1.00 0.00 C ATOM 0 H THR A 193 -3.466 -17.342 1.937 1.00 0.00 H new ATOM 0 HA THR A 193 -4.373 -19.993 1.758 1.00 0.00 H new ATOM 0 HB THR A 193 -1.931 -20.467 2.325 1.00 0.00 H new ATOM 0 HG1 THR A 193 -1.508 -17.678 1.969 1.00 0.00 H new ATOM 0 HG21 THR A 193 -1.145 -19.470 0.132 1.00 0.00 H new ATOM 0 HG22 THR A 193 -2.778 -20.162 -0.018 1.00 0.00 H new ATOM 0 HG23 THR A 193 -2.567 -18.401 0.138 1.00 0.00 H new ATOM 1117 N LYS A 194 -4.284 -18.981 4.752 1.00 0.00 N ATOM 1118 CA LYS A 194 -4.706 -19.314 6.119 1.00 0.00 C ATOM 1119 C LYS A 194 -6.222 -19.427 6.285 1.00 0.00 C ATOM 1120 O LYS A 194 -6.654 -20.146 7.189 1.00 0.00 O ATOM 1121 CB LYS A 194 -4.194 -18.266 7.114 1.00 0.00 C ATOM 1122 CG LYS A 194 -2.670 -18.219 7.130 1.00 0.00 C ATOM 1123 CD LYS A 194 -2.181 -17.122 8.076 1.00 0.00 C ATOM 1124 CE LYS A 194 -0.666 -17.146 8.273 1.00 0.00 C ATOM 1125 NZ LYS A 194 0.078 -17.093 6.999 1.00 0.00 N ATOM 0 H LYS A 194 -4.286 -17.977 4.573 1.00 0.00 H new ATOM 0 HA LYS A 194 -4.273 -20.293 6.322 1.00 0.00 H new ATOM 0 HB2 LYS A 194 -4.588 -17.285 6.848 1.00 0.00 H new ATOM 0 HB3 LYS A 194 -4.564 -18.498 8.113 1.00 0.00 H new ATOM 0 HG2 LYS A 194 -2.273 -19.184 7.446 1.00 0.00 H new ATOM 0 HG3 LYS A 194 -2.295 -18.034 6.123 1.00 0.00 H new ATOM 0 HD2 LYS A 194 -2.477 -16.150 7.682 1.00 0.00 H new ATOM 0 HD3 LYS A 194 -2.671 -17.237 9.043 1.00 0.00 H new ATOM 0 HE2 LYS A 194 -0.372 -16.301 8.896 1.00 0.00 H new ATOM 0 HE3 LYS A 194 -0.389 -18.051 8.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 0.998 -16.633 7.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 0.229 -18.059 6.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 -0.468 -16.549 6.301 1.00 0.00 H new ATOM 1139 N GLY A 195 -7.002 -18.723 5.452 1.00 0.00 N ATOM 1140 CA GLY A 195 -8.465 -18.665 5.544 1.00 0.00 C ATOM 1141 C GLY A 195 -9.152 -17.383 5.061 1.00 0.00 C ATOM 1142 O GLY A 195 -10.386 -17.338 4.991 1.00 0.00 O ATOM 0 H GLY A 195 -6.626 -18.169 4.683 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -8.872 -19.500 4.974 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -8.744 -18.824 6.586 1.00 0.00 H new ATOM 1146 N GLU A 196 -8.405 -16.317 4.768 1.00 0.00 N ATOM 1147 CA GLU A 196 -8.972 -15.089 4.203 1.00 0.00 C ATOM 1148 C GLU A 196 -9.342 -15.172 2.726 1.00 0.00 C ATOM 1149 O GLU A 196 -9.042 -16.132 2.015 1.00 0.00 O ATOM 1150 CB GLU A 196 -8.051 -13.897 4.471 1.00 0.00 C ATOM 1151 CG GLU A 196 -8.702 -12.973 5.497 1.00 0.00 C ATOM 1152 CD GLU A 196 -9.748 -11.997 4.944 1.00 0.00 C ATOM 1153 OE1 GLU A 196 -10.781 -12.451 4.390 1.00 0.00 O ATOM 1154 OE2 GLU A 196 -9.584 -10.766 5.127 1.00 0.00 O ATOM 0 H GLU A 196 -7.396 -16.279 4.914 1.00 0.00 H new ATOM 0 HA GLU A 196 -9.920 -14.945 4.721 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -7.086 -14.245 4.839 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -7.862 -13.354 3.545 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -9.174 -13.587 6.264 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -7.918 -12.397 5.989 1.00 0.00 H new ATOM 1161 N ASN A 197 -10.004 -14.106 2.294 1.00 0.00 N ATOM 1162 CA ASN A 197 -10.318 -13.744 0.932 1.00 0.00 C ATOM 1163 C ASN A 197 -10.744 -12.274 0.896 1.00 0.00 C ATOM 1164 O ASN A 197 -11.887 -11.913 1.208 1.00 0.00 O ATOM 1165 CB ASN A 197 -11.373 -14.664 0.350 1.00 0.00 C ATOM 1166 CG ASN A 197 -11.685 -14.307 -1.103 1.00 0.00 C ATOM 1167 OD1 ASN A 197 -10.800 -13.983 -1.897 1.00 0.00 O ATOM 1168 ND2 ASN A 197 -12.948 -14.307 -1.468 1.00 0.00 N ATOM 0 H ASN A 197 -10.364 -13.416 2.953 1.00 0.00 H new ATOM 0 HA ASN A 197 -9.434 -13.864 0.306 1.00 0.00 H new ATOM 0 HB2 ASN A 197 -11.029 -15.697 0.406 1.00 0.00 H new ATOM 0 HB3 ASN A 197 -12.283 -14.599 0.946 1.00 0.00 H new ATOM 0 HD21 ASN A 197 -13.204 -14.037 -2.418 1.00 0.00 H new ATOM 0 HD22 ASN A 197 -13.671 -14.577 -0.802 1.00 0.00 H new ATOM 1175 N PHE A 198 -9.782 -11.430 0.546 1.00 0.00 N ATOM 1176 CA PHE A 198 -9.959 -10.016 0.269 1.00 0.00 C ATOM 1177 C PHE A 198 -10.812 -9.828 -0.971 