USER MOD reduce.3.24.130724 H: found=0, std=0, add=453, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 454 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 Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= -1.01! C(o=-1!,f=-0.98!) USER MOD Single : A 146 ASN : amide:sc= -0.83 K(o=-0.83,f=-8.5!) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 171 ASN : amide:sc= -0.255 K(o=-0.26,f=-3.1!) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 MET CE :methyl -158:sc= -0.937 (180deg=-1.62!) USER MOD Single : A 186 TYR OH : rot 180:sc= 0 USER MOD Single : A 189 LYS NZ :NH3+ -157:sc= -0.0356 (180deg=-0.278) USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 134 0.964 0.679 -0.583 1.00 0.00 N ATOM 2 CA ALA A 134 1.702 0.843 -1.823 1.00 0.00 C ATOM 3 C ALA A 134 1.907 2.334 -2.097 1.00 0.00 C ATOM 4 O ALA A 134 0.995 3.014 -2.565 1.00 0.00 O ATOM 5 CB ALA A 134 0.957 0.139 -2.959 1.00 0.00 C ATOM 0 HA ALA A 134 2.687 0.383 -1.745 1.00 0.00 H new ATOM 0 HB1 ALA A 134 1.511 0.263 -3.889 1.00 0.00 H new ATOM 0 HB2 ALA A 134 0.864 -0.923 -2.730 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -0.036 0.575 -3.068 1.00 0.00 H new ATOM 11 N GLU A 135 3.110 2.799 -1.795 1.00 0.00 N ATOM 12 CA GLU A 135 3.446 4.198 -2.002 1.00 0.00 C ATOM 13 C GLU A 135 4.821 4.507 -1.406 1.00 0.00 C ATOM 14 O GLU A 135 5.721 4.958 -2.112 1.00 0.00 O ATOM 15 CB GLU A 135 2.373 5.113 -1.411 1.00 0.00 C ATOM 16 CG GLU A 135 2.830 6.574 -1.424 1.00 0.00 C ATOM 17 CD GLU A 135 1.762 7.476 -2.046 1.00 0.00 C ATOM 18 OE1 GLU A 135 1.396 7.203 -3.210 1.00 0.00 O ATOM 19 OE2 GLU A 135 1.336 8.419 -1.344 1.00 0.00 O ATOM 0 H GLU A 135 3.865 2.232 -1.408 1.00 0.00 H new ATOM 0 HA GLU A 135 3.486 4.387 -3.075 1.00 0.00 H new ATOM 0 HB2 GLU A 135 1.450 5.012 -1.981 1.00 0.00 H new ATOM 0 HB3 GLU A 135 2.151 4.807 -0.389 1.00 0.00 H new ATOM 0 HG2 GLU A 135 3.041 6.902 -0.406 1.00 0.00 H new ATOM 0 HG3 GLU A 135 3.759 6.663 -1.986 1.00 0.00 H new ATOM 26 N TYR A 136 4.939 4.254 -0.111 1.00 0.00 N ATOM 27 CA TYR A 136 6.189 4.499 0.588 1.00 0.00 C ATOM 28 C TYR A 136 6.572 3.304 1.464 1.00 0.00 C ATOM 29 O TYR A 136 5.737 2.774 2.195 1.00 0.00 O ATOM 30 CB TYR A 136 5.939 5.714 1.485 1.00 0.00 C ATOM 31 CG TYR A 136 6.511 7.021 0.936 1.00 0.00 C ATOM 32 CD1 TYR A 136 5.899 7.650 -0.128 1.00 0.00 C ATOM 33 CD2 TYR A 136 7.641 7.574 1.506 1.00 0.00 C ATOM 34 CE1 TYR A 136 6.438 8.881 -0.645 1.00 0.00 C ATOM 35 CE2 TYR A 136 8.180 8.805 0.989 1.00 0.00 C ATOM 36 CZ TYR A 136 7.552 9.397 -0.061 1.00 0.00 C ATOM 37 OH TYR A 136 8.062 10.560 -0.549 1.00 0.00 O ATOM 0 H TYR A 136 4.190 3.882 0.472 1.00 0.00 H new ATOM 0 HA TYR A 136 7.000 4.662 -0.122 1.00 0.00 H new ATOM 0 HB2 TYR A 136 4.865 5.832 1.629 1.00 0.00 H new ATOM 0 HB3 TYR A 136 6.373 5.523 2.467 1.00 0.00 H new ATOM 0 HD1 TYR A 136 5.015 7.219 -0.574 1.00 0.00 H new ATOM 0 HD2 TYR A 136 8.121 7.083 2.340 1.00 0.00 H new ATOM 0 HE1 TYR A 136 5.968 9.383 -1.478 1.00 0.00 H new ATOM 0 HE2 TYR A 136 9.063 9.248 1.426 1.00 0.00 H new ATOM 0 HH TYR A 136 8.857 10.810 -0.034 1.00 0.00 H new ATOM 47 N VAL A 137 7.835 2.916 1.361 1.00 0.00 N ATOM 48 CA VAL A 137 8.338 1.794 2.134 1.00 0.00 C ATOM 49 C VAL A 137 9.595 2.226 2.892 1.00 0.00 C ATOM 50 O VAL A 137 10.262 3.183 2.501 1.00 0.00 O ATOM 51 CB VAL A 137 8.577 0.592 1.217 1.00 0.00 C ATOM 52 CG1 VAL A 137 7.289 -0.212 1.021 1.00 0.00 C ATOM 53 CG2 VAL A 137 9.156 1.034 -0.128 1.00 0.00 C ATOM 0 H VAL A 137 8.525 3.359 0.754 1.00 0.00 H new ATOM 0 HA VAL A 137 7.603 1.480 2.875 1.00 0.00 H new ATOM 0 HB VAL A 137 9.308 -0.057 1.699 1.00 0.00 H new ATOM 0 HG11 VAL A 137 7.486 -1.060 0.366 1.00 0.00 H new ATOM 0 HG12 VAL A 137 6.935 -0.574 1.987 1.00 0.00 H new ATOM 0 HG13 VAL A 137 6.527 0.425 0.571 1.00 0.00 H new ATOM 0 HG21 VAL A 137 9.316 0.160 -0.760 1.00 0.00 H new ATOM 0 HG22 VAL A 137 8.459 1.714 -0.618 1.00 0.00 H new ATOM 0 HG23 VAL A 137 10.106 1.543 0.034 1.00 0.00 H new ATOM 63 N ARG A 138 9.880 1.499 3.962 1.00 0.00 N ATOM 64 CA ARG A 138 11.046 1.795 4.778 1.00 0.00 C ATOM 65 C ARG A 138 12.031 0.626 4.740 1.00 0.00 C ATOM 66 O ARG A 138 11.625 -0.530 4.636 1.00 0.00 O ATOM 67 CB ARG A 138 10.646 2.068 6.230 1.00 0.00 C ATOM 68 CG ARG A 138 11.879 2.329 7.099 1.00 0.00 C ATOM 69 CD ARG A 138 12.434 3.734 6.851 1.00 0.00 C ATOM 70 NE ARG A 138 11.372 4.611 6.313 1.00 0.00 N ATOM 71 CZ ARG A 138 10.921 5.711 6.931 1.00 0.00 C ATOM 72 NH1 ARG A 138 11.437 6.075 8.113 1.00 0.00 N ATOM 73 NH2 ARG A 138 9.953 6.448 6.368 1.00 0.00 N ATOM 0 H