USER MOD reduce.3.24.130724 H: found=0, std=0, add=379, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 381 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 168 THR OG1 : rot 82:sc= 0.00368 USER MOD Set 1.2: A 171 MET CE :methyl -146:sc= -11.2! (180deg=-14.7!) USER MOD Set 2.1: A 166 MET CE :methyl -111:sc= -6.69! (180deg=-11.8!) USER MOD Set 2.2: A 189 ASN : amide:sc= -1.11 K(o=-7.8,f=-8.3!) USER MOD Single : A 156 THR OG1 : rot 16:sc= 0.815 USER MOD Single : A 159 THR OG1 : rot 180:sc= -0.0381 USER MOD Single : A 161 SER OG : rot 180:sc= 0.109 USER MOD Single : A 163 TYR OH : rot 165:sc= -0.523 USER MOD Single : A 165 THR OG1 : rot 87:sc= 0.441 USER MOD Single : A 172 SER OG : rot 180:sc= 0 USER MOD Single : A 173 MET CE :methyl 138:sc= -8.75! (180deg=-11.5!) USER MOD Single : A 175 TYR OH : rot 180:sc= -0.942 USER MOD Single : A 187 SER OG : rot 80:sc= -1.42! USER MOD Single : A 188 TYR OH : rot 180:sc= 0 USER MOD Single : A 190 ASN : amide:sc= -4.2! C(o=-4.2!,f=-13!) USER MOD Single : A 192 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 197 TYR OH : rot -6:sc= -1.86! USER MOD Single : A 200 THR OG1 : rot 180:sc= -0.0953 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 156 -7.502 9.176 6.221 1.00 0.00 N ATOM 2 CA THR A 156 -7.736 10.444 6.960 1.00 0.00 C ATOM 3 C THR A 156 -8.869 11.249 6.332 1.00 0.00 C ATOM 4 O THR A 156 -9.403 12.172 6.947 1.00 0.00 O ATOM 5 CB THR A 156 -6.441 11.258 6.952 1.00 0.00 C ATOM 6 OG1 THR A 156 -5.339 10.443 6.599 1.00 0.00 O ATOM 7 CG2 THR A 156 -6.130 11.901 8.285 1.00 0.00 C ATOM 0 HA THR A 156 -8.029 10.212 7.984 1.00 0.00 H new ATOM 0 HB THR A 156 -6.600 12.046 6.216 1.00 0.00 H new ATOM 0 HG1 THR A 156 -5.664 9.609 6.200 1.00 0.00 H new ATOM 0 HG21 THR A 156 -5.199 12.463 8.210 1.00 0.00 H new ATOM 0 HG22 THR A 156 -6.940 12.576 8.561 1.00 0.00 H new ATOM 0 HG23 THR A 156 -6.027 11.128 9.047 1.00 0.00 H new ATOM 17 N LEU A 157 -9.230 10.892 5.105 1.00 0.00 N ATOM 18 CA LEU A 157 -10.301 11.580 4.393 1.00 0.00 C ATOM 19 C LEU A 157 -11.475 10.643 4.137 1.00 0.00 C ATOM 20 O LEU A 157 -11.310 9.571 3.554 1.00 0.00 O ATOM 21 CB LEU A 157 -9.781 12.140 3.067 1.00 0.00 C ATOM 22 CG LEU A 157 -9.576 13.654 3.039 1.00 0.00 C ATOM 23 CD1 LEU A 157 -10.916 14.375 3.054 1.00 0.00 C ATOM 24 CD2 LEU A 157 -8.719 14.097 4.215 1.00 0.00 C ATOM 0 H LEU A 157 -8.797 10.130 4.582 1.00 0.00 H new ATOM 0 HA LEU A 157 -10.648 12.404 5.017 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -8.833 11.656 2.833 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -10.481 11.869 2.277 1.00 0.00 H new ATOM 0 HG LEU A 157 -9.057 13.914 2.117 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -10.750 15.452 3.034 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -11.497 14.081 2.180 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -11.462 14.109 3.959 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -8.583 15.178 4.179 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -9.212 13.824 5.148 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -7.747 13.607 4.162 1.00 0.00 H new ATOM 36 N VAL A 158 -12.661 11.053 4.577 1.00 0.00 N ATOM 37 CA VAL A 158 -13.863 10.249 4.397 1.00 0.00 C ATOM 38 C VAL A 158 -13.571 8.769 4.616 1.00 0.00 C ATOM 39 O VAL A 158 -14.022 7.920 3.848 1.00 0.00 O ATOM 40 CB VAL A 158 -14.463 10.439 2.992 1.00 0.00 C ATOM 41 CG1 VAL A 158 -13.558 9.824 1.935 1.00 0.00 C ATOM 42 CG2 VAL A 158 -15.859 9.839 2.923 1.00 0.00 C ATOM 0 H VAL A 158 -12.814 11.938 5.061 1.00 0.00 H new ATOM 0 HA VAL A 158 -14.584 10.589 5.140 1.00 0.00 H new ATOM 0 HB VAL A 158 -14.540 11.508 2.792 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -14.000 9.969 0.949 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -12.580 10.305 1.969 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -13.445 8.757 2.129 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -16.268 9.983 1.923 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -15.808 8.773 3.145 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -16.503 10.331 3.652 1.00 0.00 H new ATOM 52 N THR A 159 -12.812 8.470 5.667 1.00 0.00 N ATOM 53 CA THR A 159 -12.454 7.093 5.992 1.00 0.00 C ATOM 54 C THR A 159 -11.285 6.617 5.136 1.00 0.00 C ATOM 55 O THR A 159 -10.173 6.434 5.632 1.00 0.00 O ATOM 56 CB THR A 159 -13.655 6.168 5.796 1.00 0.00 C ATOM 57 OG1 THR A 159 -14.818 6.722 6.387 1.00 0.00 O ATOM 58 CG2 THR A 159 -13.451 4.789 6.384 1.00 0.00 C ATOM 0 H THR A 159 -12.432 9.165 6.309 1.00 0.00 H new ATOM 0 HA THR A 159 -12.151 7.063 7.038 1.00 0.00 H new ATOM 0 HB THR A 159 -13.771 6.070 4.717 1.00 0.00 H new ATOM 0 HG1 THR A 159 -15.576 6.116 6.249 1.00 0.00 H new ATOM 0 HG21 THR A 159 -14.341 4.184 6.210 1.00 0.00 H new ATOM 0 HG22 THR A 159 -12.591 4.315 5.910 1.00 0.00 H new ATOM 0 HG23 THR A 159 -13.274 4.873 7.456 1.00 0.00 H new ATOM 66 N GLY A 160 -11.543 6.418 3.849 1.00 0.00 N ATOM 67 CA GLY A 160 -10.503 5.963 2.945 1.00 0.00 C ATOM 68 C GLY A 160 -10.748 4.554 2.444 1.00 0.00 C ATOM 69 O GLY A 160 -9.862 3.702 2.510 1.00 0.00 O ATOM 0 H GLY A 160 -12.454 6.564 3.415 1.00 0.00 H new ATOM 0 HA2 GLY A 160 -10.442 6.642 2.095 1.00 0.00 H new ATOM 0 HA3 GLY A 160 -9.540 6.002 3.454 1.00 0.00 H new ATOM 73 N SER A 161 -11.955 4.307 1.947 1.00 0.00 N ATOM 74 CA SER A 161 -12.314 2.990 1.436 1.00 0.00 C ATOM 75 C SER A 161 -11.362 2.554 0.329 1.00 0.00 C ATOM 76 O SER A 161 -10.900 1.413 0.307 1.00 0.00 O ATOM 77 CB SER A 161 -13.753 2.997 0.915 1.00 0.00 C