1.00 0.00 C ATOM 1178 O PHE A 198 -10.645 -10.528 -1.979 1.00 0.00 O ATOM 1179 CB PHE A 198 -8.587 -9.389 0.043 1.00 0.00 C ATOM 1180 CG PHE A 198 -7.882 -9.126 1.349 1.00 0.00 C ATOM 1181 CD1 PHE A 198 -7.429 -10.174 2.176 1.00 0.00 C ATOM 1182 CD2 PHE A 198 -7.807 -7.805 1.798 1.00 0.00 C ATOM 1183 CE1 PHE A 198 -6.959 -9.888 3.468 1.00 0.00 C ATOM 1184 CE2 PHE A 198 -7.331 -7.526 3.081 1.00 0.00 C ATOM 1185 CZ PHE A 198 -6.905 -8.562 3.926 1.00 0.00 C ATOM 0 H PHE A 198 -8.812 -11.730 0.444 1.00 0.00 H new ATOM 0 HA PHE A 198 -10.458 -9.538 1.112 1.00 0.00 H new ATOM 0 HB2 PHE A 198 -7.979 -10.051 -0.573 1.00 0.00 H new ATOM 0 HB3 PHE A 198 -8.698 -8.455 -0.507 1.00 0.00 H new ATOM 0 HD1 PHE A 198 -7.443 -11.193 1.817 1.00 0.00 H new ATOM 0 HD2 PHE A 198 -8.118 -6.998 1.151 1.00 0.00 H new ATOM 0 HE1 PHE A 198 -6.637 -10.692 4.113 1.00 0.00 H new ATOM 0 HE2 PHE A 198 -7.290 -6.503 3.426 1.00 0.00 H new ATOM 0 HZ PHE A 198 -6.539 -8.342 4.918 1.00 0.00 H new ATOM 1195 N THR A 199 -11.691 -8.843 -0.885 1.00 0.00 N ATOM 1196 CA THR A 199 -12.628 -8.485 -1.948 1.00 0.00 C ATOM 1197 C THR A 199 -12.092 -7.326 -2.752 1.00 0.00 C ATOM 1198 O THR A 199 -11.274 -6.559 -2.263 1.00 0.00 O ATOM 1199 CB THR A 199 -13.977 -8.035 -1.378 1.00 0.00 C ATOM 1200 OG1 THR A 199 -13.855 -6.910 -0.520 1.00 0.00 O ATOM 1201 CG2 THR A 199 -14.662 -9.177 -0.654 1.00 0.00 C ATOM 0 H THR A 199 -11.778 -8.254 -0.057 1.00 0.00 H new ATOM 0 HA THR A 199 -12.754 -9.375 -2.565 1.00 0.00 H new ATOM 0 HB THR A 199 -14.591 -7.731 -2.225 1.00 0.00 H new ATOM 0 HG1 THR A 199 -13.781 -7.214 0.409 1.00 0.00 H new ATOM 0 HG21 THR A 199 -15.618 -8.835 -0.257 1.00 0.00 H new ATOM 0 HG22 THR A 199 -14.831 -9.999 -1.349 1.00 0.00 H new ATOM 0 HG23 THR A 199 -14.030 -9.519 0.166 1.00 0.00 H new ATOM 1209 N GLU A 200 -12.664 -7.110 -3.931 1.00 0.00 N ATOM 1210 CA GLU A 200 -12.460 -5.914 -4.736 1.00 0.00 C ATOM 1211 C GLU A 200 -12.645 -4.608 -3.971 1.00 0.00 C ATOM 1212 O GLU A 200 -12.017 -3.618 -4.345 1.00 0.00 O ATOM 1213 CB GLU A 200 -13.405 -5.930 -5.931 1.00 0.00 C ATOM 1214 CG GLU A 200 -14.912 -6.006 -5.643 1.00 0.00 C ATOM 1215 CD GLU A 200 -15.581 -6.678 -6.830 1.00 0.00 C ATOM 1216 OE1 GLU A 200 -15.570 -7.941 -6.836 1.00 0.00 O ATOM 1217 OE2 GLU A 200 -16.027 -5.984 -7.785 1.00 0.00 O ATOM 0 H GLU A 200 -13.299 -7.781 -4.364 1.00 0.00 H new ATOM 0 HA GLU A 200 -11.418 -5.943 -5.055 1.00 0.00 H new ATOM 0 HB2 GLU A 200 -13.220 -5.031 -6.518 1.00 0.00 H new ATOM 0 HB3 GLU A 200 -13.139 -6.781 -6.559 1.00 0.00 H new ATOM 0 HG2 GLU A 200 -15.098 -6.571 -4.730 1.00 0.00 H new ATOM 0 HG3 GLU A 200 -15.322 -5.008 -5.489 1.00 0.00 H new ATOM 1224 N THR A 201 -13.459 -4.622 -2.907 1.00 0.00 N ATOM 1225 CA THR A 201 -13.651 -3.545 -1.962 1.00 0.00 C ATOM 1226 C THR A 201 -12.455 -3.384 -1.039 1.00 0.00 C ATOM 1227 O THR A 201 -11.866 -2.307 -0.997 1.00 0.00 O ATOM 1228 CB THR A 201 -14.920 -3.726 -1.097 1.00 0.00 C ATOM 1229 OG1 THR A 201 -15.486 -5.030 -1.174 1.00 0.00 O ATOM 1230 CG2 THR A 201 -15.996 -2.743 -1.533 1.00 0.00 C ATOM 0 H THR A 201 -14.028 -5.438 -2.681 1.00 0.00 H new ATOM 0 HA THR A 201 -13.769 -2.648 -2.571 1.00 0.00 H new ATOM 0 HB THR A 201 -14.596 -3.552 -0.071 1.00 0.00 H new ATOM 0 HG1 THR A 201 -14.912 -5.665 -0.696 1.00 0.00 H new ATOM 0 HG21 THR A 201 -16.885 -2.880 -0.917 1.00 0.00 H new ATOM 0 HG22 THR A 201 -15.627 -1.724 -1.416 1.00 0.00 H new ATOM 0 HG23 THR A 201 -16.248 -2.920 -2.578 1.00 0.00 H new ATOM 1238 N ASP A 202 -12.091 -4.459 -0.326 1.00 0.00 N ATOM 1239 CA ASP A 202 -10.935 -4.514 0.572 1.00 0.00 C ATOM 1240 C ASP A 202 -9.678 -4.055 -0.169 1.00 0.00 C ATOM 1241 O ASP A 202 -8.934 -3.183 0.285 1.00 0.00 O ATOM 1242 CB ASP A 202 -10.739 -5.939 1.124 1.00 0.00 C ATOM 1243 CG ASP A 202 -11.922 -6.475 1.924 1.00 0.00 C ATOM 1244 OD1 ASP A 202 -12.214 -5.902 3.002 1.00 0.00 O ATOM 1245 OD2 ASP A 202 -12.549 -7.463 1.459 1.00 0.00 O ATOM 0 H ASP A 202 -12.609 -5.337 -0.361 1.00 0.00 H new ATOM 0 HA ASP A 202 -11.117 -3.845 1.413 1.00 