ARG A 138 9.324 0.706 4.283 1.00 0.00 H new ATOM 0 HA ARG A 138 11.520 2.687 4.369 1.00 0.00 H new ATOM 0 HB2 ARG A 138 9.979 2.929 6.271 1.00 0.00 H new ATOM 0 HB3 ARG A 138 10.092 1.216 6.625 1.00 0.00 H new ATOM 0 HG2 ARG A 138 11.618 2.217 8.151 1.00 0.00 H new ATOM 0 HG3 ARG A 138 12.647 1.587 6.881 1.00 0.00 H new ATOM 0 HD2 ARG A 138 12.823 4.149 7.781 1.00 0.00 H new ATOM 0 HD3 ARG A 138 13.267 3.686 6.150 1.00 0.00 H new ATOM 0 HE ARG A 138 10.957 4.363 5.415 1.00 0.00 H new ATOM 0 HH11 ARG A 138 12.173 5.515 8.542 1.00 0.00 H new ATOM 0 HH12 ARG A 138 11.094 6.912 8.583 1.00 0.00 H new ATOM 0 HH21 ARG A 138 9.559 6.171 5.469 1.00 0.00 H new ATOM 0 HH22 ARG A 138 9.610 7.285 6.839 1.00 0.00 H new ATOM 87 N ALA A 139 13.309 0.968 4.825 1.00 0.00 N ATOM 88 CA ALA A 139 14.357 -0.039 4.800 1.00 0.00 C ATOM 89 C ALA A 139 15.207 0.085 6.067 1.00 0.00 C ATOM 90 O ALA A 139 16.155 0.868 6.107 1.00 0.00 O ATOM 91 CB ALA A 139 15.185 0.117 3.524 1.00 0.00 C ATOM 0 H ALA A 139 13.642 1.928 4.911 1.00 0.00 H new ATOM 0 HA ALA A 139 13.927 -1.041 4.788 1.00 0.00 H new ATOM 0 HB1 ALA A 139 15.971 -0.638 3.506 1.00 0.00 H new ATOM 0 HB2 ALA A 139 14.540 -0.009 2.654 1.00 0.00 H new ATOM 0 HB3 ALA A 139 15.635 1.109 3.501 1.00 0.00 H new ATOM 97 N LEU A 140 14.837 -0.698 7.068 1.00 0.00 N ATOM 98 CA LEU A 140 15.554 -0.687 8.332 1.00 0.00 C ATOM 99 C LEU A 140 16.367 -1.975 8.465 1.00 0.00 C ATOM 100 O LEU A 140 16.478 -2.535 9.555 1.00 0.00 O ATOM 101 CB LEU A 140 14.587 -0.447 9.494 1.00 0.00 C ATOM 102 CG LEU A 140 13.098 -0.523 9.154 1.00 0.00 C ATOM 103 CD1 LEU A 140 12.691 -1.950 8.783 1.00 0.00 C ATOM 104 CD2 LEU A 140 12.246 0.038 10.294 1.00 0.00 C ATOM 0 H LEU A 140 14.049 -1.345 7.030 1.00 0.00 H new ATOM 0 HA LEU A 140 16.263 0.141 8.360 1.00 0.00 H new ATOM 0 HB2 LEU A 140 14.799 -1.178 10.274 1.00 0.00 H new ATOM 0 HB3 LEU A 140 14.793 0.537 9.915 1.00 0.00 H new ATOM 0 HG LEU A 140 12.916 0.101 8.279 1.00 0.00 H new ATOM 0 HD11 LEU A 140 11.627 -1.975 8.546 1.00 0.00 H new ATOM 0 HD12 LEU A 140 13.264 -2.278 7.916 1.00 0.00 H new ATOM 0 HD13 LEU A 140 12.891 -2.615 9.623 1.00 0.00 H new ATOM 0 HD21 LEU A 140 11.191 -0.028 10.026 1.00 0.00 H new ATOM 0 HD22 LEU A 140 12.427 -0.539 11.201 1.00 0.00 H new ATOM 0 HD23 LEU A 140 12.512 1.081 10.468 1.00 0.00 H new ATOM 116 N PHE A 141 16.916 -2.410 7.339 1.00 0.00 N ATOM 117 CA PHE A 141 17.716 -3.622 7.316 1.00 0.00 C ATOM 118 C PHE A 141 18.904 -3.476 6.361 1.00 0.00 C ATOM 119 O PHE A 141 19.863 -4.243 6.438 1.00 0.00 O ATOM 120 CB PHE A 141 16.809 -4.747 6.815 1.00 0.00 C ATOM 121 CG PHE A 141 16.329 -5.695 7.915 1.00 0.00 C ATOM 122 CD1 PHE A 141 15.229 -5.382 8.652 1.00 0.00 C ATOM 123 CD2 PHE A 141 17.002 -6.853 8.157 1.00 0.00 C ATOM 124 CE1 PHE A 141 14.783 -6.262 9.672 1.00 0.00 C ATOM 125 CE2 PHE A 141 16.556 -7.733 9.178 1.00 0.00 C ATOM 126 CZ PHE A 141 15.456 -7.420 9.915 1.00 0.00 C ATOM 0 H PHE A 141 16.822 -1.944 6.437 1.00 0.00 H new ATOM 0 HA PHE A 141 18.108 -3.829 8.312 1.00 0.00 H new ATOM 0 HB2 PHE A 141 15.941 -4.308 6.323 1.00 0.00 H new ATOM 0 HB3 PHE A 141 17.345 -5.323 6.061 1.00 0.00 H new ATOM 0 HD1 PHE A 141 14.695 -4.463 8.461 1.00 0.00 H new ATOM 0 HD2 PHE A 141 17.875 -7.102 7.572 1.00 0.00 H new ATOM 0 HE1 PHE A 141 13.909 -6.013 10.256 1.00 0.00 H new ATOM 0 HE2 PHE A 141 17.090 -8.652 9.370 1.00 0.00 H new ATOM 0 HZ PHE A 141 15.117 -8.089 10.692 1.00 0.00 H new ATOM 136 N ASP A 142 18.800 -2.489 5.484 1.00 0.00 N ATOM 137 CA ASP A 142 19.852 -2.235 4.516 1.00 0.00 C ATOM 138 C ASP A 142 20.128 -3.512 3.720 1.00 0.00 C ATOM 139 O ASP A 142 19.771 -4.606 4.153 1.00 0.00 O ATOM 140 CB ASP A 142 21.151 -1.821 5.210 1.00 0.00 C ATOM 141 CG ASP A 142 22.432 -2.178 4.454 1.00 0.00 C ATOM 142 OD1 ASP A 142 22.577 -1.676 3.318 1.00 0.00 O ATOM 143 OD2 ASP A 142 23.236 -2.943 5.027 1.00 0.00 O ATOM 0 H ASP A 142 18.003 -1.856 5.424 1.00 0.00 H new ATOM 0 HA ASP A 142 19.519 -1.429 3.862 1.00 0.00 H new ATOM 0 HB2 ASP A 142 21.131 -0.743 5.371 1.00 0.00 H new ATOM 0 HB3 ASP A 142 21.185 -2.290 6.193 1.00 0.00 H new ATOM 148 N PHE A 143 20.760 -3.330 2.571 1.00 0.00 N ATOM 149 CA PHE A 143 21.088 -4.454 1.710 1.00 0.00 C ATOM 150 C PHE A 143 22.198 -4.084 0.724 1.00 0.00 C ATOM 151 O PHE A 143 23.125 -4.863 0.508 1.00 0.00 O ATOM 152 CB PHE A 143 19.821 -4.802 0.926 1.00 0.00 C ATOM 153 CG PHE A 143 20.088 -5.468 -0.424 1.00 0.00 C ATOM 154 CD1 PHE A 143 20.451 -4.712 -1.495 1.00 0.00 C ATOM 155 CD2 PHE A 143 19.961 -6.816 -0.555 1.00 0.00 C ATOM 156 CE1 