ATOM 78 OG SER A 161 -14.219 4.321 0.720 1.00 0.00 O ATOM 0 H SER A 161 -12.700 5.001 1.887 1.00 0.00 H new ATOM 0 HA SER A 161 -12.235 2.277 2.257 1.00 0.00 H new ATOM 0 HB2 SER A 161 -13.805 2.448 -0.025 1.00 0.00 H new ATOM 0 HB3 SER A 161 -14.402 2.480 1.622 1.00 0.00 H new ATOM 0 HG SER A 161 -15.140 4.298 0.385 1.00 0.00 H new ATOM 84 N GLU A 162 -11.073 3.468 -0.591 1.00 0.00 N ATOM 85 CA GLU A 162 -10.175 3.174 -1.701 1.00 0.00 C ATOM 86 C GLU A 162 -8.794 2.777 -1.191 1.00 0.00 C ATOM 87 O GLU A 162 -8.188 1.825 -1.686 1.00 0.00 O ATOM 88 CB GLU A 162 -10.059 4.388 -2.626 1.00 0.00 C ATOM 89 CG GLU A 162 -9.686 4.028 -4.054 1.00 0.00 C ATOM 90 CD GLU A 162 -10.880 4.044 -4.989 1.00 0.00 C ATOM 91 OE1 GLU A 162 -11.947 4.551 -4.582 1.00 0.00 O ATOM 92 OE2 GLU A 162 -10.748 3.546 -6.126 1.00 0.00 O ATOM 0 H GLU A 162 -11.447 4.417 -0.590 1.00 0.00 H new ATOM 0 HA GLU A 162 -10.592 2.337 -2.261 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -11.009 4.923 -2.631 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -9.310 5.071 -2.224 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -8.935 4.729 -4.417 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -9.231 3.038 -4.068 1.00 0.00 H new ATOM 99 N TYR A 163 -8.304 3.507 -0.196 1.00 0.00 N ATOM 100 CA TYR A 163 -6.997 3.228 0.386 1.00 0.00 C ATOM 101 C TYR A 163 -6.942 1.813 0.933 1.00 0.00 C ATOM 102 O TYR A 163 -6.170 0.979 0.462 1.00 0.00 O ATOM 103 CB TYR A 163 -6.696 4.213 1.516 1.00 0.00 C ATOM 104 CG TYR A 163 -5.232 4.540 1.677 1.00 0.00 C ATOM 105 CD1 TYR A 163 -4.402 4.686 0.576 1.00 0.00 C ATOM 106 CD2 TYR A 163 -4.682 4.703 2.940 1.00 0.00 C ATOM 107 CE1 TYR A 163 -3.064 4.985 0.730 1.00 0.00 C ATOM 108 CE2 TYR A 163 -3.345 5.003 3.103 1.00 0.00 C ATOM 109 CZ TYR A 163 -2.538 5.143 1.995 1.00 0.00 C ATOM 110 OH TYR A 163 -1.204 5.443 2.151 1.00 0.00 O ATOM 0 H TYR A 163 -8.793 4.297 0.225 1.00 0.00 H new ATOM 0 HA TYR A 163 -6.251 3.336 -0.401 1.00 0.00 H new ATOM 0 HB2 TYR A 163 -7.245 5.137 1.334 1.00 0.00 H new ATOM 0 HB3 TYR A 163 -7.070 3.799 2.453 1.00 0.00 H new ATOM 0 HD1 TYR A 163 -4.809 4.564 -0.417 1.00 0.00 H new ATOM 0 HD2 TYR A 163 -5.311 4.593 3.811 1.00 0.00 H new ATOM 0 HE1 TYR A 163 -2.430 5.095 -0.138 1.00 0.00 H new ATOM 0 HE2 TYR A 163 -2.933 5.127 4.094 1.00 0.00 H new ATOM 0 HH TYR A 163 -1.044 5.755 3.066 1.00 0.00 H new ATOM 120 N GLU A 164 -7.757 1.559 1.950 1.00 0.00 N ATOM 121 CA GLU A 164 -7.799 0.258 2.595 1.00 0.00 C ATOM 122 C GLU A 164 -8.102 -0.865 1.605 1.00 0.00 C ATOM 123 O GLU A 164 -7.721 -2.010 1.836 1.00 0.00 O ATOM 124 CB GLU A 164 -8.837 0.261 3.717 1.00 0.00 C ATOM 125 CG GLU A 164 -8.323 0.861 5.015 1.00 0.00 C ATOM 126 CD GLU A 164 -9.286 0.665 6.168 1.00 0.00 C ATOM 127 OE1 GLU A 164 -10.465 1.051 6.032 1.00 0.00 O ATOM 128 OE2 GLU A 164 -8.860 0.123 7.210 1.00 0.00 O ATOM 0 H GLU A 164 -8.401 2.244 2.346 1.00 0.00 H new ATOM 0 HA GLU A 164 -6.810 0.069 3.012 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -9.713 0.820 3.389 1.00 0.00 H new ATOM 0 HB3 GLU A 164 -9.163 -0.762 3.903 1.00 0.00 H new ATOM 0 HG2 GLU A 164 -7.364 0.408 5.266 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -8.144 1.927 4.873 1.00 0.00 H new ATOM 135 N THR A 165 -8.785 -0.547 0.506 1.00 0.00 N ATOM 136 CA THR A 165 -9.110 -1.563 -0.493 1.00 0.00 C ATOM 137 C THR A 165 -7.916 -1.827 -1.396 1.00 0.00 C ATOM 138 O THR A 165 -7.756 -2.925 -1.928 1.00 0.00 O ATOM 139 CB THR A 165 -10.305 -1.154 -1.348 1.00 0.00 C ATOM 140 OG1 THR A 165 -11.512 -1.256 -0.614 1.00 0.00 O ATOM 141 CG2 THR A 165 -10.441 -2.010 -2.590 1.00 0.00 C ATOM 0 H THR A 165 -9.120 0.391 0.287 1.00 0.00 H new ATOM 0 HA THR A 165 -9.368 -2.472 0.049 1.00 0.00 H new ATOM 0 HB THR A 165 -10.124 -0.121 -1.643 1.00 0.00 H new ATOM 0 HG1 THR A 165 -11.666 -0.423 -0.121 1.00 0.00 H new ATOM 0 HG21 THR A 165 -11.306 -1.681 -3.166 1.00 0.00 H new ATOM 0 HG22 THR A 165 -9.542 -1.914 -3.198 1.00 0.00 H new ATOM 0 HG23 THR A 165 -10.574 -3.052 -2.301 1.00 0.00 H new ATOM 149 N MET A 166 -7.064 -0.823 -1.538 1.00 0.00 N ATOM 150 CA MET A 166 -5.876 -0.940 -2.330 1.00 0.00 C ATOM 151 C MET A 166 -4.937 -1.845 -1.588 1.00 0.00 C ATOM 152 O MET A 166 -4.219 -2.668 -2.157 1.00 0.00 O ATOM 153 CB MET A 166 -5.271 0.441 -2.495 1.00 0.00 C ATOM 154 CG MET A 166 -3.814 0.407 -2.819 1.00 0.00 C ATOM 155 SD MET A 166 -3.271 1.874 -3.718 1.00 0.00 S ATOM 156 CE MET A 166 -3.904 3.186 -2.669 1.00 0.00 C ATOM 0 H MET A 166 -7.188 0.091 -1.102 1.00 0.00 H new ATOM 0 HA MET A 166 -6.082 -1.350 -3.319 1.00 0.00 H new ATOM 0 HB2 MET A 166 -5.801 0.971 -3.286 1.00 0.00 H new ATOM 0 HB3 MET A 166 -5.420 1.008 -1.576 1.00 0.00 H new ATOM 0 HG2 MET A 166 -3.242 0.318 -1.895 1.00 0.00 H new ATOM 0 HG3 MET A 166 -3.598 -0.480 -3.414 1.00 0.00 H new ATOM 0 HE1 MET A 166 -4.714 3.703 -3.182 1.00 0.00 H new ATOM 0 HE2 MET A 166 -4.278 2.759 -1.738 1.00 0.00 H new ATOM 0 HE3 MET A 166 -3.104 3.893 -2.448 1.00 0.00 H new ATOM 166 N LEU A 167 -5.004 -1.689 -0.284 1.00 0.00 N ATOM 167 CA LEU A 167 -4.229 -2.484 0.626 1.00 0.00 C ATOM 168 C LEU A 167 -4.691 -3.921 0.551 1.00 0.00 C ATOM 169 O LEU A 167 -3.892 -4.832 0.441 1.00 0.00 O ATOM 170 CB LEU A 167 -4.426 -1.964 2.043 1.00 0.00 C ATOM 171 CG LEU A 167 -4.078 -0.492 2.247 1.00 0.00 C ATOM 172 CD1 LEU A 167 -3.791 -0.229 3.726 1.00 0.00 C ATOM 173 CD2 LEU A 167 -2.820 -0.139 1.457 1.00 0.00 C ATOM 0 H LEU A 167 -5.603 -1.001 0.172 1.00 0.00 H new ATOM 0 HA LEU A 167 -3.174 -2.424 0.358 