0.00 H new ATOM 0 HB2 ASP A 202 -10.544 -6.614 0.291 1.00 0.00 H new ATOM 0 HB3 ASP A 202 -9.852 -5.951 1.758 1.00 0.00 H new ATOM 1250 N ILE A 203 -9.533 -4.600 -1.376 1.00 0.00 N ATOM 1251 CA ILE A 203 -8.569 -4.241 -2.395 1.00 0.00 C ATOM 1252 C ILE A 203 -8.595 -2.754 -2.654 1.00 0.00 C ATOM 1253 O ILE A 203 -7.565 -2.120 -2.465 1.00 0.00 O ATOM 1254 CB ILE A 203 -8.862 -5.060 -3.667 1.00 0.00 C ATOM 1255 CG1 ILE A 203 -8.450 -6.521 -3.433 1.00 0.00 C ATOM 1256 CG2 ILE A 203 -8.238 -4.493 -4.949 1.00 0.00 C ATOM 1257 CD1 ILE A 203 -6.937 -6.698 -3.461 1.00 0.00 C ATOM 0 H ILE A 203 -10.137 -5.362 -1.683 1.00 0.00 H new ATOM 0 HA ILE A 203 -7.561 -4.478 -2.056 1.00 0.00 H new ATOM 0 HB ILE A 203 -9.936 -4.998 -3.844 1.00 0.00 H new ATOM 0 HG12 ILE A 203 -8.837 -6.857 -2.471 1.00 0.00 H new ATOM 0 HG13 ILE A 203 -8.903 -7.152 -4.197 1.00 0.00 H new ATOM 0 HG21 ILE A 203 -8.496 -5.133 -5.793 1.00 0.00 H new ATOM 0 HG22 ILE A 203 -8.620 -3.488 -5.126 1.00 0.00 H new ATOM 0 HG23 ILE A 203 -7.154 -4.455 -4.840 1.00 0.00 H new ATOM 0 HD11 ILE A 203 -6.690 -7.746 -3.291 1.00 0.00 H new ATOM 0 HD12 ILE A 203 -6.552 -6.387 -4.432 1.00 0.00 H new ATOM 0 HD13 ILE A 203 -6.485 -6.088 -2.679 1.00 0.00 H new ATOM 1269 N LYS A 204 -9.730 -2.189 -3.079 1.00 0.00 N ATOM 1270 CA LYS A 204 -9.772 -0.779 -3.443 1.00 0.00 C ATOM 1271 C LYS A 204 -9.333 0.147 -2.307 1.00 0.00 C ATOM 1272 O LYS A 204 -8.562 1.076 -2.541 1.00 0.00 O ATOM 1273 CB LYS A 204 -11.161 -0.378 -3.938 1.00 0.00 C ATOM 1274 CG LYS A 204 -10.974 0.533 -5.146 1.00 0.00 C ATOM 1275 CD LYS A 204 -12.319 0.853 -5.784 1.00 0.00 C ATOM 1276 CE LYS A 204 -13.191 1.799 -4.959 1.00 0.00 C ATOM 1277 NZ LYS A 204 -12.599 3.144 -4.840 1.00 0.00 N ATOM 0 H LYS A 204 -10.617 -2.683 -3.177 1.00 0.00 H new ATOM 0 HA LYS A 204 -9.053 -0.658 -4.253 1.00 0.00 H new ATOM 0 HB2 LYS A 204 -11.740 -1.260 -4.210 1.00 0.00 H new ATOM 0 HB3 LYS A 204 -11.714 0.137 -3.152 1.00 0.00 H new ATOM 0 HG2 LYS A 204 -10.481 1.456 -4.840 1.00 0.00 H new ATOM 0 HG3 LYS A 204 -10.324 0.051 -5.876 1.00 0.00 H new ATOM 0 HD2 LYS A 204 -12.148 1.296 -6.765 1.00 0.00 H new ATOM 0 HD3 LYS A 204 -12.863 -0.078 -5.946 1.00 0.00 H new ATOM 0 HE2 LYS A 204 -14.176 1.877 -5.420 1.00 0.00 H new ATOM 0 HE3 LYS A 204 -13.338 1.379 -3.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 -12.436 3.364 -3.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 -11.694 3.171 -5.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 -13.249 3.846 -5.248 1.00 0.00 H new ATOM 1291 N ILE A 205 -9.780 -0.150 -1.079 1.00 0.00 N ATOM 1292 CA ILE A 205 -9.329 0.551 0.126 1.00 0.00 C ATOM 1293 C ILE A 205 -7.810 0.507 0.236 1.00 0.00 C ATOM 1294 O ILE A 205 -7.162 1.548 0.298 1.00 0.00 O ATOM 1295 CB ILE A 205 -9.965 -0.022 1.403 1.00 0.00 C ATOM 1296 CG1 ILE A 205 -11.497 0.051 1.405 1.00 0.00 C ATOM 1297 CG2 ILE A 205 -9.410 0.740 2.612 1.00 0.00 C ATOM 1298 CD1 ILE A 205 -12.068 1.451 1.231 1.00 0.00 C ATOM 0 H ILE A 205 -10.465 -0.884 -0.896 1.00 0.00 H new ATOM 0 HA ILE A 205 -9.653 1.587 0.031 1.00 0.00 H new ATOM 0 HB ILE A 205 -9.708 -1.080 1.450 1.00 0.00 H new ATOM 0 HG12 ILE A 205 -11.878 -0.584 0.605 1.00 0.00 H new ATOM 0 HG13 ILE A 205 -11.866 -0.363 2.344 1.00 0.00 H new ATOM 0 HG21 ILE A 205 -9.853 0.344 3.526 1.00 0.00 H new ATOM 0 HG22 ILE A 205 -8.327 0.620 2.652 1.00 0.00 H new ATOM 0 HG23 ILE A 205 -9.655 1.798 2.519 1.00 0.00 H new ATOM 0 HD11 ILE A 205 -13.157 1.404 1.245 1.00 0.00 H new ATOM 0 HD12 ILE A 205 -11.722 2.089 2.044 1.00 0.00 H new ATOM 0 HD13 ILE A 205 -11.735 1.864 0.279 1.00 0.00 H new ATOM 1310 N MET A 206 -7.248 -0.699 0.251 1.00 0.00 N ATOM 1311 CA MET A 206 -5.810 -0.915 0.307 1.00 0.00 C ATOM 1312 C MET A 206 -5.115 -0.184 -0.828 1.00 0.00 C ATOM 1313 O MET A 206 -4.392 0.753 -0.544 1.00 0.00 O ATOM 1314 CB MET A 206 -5.514 -2.405 0.277 1.00 0.00 C ATOM 1315 CG MET A 206 -5.854 -3.035 1.623 1.00 0.00 C ATOM 1316 SD MET A 206 -6.344 -4.766 1.500 1.00 0.00 S ATOM 1317 CE MET A 206 -5.067 -5.415 0.403 1.00 0.00 