PHE A 143 20.699 -5.331 -2.749 1.00 0.00 C ATOM 157 CE2 PHE A 143 20.208 -7.434 -1.809 1.00 0.00 C ATOM 158 CZ PHE A 143 20.572 -6.678 -2.879 1.00 0.00 C ATOM 0 H PHE A 143 21.054 -2.420 2.215 1.00 0.00 H new ATOM 0 HA PHE A 143 21.438 -5.293 2.311 1.00 0.00 H new ATOM 0 HB2 PHE A 143 19.203 -5.465 1.531 1.00 0.00 H new ATOM 0 HB3 PHE A 143 19.246 -3.891 0.763 1.00 0.00 H new ATOM 0 HD1 PHE A 143 20.551 -3.642 -1.392 1.00 0.00 H new ATOM 0 HD2 PHE A 143 19.672 -7.416 0.295 1.00 0.00 H new ATOM 0 HE1 PHE A 143 20.989 -4.731 -3.599 1.00 0.00 H new ATOM 0 HE2 PHE A 143 20.107 -8.504 -1.913 1.00 0.00 H new ATOM 0 HZ PHE A 143 20.760 -7.148 -3.833 1.00 0.00 H new ATOM 168 N ASN A 144 22.065 -2.897 0.152 1.00 0.00 N ATOM 169 CA ASN A 144 23.046 -2.415 -0.807 1.00 0.00 C ATOM 170 C ASN A 144 23.869 -3.595 -1.325 1.00 0.00 C ATOM 171 O ASN A 144 23.512 -4.215 -2.326 1.00 0.00 O ATOM 172 CB ASN A 144 24.007 -1.417 -0.158 1.00 0.00 C ATOM 173 CG ASN A 144 25.241 -1.194 -1.034 1.00 0.00 C ATOM 174 OD1 ASN A 144 25.152 -0.975 -2.231 1.00 0.00 O ATOM 175 ND2 ASN A 144 26.393 -1.263 -0.373 1.00 0.00 N ATOM 0 H ASN A 144 21.294 -2.255 0.333 1.00 0.00 H new ATOM 0 HA ASN A 144 22.510 -1.924 -1.619 1.00 0.00 H new ATOM 0 HB2 ASN A 144 23.496 -0.468 0.005 1.00 0.00 H new ATOM 0 HB3 ASN A 144 24.313 -1.786 0.821 1.00 0.00 H new ATOM 0 HD21 ASN A 144 27.274 -1.129 -0.869 1.00 0.00 H new ATOM 0 HD22 ASN A 144 26.395 -1.450 0.630 1.00 0.00 H new ATOM 182 N GLY A 145 24.957 -3.872 -0.620 1.00 0.00 N ATOM 183 CA GLY A 145 25.834 -4.967 -0.996 1.00 0.00 C ATOM 184 C GLY A 145 26.537 -4.675 -2.323 1.00 0.00 C ATOM 185 O GLY A 145 27.754 -4.499 -2.360 1.00 0.00 O ATOM 0 H GLY A 145 25.250 -3.356 0.210 1.00 0.00 H new ATOM 0 HA2 GLY A 145 26.577 -5.128 -0.215 1.00 0.00 H new ATOM 0 HA3 GLY A 145 25.256 -5.888 -1.081 1.00 0.00 H new ATOM 189 N ASN A 146 25.741 -4.633 -3.382 1.00 0.00 N ATOM 190 CA ASN A 146 26.273 -4.366 -4.707 1.00 0.00 C ATOM 191 C ASN A 146 25.116 -4.083 -5.668 1.00 0.00 C ATOM 192 O ASN A 146 25.317 -3.503 -6.733 1.00 0.00 O ATOM 193 CB ASN A 146 27.049 -5.570 -5.243 1.00 0.00 C ATOM 194 CG ASN A 146 26.224 -6.853 -5.117 1.00 0.00 C ATOM 195 OD1 ASN A 146 25.083 -6.932 -5.540 1.00 0.00 O ATOM 196 ND2 ASN A 146 26.866 -7.851 -4.515 1.00 0.00 N ATOM 0 H ASN A 146 24.732 -4.779 -3.349 1.00 0.00 H new ATOM 0 HA ASN A 146 26.943 -3.509 -4.635 1.00 0.00 H new ATOM 0 HB2 ASN A 146 27.311 -5.403 -6.288 1.00 0.00 H new ATOM 0 HB3 ASN A 146 27.984 -5.679 -4.693 1.00 0.00 H new ATOM 0 HD21 ASN A 146 26.403 -8.750 -4.384 1.00 0.00 H new ATOM 0 HD22 ASN A 146 27.822 -7.717 -4.184 1.00 0.00 H new ATOM 203 N ASP A 147 23.930 -4.507 -5.256 1.00 0.00 N ATOM 204 CA ASP A 147 22.740 -4.306 -6.066 1.00 0.00 C ATOM 205 C ASP A 147 23.010 -4.800 -7.490 1.00 0.00 C ATOM 206 O ASP A 147 22.921 -4.029 -8.445 1.00 0.00 O ATOM 207 CB ASP A 147 22.369 -2.824 -6.143 1.00 0.00 C ATOM 208 CG ASP A 147 23.415 -1.929 -6.809 1.00 0.00 C ATOM 209 OD1 ASP A 147 24.313 -1.462 -6.075 1.00 0.00 O ATOM 210 OD2 ASP A 147 23.294 -1.731 -8.038 1.00 0.00 O ATOM 0 H ASP A 147 23.768 -4.989 -4.372 1.00 0.00 H new ATOM 0 HA ASP A 147 21.921 -4.859 -5.606 1.00 0.00 H new ATOM 0 HB2 ASP A 147 21.430 -2.728 -6.689 1.00 0.00 H new ATOM 0 HB3 ASP A 147 22.189 -2.457 -5.132 1.00 0.00 H new ATOM 215 N GLU A 148 23.332 -6.081 -7.587 1.00 0.00 N ATOM 216 CA GLU A 148 23.615 -6.686 -8.876 1.00 0.00 C ATOM 217 C GLU A 148 22.319 -6.875 -9.669 1.00 0.00 C ATOM 218 O GLU A 148 22.356 -7.162 -10.865 1.00 0.00 O ATOM 219 CB GLU A 148 24.354 -8.016 -8.708 1.00 0.00 C ATOM 220 CG GLU A 148 25.672 -8.012 -9.486 1.00 0.00 C ATOM 221 CD GLU A 148 26.132 -9.439 -9.791 1.00 0.00 C ATOM 222 OE1 GLU A 148 26.204 -10.231 -8.826 1.00 0.00 O ATOM 223 OE2 GLU A 148 26.401 -9.706 -10.982 1.00 0.00 O ATOM 0 H GLU A 148 23.403 -6.717 -6.793 1.00 0.00 H new ATOM 0 HA GLU A 148 24.267 -6.015 -9.435 1.00 0.00 H new ATOM 0 HB2 GLU A 148 24.552 -8.196 -7.651 1.00 0.00 H new ATOM 0 HB3 GLU A 148 23.723 -8.833 -9.058 1.00 0.00 H new ATOM 0 HG2 GLU A 148 25.547 -7.459 -10.417 1.00 0.00 H new ATOM 0 HG3 GLU A 148 26.438 -7.495 -8.908 1.00 0.00 H new ATOM 230 N GLU A 149 21.206 -6.707 -8.972 1.00 0.00 N ATOM 231 CA GLU A 149 19.902 -6.855 -9.595 1.00 0.00 C ATOM 232 C GLU A 149 18.793 -6.600 -8.573 1.00 0.00 C ATOM 233 O GLU A 149 17.749 -7.248 -8.610 1.00 0.00 O ATOM 234 CB GLU A 149 19.754 -8.239 -10.232 1.00 0.00 C ATOM 235 CG GLU A 149 18.459 -8.332 -11.042 1.00 0.00 C ATOM 236 CD GLU A 149 18.556 -9.426 -12.107 1.00 0.00 