1.00 0.00 H new ATOM 0 HB2 LEU A 167 -5.467 -2.118 2.329 1.00 0.00 H new ATOM 0 HB3 LEU A 167 -3.817 -2.562 2.721 1.00 0.00 H new ATOM 0 HG LEU A 167 -4.920 0.111 1.907 1.00 0.00 H new ATOM 0 HD11 LEU A 167 -3.543 0.823 3.867 1.00 0.00 H new ATOM 0 HD12 LEU A 167 -4.673 -0.476 4.317 1.00 0.00 H new ATOM 0 HD13 LEU A 167 -2.953 -0.846 4.049 1.00 0.00 H new ATOM 0 HD21 LEU A 167 -2.579 0.913 1.608 1.00 0.00 H new ATOM 0 HD22 LEU A 167 -1.989 -0.755 1.801 1.00 0.00 H new ATOM 0 HD23 LEU A 167 -2.993 -0.323 0.397 1.00 0.00 H new ATOM 185 N THR A 168 -6.005 -4.092 0.620 1.00 0.00 N ATOM 186 CA THR A 168 -6.630 -5.406 0.580 1.00 0.00 C ATOM 187 C THR A 168 -6.334 -6.144 -0.720 1.00 0.00 C ATOM 188 O THR A 168 -6.192 -7.360 -0.714 1.00 0.00 O ATOM 189 CB THR A 168 -8.139 -5.267 0.783 1.00 0.00 C ATOM 190 OG1 THR A 168 -8.450 -5.148 2.160 1.00 0.00 O ATOM 191 CG2 THR A 168 -8.925 -6.433 0.237 1.00 0.00 C ATOM 0 H THR A 168 -6.668 -3.321 0.705 1.00 0.00 H new ATOM 0 HA THR A 168 -6.206 -6.001 1.389 1.00 0.00 H new ATOM 0 HB THR A 168 -8.423 -4.369 0.234 1.00 0.00 H new ATOM 0 HG1 THR A 168 -8.325 -4.219 2.444 1.00 0.00 H new ATOM 0 HG21 THR A 168 -9.988 -6.270 0.414 1.00 0.00 H new ATOM 0 HG22 THR A 168 -8.745 -6.523 -0.834 1.00 0.00 H new ATOM 0 HG23 THR A 168 -8.610 -7.350 0.736 1.00 0.00 H new ATOM 199 N GLU A 169 -6.223 -5.426 -1.825 1.00 0.00 N ATOM 200 CA GLU A 169 -5.909 -6.079 -3.087 1.00 0.00 C ATOM 201 C GLU A 169 -4.461 -6.554 -3.042 1.00 0.00 C ATOM 202 O GLU A 169 -4.167 -7.762 -2.953 1.00 0.00 O ATOM 203 CB GLU A 169 -6.152 -5.147 -4.292 1.00 0.00 C ATOM 204 CG GLU A 169 -5.700 -3.699 -4.131 1.00 0.00 C ATOM 205 CD GLU A 169 -6.394 -2.776 -5.111 1.00 0.00 C ATOM 206 OE1 GLU A 169 -7.558 -3.058 -5.467 1.00 0.00 O ATOM 207 OE2 GLU A 169 -5.775 -1.774 -5.524 1.00 0.00 O ATOM 0 H GLU A 169 -6.342 -4.414 -1.877 1.00 0.00 H new ATOM 0 HA GLU A 169 -6.573 -6.933 -3.220 1.00 0.00 H new ATOM 0 HB2 GLU A 169 -5.643 -5.569 -5.159 1.00 0.00 H new ATOM 0 HB3 GLU A 169 -7.219 -5.149 -4.516 1.00 0.00 H new ATOM 0 HG2 GLU A 169 -5.904 -3.367 -3.113 1.00 0.00 H new ATOM 0 HG3 GLU A 169 -4.621 -3.637 -4.276 1.00 0.00 H new ATOM 214 N ILE A 170 -3.560 -5.594 -3.042 1.00 0.00 N ATOM 215 CA ILE A 170 -2.146 -5.892 -2.945 1.00 0.00 C ATOM 216 C ILE A 170 -1.925 -6.845 -1.787 1.00 0.00 C ATOM 217 O ILE A 170 -0.994 -7.648 -1.776 1.00 0.00 O ATOM 218 CB ILE A 170 -1.334 -4.610 -2.747 1.00 0.00 C ATOM 219 CG1 ILE A 170 -1.509 -3.741 -3.978 1.00 0.00 C ATOM 220 CG2 ILE A 170 0.125 -4.938 -2.522 1.00 0.00 C ATOM 221 CD1 ILE A 170 -1.377 -2.266 -3.712 1.00 0.00 C ATOM 0 H ILE A 170 -3.781 -4.600 -3.108 1.00 0.00 H new ATOM 0 HA ILE A 170 -1.810 -6.357 -3.872 1.00 0.00 H new ATOM 0 HB ILE A 170 -1.688 -4.074 -1.866 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -0.769 -4.033 -4.724 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -2.491 -3.935 -4.410 1.00 0.00 H new ATOM 0 HG21 ILE A 170 0.688 -4.015 -2.383 1.00 0.00 H new ATOM 0 HG22 ILE A 170 0.225 -5.561 -1.633 1.00 0.00 H new ATOM 0 HG23 ILE A 170 0.515 -5.474 -3.387 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -1.515 -1.715 -4.642 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -2.134 -1.957 -2.991 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -0.386 -2.056 -3.310 1.00 0.00 H new ATOM 233 N MET A 171 -2.829 -6.754 -0.829 1.00 0.00 N ATOM 234 CA MET A 171 -2.800 -7.613 0.345 1.00 0.00 C ATOM 235 C MET A 171 -2.897 -9.066 -0.073 1.00 0.00 C ATOM 236 O MET A 171 -1.944 -9.830 0.038 1.00 0.00 O ATOM 237 CB MET A 171 -3.976 -7.284 1.258 1.00 0.00 C ATOM 238 CG MET A 171 -3.587 -6.467 2.456 1.00 0.00 C ATOM 239 SD MET A 171 -4.806 -6.518 3.777 1.00 0.00 S ATOM 240 CE MET A 171 -5.084 -4.762 3.999 1.00 0.00 C ATOM 0 H MET A 171 -3.601 -6.087 -0.840 1.00 0.00 H new ATOM 0 HA MET A 171 -1.863 -7.445 0.875 1.00 0.00 H new ATOM 0 HB2 MET A 171 -4.730 -6.742 0.687 1.00 0.00 H new ATOM 0 HB3 MET A 171 -4.437 -8.213 1.594 1.00 0.00 H new ATOM 0 HG2 MET A 171 -2.632 -6.827 2.838 1.00 0.00 H new ATOM 0 HG3 MET A 171 -3.438 -5.432 2.148 1.00 0.00 H new ATOM 0 HE1 MET A 171 -5.282 -4.555 5.051 1.00 0.00 H new ATOM 0 HE2 MET A 171 -4.199 -4.210 3.681 1.00 0.00 H new ATOM 0 HE3 MET A 171 -5.940 -4.451 3.401 1.00 0.00 H new ATOM 250 N SER A 172 -4.071 -9.432 -0.564 1.00 0.00 N ATOM 251 CA SER A 172 -4.324 -10.790 -1.029 1.00 0.00 C ATOM 252 C SER A 172 -3.056 -11.378 -1.626 1.00 0.00 C ATOM 253 O SER A 172 -2.803 -12.579 -1.523 1.00 0.00 O ATOM 254 CB SER A 172 -5.449 -10.801 -2.065 1.00 0.00 C ATOM 255 OG SER A 172 -6.349 -11.869 -1.831 1.00 0.00 O ATOM 0 H SER A 172 -4.870 -8.804 -0.652 1.00 0.00 H new ATOM 0 HA SER A 172 -4.632 -11.399 -0.179 1.00 0.00 H new ATOM 0 HB2 SER A 172 -5.988 -9.854 -2.031 1.00 0.00 H new ATOM 0 HB3 SER A 172 -5.025 -10.891 -3.065 1.00 0.00 H new ATOM 0 HG SER A 172 -7.059 -11.852 -2.506 1.00 0.00 H new ATOM 261 N MET A 173 -2.246 -10.515 -2.240 1.00 0.00 N ATOM 262 CA MET A 173 -0.993 -10.942 -2.837 1.00 0.00 C ATOM 263 C MET A 173 0.130 -11.006 -1.796 1.00 0.00 C ATOM 264 O MET A 173 1.280 -10.677 -2.092 1.00 0.00 O ATOM 265 CB MET A 173 -0.602 -10.002 -3.971 1.00 0.00 C ATOM 266 CG MET A 173 -1.694 -9.023 -4.365 1.00 0.00 C ATOM 267 SD MET A 173 -1.464 -8.356 -6.022 1.00 0.00 S ATOM 268 CE MET A 173 -0.036 -7.307 -5.763 1.00 0.00 C ATOM 0 H MET A 173 -2.440 -9.518 -2.334 1.00 0.00 H new ATOM 0 HA MET A 173 -1.139 -11.945 -3.237 1.00 0.00 H new ATOM 0 HB2 MET A 173 0.285 -9.442 -3.675 1.00 0.00 H new