C ATOM 0 H MET A 206 -7.788 -1.564 0.224 1.00 0.00 H new ATOM 0 HA MET A 206 -5.421 -0.509 1.241 1.00 0.00 H new ATOM 0 HB2 MET A 206 -6.093 -2.883 -0.513 1.00 0.00 H new ATOM 0 HB3 MET A 206 -4.462 -2.570 0.045 1.00 0.00 H new ATOM 0 HG2 MET A 206 -4.989 -2.956 2.282 1.00 0.00 H new ATOM 0 HG3 MET A 206 -6.661 -2.469 2.087 1.00 0.00 H new ATOM 0 HE1 MET A 206 -5.130 -6.503 0.375 1.00 0.00 H new ATOM 0 HE2 MET A 206 -5.213 -5.017 -0.601 1.00 0.00 H new ATOM 0 HE3 MET A 206 -4.085 -5.118 0.772 1.00 0.00 H new ATOM 1327 N GLU A 207 -5.364 -0.552 -2.085 1.00 0.00 N ATOM 1328 CA GLU A 207 -4.931 0.110 -3.323 1.00 0.00 C ATOM 1329 C GLU A 207 -4.929 1.639 -3.304 1.00 0.00 C ATOM 1330 O GLU A 207 -4.085 2.223 -3.995 1.00 0.00 O ATOM 1331 CB GLU A 207 -5.799 -0.365 -4.489 1.00 0.00 C ATOM 1332 CG GLU A 207 -5.539 -1.828 -4.824 1.00 0.00 C ATOM 1333 CD GLU A 207 -4.348 -2.077 -5.766 1.00 0.00 C ATOM 1334 OE1 GLU A 207 -3.736 -1.110 -6.293 1.00 0.00 O ATOM 1335 OE2 GLU A 207 -4.066 -3.268 -6.050 1.00 0.00 O ATOM 0 H GLU A 207 -5.917 -1.386 -2.283 1.00 0.00 H new ATOM 0 HA GLU A 207 -3.886 -0.180 -3.435 1.00 0.00 H new ATOM 0 HB2 GLU A 207 -6.851 -0.230 -4.238 1.00 0.00 H new ATOM 0 HB3 GLU A 207 -5.599 0.250 -5.366 1.00 0.00 H new ATOM 0 HG2 GLU A 207 -5.369 -2.373 -3.896 1.00 0.00 H new ATOM 0 HG3 GLU A 207 -6.437 -2.246 -5.279 1.00 0.00 H new ATOM 1342 N ARG A 208 -5.807 2.299 -2.539 1.00 0.00 N ATOM 1343 CA ARG A 208 -5.747 3.737 -2.304 1.00 0.00 C ATOM 1344 C ARG A 208 -4.623 4.114 -1.349 1.00 0.00 C ATOM 1345 O ARG A 208 -3.769 4.944 -1.665 1.00 0.00 O ATOM 1346 CB ARG A 208 -7.106 4.196 -1.781 1.00 0.00 C ATOM 1347 CG ARG A 208 -7.130 5.696 -1.482 1.00 0.00 C ATOM 1348 CD ARG A 208 -6.617 6.549 -2.637 1.00 0.00 C ATOM 1349 NE ARG A 208 -7.358 6.251 -3.867 1.00 0.00 N ATOM 1350 CZ ARG A 208 -8.578 6.664 -4.168 1.00 0.00 C ATOM 1351 NH1 ARG A 208 -9.176 7.639 -3.516 1.00 0.00 N ATOM 1352 NH2 ARG A 208 -9.207 6.047 -5.137 1.00 0.00 N ATOM 0 H ARG A 208 -6.584 1.841 -2.064 1.00 0.00 H new ATOM 0 HA ARG A 208 -5.523 4.245 -3.242 1.00 0.00 H new ATOM 0 HB2 ARG A 208 -7.875 3.961 -2.516 1.00 0.00 H new ATOM 0 HB3 ARG A 208 -7.351 3.642 -0.875 1.00 0.00 H new ATOM 0 HG2 ARG A 208 -8.150 5.996 -1.243 1.00 0.00 H new ATOM 0 HG3 ARG A 208 -6.525 5.893 -0.597 1.00 0.00 H new ATOM 0 HD2 ARG A 208 -6.721 7.606 -2.390 1.00 0.00 H new ATOM 0 HD3 ARG A 208 -5.555 6.361 -2.791 1.00 0.00 H new ATOM 0 HE ARG A 208 -6.886 5.668 -4.558 1.00 0.00 H new ATOM 0 HH11 ARG A 208 -8.697 8.107 -2.746 1.00 0.00 H new ATOM 0 HH12 ARG A 208 -10.118 7.927 -3.781 1.00 0.00 H new ATOM 0 HH21 ARG A 208 -8.754 5.277 -5.630 1.00 0.00 H new ATOM 0 HH22 ARG A 208 -10.149 6.336 -5.399 1.00 0.00 H new ATOM 1366 N VAL A 209 -4.668 3.515 -0.165 1.00 0.00 N ATOM 1367 CA VAL A 209 -3.837 3.826 0.990 1.00 0.00 C ATOM 1368 C VAL A 209 -2.405 3.480 0.648 1.00 0.00 C ATOM 1369 O VAL A 209 -1.477 4.256 0.871 1.00 0.00 O ATOM 1370 CB VAL A 209 -4.340 2.989 2.187 1.00 0.00 C ATOM 1371 CG1 VAL A 209 -3.478 3.191 3.434 1.00 0.00 C ATOM 1372 CG2 VAL A 209 -5.814 3.277 2.512 1.00 0.00 C ATOM 0 H VAL A 209 -5.323 2.756 0.025 1.00 0.00 H new ATOM 0 HA VAL A 209 -3.891 4.883 1.252 1.00 0.00 H new ATOM 0 HB VAL A 209 -4.255 1.946 1.882 1.00 0.00 H new ATOM 0 HG11 VAL A 209 -3.870 2.583 4.249 1.00 0.00 H new ATOM 0 HG12 VAL A 209 -2.452 2.893 3.219 1.00 0.00 H new ATOM 0 HG13 VAL A 209 -3.497 4.242 3.723 1.00 0.00 H new ATOM 0 HG21 VAL A 209 -6.126 2.667 3.360 1.00 0.00 H new ATOM 0 HG22 VAL A 209 -5.932 4.332 2.761 1.00 0.00 H new ATOM 0 HG23 VAL A 209 -6.431 3.037 1.646 1.00 0.00 H new ATOM 1382 N VAL A 210 -2.256 2.307 0.043 1.00 0.00 N ATOM 1383 CA VAL A 210 -0.977 1.770 -0.342 1.00 0.00 C ATOM 1384 C VAL A 210 -0.389 2.518 -1.539 1.00 0.00 C ATOM 1385 O VAL A 210 0.811 2.724 -1.530 1.00 0.00 O ATOM 1386 CB VAL A 210 -1.102 0.252 -0.489 1.00 0.00 C ATOM 1387 CG1 VAL A 210 -1.915 -0.245 -1.669 1.00 0.00 C ATOM 1388 CG2 VAL A 210 0.255 -0.408 -0.584 1.00 0.00 C ATOM 0 H VAL A 210 -3.041 1.700 -0.193 