C ATOM 237 OE1 GLU A 149 19.456 -9.302 -12.967 1.00 0.00 O ATOM 238 OE2 GLU A 149 17.730 -10.362 -12.037 1.00 0.00 O ATOM 0 H GLU A 149 21.180 -6.469 -7.980 1.00 0.00 H new ATOM 0 HA GLU A 149 19.814 -6.114 -10.389 1.00 0.00 H new ATOM 0 HB2 GLU A 149 20.608 -8.439 -10.880 1.00 0.00 H new ATOM 0 HB3 GLU A 149 19.757 -9.004 -9.455 1.00 0.00 H new ATOM 0 HG2 GLU A 149 17.623 -8.542 -10.375 1.00 0.00 H new ATOM 0 HG3 GLU A 149 18.254 -7.373 -11.518 1.00 0.00 H new ATOM 245 N ASP A 150 19.057 -5.654 -7.683 1.00 0.00 N ATOM 246 CA ASP A 150 18.095 -5.305 -6.652 1.00 0.00 C ATOM 247 C ASP A 150 18.318 -3.854 -6.222 1.00 0.00 C ATOM 248 O ASP A 150 19.411 -3.315 -6.387 1.00 0.00 O ATOM 249 CB ASP A 150 18.262 -6.194 -5.419 1.00 0.00 C ATOM 250 CG ASP A 150 17.906 -7.668 -5.631 1.00 0.00 C ATOM 251 OD1 ASP A 150 16.869 -7.913 -6.284 1.00 0.00 O ATOM 252 OD2 ASP A 150 18.681 -8.515 -5.136 1.00 0.00 O ATOM 0 H ASP A 150 19.924 -5.118 -7.655 1.00 0.00 H new ATOM 0 HA ASP A 150 17.095 -5.443 -7.064 1.00 0.00 H new ATOM 0 HB2 ASP A 150 19.296 -6.131 -5.081 1.00 0.00 H new ATOM 0 HB3 ASP A 150 17.640 -5.797 -4.617 1.00 0.00 H new ATOM 257 N LEU A 151 17.263 -3.263 -5.681 1.00 0.00 N ATOM 258 CA LEU A 151 17.330 -1.884 -5.226 1.00 0.00 C ATOM 259 C LEU A 151 18.145 -1.817 -3.933 1.00 0.00 C ATOM 260 O LEU A 151 17.729 -2.349 -2.904 1.00 0.00 O ATOM 261 CB LEU A 151 15.924 -1.293 -5.099 1.00 0.00 C ATOM 262 CG LEU A 151 15.846 0.145 -4.584 1.00 0.00 C ATOM 263 CD1 LEU A 151 16.967 1.002 -5.174 1.00 0.00 C ATOM 264 CD2 LEU A 151 14.464 0.748 -4.849 1.00 0.00 C ATOM 0 H LEU A 151 16.357 -3.713 -5.547 1.00 0.00 H new ATOM 0 HA LEU A 151 17.846 -1.265 -5.960 1.00 0.00 H new ATOM 0 HB2 LEU A 151 15.444 -1.334 -6.077 1.00 0.00 H new ATOM 0 HB3 LEU A 151 15.343 -1.929 -4.432 1.00 0.00 H new ATOM 0 HG LEU A 151 15.989 0.128 -3.504 1.00 0.00 H new ATOM 0 HD11 LEU A 151 16.887 2.019 -4.791 1.00 0.00 H new ATOM 0 HD12 LEU A 151 17.933 0.583 -4.892 1.00 0.00 H new ATOM 0 HD13 LEU A 151 16.881 1.016 -6.261 1.00 0.00 H new ATOM 0 HD21 LEU A 151 14.435 1.771 -4.473 1.00 0.00 H new ATOM 0 HD22 LEU A 151 14.267 0.750 -5.921 1.00 0.00 H new ATOM 0 HD23 LEU A 151 13.704 0.153 -4.342 1.00 0.00 H new ATOM 276 N PRO A 152 19.321 -1.142 -4.029 1.00 0.00 N ATOM 277 CA PRO A 152 20.199 -0.999 -2.880 1.00 0.00 C ATOM 278 C PRO A 152 19.647 0.035 -1.896 1.00 0.00 C ATOM 279 O PRO A 152 19.455 1.196 -2.252 1.00 0.00 O ATOM 280 CB PRO A 152 21.547 -0.605 -3.461 1.00 0.00 C ATOM 281 CG PRO A 152 21.263 -0.090 -4.863 1.00 0.00 C ATOM 282 CD PRO A 152 19.847 -0.500 -5.231 1.00 0.00 C ATOM 0 HA PRO A 152 20.285 -1.917 -2.298 1.00 0.00 H new ATOM 0 HB2 PRO A 152 22.025 0.163 -2.852 1.00 0.00 H new ATOM 0 HB3 PRO A 152 22.225 -1.458 -3.488 1.00 0.00 H new ATOM 0 HG2 PRO A 152 21.369 0.994 -4.900 1.00 0.00 H new ATOM 0 HG3 PRO A 152 21.978 -0.504 -5.574 1.00 0.00 H new ATOM 0 HD2 PRO A 152 19.246 0.364 -5.514 1.00 0.00 H new ATOM 0 HD3 PRO A 152 19.841 -1.184 -6.080 1.00 0.00 H new ATOM 290 N PHE A 153 19.409 -0.426 -0.675 1.00 0.00 N ATOM 291 CA PHE A 153 18.884 0.444 0.362 1.00 0.00 C ATOM 292 C PHE A 153 19.709 0.326 1.647 1.00 0.00 C ATOM 293 O PHE A 153 20.528 -0.582 1.781 1.00 0.00 O ATOM 294 CB PHE A 153 17.452 -0.014 0.648 1.00 0.00 C ATOM 295 CG PHE A 153 17.340 -1.478 1.080 1.00 0.00 C ATOM 296 CD1 PHE A 153 17.487 -1.813 2.389 1.00 0.00 C ATOM 297 CD2 PHE A 153 17.095 -2.443 0.154 1.00 0.00 C ATOM 298 CE1 PHE A 153 17.383 -3.171 2.791 1.00 0.00 C ATOM 299 CE2 PHE A 153 16.991 -3.801 0.555 1.00 0.00 C ATOM 300 CZ PHE A 153 17.138 -4.136 1.865 1.00 0.00 C ATOM 0 H PHE A 153 19.570 -1.390 -0.383 1.00 0.00 H new ATOM 0 HA PHE A 153 18.922 1.482 0.031 1.00 0.00 H new ATOM 0 HB2 PHE A 153 17.029 0.618 1.429 1.00 0.00 H new ATOM 0 HB3 PHE A 153 16.848 0.137 -0.247 1.00 0.00 H new ATOM 0 HD1 PHE A 153 17.683 -1.046 3.124 1.00 0.00 H new ATOM 0 HD2 PHE A 153 16.980 -2.177 -0.886 1.00 0.00 H new ATOM 0 HE1 PHE A 153 17.498 -3.437 3.831 1.00 0.00 H new ATOM 0 HE2 PHE A 153 16.795 -4.568 -0.180 1.00 0.00 H new ATOM 0 HZ PHE A 153 17.060 -5.169 2.170 1.00 0.00 H new ATOM 310 N LYS A 154 19.464 1.256 2.557 1.00 0.00 N ATOM 311 CA LYS A 154 20.174 1.268 3.825 1.00 0.00 C ATOM 312 C LYS A 154 19.184 1.006 4.961 1.00 0.00 C ATOM 313 O LYS A 154 17.975 0.958 4.737 1.00 0.00 O ATOM 314 CB LYS A 154 20.964 2.568 3.985 1.00 0.00 C ATOM 315 CG LYS A 154 21.830 2.839 2.752 1.00 0.00 C ATOM 316 CD LYS A 154 23.306 2.955 3.133 1.00 0.00 C ATOM 317 CE LYS A 154 23.611 4.329 3.734 1.00 0.00 C ATOM 318 NZ LYS A 154 24.175 5.231 2.706 1.00 0.00 N ATOM 0 H LYS A 154 18.784 2.007 2.442 1.00 0.00 H new ATOM 0 HA LYS A 154 20.913 0.468 3.855 1.00 0.00 H new ATOM 0 HB2 LYS A 154 20.276 3.399 4.140 1.00 0.00 H new ATOM 0 HB3 LYS A 154 21.596 2.507 4.871 1.00 0.00 H new ATOM 0 HG2 LYS A 154 21.700 2.035 2.028 1.00 0.00 H new ATOM 0 HG3 LYS A 154 21.502 3.759 2.268 1.00 0.00 H new ATOM 0 HD2 LYS A 154 23.562 2.175 3.850 1.00 0.00 H new ATOM 0 HD3 LYS A 154 23.927 2.794 2.252 1.00 0.00 H new ATOM 0 HE2 LYS A 154 22.700 4.763 4.146 1.00 0.00 H new ATOM 0 HE3 LYS A 154 24.315 4.223 4.