ATOM 0 HB3 MET A 173 -0.328 -10.595 -4.843 1.00 0.00 H new ATOM 0 HG2 MET A 173 -2.661 -9.522 -4.310 1.00 0.00 H new ATOM 0 HG3 MET A 173 -1.717 -8.203 -3.648 1.00 0.00 H new ATOM 0 HE1 MET A 173 0.653 -7.417 -6.601 1.00 0.00 H new ATOM 0 HE2 MET A 173 -0.356 -6.268 -5.691 1.00 0.00 H new ATOM 0 HE3 MET A 173 0.466 -7.597 -4.840 1.00 0.00 H new ATOM 278 N GLY A 174 -0.208 -11.446 -0.585 1.00 0.00 N ATOM 279 CA GLY A 174 0.779 -11.568 0.475 1.00 0.00 C ATOM 280 C GLY A 174 1.452 -10.256 0.846 1.00 0.00 C ATOM 281 O GLY A 174 2.676 -10.197 0.951 1.00 0.00 O ATOM 0 H GLY A 174 -1.153 -11.721 -0.319 1.00 0.00 H new ATOM 0 HA2 GLY A 174 0.297 -11.981 1.361 1.00 0.00 H new ATOM 0 HA3 GLY A 174 1.543 -12.282 0.166 1.00 0.00 H new ATOM 285 N TYR A 175 0.662 -9.206 1.057 1.00 0.00 N ATOM 286 CA TYR A 175 1.213 -7.906 1.429 1.00 0.00 C ATOM 287 C TYR A 175 0.307 -7.162 2.410 1.00 0.00 C ATOM 288 O TYR A 175 -0.538 -6.365 2.007 1.00 0.00 O ATOM 289 CB TYR A 175 1.444 -7.049 0.189 1.00 0.00 C ATOM 290 CG TYR A 175 2.299 -7.724 -0.866 1.00 0.00 C ATOM 291 CD1 TYR A 175 3.524 -8.284 -0.533 1.00 0.00 C ATOM 292 CD2 TYR A 175 1.881 -7.804 -2.190 1.00 0.00 C ATOM 293 CE1 TYR A 175 4.311 -8.903 -1.484 1.00 0.00 C ATOM 294 CE2 TYR A 175 2.664 -8.423 -3.147 1.00 0.00 C ATOM 295 CZ TYR A 175 3.877 -8.970 -2.789 1.00 0.00 C ATOM 296 OH TYR A 175 4.657 -9.586 -3.739 1.00 0.00 O ATOM 0 H TYR A 175 -0.355 -9.229 0.977 1.00 0.00 H new ATOM 0 HA TYR A 175 2.166 -8.090 1.925 1.00 0.00 H new ATOM 0 HB2 TYR A 175 0.480 -6.790 -0.248 1.00 0.00 H new ATOM 0 HB3 TYR A 175 1.920 -6.115 0.487 1.00 0.00 H new ATOM 0 HD1 TYR A 175 3.869 -8.235 0.489 1.00 0.00 H new ATOM 0 HD2 TYR A 175 0.931 -7.376 -2.475 1.00 0.00 H new ATOM 0 HE1 TYR A 175 5.262 -9.332 -1.206 1.00 0.00 H new ATOM 0 HE2 TYR A 175 2.326 -8.478 -4.171 1.00 0.00 H new ATOM 0 HH TYR A 175 4.205 -9.548 -4.608 1.00 0.00 H new ATOM 306 N GLU A 176 0.499 -7.419 3.699 1.00 0.00 N ATOM 307 CA GLU A 176 -0.294 -6.768 4.740 1.00 0.00 C ATOM 308 C GLU A 176 -0.638 -5.330 4.361 1.00 0.00 C ATOM 309 O GLU A 176 0.040 -4.710 3.547 1.00 0.00 O ATOM 310 CB GLU A 176 0.459 -6.788 6.070 1.00 0.00 C ATOM 311 CG GLU A 176 -0.406 -7.192 7.253 1.00 0.00 C ATOM 312 CD GLU A 176 -1.374 -6.101 7.665 1.00 0.00 C ATOM 313 OE1 GLU A 176 -0.910 -5.030 8.107 1.00 0.00 O ATOM 314 OE2 GLU A 176 -2.599 -6.318 7.543 1.00 0.00 O ATOM 0 H GLU A 176 1.197 -8.074 4.050 1.00 0.00 H new ATOM 0 HA GLU A 176 -1.226 -7.324 4.844 1.00 0.00 H new ATOM 0 HB2 GLU A 176 1.299 -7.478 5.992 1.00 0.00 H new ATOM 0 HB3 GLU A 176 0.876 -5.798 6.257 1.00 0.00 H new ATOM 0 HG2 GLU A 176 -0.965 -8.092 6.999 1.00 0.00 H new ATOM 0 HG3 GLU A 176 0.235 -7.443 8.098 1.00 0.00 H new ATOM 321 N ARG A 177 -1.707 -4.815 4.962 1.00 0.00 N ATOM 322 CA ARG A 177 -2.169 -3.455 4.696 1.00 0.00 C ATOM 323 C ARG A 177 -1.083 -2.424 4.963 1.00 0.00 C ATOM 324 O ARG A 177 -1.052 -1.375 4.337 1.00 0.00 O ATOM 325 CB ARG A 177 -3.403 -3.146 5.563 1.00 0.00 C ATOM 326 CG ARG A 177 -3.213 -2.025 6.583 1.00 0.00 C ATOM 327 CD ARG A 177 -4.184 -2.162 7.744 1.00 0.00 C ATOM 328 NE ARG A 177 -5.405 -2.863 7.358 1.00 0.00 N ATOM 329 CZ ARG A 177 -6.277 -3.359 8.229 1.00 0.00 C ATOM 330 NH1 ARG A 177 -6.062 -3.231 9.531 1.00 0.00 N ATOM 331 NH2 ARG A 177 -7.366 -3.982 7.798 1.00 0.00 N ATOM 0 H ARG A 177 -2.273 -5.323 5.641 1.00 0.00 H new ATOM 0 HA ARG A 177 -2.431 -3.395 3.640 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -4.232 -2.882 4.907 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -3.692 -4.054 6.093 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -2.190 -2.042 6.958 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -3.358 -1.060 6.097 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -3.700 -2.700 8.559 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -4.439 -1.172 8.122 1.00 0.00 H new ATOM 0 HE ARG A 177 -5.600 -2.978 6.363 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -5.226 -2.751 9.865 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -6.732 -3.612 10.199 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -7.535 -4.081 6.797 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -8.035 -4.362 8.468 1.00 0.00 H new ATOM 345 N GLU A 178 -0.238 -2.698 5.938 1.00 0.00 N ATOM 346 CA GLU A 178 0.799 -1.745 6.317 1.00 0.00 C ATOM 347 C GLU A 178 1.965 -1.692 5.335 1.00 0.00 C ATOM 348 O GLU A 178 2.542 -0.628 5.118 1.00 0.00 O ATOM 349 CB GLU A 178 1.315 -2.050 7.722 1.00 0.00 C ATOM 350 CG GLU A 178 1.921 -0.844 8.421 1.00 0.00 C ATOM 351 CD GLU A 178 2.495 -1.186 9.782 1.00 0.00 C ATOM 352 OE1 GLU A 178 2.014 -2.159 10.401 1.00 0.00 O ATOM 353 OE2 GLU A 178 3.423 -0.481 10.229 1.00 0.00 O ATOM 0 H GLU A 178 -0.244 -3.562 6.480 1.00 0.00 H new ATOM 0 HA GLU A 178 0.329 -0.762 6.298 1.00 0.00 H new ATOM 0 HB2 GLU A 178 0.494 -2.435 8.326 1.00 0.00 H new ATOM 0 HB3 GLU A 178 2.064 -2.839 7.662 1.00 0.00 H new ATOM 0 HG2 GLU A 178 2.707 -0.423 7.795 1.00 0.00 H new ATOM 0 HG3 GLU A 178 1.158 -0.074 8.536 1.00 0.00 H new ATOM 360 N ARG A 179 2.325 -2.823 4.753 1.00 0.00 N ATOM 361 CA ARG A 179 3.429 -2.865 3.820 1.00 0.00 C ATOM 362 C ARG A 179 3.098 -2.133 2.536 1.00 0.00 C ATOM 363 O ARG A 179 3.942 -1.463 1.944 1.00 0.00 O ATOM 364 CB ARG A 179 3.766 -4.312 3.503 1.00 0.00 C ATOM 365 CG ARG A 179 4.292 -5.096 4.694 1.00 0.00 C ATOM 366 CD ARG A 179 3.455 -6.336 4.959 1.00 0.00 C ATOM 367 NE ARG A 179 3.798 -6.965 6.229 1.00 0.00 N ATOM 368 CZ ARG A 179 3.558 -6.413 7.414 1.00 