1.00 0.00 H new ATOM 0 HA VAL A 210 -0.232 1.935 0.436 1.00 0.00 H new ATOM 0 HB VAL A 210 -1.641 -0.025 0.417 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -1.931 -1.335 -1.667 1.00 0.00 H new ATOM 0 HG12 VAL A 210 -2.935 0.133 -1.593 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -1.464 0.109 -2.596 1.00 0.00 H new ATOM 0 HG21 VAL A 210 0.129 -1.486 -0.688 1.00 0.00 H new ATOM 0 HG22 VAL A 210 0.788 -0.020 -1.452 1.00 0.00 H new ATOM 0 HG23 VAL A 210 0.827 -0.195 0.319 1.00 0.00 H new ATOM 1398 N GLU A 211 -1.167 3.012 -2.517 1.00 0.00 N ATOM 1399 CA GLU A 211 -0.614 3.827 -3.614 1.00 0.00 C ATOM 1400 C GLU A 211 -0.123 5.196 -3.125 1.00 0.00 C ATOM 1401 O GLU A 211 0.982 5.607 -3.489 1.00 0.00 O ATOM 1402 CB GLU A 211 -1.631 3.916 -4.759 1.00 0.00 C ATOM 1403 CG GLU A 211 -1.185 4.833 -5.903 1.00 0.00 C ATOM 1404 CD GLU A 211 -2.133 4.865 -7.109 1.00 0.00 C ATOM 1405 OE1 GLU A 211 -3.387 4.861 -6.949 1.00 0.00 O ATOM 1406 OE2 GLU A 211 -1.627 5.088 -8.242 1.00 0.00 O ATOM 0 H GLU A 211 -2.175 2.863 -2.571 1.00 0.00 H new ATOM 0 HA GLU A 211 0.276 3.335 -4.006 1.00 0.00 H new ATOM 0 HB2 GLU A 211 -1.810 2.916 -5.154 1.00 0.00 H new ATOM 0 HB3 GLU A 211 -2.581 4.277 -4.364 1.00 0.00 H new ATOM 0 HG2 GLU A 211 -1.077 5.846 -5.517 1.00 0.00 H new ATOM 0 HG3 GLU A 211 -0.199 4.514 -6.242 1.00 0.00 H new ATOM 1413 N GLN A 212 -0.897 5.856 -2.251 1.00 0.00 N ATOM 1414 CA GLN A 212 -0.473 7.063 -1.538 1.00 0.00 C ATOM 1415 C GLN A 212 0.818 6.828 -0.754 1.00 0.00 C ATOM 1416 O GLN A 212 1.739 7.643 -0.833 1.00 0.00 O ATOM 1417 CB GLN A 212 -1.590 7.536 -0.593 1.00 0.00 C ATOM 1418 CG GLN A 212 -2.704 8.265 -1.358 1.00 0.00 C ATOM 1419 CD GLN A 212 -2.262 9.669 -1.760 1.00 0.00 C ATOM 1420 OE1 GLN A 212 -2.161 10.562 -0.916 1.00 0.00 O ATOM 1421 NE2 GLN A 212 -1.966 9.897 -3.026 1.00 0.00 N ATOM 0 H GLN A 212 -1.845 5.561 -2.019 1.00 0.00 H new ATOM 0 HA GLN A 212 -0.275 7.838 -2.279 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -2.010 6.679 -0.067 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -1.171 8.201 0.163 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -2.972 7.695 -2.248 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -3.598 8.325 -0.737 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -2.054 9.148 -3.713 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -1.649 10.822 -3.317 1.00 0.00 H new ATOM 1430 N MET A 213 0.918 5.718 -0.018 1.00 0.00 N ATOM 1431 CA MET A 213 2.158 5.331 0.646 1.00 0.00 C ATOM 1432 C MET A 213 3.295 5.037 -0.317 1.00 0.00 C ATOM 1433 O MET A 213 4.347 5.626 -0.159 1.00 0.00 O ATOM 1434 CB MET A 213 1.916 4.098 1.483 1.00 0.00 C ATOM 1435 CG MET A 213 1.143 4.457 2.730 1.00 0.00 C ATOM 1436 SD MET A 213 2.077 5.404 3.963 1.00 0.00 S ATOM 1437 CE MET A 213 3.422 4.233 4.302 1.00 0.00 C ATOM 0 H MET A 213 0.146 5.069 0.132 1.00 0.00 H new ATOM 0 HA MET A 213 2.457 6.182 1.257 1.00 0.00 H new ATOM 0 HB2 MET A 213 1.363 3.359 0.903 1.00 0.00 H new ATOM 0 HB3 MET A 213 2.868 3.642 1.755 1.00 0.00 H new ATOM 0 HG2 MET A 213 0.264 5.033 2.441 1.00 0.00 H new ATOM 0 HG3 MET A 213 0.784 3.538 3.194 1.00 0.00 H new ATOM 0 HE1 MET A 213 3.892 4.484 5.253 1.00 0.00 H new ATOM 0 HE2 MET A 213 3.020 3.221 4.352 1.00 0.00 H new ATOM 0 HE3 MET A 213 4.163 4.290 3.505 1.00 0.00 H new ATOM 1447 N CYS A 214 3.109 4.148 -1.287 1.00 0.00 N ATOM 1448 CA CYS A 214 4.073 3.763 -2.312 1.00 0.00 C ATOM 1449 C CYS A 214 4.732 4.987 -2.944 1.00 0.00 C ATOM 1450 O CYS A 214 5.931 5.198 -2.769 1.00 0.00 O ATOM 1451 CB CYS A 214 3.337 2.939 -3.366 1.00 0.00 C ATOM 1452 SG CYS A 214 3.048 1.214 -2.935 1.00 0.00 S ATOM 0 H CYS A 214 2.226 3.646 -1.385 1.00 0.00 H new ATOM 0 HA CYS A 214 4.871 3.173 -1.861 1.00 0.00 H new ATOM 0 HB2 CYS A 214 2.376 3.412 -3.566 1.00 0.00 H new ATOM 0 HB3 CYS A 214 3.908 2.973 -4.294 1.00 0.00 H new ATOM 1457 N THR A 215 3.942 5.818 -3.639 1.00 0.00 N ATOM 1458 CA THR A 215 4.405 7.097 -4.174 1.00 0.00 C ATOM 1459 C THR A 215 5.149 7.918 -3.113 1.00 0.00 C ATOM 1460 