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 24.376 6.159 3.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 25.056 4.823 2.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 23.490 5.346 1.932 1.00 0.00 H new ATOM 332 N LYS A 155 19.733 0.844 6.156 1.00 0.00 N ATOM 333 CA LYS A 155 18.913 0.589 7.328 1.00 0.00 C ATOM 334 C LYS A 155 18.292 1.902 7.807 1.00 0.00 C ATOM 335 O LYS A 155 18.816 2.546 8.714 1.00 0.00 O ATOM 336 CB LYS A 155 19.726 -0.135 8.403 1.00 0.00 C ATOM 337 CG LYS A 155 18.899 -0.331 9.676 1.00 0.00 C ATOM 338 CD LYS A 155 19.285 0.693 10.744 1.00 0.00 C ATOM 339 CE LYS A 155 18.101 1.598 11.090 1.00 0.00 C ATOM 340 NZ LYS A 155 17.735 1.450 12.516 1.00 0.00 N ATOM 0 H LYS A 155 20.736 0.884 6.338 1.00 0.00 H new ATOM 0 HA LYS A 155 18.090 -0.080 7.078 1.00 0.00 H new ATOM 0 HB2 LYS A 155 20.054 -1.103 8.025 1.00 0.00 H new ATOM 0 HB3 LYS A 155 20.624 0.438 8.633 1.00 0.00 H new ATOM 0 HG2 LYS A 155 17.838 -0.236 9.443 1.00 0.00 H new ATOM 0 HG3 LYS A 155 19.052 -1.339 10.062 1.00 0.00 H new ATOM 0 HD2 LYS A 155 19.627 0.177 11.641 1.00 0.00 H new ATOM 0 HD3 LYS A 155 20.118 1.299 10.388 1.00 0.00 H new ATOM 0 HE2 LYS A 155 18.356 2.637 10.880 1.00 0.00 H new ATOM 0 HE3 LYS A 155 17.247 1.346 10.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 16.930 2.071 12.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 17.472 0.462 12.706 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 18.546 1.713 13.112 1.00 0.00 H new ATOM 354 N GLY A 156 17.184 2.261 7.175 1.00 0.00 N ATOM 355 CA GLY A 156 16.485 3.487 7.525 1.00 0.00 C ATOM 356 C GLY A 156 16.247 4.353 6.288 1.00 0.00 C ATOM 357 O GLY A 156 16.028 5.559 6.402 1.00 0.00 O ATOM 0 H GLY A 156 16.753 1.724 6.422 1.00 0.00 H new ATOM 0 HA2 GLY A 156 15.531 3.245 7.993 1.00 0.00 H new ATOM 0 HA3 GLY A 156 17.067 4.045 8.258 1.00 0.00 H new ATOM 361 N ASP A 157 16.298 3.707 5.132 1.00 0.00 N ATOM 362 CA ASP A 157 16.090 4.404 3.875 1.00 0.00 C ATOM 363 C ASP A 157 14.590 4.483 3.581 1.00 0.00 C ATOM 364 O ASP A 157 13.816 3.657 4.064 1.00 0.00 O ATOM 365 CB ASP A 157 16.760 3.663 2.716 1.00 0.00 C ATOM 366 CG ASP A 157 16.580 4.313 1.342 1.00 0.00 C ATOM 367 OD1 ASP A 157 16.659 5.558 1.288 1.00 0.00 O ATOM 368 OD2 ASP A 157 16.367 3.548 0.377 1.00 0.00 O ATOM 0 H ASP A 157 16.481 2.708 5.040 1.00 0.00 H new ATOM 0 HA ASP A 157 16.525 5.399 3.967 1.00 0.00 H new ATOM 0 HB2 ASP A 157 17.827 3.581 2.925 1.00 0.00 H new ATOM 0 HB3 ASP A 157 16.364 2.648 2.676 1.00 0.00 H new ATOM 373 N ILE A 158 14.225 5.481 2.791 1.00 0.00 N ATOM 374 CA ILE A 158 12.832 5.677 2.428 1.00 0.00 C ATOM 375 C ILE A 158 12.677 5.516 0.914 1.00 0.00 C ATOM 376 O ILE A 158 13.427 6.111 0.143 1.00 0.00 O ATOM 377 CB ILE A 158 12.323 7.019 2.959 1.00 0.00 C ATOM 378 CG1 ILE A 158 11.920 6.909 4.431 1.00 0.00 C ATOM 379 CG2 ILE A 158 11.183 7.556 2.091 1.00 0.00 C ATOM 380 CD1 ILE A 158 13.151 6.750 5.326 1.00 0.00 C ATOM 0 H ILE A 158 14.870 6.163 2.392 1.00 0.00 H new ATOM 0 HA ILE A 158 12.206 4.917 2.896 1.00 0.00 H new ATOM 0 HB ILE A 158 13.138 7.740 2.901 1.00 0.00 H new ATOM 0 HG12 ILE A 158 11.363 7.798 4.727 1.00 0.00 H new ATOM 0 HG13 ILE A 158 11.255 6.056 4.567 1.00 0.00 H new ATOM 0 HG21 ILE A 158 10.840 8.510 2.491 1.00 0.00 H new ATOM 0 HG22 ILE A 158 11.538 7.697 1.070 1.00 0.00 H new ATOM 0 HG23 ILE A 158 10.358 6.844 2.093 1.00 0.00 H new ATOM 0 HD11 ILE A 158 12.837 6.674 6.367 1.00 0.00 H new ATOM 0 HD12 ILE A 158 13.692 5.847 5.044 1.00 0.00 H new ATOM 0 HD13 ILE A 158 13.802 7.616 5.206 1.00 0.00 H new ATOM 392 N LEU A 159 11.697 4.709 0.535 1.00 0.00 N ATOM 393 CA LEU A 159 11.434 4.461 -0.872 1.00 0.00 C ATOM 394 C LEU A 159 9.923 4.479 -1.114 1.00 0.00 C ATOM 395 O LEU A 159 9.145 4.701 -0.189 1.00 0.00 O ATOM 396 CB LEU A 159 12.115 3.169 -1.326 1.00 0.00 C ATOM 397 CG LEU A 159 13.395 2.787 -0.580 1.00 0.00 C ATOM 398 CD1 LEU A 159 13.099 1.784 0.537 1.00 0.00 C ATOM 399 CD2 