0.00 C ATOM 369 NH1 ARG A 179 2.976 -5.224 7.487 1.00 0.00 N ATOM 370 NH2 ARG A 179 3.899 -7.049 8.526 1.00 0.00 N ATOM 0 H ARG A 179 1.868 -3.721 4.912 1.00 0.00 H new ATOM 0 HA ARG A 179 4.283 -2.370 4.282 1.00 0.00 H new ATOM 0 HB2 ARG A 179 2.874 -4.807 3.120 1.00 0.00 H new ATOM 0 HB3 ARG A 179 4.510 -4.336 2.707 1.00 0.00 H new ATOM 0 HG2 ARG A 179 5.327 -5.387 4.511 1.00 0.00 H new ATOM 0 HG3 ARG A 179 4.291 -4.459 5.579 1.00 0.00 H new ATOM 0 HD2 ARG A 179 2.399 -6.067 4.961 1.00 0.00 H new ATOM 0 HD3 ARG A 179 3.600 -7.051 4.149 1.00 0.00 H new ATOM 0 HE ARG A 179 4.248 -7.880 6.207 1.00 0.00 H new ATOM 0 HH11 ARG A 179 2.712 -4.732 6.633 1.00 0.00 H new ATOM 0 HH12 ARG A 179 2.792 -4.801 8.397 1.00 0.00 H new ATOM 0 HH21 ARG A 179 4.347 -7.964 8.473 1.00 0.00 H new ATOM 0 HH22 ARG A 179 3.714 -6.623 9.434 1.00 0.00 H new ATOM 384 N VAL A 180 1.864 -2.279 2.123 1.00 0.00 N ATOM 385 CA VAL A 180 1.381 -1.660 0.900 1.00 0.00 C ATOM 386 C VAL A 180 0.997 -0.221 1.133 1.00 0.00 C ATOM 387 O VAL A 180 1.387 0.640 0.359 1.00 0.00 O ATOM 388 CB VAL A 180 0.237 -2.488 0.278 1.00 0.00 C ATOM 389 CG1 VAL A 180 -0.417 -3.354 1.332 1.00 0.00 C ATOM 390 CG2 VAL A 180 -0.775 -1.612 -0.432 1.00 0.00 C ATOM 0 H VAL A 180 1.162 -2.828 2.619 1.00 0.00 H new ATOM 0 HA VAL A 180 2.194 -1.650 0.174 1.00 0.00 H new ATOM 0 HB VAL A 180 0.669 -3.140 -0.481 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -1.222 -3.933 0.879 1.00 0.00 H new ATOM 0 HG12 VAL A 180 0.323 -4.032 1.756 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -0.824 -2.722 2.121 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -1.563 -2.235 -0.855 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -1.210 -0.910 0.279 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -0.281 -1.060 -1.231 1.00 0.00 H new ATOM 400 N VAL A 181 0.279 0.051 2.210 1.00 0.00 N ATOM 401 CA VAL A 181 -0.090 1.419 2.520 1.00 0.00 C ATOM 402 C VAL A 181 1.168 2.242 2.685 1.00 0.00 C ATOM 403 O VAL A 181 1.254 3.376 2.226 1.00 0.00 O ATOM 404 CB VAL A 181 -0.968 1.515 3.781 1.00 0.00 C ATOM 405 CG1 VAL A 181 -0.136 1.736 5.029 1.00 0.00 C ATOM 406 CG2 VAL A 181 -1.971 2.627 3.639 1.00 0.00 C ATOM 0 H VAL A 181 -0.055 -0.647 2.875 1.00 0.00 H new ATOM 0 HA VAL A 181 -0.686 1.808 1.695 1.00 0.00 H new ATOM 0 HB VAL A 181 -1.491 0.564 3.885 1.00 0.00 H new ATOM 0 HG11 VAL A 181 -0.792 1.798 5.897 1.00 0.00 H new ATOM 0 HG12 VAL A 181 0.557 0.904 5.157 1.00 0.00 H new ATOM 0 HG13 VAL A 181 0.426 2.665 4.932 1.00 0.00 H new ATOM 0 HG21 VAL A 181 -2.584 2.681 4.539 1.00 0.00 H new ATOM 0 HG22 VAL A 181 -1.448 3.573 3.498 1.00 0.00 H new ATOM 0 HG23 VAL A 181 -2.609 2.434 2.777 1.00 0.00 H new ATOM 416 N ALA A 182 2.161 1.624 3.298 1.00 0.00 N ATOM 417 CA ALA A 182 3.455 2.259 3.467 1.00 0.00 C ATOM 418 C ALA A 182 4.083 2.334 2.095 1.00 0.00 C ATOM 419 O ALA A 182 4.821 3.266 1.778 1.00 0.00 O ATOM 420 CB ALA A 182 4.337 1.461 4.441 1.00 0.00 C ATOM 0 H ALA A 182 2.096 0.683 3.687 1.00 0.00 H new ATOM 0 HA ALA A 182 3.348 3.255 3.896 1.00 0.00 H new ATOM 0 HB1 ALA A 182 5.301 1.958 4.550 1.00 0.00 H new ATOM 0 HB2 ALA A 182 3.846 1.404 5.413 1.00 0.00 H new ATOM 0 HB3 ALA A 182 4.490 0.454 4.052 1.00 0.00 H new ATOM 426 N ALA A 183 3.721 1.363 1.261 1.00 0.00 N ATOM 427 CA ALA A 183 4.181 1.337 -0.111 1.00 0.00 C ATOM 428 C ALA A 183 3.438 2.412 -0.888 1.00 0.00 C ATOM 429 O ALA A 183 3.871 2.837 -1.951 1.00 0.00 O ATOM 430 CB ALA A 183 3.955 -0.026 -0.735 1.00 0.00 C ATOM 0 H ALA A 183 3.111 0.587 1.518 1.00 0.00 H new ATOM 0 HA ALA A 183 5.253 1.532 -0.139 1.00 0.00 H new ATOM 0 HB1 ALA A 183 4.310 -0.018 -1.766 1.00 0.00 H new ATOM 0 HB2 ALA A 183 4.502 -0.780 -0.169 1.00 0.00 H new ATOM 0 HB3 ALA A 183 2.891 -0.261 -0.719 1.00 0.00 H new ATOM 436 N LEU A 184 2.324 2.872 -0.311 1.00 0.00 N ATOM 437 CA LEU A 184 1.522 3.932 -0.896 1.00 0.00 C ATOM 438 C LEU A 184 2.137 5.253 -0.480 1.00 0.00 C ATOM 439 O LEU A 184 2.121 6.237 -1.209 1.00 0.00 O ATOM 440 CB LEU A 184 0.071 3.845 -0.416 1.00 0.00 C ATOM 441 CG LEU A 184 -0.652 2.528 -0.719 1.00 0.00 C ATOM 442 CD1 LEU A 184 -2.029 2.501 -0.080 1.00 0.00 C ATOM 443 CD2 LEU A 184 -0.764 2.331 -2.212 1.00 0.00 C ATOM 0 H LEU A 184 1.960 2.516 0.573 1.00 0.00 H new ATOM 0 HA LEU A 184 1.511 3.839 -1.982 1.00 0.00 H new ATOM 0 HB2 LEU A 184 0.054 4.008 0.662 1.00 0.00 H new ATOM 0 HB3 LEU A 184 -0.492 4.660 -0.871 1.00 0.00 H new ATOM 0 HG LEU A 184 -0.067 1.712 -0.294 1.00 0.00 H new ATOM 0 HD11 LEU A 184 -2.519 1.555 -0.311 1.00 0.00 H new ATOM 0 HD12 LEU A 184 -1.931 2.604 1.001 1.00 0.00 H new ATOM 0 HD13 LEU A 184 -2.627 3.325 -0.470 1.00 0.00 H new ATOM 0 HD21 LEU A 184 -1.279 1.393 -2.418 1.00 0.00 H new ATOM 0 HD22 LEU A 184 -1.327 3.157 -2.647 1.00 0.00 H new ATOM 0 HD23 LEU A 184 0.233 2.301 -2.651 1.00 0.00 H new ATOM 455 N ARG A 185 2.736 5.247 0.696 1.00 0.00 N ATOM 456 CA ARG A 185 3.423 6.420 1.190 1.00 0.00 C ATOM 457 C ARG A 185 4.755 6.510 0.465 1.00 0.00 C ATOM 458 O ARG A 185 5.349 7.582 0.349 1.00 0.00 O ATOM 459 CB ARG A 185 3.647 6.336 2.700 1.00 0.00 C ATOM 460 CG ARG A 185 2.387 6.016 3.488 1.00 0.00 C ATOM 461 CD ARG A 185 2.683 5.891 4.972 1.00 0.00 C ATOM 462 NE ARG A 185 1.538 6.274 5.794 1.00 0.00 N ATOM 463 CZ ARG A 185 1.635 6.635 7.069 1.00 0.00 C ATOM 464 NH1 ARG A 185 2.818 6.662 7.663 1.00 0.00 N ATOM 465 NH2 ARG A 185 0.546 6.973 7.747 1.00 0.00 N ATOM 0 H ARG A 185 2.760 4.444 1.324 1.00 0.00 H new ATOM 0 HA ARG A 185 2.819 7.308 1.004 1.00 0.00 H new