O THR A 215 6.235 8.413 -3.384 1.00 0.00 O ATOM 1461 CB THR A 215 3.224 7.824 -4.856 1.00 0.00 C ATOM 1462 OG1 THR A 215 3.614 8.404 -6.079 1.00 0.00 O ATOM 1463 CG2 THR A 215 2.641 8.937 -4.006 1.00 0.00 C ATOM 0 H THR A 215 2.963 5.618 -3.844 1.00 0.00 H new ATOM 0 HA THR A 215 5.154 6.933 -4.949 1.00 0.00 H new ATOM 0 HB THR A 215 2.471 7.050 -5.009 1.00 0.00 H new ATOM 0 HG1 THR A 215 2.845 8.855 -6.487 1.00 0.00 H new ATOM 0 HG21 THR A 215 1.816 9.408 -4.540 1.00 0.00 H new ATOM 0 HG22 THR A 215 2.276 8.524 -3.066 1.00 0.00 H new ATOM 0 HG23 THR A 215 3.412 9.680 -3.801 1.00 0.00 H new ATOM 1471 N THR A 216 4.624 8.014 -1.885 1.00 0.00 N ATOM 1472 CA THR A 216 5.255 8.787 -0.811 1.00 0.00 C ATOM 1473 C THR A 216 6.592 8.183 -0.375 1.00 0.00 C ATOM 1474 O THR A 216 7.553 8.925 -0.207 1.00 0.00 O ATOM 1475 CB THR A 216 4.301 8.936 0.385 1.00 0.00 C ATOM 1476 OG1 THR A 216 3.114 9.581 -0.029 1.00 0.00 O ATOM 1477 CG2 THR A 216 4.890 9.742 1.535 1.00 0.00 C ATOM 0 H THR A 216 3.753 7.559 -1.610 1.00 0.00 H new ATOM 0 HA THR A 216 5.468 9.779 -1.208 1.00 0.00 H new ATOM 0 HB THR A 216 4.111 7.925 0.744 1.00 0.00 H new ATOM 0 HG1 THR A 216 2.489 8.917 -0.388 1.00 0.00 H new ATOM 0 HG21 THR A 216 4.162 9.807 2.344 1.00 0.00 H new ATOM 0 HG22 THR A 216 5.793 9.252 1.898 1.00 0.00 H new ATOM 0 HG23 THR A 216 5.136 10.745 1.187 1.00 0.00 H new ATOM 1485 N GLN A 217 6.713 6.858 -0.243 1.00 0.00 N ATOM 1486 CA GLN A 217 7.963 6.187 0.092 1.00 0.00 C ATOM 1487 C GLN A 217 9.053 6.581 -0.919 1.00 0.00 C ATOM 1488 O GLN A 217 10.180 6.879 -0.519 1.00 0.00 O ATOM 1489 CB GLN A 217 7.769 4.656 0.170 1.00 0.00 C ATOM 1490 CG GLN A 217 6.804 4.163 1.275 1.00 0.00 C ATOM 1491 CD GLN A 217 7.413 3.737 2.613 1.00 0.00 C ATOM 1492 OE1 GLN A 217 6.796 3.026 3.397 1.00 0.00 O ATOM 1493 NE2 GLN A 217 8.590 4.177 3.002 1.00 0.00 N ATOM 0 H GLN A 217 5.930 6.216 -0.369 1.00 0.00 H new ATOM 0 HA GLN A 217 8.287 6.511 1.081 1.00 0.00 H new ATOM 0 HB2 GLN A 217 7.400 4.304 -0.794 1.00 0.00 H new ATOM 0 HB3 GLN A 217 8.742 4.191 0.328 1.00 0.00 H new ATOM 0 HG2 GLN A 217 6.085 4.958 1.472 1.00 0.00 H new ATOM 0 HG3 GLN A 217 6.243 3.317 0.877 1.00 0.00 H new ATOM 0 HE21 GLN A 217 9.142 4.772 2.384 1.00 0.00 H new ATOM 0 HE22 GLN A 217 8.951 3.923 3.921 1.00 0.00 H new ATOM 1502 N TYR A 218 8.703 6.689 -2.210 1.00 0.00 N ATOM 1503 CA TYR A 218 9.620 7.046 -3.287 1.00 0.00 C ATOM 1504 C TYR A 218 10.118 8.480 -3.131 1.00 0.00 C ATOM 1505 O TYR A 218 11.264 8.768 -3.464 1.00 0.00 O ATOM 1506 CB TYR A 218 8.927 6.883 -4.647 1.00 0.00 C ATOM 1507 CG TYR A 218 8.785 5.466 -5.161 1.00 0.00 C ATOM 1508 CD1 TYR A 218 8.450 4.420 -4.288 1.00 0.00 C ATOM 1509 CD2 TYR A 218 8.965 5.193 -6.530 1.00 0.00 C ATOM 1510 CE1 TYR A 218 8.353 3.110 -4.759 1.00 0.00 C ATOM 1511 CE2 TYR A 218 8.878 3.882 -7.016 1.00 0.00 C ATOM 1512 CZ TYR A 218 8.611 2.828 -6.114 1.00 0.00 C ATOM 1513 OH TYR A 218 8.665 1.535 -6.509 1.00 0.00 O ATOM 0 H TYR A 218 7.750 6.525 -2.535 1.00 0.00 H new ATOM 0 HA TYR A 218 10.478 6.376 -3.235 1.00 0.00 H new ATOM 0 HB2 TYR A 218 7.932 7.324 -4.579 1.00 0.00 H new ATOM 0 HB3 TYR A 218 9.482 7.461 -5.386 1.00 0.00 H new ATOM 0 HD1 TYR A 218 8.266 4.630 -3.245 1.00 0.00 H new ATOM 0 HD2 TYR A 218 9.172 6.003 -7.213 1.00 0.00 H new ATOM 0 HE1 TYR A 218 8.080 2.312 -4.084 1.00 0.00 H new ATOM 0 HE2 TYR A 218 9.013 3.679 -8.068 1.00 0.00 H new ATOM 0 HH TYR A 218 9.583 1.310 -6.768 1.00 0.00 H new ATOM 1523 N GLN A 219 9.293 9.372 -2.581 1.00 0.00 N ATOM 1524 CA GLN A 219 9.679 10.735 -2.233 1.00 0.00 C ATOM 1525 C GLN A 219 10.747 10.738 -1.133 1.00 0.00 C ATOM 1526 O GLN A 219 11.743 11.449 -1.263 1.00 0.00 O ATOM 1527 CB GLN A 219 8.457 11.546 -1.796 1.00 0.00 C ATOM 1528 CG GLN A 219 7.312 11.537 -2.816 1.00 0.00 C ATOM 1529 CD GLN A 219 6.011 12.122 -2.302 1.00 0.00 C ATOM 1530 OE1 GLN A 219 5.924 12.709 -1.224 1.00 0.00 O ATOM 1531 NE2 GLN A 219 4.954 11.941 -3.067 1.00 0.00 N ATOM 0 H GLN A 219 8.320 9.161 -2.362 1.00 0.00 H new ATOM 0 HA GLN A 219 10.105 