LEU A 159 14.460 2.270 -1.548 1.00 0.00 C ATOM 0 H LEU A 159 11.075 4.218 1.178 1.00 0.00 H new ATOM 0 HA LEU A 159 11.865 5.252 -1.485 1.00 0.00 H new ATOM 0 HB2 LEU A 159 11.402 2.351 -1.225 1.00 0.00 H new ATOM 0 HB3 LEU A 159 12.349 3.259 -2.387 1.00 0.00 H new ATOM 0 HG LEU A 159 13.797 3.684 -0.109 1.00 0.00 H new ATOM 0 HD11 LEU A 159 14.025 1.529 1.052 1.00 0.00 H new ATOM 0 HD12 LEU A 159 12.399 2.226 1.247 1.00 0.00 H new ATOM 0 HD13 LEU A 159 12.661 0.882 0.109 1.00 0.00 H new ATOM 0 HD21 LEU A 159 15.359 2.006 -0.992 1.00 0.00 H new ATOM 0 HD22 LEU A 159 14.083 1.389 -2.068 1.00 0.00 H new ATOM 0 HD23 LEU A 159 14.698 3.046 -2.275 1.00 0.00 H new ATOM 411 N ARG A 160 9.554 4.240 -2.365 1.00 0.00 N ATOM 412 CA ARG A 160 8.150 4.226 -2.740 1.00 0.00 C ATOM 413 C ARG A 160 7.832 2.970 -3.556 1.00 0.00 C ATOM 414 O ARG A 160 8.670 2.494 -4.321 1.00 0.00 O ATOM 415 CB ARG A 160 7.786 5.464 -3.561 1.00 0.00 C ATOM 416 CG ARG A 160 7.607 6.687 -2.658 1.00 0.00 C ATOM 417 CD ARG A 160 8.260 7.925 -3.276 1.00 0.00 C ATOM 418 NE ARG A 160 9.724 7.733 -3.367 1.00 0.00 N ATOM 419 CZ ARG A 160 10.382 7.496 -4.510 1.00 0.00 C ATOM 420 NH1 ARG A 160 9.710 7.422 -5.667 1.00 0.00 N ATOM 421 NH2 ARG A 160 11.712 7.335 -4.497 1.00 0.00 N ATOM 0 H ARG A 160 10.202 4.055 -3.130 1.00 0.00 H new ATOM 0 HA ARG A 160 7.562 4.227 -1.822 1.00 0.00 H new ATOM 0 HB2 ARG A 160 8.567 5.661 -4.295 1.00 0.00 H new ATOM 0 HB3 ARG A 160 6.866 5.279 -4.116 1.00 0.00 H new ATOM 0 HG2 ARG A 160 6.545 6.873 -2.498 1.00 0.00 H new ATOM 0 HG3 ARG A 160 8.047 6.489 -1.680 1.00 0.00 H new ATOM 0 HD2 ARG A 160 7.847 8.107 -4.268 1.00 0.00 H new ATOM 0 HD3 ARG A 160 8.037 8.804 -2.671 1.00 0.00 H new ATOM 0 HE ARG A 160 10.267 7.784 -2.505 1.00 0.00 H new ATOM 0 HH11 ARG A 160 8.698 7.546 -5.678 1.00 0.00 H new ATOM 0 HH12 ARG A 160 10.211 7.242 -6.537 1.00 0.00 H new ATOM 0 HH21 ARG A 160 12.224 7.393 -3.617 1.00 0.00 H new ATOM 0 HH22 ARG A 160 12.212 7.155 -5.367 1.00 0.00 H new ATOM 435 N ILE A 161 6.621 2.470 -3.365 1.00 0.00 N ATOM 436 CA ILE A 161 6.181 1.280 -4.073 1.00 0.00 C ATOM 437 C ILE A 161 5.563 1.687 -5.412 1.00 0.00 C ATOM 438 O ILE A 161 4.557 2.396 -5.445 1.00 0.00 O ATOM 439 CB ILE A 161 5.248 0.446 -3.193 1.00 0.00 C ATOM 440 CG1 ILE A 161 5.898 -0.886 -2.814 1.00 0.00 C ATOM 441 CG2 ILE A 161 3.889 0.250 -3.867 1.00 0.00 C ATOM 442 CD1 ILE A 161 7.288 -0.667 -2.213 1.00 0.00 C ATOM 0 H ILE A 161 5.929 2.868 -2.729 1.00 0.00 H new ATOM 0 HA ILE A 161 7.031 0.635 -4.297 1.00 0.00 H new ATOM 0 HB ILE A 161 5.072 0.993 -2.267 1.00 0.00 H new ATOM 0 HG12 ILE A 161 5.267 -1.412 -2.097 1.00 0.00 H new ATOM 0 HG13 ILE A 161 5.975 -1.521 -3.697 1.00 0.00 H new ATOM 0 HG21 ILE A 161 3.245 -0.346 -3.221 1.00 0.00 H new ATOM 0 HG22 ILE A 161 3.427 1.221 -4.044 1.00 0.00 H new ATOM 0 HG23 ILE A 161 4.025 -0.265 -4.818 1.00 0.00 H new ATOM 0 HD11 ILE A 161 7.728 -1.630 -1.952 1.00 0.00 H new ATOM 0 HD12 ILE A 161 7.924 -0.163 -2.941 1.00 0.00 H new ATOM 0 HD13 ILE A 161 7.204 -0.052 -1.317 1.00 0.00 H new ATOM 454 N ARG A 162 6.189 1.222 -6.483 1.00 0.00 N ATOM 455 CA ARG A 162 5.713 1.529 -7.821 1.00 0.00 C ATOM 456 C ARG A 162 5.095 0.286 -8.463 1.00 0.00 C ATOM 457 O ARG A 162 3.997 0.349 -9.015 1.00 0.00 O ATOM 458 CB ARG A 162 6.851 2.040 -8.707 1.00 0.00 C ATOM 459 CG ARG A 162 6.392 2.186 -10.159 1.00 0.00 C ATOM 460 CD ARG A 162 5.409 3.348 -10.310 1.00 0.00 C ATOM 461 NE ARG A 162 6.149 4.617 -10.494 1.00 0.00 N ATOM 462 CZ ARG A 162 6.582 5.067 -11.680 1.00 0.00 C ATOM 463 NH1 ARG A 162 6.352 4.356 -12.792 1.00 0.00 N ATOM 464 NH2 ARG A 162 7.246 6.229 -11.752 1.00 0.00 N ATOM 0 H ARG A 162 7.022 0.635 -6.451 1.00 0.00 H new ATOM 0 HA ARG A 162 4.958 2.310 -7.733 1.00 0.00 H new ATOM 0 HB2 ARG A 162 7.203 3.002 -8.335 1.00 0.00 H new ATOM 0 HB3 ARG A 162 7.694 1.351 -8.656 1.00 0.00 H new ATOM 0 HG2 ARG A 162 7.256 2.351 -10.802 1.00 0.00 H new ATOM 0 HG3 ARG A 162 5.920 1.261 -10.490 1.00 0.00 H new ATOM 0 HD2 ARG A 162 4.754 3.172 -11.163 1.00 0.00 H new ATOM 0 HD3 ARG A 162 4.772 3.413 -9.428 1.00 0.00 H new ATOM 0 HE ARG A 162 6.341 5.183 -9.668 1.00 0.00 H new ATOM 0 HH11 ARG A 162 5.847 3.472 -12.736 1.00 0.00 H new ATOM 0 HH12 ARG A 162 6.682 4.699 -13.694 1.00 0.00 H new ATOM 0 HH21 ARG A 162 7.421 6.770 -10.905 1.00 0.00 H new ATOM 0 HH22 ARG A 162 7.576 6.573 -12.654 1.00 0.00 H new ATOM 478 N ASP A 163 5.826 -0.814 -8.369 1.00 0.00 N ATOM 479 CA ASP A 163 5.364 -2.071 -8.934 1.00 0.00 C ATOM 480 C ASP A 163 5.840 -3.227 -8.052 1.00 0.00 C