ATOM 0 HB2 ARG A 185 4.397 5.572 2.905 1.00 0.00 H new ATOM 0 HB3 ARG A 185 4.054 7.284 3.051 1.00 0.00 H new ATOM 0 HG2 ARG A 185 1.646 6.799 3.327 1.00 0.00 H new ATOM 0 HG3 ARG A 185 1.953 5.086 3.122 1.00 0.00 H new ATOM 0 HD2 ARG A 185 2.965 4.863 5.200 1.00 0.00 H new ATOM 0 HD3 ARG A 185 3.537 6.519 5.225 1.00 0.00 H new ATOM 0 HE ARG A 185 0.612 6.264 5.365 1.00 0.00 H new ATOM 0 HH11 ARG A 185 3.656 6.405 7.142 1.00 0.00 H new ATOM 0 HH12 ARG A 185 2.891 6.939 8.642 1.00 0.00 H new ATOM 0 HH21 ARG A 185 -0.365 6.956 7.289 1.00 0.00 H new ATOM 0 HH22 ARG A 185 0.620 7.250 8.726 1.00 0.00 H new ATOM 479 N ALA A 186 5.213 5.353 -0.024 1.00 0.00 N ATOM 480 CA ALA A 186 6.477 5.275 -0.746 1.00 0.00 C ATOM 481 C ALA A 186 6.275 5.121 -2.258 1.00 0.00 C ATOM 482 O ALA A 186 7.233 5.219 -3.024 1.00 0.00 O ATOM 483 CB ALA A 186 7.312 4.123 -0.207 1.00 0.00 C ATOM 0 H ALA A 186 4.725 4.462 0.069 1.00 0.00 H new ATOM 0 HA ALA A 186 7.004 6.216 -0.586 1.00 0.00 H new ATOM 0 HB1 ALA A 186 8.255 4.071 -0.751 1.00 0.00 H new ATOM 0 HB2 ALA A 186 7.513 4.284 0.852 1.00 0.00 H new ATOM 0 HB3 ALA A 186 6.767 3.188 -0.335 1.00 0.00 H new ATOM 489 N SER A 187 5.032 4.893 -2.693 1.00 0.00 N ATOM 490 CA SER A 187 4.745 4.744 -4.123 1.00 0.00 C ATOM 491 C SER A 187 4.003 5.972 -4.647 1.00 0.00 C ATOM 492 O SER A 187 4.016 6.242 -5.846 1.00 0.00 O ATOM 493 CB SER A 187 3.932 3.469 -4.410 1.00 0.00 C ATOM 494 OG SER A 187 4.668 2.308 -4.064 1.00 0.00 O ATOM 0 H SER A 187 4.218 4.808 -2.084 1.00 0.00 H new ATOM 0 HA SER A 187 5.699 4.654 -4.643 1.00 0.00 H new ATOM 0 HB2 SER A 187 2.999 3.494 -3.847 1.00 0.00 H new ATOM 0 HB3 SER A 187 3.666 3.434 -5.466 1.00 0.00 H new ATOM 0 HG SER A 187 4.614 2.162 -3.096 1.00 0.00 H new ATOM 500 N TYR A 188 3.378 6.713 -3.723 1.00 0.00 N ATOM 501 CA TYR A 188 2.630 7.938 -4.043 1.00 0.00 C ATOM 502 C TYR A 188 1.116 7.716 -3.998 1.00 0.00 C ATOM 503 O TYR A 188 0.357 8.519 -4.538 1.00 0.00 O ATOM 504 CB TYR A 188 3.032 8.497 -5.412 1.00 0.00 C ATOM 505 CG TYR A 188 2.466 9.876 -5.702 1.00 0.00 C ATOM 506 CD1 TYR A 188 2.478 10.874 -4.732 1.00 0.00 C ATOM 507 CD2 TYR A 188 1.920 10.180 -6.945 1.00 0.00 C ATOM 508 CE1 TYR A 188 1.965 12.130 -4.992 1.00 0.00 C ATOM 509 CE2 TYR A 188 1.405 11.435 -7.210 1.00 0.00 C ATOM 510 CZ TYR A 188 1.430 12.405 -6.232 1.00 0.00 C ATOM 511 OH TYR A 188 0.918 13.655 -6.495 1.00 0.00 O ATOM 0 H TYR A 188 3.376 6.480 -2.730 1.00 0.00 H new ATOM 0 HA TYR A 188 2.889 8.667 -3.275 1.00 0.00 H new ATOM 0 HB2 TYR A 188 4.120 8.541 -5.471 1.00 0.00 H new ATOM 0 HB3 TYR A 188 2.699 7.807 -6.188 1.00 0.00 H new ATOM 0 HD1 TYR A 188 2.896 10.663 -3.759 1.00 0.00 H new ATOM 0 HD2 TYR A 188 1.898 9.423 -7.715 1.00 0.00 H new ATOM 0 HE1 TYR A 188 1.983 12.893 -4.227 1.00 0.00 H new ATOM 0 HE2 TYR A 188 0.985 11.654 -8.180 1.00 0.00 H new ATOM 0 HH TYR A 188 0.581 13.684 -7.415 1.00 0.00 H new ATOM 521 N ASN A 189 0.691 6.624 -3.354 1.00 0.00 N ATOM 522 CA ASN A 189 -0.727 6.275 -3.224 1.00 0.00 C ATOM 523 C ASN A 189 -1.091 5.201 -4.225 1.00 0.00 C ATOM 524 O ASN A 189 -2.064 4.470 -4.047 1.00 0.00 O ATOM 525 CB ASN A 189 -1.636 7.488 -3.410 1.00 0.00 C ATOM 526 CG ASN A 189 -3.078 7.184 -3.061 1.00 0.00 C ATOM 527 OD1 ASN A 189 -3.703 6.305 -3.656 1.00 0.00 O ATOM 528 ND2 ASN A 189 -3.617 7.913 -2.091 1.00 0.00 N ATOM 0 H ASN A 189 1.321 5.957 -2.908 1.00 0.00 H new ATOM 0 HA ASN A 189 -0.879 5.901 -2.212 1.00 0.00 H new ATOM 0 HB2 ASN A 189 -1.278 8.307 -2.786 1.00 0.00 H new ATOM 0 HB3 ASN A 189 -1.578 7.827 -4.444 1.00 0.00 H new ATOM 0 HD21 ASN A 189 -4.585 7.755 -1.812 1.00 0.00 H new ATOM 0 HD22 ASN A 189 -3.063 8.631 -1.625 1.00 0.00 H new ATOM 535 N ASN A 190 -0.290 5.098 -5.271 1.00 0.00 N ATOM 536 CA ASN A 190 -0.523 4.092 -6.287 1.00 0.00 C ATOM 537 C ASN A 190 -0.525 2.720 -5.639 1.00 0.00 C ATOM 538 O ASN A 190 0.191 2.491 -4.674 1.00 0.00 O ATOM 539 CB ASN A 190 0.557 4.114 -7.355 1.00 0.00 C ATOM 540 CG ASN A 190 1.157 5.483 -7.582 1.00 0.00 C ATOM 541 OD1 ASN A 190 1.926 5.984 -6.768 1.00 0.00 O ATOM 542 ND2 ASN A 190 0.814 6.088 -8.706 1.00 0.00 N ATOM 0 H ASN A 190 0.521 5.694 -5.437 1.00 0.00 H new ATOM 0 HA ASN A 190 -1.483 4.307 -6.756 1.00 0.00 H new ATOM 0 HB2 ASN A 190 1.350 3.422 -7.072 1.00 0.00 H new ATOM 0 HB3 ASN A 190 0.136 3.751 -8.293 1.00 0.00 H new ATOM 0 HD21 ASN A 190 1.192 7.009 -8.925 1.00 0.00 H new ATOM 0 HD22 ASN A 190 0.171 5.633 -9.354 1.00 0.00 H new ATOM 549 N PRO A 191 -1.328 1.793 -6.160 1.00 0.00 N ATOM 550 CA PRO A 191 -1.445 0.438 -5.645 1.00 0.00 C ATOM 551 C PRO A 191 -0.489 -0.509 -6.341 1.00 0.00 C ATOM 552 O PRO A 191 0.427 -1.059 -5.732 1.00 0.00 O ATOM 553 CB PRO A 191 -2.869 0.051 -6.019 1.00 0.00 C ATOM 554 CG PRO A 191 -3.415 1.223 -6.784 1.00 0.00 C ATOM 555 CD PRO A 191 -2.217 1.966 -7.290 1.00 0.00 C ATOM 0 HA PRO A 191 -1.220 0.385 -4.580 1.00 0.00 H new ATOM 0 HB2 PRO A 191 -2.883 -0.855 -6.625 1.00 0.00 H new ATOM 0 HB3 PRO A 191 -3.467 -0.151 -5.130 1.00 0.00 H new ATOM 0 HG2 PRO A 191 -4.048 0.893 -7.607 1.00 0.00 H new ATOM 0 HG3 PRO A 191 -4.029 1.857 -6.144 1.00 0.00 H new ATOM 0 HD2 PRO A 191 -1.815 1.536 -8.208 1.00 0.00 H new ATOM 0 HD3 PRO A 191 -2.432 3.015 -7.496 1.00 0.00 H new ATOM 563 N HIS A 192 -0.723 -0.696 -7.633 1.00 0.00 N ATOM 564 CA HIS A 192 0.104 -1.565 -8.441 1.00 0.00 C ATOM 565 C HIS A 192 1.567 -1.265 -8.170 1.00 0.00 C ATOM 566 O HIS A 192 2.352 -2.168 -7.903 1.00 0.00 O ATOM 567 CB HIS A 192 -0.218 -1.362 -9.920 1.00 0.00 C ATOM 568 CG