11.202 -3.121 1.00 0.00 H new ATOM 0 HB2 GLN A 219 8.090 11.151 -0.848 1.00 0.00 H new ATOM 0 HB3 GLN A 219 8.762 12.577 -1.615 1.00 0.00 H new ATOM 0 HG2 GLN A 219 7.624 12.095 -3.699 1.00 0.00 H new ATOM 0 HG3 GLN A 219 7.134 10.510 -3.135 1.00 0.00 H new ATOM 0 HE21 GLN A 219 5.047 11.452 -3.957 1.00 0.00 H new ATOM 0 HE22 GLN A 219 4.043 12.290 -2.769 1.00 0.00 H new ATOM 1540 N LYS A 220 10.591 9.910 -0.085 1.00 0.00 N ATOM 1541 CA LYS A 220 11.602 9.806 0.992 1.00 0.00 C ATOM 1542 C LYS A 220 12.920 9.271 0.465 1.00 0.00 C ATOM 1543 O LYS A 220 13.976 9.818 0.784 1.00 0.00 O ATOM 1544 CB LYS A 220 11.203 8.924 2.194 1.00 0.00 C ATOM 1545 CG LYS A 220 9.718 8.748 2.478 1.00 0.00 C ATOM 1546 CD LYS A 220 8.976 10.077 2.536 1.00 0.00 C ATOM 1547 CE LYS A 220 7.961 10.026 3.675 1.00 0.00 C ATOM 1548 NZ LYS A 220 7.610 11.371 4.162 1.00 0.00 N ATOM 0 H LYS A 220 9.780 9.304 0.043 1.00 0.00 H new ATOM 0 HA LYS A 220 11.689 10.833 1.348 1.00 0.00 H new ATOM 0 HB2 LYS A 220 11.635 7.935 2.043 1.00 0.00 H new ATOM 0 HB3 LYS A 220 11.668 9.342 3.087 1.00 0.00 H new ATOM 0 HG2 LYS A 220 9.275 8.121 1.704 1.00 0.00 H new ATOM 0 HG3 LYS A 220 9.592 8.223 3.425 1.00 0.00 H new ATOM 0 HD2 LYS A 220 9.679 10.895 2.694 1.00 0.00 H new ATOM 0 HD3 LYS A 220 8.471 10.269 1.589 1.00 0.00 H new ATOM 0 HE2 LYS A 220 7.059 9.517 3.335 1.00 0.00 H new ATOM 0 HE3 LYS A 220 8.368 9.437 4.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 220 6.919 11.291 4.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 220 8.466 11.848 4.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 220 7.198 11.925 3.385 1.00 0.00 H new ATOM 1562 N GLU A 221 12.827 8.210 -0.339 1.00 0.00 N ATOM 1563 CA GLU A 221 13.942 7.552 -1.015 1.00 0.00 C ATOM 1564 C GLU A 221 14.639 8.518 -1.973 1.00 0.00 C ATOM 1565 O GLU A 221 15.861 8.450 -2.106 1.00 0.00 O ATOM 1566 CB GLU A 221 13.428 6.351 -1.822 1.00 0.00 C ATOM 1567 CG GLU A 221 12.683 5.288 -1.005 1.00 0.00 C ATOM 1568 CD GLU A 221 13.525 4.102 -0.534 1.00 0.00 C ATOM 1569 OE1 GLU A 221 14.507 3.717 -1.208 1.00 0.00 O ATOM 1570 OE2 GLU A 221 13.186 3.537 0.541 1.00 0.00 O ATOM 0 H GLU A 221 11.931 7.768 -0.545 1.00 0.00 H new ATOM 0 HA GLU A 221 14.650 7.221 -0.255 1.00 0.00 H new ATOM 0 HB2 GLU A 221 12.763 6.717 -2.605 1.00 0.00 H new ATOM 0 HB3 GLU A 221 14.275 5.878 -2.318 1.00 0.00 H new ATOM 0 HG2 GLU A 221 12.246 5.769 -0.130 1.00 0.00 H new ATOM 0 HG3 GLU A 221 11.857 4.907 -1.606 1.00 0.00 H new ATOM 1577 N SER A 222 13.864 9.406 -2.620 1.00 0.00 N ATOM 1578 CA SER A 222 14.341 10.402 -3.585 1.00 0.00 C ATOM 1579 C SER A 222 15.029 11.569 -2.889 1.00 0.00 C ATOM 1580 O SER A 222 16.087 12.014 -3.334 1.00 0.00 O ATOM 1581 CB SER A 222 13.186 10.942 -4.419 1.00 0.00 C ATOM 1582 OG SER A 222 12.643 9.918 -5.225 1.00 0.00 O ATOM 0 H SER A 222 12.855 9.448 -2.478 1.00 0.00 H new ATOM 0 HA SER A 222 15.060 9.899 -4.231 1.00 0.00 H new ATOM 0 HB2 SER A 222 12.414 11.347 -3.765 1.00 0.00 H new ATOM 0 HB3 SER A 222 13.534 11.762 -5.047 1.00 0.00 H new ATOM 0 HG SER A 222 11.898 9.491 -4.753 1.00 0.00 H new ATOM 1588 N GLN A 223 14.447 12.054 -1.786 1.00 0.00 N ATOM 1589 CA GLN A 223 15.112 12.974 -0.871 1.00 0.00 C ATOM 1590 C GLN A 223 16.419 12.350 -0.395 1.00 0.00 C ATOM 1591 O GLN A 223 17.446 13.021 -0.425 1.00 0.00 O ATOM 1592 CB GLN A 223 14.244 13.222 0.362 1.00 0.00 C ATOM 1593 CG GLN A 223 13.202 14.340 0.272 1.00 0.00 C ATOM 1594 CD GLN A 223 12.517 14.485 1.630 1.00 0.00 C ATOM 1595 OE1 GLN A 223 11.424 13.972 1.870 1.00 0.00 O ATOM 1596 NE2 GLN A 223 13.187 15.067 2.609 1.00 0.00 N ATOM 0 H GLN A 223 13.496 11.815 -1.506 1.00 0.00 H new ATOM 0 HA GLN A 223 15.290 13.912 -1.396 1.00 0.00 H new ATOM 0 HB2 GLN A 223 13.724 12.294 0.601 1.00 0.00 H new ATOM 0 HB3 GLN A 223 14.904 13.443 1.201 1.00 0.00 H new ATOM 0 HG2 GLN A 223 13.679 15.278 -0.012 1.00 0.00 H new ATOM 0 HG3 GLN A 223 12.467 14.109 -0.499 1.00 0.00 H new ATOM 0 HE21 GLN A 223 14.094 15.495 2.422 1.00 0.00 H new ATOM 0 HE22 GLN A 223 12.798 15.088 