HIS A 192 0.217 -2.499 -10.792 1.00 0.00 C ATOM 569 ND1 HIS A 192 -0.671 -3.350 -11.419 1.00 0.00 N ATOM 570 CD2 HIS A 192 1.455 -2.925 -11.140 1.00 0.00 C ATOM 571 CE1 HIS A 192 0.003 -4.249 -12.113 1.00 0.00 C ATOM 572 NE2 HIS A 192 1.294 -4.014 -11.962 1.00 0.00 N ATOM 0 H HIS A 192 -1.487 -0.251 -8.142 1.00 0.00 H new ATOM 0 HA HIS A 192 -0.098 -2.605 -8.183 1.00 0.00 H new ATOM 0 HB2 HIS A 192 -1.293 -1.220 -10.033 1.00 0.00 H new ATOM 0 HB3 HIS A 192 0.262 -0.447 -10.265 1.00 0.00 H new ATOM 0 HD2 HIS A 192 2.393 -2.490 -10.829 1.00 0.00 H new ATOM 0 HE1 HIS A 192 -0.429 -5.043 -12.704 1.00 0.00 H new ATOM 0 HE2 HIS A 192 2.049 -4.553 -12.387 1.00 0.00 H new ATOM 580 N ARG A 193 1.918 0.020 -8.209 1.00 0.00 N ATOM 581 CA ARG A 193 3.282 0.437 -7.924 1.00 0.00 C ATOM 582 C ARG A 193 3.570 0.144 -6.465 1.00 0.00 C ATOM 583 O ARG A 193 4.688 -0.190 -6.089 1.00 0.00 O ATOM 584 CB ARG A 193 3.463 1.930 -8.197 1.00 0.00 C ATOM 585 CG ARG A 193 4.756 2.505 -7.639 1.00 0.00 C ATOM 586 CD ARG A 193 5.740 2.849 -8.743 1.00 0.00 C ATOM 587 NE ARG A 193 5.978 1.718 -9.636 1.00 0.00 N ATOM 588 CZ ARG A 193 6.591 1.825 -10.812 1.00 0.00 C ATOM 589 NH1 ARG A 193 7.023 3.006 -11.230 1.00 0.00 N ATOM 590 NH2 ARG A 193 6.771 0.750 -11.567 1.00 0.00 N ATOM 0 H ARG A 193 1.279 0.782 -8.434 1.00 0.00 H new ATOM 0 HA ARG A 193 3.972 -0.108 -8.569 1.00 0.00 H new ATOM 0 HB2 ARG A 193 3.436 2.099 -9.274 1.00 0.00 H new ATOM 0 HB3 ARG A 193 2.620 2.473 -7.768 1.00 0.00 H new ATOM 0 HG2 ARG A 193 4.535 3.400 -7.057 1.00 0.00 H new ATOM 0 HG3 ARG A 193 5.210 1.785 -6.958 1.00 0.00 H new ATOM 0 HD2 ARG A 193 5.358 3.692 -9.319 1.00 0.00 H new ATOM 0 HD3 ARG A 193 6.684 3.167 -8.301 1.00 0.00 H new ATOM 0 HE ARG A 193 5.657 0.796 -9.342 1.00 0.00 H new ATOM 0 HH11 ARG A 193 6.886 3.834 -10.650 1.00 0.00 H new ATOM 0 HH12 ARG A 193 7.493 3.087 -12.132 1.00 0.00 H new ATOM 0 HH21 ARG A 193 6.439 -0.160 -11.246 1.00 0.00 H new ATOM 0 HH22 ARG A 193 7.241 0.833 -12.468 1.00 0.00 H new ATOM 604 N ALA A 194 2.520 0.271 -5.659 1.00 0.00 N ATOM 605 CA ALA A 194 2.592 0.017 -4.229 1.00 0.00 C ATOM 606 C ALA A 194 3.114 -1.382 -3.941 1.00 0.00 C ATOM 607 O ALA A 194 3.815 -1.606 -2.955 1.00 0.00 O ATOM 608 CB ALA A 194 1.211 0.182 -3.610 1.00 0.00 C ATOM 0 H ALA A 194 1.595 0.554 -5.982 1.00 0.00 H new ATOM 0 HA ALA A 194 3.285 0.736 -3.792 1.00 0.00 H new ATOM 0 HB1 ALA A 194 1.267 -0.009 -2.538 1.00 0.00 H new ATOM 0 HB2 ALA A 194 0.855 1.198 -3.779 1.00 0.00 H new ATOM 0 HB3 ALA A 194 0.520 -0.525 -4.069 1.00 0.00 H new ATOM 614 N VAL A 195 2.752 -2.328 -4.803 1.00 0.00 N ATOM 615 CA VAL A 195 3.172 -3.707 -4.629 1.00 0.00 C ATOM 616 C VAL A 195 4.462 -3.978 -5.357 1.00 0.00 C ATOM 617 O VAL A 195 5.320 -4.708 -4.875 1.00 0.00 O ATOM 618 CB VAL A 195 2.071 -4.675 -5.066 1.00 0.00 C ATOM 619 CG1 VAL A 195 1.744 -4.536 -6.525 1.00 0.00 C ATOM 620 CG2 VAL A 195 2.439 -6.109 -4.715 1.00 0.00 C ATOM 0 H VAL A 195 2.171 -2.162 -5.625 1.00 0.00 H new ATOM 0 HA VAL A 195 3.354 -3.871 -3.567 1.00 0.00 H new ATOM 0 HB VAL A 195 1.169 -4.412 -4.514 1.00 0.00 H new ATOM 0 HG11 VAL A 195 0.958 -5.242 -6.791 1.00 0.00 H new ATOM 0 HG12 VAL A 195 1.403 -3.521 -6.726 1.00 0.00 H new ATOM 0 HG13 VAL A 195 2.634 -4.744 -7.119 1.00 0.00 H new ATOM 0 HG21 VAL A 195 1.641 -6.778 -5.036 1.00 0.00 H new ATOM 0 HG22 VAL A 195 3.366 -6.381 -5.221 1.00 0.00 H new ATOM 0 HG23 VAL A 195 2.575 -6.196 -3.637 1.00 0.00 H new ATOM 630 N GLU A 196 4.637 -3.311 -6.471 1.00 0.00 N ATOM 631 CA GLU A 196 5.899 -3.411 -7.185 1.00 0.00 C ATOM 632 C GLU A 196 6.949 -2.848 -6.240 1.00 0.00 C ATOM 633 O GLU A 196 8.138 -3.156 -6.325 1.00 0.00 O ATOM 634 CB GLU A 196 5.859 -2.624 -8.496 1.00 0.00 C ATOM 635 CG GLU A 196 6.222 -3.454 -9.715 1.00 0.00 C ATOM 636 CD GLU A 196 7.719 -3.563 -9.923 1.00 0.00 C ATOM 637 OE1 GLU A 196 8.454 -2.680 -9.429 1.00 0.00 O ATOM 638 OE2 GLU A 196 8.161 -4.530 -10.578 1.00 0.00 O ATOM 0 H GLU A 196 3.941 -2.703 -6.902 1.00 0.00 H new ATOM 0 HA GLU A 196 6.120 -4.442 -7.461 1.00 0.00 H new ATOM 0 HB2 GLU A 196 4.859 -2.212 -8.632 1.00 0.00 H new ATOM 0 HB3 GLU A 196 6.545 -1.780 -8.424 1.00 0.00 H new ATOM 0 HG2 GLU A 196 5.800 -4.453 -9.608 1.00 0.00 H new ATOM 0 HG3 GLU A 196 5.768 -3.010 -10.601 1.00 0.00 H new ATOM 645 N TYR A 197 6.444 -2.051 -5.292 1.00 0.00 N ATOM 646 CA TYR A 197 7.233 -1.450 -4.245 1.00 0.00 C ATOM 647 C TYR A 197 7.455 -2.500 -3.181 1.00 0.00 C ATOM 648 O TYR A 197 8.574 -2.733 -2.722 1.00 0.00 O ATOM 649 CB TYR A 197 6.470 -0.264 -3.666 1.00 0.00 C ATOM 650 CG TYR A 197 7.357 0.814 -3.123 1.00 0.00 C ATOM 651 CD1 TYR A 197 7.957 0.688 -1.880 1.00 0.00 C ATOM 652 CD2 TYR A 197 7.592 1.956 -3.865 1.00 0.00 C ATOM 653 CE1 TYR A 197 8.779 1.696 -1.385 1.00 0.00 C ATOM 654 CE2 TYR A 197 8.412 2.968 -3.383 1.00 0.00 C ATOM 655 CZ TYR A 197 9.000 2.830 -2.144 1.00 0.00 C ATOM 656 OH TYR A 197 9.814 3.827 -1.659 1.00 0.00 O ATOM 0 H TYR A 197 5.454 -1.809 -5.242 1.00 0.00 H new ATOM 0 HA TYR A 197 8.191 -1.095 -4.626 1.00 0.00 H new ATOM 0 HB2 TYR A 197 5.831 0.159 -4.441 1.00 0.00 H new ATOM 0 HB3 TYR A 197 5.814 -0.618 -2.871 1.00 0.00 H new ATOM 0 HD1 TYR A 197 7.785 -0.200 -1.290 1.00 0.00 H new ATOM 0 HD2 TYR A 197 7.130 2.063 -4.836 1.00 0.00 H new ATOM 0 HE1 TYR A 197 9.241 1.593 -0.414 1.00 0.00 H new ATOM 0 HE2 TYR A 197 8.587 3.855 -3.974 1.00 0.00 H new ATOM 0 HH TYR A 197 10.073 3.618 -0.737 1.00 0.00 H new ATOM 666 N LEU A 198 6.363 -3.173 -2.841 1.00 0.00 N ATOM 667 CA LEU A 198 6.392 -4.258 -1.882 1.00 0.00 C ATOM 668 C LEU A 198 7.538 -5.185 -2.256 1.00 0.00 C ATOM 669 O LEU A 198 8.161 -5.827 -1.411 1.00 0.00 O ATOM 670 CB LEU A 198 5.075 -5.027 -1.972 1.00 0.00 C ATOM 671 CG LEU A 198 4.010 -4.738 -0.907 1.00 0.00 C ATOM 672 CD1 LEU A 198 4.403 -3.584 -0.016 1.00 0.00 C ATOM 673 CD2 LEU A 198 2.684 -4.442 -1.572 1.00 0.00 C ATOM 0 H LEU A 198 5.438 -2.979 -3.224 1.00 0.00 H new ATOM 0 HA LEU A 198 6.527 -3.877 -0.870 1.00 0.00 H new ATOM 0 HB2 LEU A 198 4.636 -4.828 -2.949 1.00 0.00 H new ATOM 0 HB3 LEU A 198 5.305 -6.092 -1.937 1.00 0.00 H new ATOM 0 HG LEU A 198 3.920 -5.626 -0.281 1.00 0.00 H new ATOM 0 HD11 LEU A 198 3.621 -3.413 0.724 1.00 0.00 H new ATOM 0 HD12 LEU A 198 5.338 -3.819 0.492 1.00 0.00 H new ATOM 0 HD13 LEU A 198 4.534 -2.686 -0.620 1.00 0.00 H new ATOM 0 HD21 LEU A 198 1.932 -4.238 -0.810 1.00 0.00 H new ATOM 0 HD22 LEU A 198 2.788 -3.572 -2.221 1.00 0.00 H new ATOM 0 HD23 LEU A 198 2.374 -5.302 -2.165 1.00 0.00 H new ATOM 685 N LEU A 199 7.786 -5.232 -3.562 1.00 0.00 N ATOM 686 CA LEU A 199 8.831 -6.053 -4.147 1.00 0.00 C ATOM 687 C LEU A 199 10.206 -5.431 -3.930 1.00 0.00 C ATOM 688 O LEU A 199 10.934 -5.809 -3.013 1.00 0.00 O ATOM 689 CB LEU A 199 8.554 -6.201 -5.647 1.00 0.00 C ATOM 690 CG LEU A 199 7.454 -7.202 -6.027 1.00 0.00 C ATOM 691 CD1 LEU A 199 7.962 -8.167 -7.082 1.00 0.00 C ATOM 692 CD2 LEU A 199 6.952 -7.963 -4.808 1.00 0.00 C ATOM 0 H LEU A 199 7.258 -4.693 -4.248 1.00 0.00 H new ATOM 0 HA LEU A 199 8.829 -7.030 -3.664 1.00 0.00 H new ATOM 0 HB2 LEU A 199 8.283 -5.223 -6.046 1.00 0.00 H new ATOM 0 HB3 LEU A 199 9.479 -6.501 -6.140 1.00 0.00 H new ATOM 0 HG LEU A 199 6.615 -6.640 -6.437 1.00 0.00 H new ATOM 0 HD11 LEU A 199 7.172 -8.871 -7.342 1.00 0.00 H new ATOM 0 HD12 LEU A 199 8.259 -7.611 -7.971 1.00 0.00 H new ATOM 0 HD13 LEU A 199 8.821 -8.713 -6.692 1.00 0.00 H new ATOM 0 HD21 LEU A 199 6.174 -8.663 -5.111 1.00 0.00 H new ATOM 0 HD22 LEU A 199 7.778 -8.512 -4.356 1.00 0.00 H new ATOM 0 HD23 LEU A 199 6.544 -7.259 -4.082 1.00 0.00 H new ATOM 704 N THR A 200 10.551 -4.470 -4.783 1.00 0.00 N ATOM 705 CA THR A 200 11.839 -3.791 -4.691 1.00 0.00 C ATOM 706 C THR A 200 12.270 -3.628 -3.238 1.00 0.00 C ATOM 707 O THR A 200 13.305 -4.152 -2.825 1.00 0.00 O ATOM 708 CB THR A 200 11.770 -2.421 -5.372 1.00 0.00 C ATOM 709 OG1 THR A 200 12.414 -1.437 -4.580 1.00 0.00 O ATOM 710 CG2 THR A 200 10.358 -1.945 -5.631 1.00 0.00 C ATOM 0 H THR A 200 9.956 -4.145 -5.545 1.00 0.00 H new ATOM 0 HA THR A 200 12.579 -4.406 -5.202 1.00 0.00 H new ATOM 0 HB THR A 200 12.271 -2.553 -6.331 1.00 0.00 H new ATOM 0 HG1 THR A 200 12.362 -0.568 -5.031 1.00 0.00 H new ATOM 0 HG21 THR A 200 10.386 -0.969 -6.115 1.00 0.00 H new ATOM 0 HG22 THR A 200 9.847 -2.657 -6.279 1.00 0.00 H new ATOM 0 HG23 THR A 200 9.822 -1.866 -4.685 1.00 0.00 H new ATOM 718 N GLY A 201 11.472 -2.897 -2.466 1.00 0.00 N ATOM 719 CA GLY A 201 11.790 -2.679 -1.068 1.00 0.00 C ATOM 720 C GLY A 201 11.769 -1.211 -0.691 1.00 0.00 C ATOM 721 O GLY A 201 11.810 -0.339 -1.559 1.00 0.00 O ATOM 0 H GLY A 201 10.611 -2.452 -2.784 1.00 0.00 H new ATOM 0 HA2 GLY A 201 11.076 -3.221 -0.447 1.00 0.00 H new ATOM 0 HA3 GLY A 201 12.776 -3.092 -0.854 1.00 0.00 H new ATOM 725 N ILE A 202 11.702 -0.936 0.607 1.00 0.00 N ATOM 726 CA ILE A 202 11.675 0.436 1.097 1.00 0.00 C ATOM 727 C ILE A 202 13.001 0.815 1.746 1.00 0.00 C ATOM 728 O ILE A 202 13.195 0.624 2.946 1.00 0.00 O ATOM 729 CB ILE A 202 10.538 0.649 2.114 1.00 0.00 C ATOM 730 CG1 ILE A 202 9.284 -0.111 1.678 1.00 0.00 C ATOM 731 CG2 ILE A 202 10.241 2.132 2.273 1.00 0.00 C ATOM 732 CD1 ILE A 202 8.033 0.318 2.413 1.00 0.00 C ATOM 0 H ILE A 202 11.665 -1.646 1.339 1.00 0.00 H new ATOM 0 HA ILE A 202 11.502 1.076 0.232 1.00 0.00 H new ATOM 0 HB ILE A 202 10.856 0.258 3.080 1.00 0.00 H new ATOM 0 HG12 ILE A 202 9.135 0.033 0.608 1.00 0.00 H new ATOM 0 HG13 ILE A 202 9.442 -1.178 1.837 1.00 0.00 H new ATOM 0 HG21 ILE A 202 9.435 2.266 2.995 1.00 0.00 H new ATOM 0 HG22 ILE A 202 11.135 2.646 2.627 1.00 0.00 H new ATOM 0 HG23 ILE A 202 9.940 2.548 1.312 1.00 0.00 H new ATOM 0 HD11 ILE A 202 7.183 -0.262 2.054 1.00 0.00 H new ATOM 0 HD12 ILE A 202 8.163 0.148 3.482 1.00 0.00 H new ATOM 0 HD13 ILE A 202 7.851 1.378 2.234 1.00 0.00 H new ATOM 744 N PRO A 203 13.935 1.359 0.954 1.00 0.00 N ATOM 745 CA PRO A 203 15.254 1.770 1.445 1.00 0.00 C ATOM 746 C PRO A 203 15.165 2.913 2.453 1.00 0.00 C ATOM 747 O PRO A 203 15.132 2.685 3.661 1.00 0.00 O ATOM 748 CB PRO A 203 15.988 2.226 0.181 1.00 0.00 C ATOM 749 CG PRO A 203 14.911 2.551 -0.796 1.00 0.00 C ATOM 750 CD PRO A 203 13.774 1.618 -0.486 1.00 0.00 C ATOM 0 HA PRO A 203 15.759 0.961 1.973 1.00 0.00 H new ATOM 0 HB2 PRO A 203 16.615 3.095 0.381 1.00 0.00 H new ATOM 0 HB3 PRO A 203 16.642 1.442 -0.200 1.00 0.00 H new ATOM 0 HG2 PRO A 203 14.599 3.591 -0.701 1.00 0.00 H new ATOM 0 HG3 PRO A 203 15.259 2.415 -1.820 1.00 0.00 H new ATOM 0 HD2 PRO A 203 12.808 2.072 -0.708 1.00 0.00 H new ATOM 0 HD3 PRO A 203 13.836 0.700 -1.070 1.00 0.00 H new ATOM 758 N GLY A 204 15.128 4.141 1.947 1.00 0.00 N ATOM 759 CA GLY A 204 15.044 5.299 2.818 1.00 0.00 C ATOM 760 C GLY A 204 15.989 6.408 2.402 1.00 0.00 C ATOM 761 O GLY A 204 17.159 6.388 2.840 1.00 0.00 O ATOM 762 OXT GLY A 204 15.561 7.297 1.638 1.00 0.00 O ATOM 0 H GLY A 204 15.155 4.355 0.950 1.00 0.00 H new ATOM 0 HA2 GLY A 204 14.022 5.677 2.816 1.00 0.00 H new ATOM 0 HA3 GLY A 204 15.271 4.998 3.841 1.00 0.00 H new TER 766 GLY A 204