3.552 1.00 0.00 H new ATOM 1605 N ALA A 224 16.395 11.075 0.010 1.00 0.00 N ATOM 1606 CA ALA A 224 17.552 10.324 0.456 1.00 0.00 C ATOM 1607 C ALA A 224 18.621 10.278 -0.647 1.00 0.00 C ATOM 1608 O ALA A 224 19.799 10.514 -0.379 1.00 0.00 O ATOM 1609 CB ALA A 224 17.115 8.927 0.917 1.00 0.00 C ATOM 0 H ALA A 224 15.535 10.528 0.033 1.00 0.00 H new ATOM 0 HA ALA A 224 18.009 10.822 1.311 1.00 0.00 H new ATOM 0 HB1 ALA A 224 17.987 8.365 1.252 1.00 0.00 H new ATOM 0 HB2 ALA A 224 16.406 9.021 1.740 1.00 0.00 H new ATOM 0 HB3 ALA A 224 16.641 8.402 0.088 1.00 0.00 H new ATOM 1615 N TYR A 225 18.178 10.096 -1.901 1.00 0.00 N ATOM 1616 CA TYR A 225 18.973 10.091 -3.131 1.00 0.00 C ATOM 1617 C TYR A 225 19.639 11.443 -3.433 1.00 0.00 C ATOM 1618 O TYR A 225 20.453 11.520 -4.343 1.00 0.00 O ATOM 1619 CB TYR A 225 18.081 9.666 -4.310 1.00 0.00 C ATOM 1620 CG TYR A 225 18.719 8.743 -5.327 1.00 0.00 C ATOM 1621 CD1 TYR A 225 19.473 9.266 -6.391 1.00 0.00 C ATOM 1622 CD2 TYR A 225 18.498 7.357 -5.239 1.00 0.00 C ATOM 1623 CE1 TYR A 225 19.999 8.406 -7.372 1.00 0.00 C ATOM 1624 CE2 TYR A 225 19.020 6.492 -6.220 1.00 0.00 C ATOM 1625 CZ TYR A 225 19.757 7.016 -7.306 1.00 0.00 C ATOM 1626 OH TYR A 225 20.220 6.209 -8.309 1.00 0.00 O ATOM 0 H TYR A 225 17.188 9.938 -2.091 1.00 0.00 H new ATOM 0 HA TYR A 225 19.784 9.377 -2.986 1.00 0.00 H new ATOM 0 HB2 TYR A 225 17.194 9.175 -3.910 1.00 0.00 H new ATOM 0 HB3 TYR A 225 17.743 10.565 -4.826 1.00 0.00 H new ATOM 0 HD1 TYR A 225 19.649 10.330 -6.456 1.00 0.00 H new ATOM 0 HD2 TYR A 225 17.926 6.955 -4.416 1.00 0.00 H new ATOM 0 HE1 TYR A 225 20.591 8.811 -8.180 1.00 0.00 H new ATOM 0 HE2 TYR A 225 18.857 5.427 -6.142 1.00 0.00 H new ATOM 0 HH TYR A 225 19.845 5.310 -8.205 1.00 0.00 H new ATOM 1636 N TYR A 226 19.326 12.493 -2.666 1.00 0.00 N ATOM 1637 CA TYR A 226 19.993 13.794 -2.701 1.00 0.00 C ATOM 1638 C TYR A 226 20.636 14.177 -1.353 1.00 0.00 C ATOM 1639 O TYR A 226 21.663 14.852 -1.324 1.00 0.00 O ATOM 1640 CB TYR A 226 18.990 14.841 -3.188 1.00 0.00 C ATOM 1641 CG TYR A 226 19.631 16.143 -3.616 1.00 0.00 C ATOM 1642 CD1 TYR A 226 19.838 17.173 -2.679 1.00 0.00 C ATOM 1643 CD2 TYR A 226 20.036 16.309 -4.953 1.00 0.00 C ATOM 1644 CE1 TYR A 226 20.444 18.380 -3.085 1.00 0.00 C ATOM 1645 CE2 TYR A 226 20.628 17.515 -5.366 1.00 0.00 C ATOM 1646 CZ TYR A 226 20.826 18.559 -4.436 1.00 0.00 C ATOM 1647 OH TYR A 226 21.425 19.713 -4.842 1.00 0.00 O ATOM 0 H TYR A 226 18.573 12.456 -1.979 1.00 0.00 H new ATOM 0 HA TYR A 226 20.829 13.742 -3.399 1.00 0.00 H new ATOM 0 HB2 TYR A 226 18.427 14.430 -4.026 1.00 0.00 H new ATOM 0 HB3 TYR A 226 18.274 15.043 -2.392 1.00 0.00 H new ATOM 0 HD1 TYR A 226 19.533 17.039 -1.652 1.00 0.00 H new ATOM 0 HD2 TYR A 226 19.892 15.508 -5.663 1.00 0.00 H new ATOM 0 HE1 TYR A 226 20.616 19.167 -2.366 1.00 0.00 H new ATOM 0 HE2 TYR A 226 20.931 17.643 -6.395 1.00 0.00 H new ATOM 0 HH TYR A 226 21.619 19.661 -5.801 1.00 0.00 H new ATOM 1657 N ASP A 227 20.074 13.703 -0.238 1.00 0.00 N ATOM 1658 CA ASP A 227 20.620 13.754 1.116 1.00 0.00 C ATOM 1659 C ASP A 227 21.949 12.977 1.242 1.00 0.00 C ATOM 1660 O ASP A 227 22.849 13.394 1.974 1.00 0.00 O ATOM 1661 CB ASP A 227 19.542 13.190 2.048 1.00 0.00 C ATOM 1662 CG ASP A 227 19.785 13.419 3.530 1.00 0.00 C ATOM 1663 OD1 ASP A 227 19.361 14.484 4.040 1.00 0.00 O ATOM 1664 OD2 ASP A 227 20.260 12.474 4.215 1.00 0.00 O ATOM 0 H ASP A 227 19.164 13.243 -0.262 1.00 0.00 H new ATOM 0 HA ASP A 227 20.866 14.781 1.385 1.00 0.00 H new ATOM 0 HB2 ASP A 227 18.584 13.635 1.780 1.00 0.00 H new ATOM 0 HB3 ASP A 227 19.456 12.118 1.871 1.00 0.00 H new ATOM 1669 N GLY A 228 22.099 11.863 0.517 1.00 0.00 N ATOM 1670 CA GLY A 228 23.364 11.146 0.333 1.00 0.00 C ATOM 1671 C GLY A 228 23.229 9.637 0.154 1.00 0.00 C ATOM 1672 O GLY A 228 24.096 9.018 -0.468 1.00 0.00 O ATOM 0 H GLY A 228 21.320 11.423 0.028 1.00 0.00 H new ATOM 0 HA2 GLY A 228 23.873 11.556 -0.539 1.00 0.00 H new ATOM 0 HA3 GLY A 228 24.002 11.339 1.195 1.00 0.00 H new TER 1676 GLY A 228