ATOM 481 O ASP A 163 6.449 -3.006 -7.007 1.00 0.00 O ATOM 482 CB ASP A 163 5.929 -2.285 -10.340 1.00 0.00 C ATOM 483 CG ASP A 163 5.391 -1.329 -11.404 1.00 0.00 C ATOM 484 OD1 ASP A 163 4.182 -1.435 -11.705 1.00 0.00 O ATOM 485 OD2 ASP A 163 6.200 -0.512 -11.896 1.00 0.00 O ATOM 0 H ASP A 163 6.736 -0.862 -7.910 1.00 0.00 H new ATOM 0 HA ASP A 163 4.276 -2.038 -8.985 1.00 0.00 H new ATOM 0 HB2 ASP A 163 7.014 -2.185 -10.299 1.00 0.00 H new ATOM 0 HB3 ASP A 163 5.714 -3.308 -10.650 1.00 0.00 H new ATOM 490 N LYS A 164 5.543 -4.436 -8.506 1.00 0.00 N ATOM 491 CA LYS A 164 5.932 -5.628 -7.771 1.00 0.00 C ATOM 492 C LYS A 164 5.534 -6.869 -8.573 1.00 0.00 C ATOM 493 O LYS A 164 4.350 -7.181 -8.693 1.00 0.00 O ATOM 494 CB LYS A 164 5.353 -5.598 -6.355 1.00 0.00 C ATOM 495 CG LYS A 164 3.823 -5.576 -6.389 1.00 0.00 C ATOM 496 CD LYS A 164 3.268 -4.571 -5.380 1.00 0.00 C ATOM 497 CE LYS A 164 2.063 -5.151 -4.635 1.00 0.00 C ATOM 498 NZ LYS A 164 0.812 -4.865 -5.372 1.00 0.00 N ATOM 0 H LYS A 164 5.038 -4.616 -9.374 1.00 0.00 H new ATOM 0 HA LYS A 164 7.014 -5.662 -7.646 1.00 0.00 H new ATOM 0 HB2 LYS A 164 5.696 -6.471 -5.800 1.00 0.00 H new ATOM 0 HB3 LYS A 164 5.721 -4.719 -5.826 1.00 0.00 H new ATOM 0 HG2 LYS A 164 3.481 -5.317 -7.391 1.00 0.00 H new ATOM 0 HG3 LYS A 164 3.436 -6.571 -6.167 1.00 0.00 H new ATOM 0 HD2 LYS A 164 4.046 -4.300 -4.666 1.00 0.00 H new ATOM 0 HD3 LYS A 164 2.976 -3.656 -5.896 1.00 0.00 H new ATOM 0 HE2 LYS A 164 2.185 -6.228 -4.517 1.00 0.00 H new ATOM 0 HE3 LYS A 164 2.008 -4.725 -3.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 0.004 -5.265 -4.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 0.690 -3.836 -5.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 0.861 -5.292 -6.319 1.00 0.00 H new ATOM 512 N PRO A 165 6.572 -7.561 -9.114 1.00 0.00 N ATOM 513 CA PRO A 165 6.342 -8.761 -9.901 1.00 0.00 C ATOM 514 C PRO A 165 5.977 -9.944 -9.003 1.00 0.00 C ATOM 515 O PRO A 165 4.953 -10.593 -9.210 1.00 0.00 O ATOM 516 CB PRO A 165 7.634 -8.978 -10.674 1.00 0.00 C ATOM 517 CG PRO A 165 8.695 -8.169 -9.948 1.00 0.00 C ATOM 518 CD PRO A 165 7.986 -7.221 -8.993 1.00 0.00 C ATOM 0 HA PRO A 165 5.497 -8.662 -10.583 1.00 0.00 H new ATOM 0 HB2 PRO A 165 7.900 -10.035 -10.702 1.00 0.00 H new ATOM 0 HB3 PRO A 165 7.531 -8.648 -11.708 1.00 0.00 H new ATOM 0 HG2 PRO A 165 9.370 -8.828 -9.401 1.00 0.00 H new ATOM 0 HG3 PRO A 165 9.303 -7.610 -10.660 1.00 0.00 H new ATOM 0 HD2 PRO A 165 8.339 -7.353 -7.970 1.00 0.00 H new ATOM 0 HD3 PRO A 165 8.167 -6.180 -9.261 1.00 0.00 H new ATOM 526 N GLU A 166 6.836 -10.189 -8.023 1.00 0.00 N ATOM 527 CA GLU A 166 6.616 -11.283 -7.092 1.00 0.00 C ATOM 528 C GLU A 166 6.043 -10.753 -5.777 1.00 0.00 C ATOM 529 O GLU A 166 5.660 -9.587 -5.687 1.00 0.00 O ATOM 530 CB GLU A 166 7.909 -12.065 -6.851 1.00 0.00 C ATOM 531 CG GLU A 166 8.635 -12.344 -8.169 1.00 0.00 C ATOM 532 CD GLU A 166 8.656 -13.842 -8.476 1.00 0.00 C ATOM 533 OE1 GLU A 166 7.550 -14.406 -8.632 1.00 0.00 O ATOM 534 OE2 GLU A 166 9.777 -14.391 -8.549 1.00 0.00 O ATOM 0 H GLU A 166 7.685 -9.649 -7.854 1.00 0.00 H new ATOM 0 HA GLU A 166 5.891 -11.969 -7.531 1.00 0.00 H new ATOM 0 HB2 GLU A 166 8.561 -11.500 -6.185 1.00 0.00 H new ATOM 0 HB3 GLU A 166 7.681 -13.006 -6.351 1.00 0.00 H new ATOM 0 HG2 GLU A 166 8.141 -11.810 -8.981 1.00 0.00 H new ATOM 0 HG3 GLU A 166 9.656 -11.966 -8.113 1.00 0.00 H new ATOM 541 N GLU A 167 6.002 -11.634 -4.788 1.00 0.00 N ATOM 542 CA GLU A 167 5.482 -11.270 -3.481 1.00 0.00 C ATOM 543 C GLU A 167 6.631 -11.035 -2.499 1.00 0.00 C ATOM 544 O GLU A 167 6.535 -10.180 -1.618 1.00 0.00 O ATOM 545 CB GLU A 167 4.521 -12.338 -2.955 1.00 0.00 C ATOM 546 CG GLU A 167 5.143 -13.732 -3.059 1.00 0.00 C ATOM 547 CD GLU A 167 4.489 -14.544 -4.179 1.00 0.00 C ATOM 548 OE1 GLU A 167 4.872 -14.310 -5.346 1.00 0.00 O ATOM 549 OE2 GLU A 167 3.621 -15.377 -3.843 1.00 0.00 O ATOM 0 H GLU A 167 6.321 -12.600 -4.866 1.00 0.00 H new ATOM 0 HA GLU A 167 4.920 -10.341 -3.582 1.00 0.00 H new ATOM 0 HB2 GLU A 167 4.268 -12.125 -1.916 1.00 0.00 H new ATOM 0 HB3 GLU A 167 3.591 -12.307 -3.523 1.00 0.00 H new ATOM 0 HG2 GLU A 167 6.213 -13.643 -3.247 1.00 0.00 H new ATOM 0 HG3 GLU A 167 5.028 -14.257 -2.110 1.00 0.00 H new ATOM 556 N GLN A 168 7.692 -11.806 -2.683 1.00 0.00 N ATOM 557 CA GLN A 168 8.859 -11.692 -1.824 1.00 0.00 C ATOM 558 C GLN A 168 9.629 -10.410 -2.144 1.00 0.00 C ATOM 559 O GLN A 168 10.018 -9.673 -1.239 1.00 0.00 O ATOM 560 CB GLN A 168 9.760 -12.921 -1.957 1.00 0.00 C ATOM 561 CG GLN A 168 9.161 -14.122 -1.221 1.00 0.00 C ATOM 562 CD GLN A 168 10.233 -14.863 -0.418 1.00 0.00 C ATOM 563 OE1 GLN A 168 10.276 -14.814 0.800 1.00 0.00 O ATOM 564 NE2 GLN A 168 11.094 -15.547 -1.167 1.00 0.00 N ATOM 0 H GLN A 168 7.769 -12.513 -3.415 1.00 0.00 H new ATOM 0 HA GLN A 168 8.521 -11.641 -0.789 1.00 0.00 H new ATOM 0 HB2 GLN A 168 9.894 -13.166 -3.011 1.00 0.00 H new ATOM 0 HB3 GLN A 168 10.748 -12.698 -1.553 1.00 0.00 H new ATOM 0 HG2 GLN A 168 8.369 -13.785 -0.553 1.00 0.00 H new ATOM 0 HG3 GLN A 168 8.704 -14.803 -1.939 1.00 0.00 H new ATOM 0 HE21 GLN A 168 11.000 -15.545 -2.183 1.00 0.00 H new ATOM 0 HE22 GLN A 168 11.848 -16.073 -0.726 1.00 0.00 H new ATOM 573 N TRP A 169 9.828 -10.183 -3.434 1.00 0.00 N ATOM 574 CA TRP A 169 10.546 -9.002 -3.885 1.00 0.00 C ATOM 575 C TRP A 169 9.534 -8.049 -4.523 1.00 0.00 C ATOM 576 O TRP A 169 8.653 -8.480 -5.265 1.00 0.00 O ATOM 577 CB TRP A 169 11.688 -9.383 -4.829 1.00 0.00 C ATOM 578 CG TRP A 169 12.982 -9.773 -4.114 1.00 0.00 C ATOM 579 CD1 TRP A 169 13.364 -10.992 -3.706 1.00 0.00 C ATOM 580 CD2 TRP A 169 14.058 -8.888 -3.736 1.00 0.00 C ATOM 581 NE1 TRP A 169 14.602 -10.956 -3.096 1.00 0.00 N ATOM 582 CE2 TRP A 169 15.036 -9.636 -3.114 1.00 0.00 C ATOM 583 CE3 TRP A 169 14.198 -7.500 -3.914 1.00 0.00 C ATOM 584 CZ2 TRP A 169 16.225 -9.085 -2.620 1.00 0.00 C ATOM 585 CZ3 TRP A 169 15.391 -6.965 -3.415 1.00 0.00 C ATOM 586 CH2 TRP A 169 16.387 -7.704 -2.787 1.00 0.00 C ATOM 0 H TRP A 169 9.505 -10.797 -4.182 1.00 0.00 H new ATOM 0 HA TRP A 169 11.020 -8.494 -3.045 1.00 0.00 H new ATOM 0 HB2 TRP A 169 11.366 -10.215 -5.455 1.00 0.00 H new ATOM 0 HB3 TRP A 169 11.891 -8.544 -5.494 1.00 0.00 H new ATOM 0 HD1 TRP A 169 12.777 -11.889 -3.838 1.00 0.00 H new ATOM 0 HE1 TRP A 169 15.105 -11.752 -2.704 1.00 0.00 H new ATOM 0 HE3 TRP A 169 13.445 -6.895 -4.397 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 16.976 -9.692 -2.137 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 15.549 -5.902 -3.526 1.00 0.00 H new ATOM 0 HH2 TRP A 169 17.281 -7.215 -2.430 1.00 0.00 H new ATOM 597 N TRP A 170 9.695 -6.771 -4.212 1.00 0.00 N ATOM 598 CA TRP A 170 8.806 -5.753 -4.747 1.00 0.00 C ATOM 599 C TRP A 170 9.638 -4.809 -5.616 1.00 0.00 C ATOM 600 O TRP A 170 10.857 -4.952 -5.704 1.00 0.00 O ATOM 601 CB TRP A 170 8.062 -5.031 -3.622 1.00 0.00 C ATOM 602 CG TRP A 170 6.832 -5.781 -3.107 1.00 0.00 C ATOM 603 CD1 TRP A 170 6.342 -6.953 -3.533 1.00 0.00 C ATOM 604 CD2 TRP A 170 5.950 -5.360 -2.045 1.00 0.00 C ATOM 605 NE1 TRP A 170 5.214 -7.317 -2.827 1.00 0.00 N ATOM 606 CE2 TRP A 170 4.969 -6.318 -1.892 1.00 0.00 C ATOM 607 CE3 TRP A 170 5.982 -4.209 -1.238 1.00 0.00 C ATOM 608 CZ2 TRP A 170 3.945 -6.222 -0.942 1.00 0.00 C ATOM 609 CZ3 TRP A 170 4.952 -4.128 -0.294 1.00 0.00 C ATOM 610 CH2 TRP A 170 3.956 -5.083 -0.128 1.00 0.00 C ATOM 0 H TRP A 170 10.427 -6.417 -3.597 1.00 0.00 H new ATOM 0 HA TRP A 170 8.031 -6.203 -5.367 1.00 0.00 H new ATOM 0 HB2 TRP A 170 8.749 -4.868 -2.792 1.00 0.00 H new ATOM 0 HB3 TRP A 170 7.753 -4.048 -3.977 1.00 0.00 H new ATOM 0 HD1 TRP A 170 6.776 -7.539 -4.329 1.00 0.00 H new ATOM 0 HE1 TRP A 170 4.662 -8.163 -2.966 1.00 0.00 H new ATOM 0 HE3 TRP A 170 6.741 -3.448 -1.339 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 3.188 -6.985 -0.843 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 4.930 -3.262 0.351 1.00 0.00 H new ATOM 0 HH2 TRP A 170 3.194 -4.947 0.625 1.00 0.00 H new ATOM 621 N ASN A 171 8.947 -3.863 -6.237 1.00 0.00 N ATOM 622 CA ASN A 171 9.607 -2.896 -7.096 1.00 0.00 C ATOM 623 C ASN A 171 9.268 -1.482 -6.619 1.00 0.00 C ATOM 624 O ASN A 171 8.204 -0.954 -6.938 1.00 0.00 O ATOM 625 CB ASN A 171 9.134 -3.032 -8.545 1.00 0.00 C ATOM 626 CG ASN A 171 10.058 -2.273 -9.498 1.00 0.00 C ATOM 627 OD1 ASN A 171 10.559 -1.202 -9.196 1.00 0.00 O ATOM 628 ND2 ASN A 171 10.256 -2.884 -10.662 1.00 0.00 N ATOM 0 H ASN A 171 7.936 -3.747 -6.162 1.00 0.00 H new ATOM 0 HA ASN A 171 10.680 -3.080 -7.048 1.00 0.00 H new ATOM 0 HB2 ASN A 171 9.104 -4.085 -8.824 1.00 0.00 H new ATOM 0 HB3 ASN A 171 8.118 -2.649 -8.637 1.00 0.00 H new ATOM 0 HD21 ASN A 171 10.858 -2.457 -11.366 1.00 0.00 H new ATOM 0 HD22 ASN A 171 9.806 -3.780 -10.851 1.00 0.00 H new ATOM 635 N ALA A 172 10.193 -0.909 -5.863 1.00 0.00 N ATOM 636 CA ALA A 172 10.005 0.433 -5.339 1.00 0.00 C ATOM 637 C ALA A 172 11.059 1.364 -5.944 1.00 0.00 C ATOM 638 O ALA A 172 12.048 0.902 -6.511 1.00 0.00 O ATOM 639 CB ALA A 172 10.067 0.398 -3.811 1.00 0.00 C ATOM 0 H ALA A 172 11.075 -1.350 -5.601 1.00 0.00 H new ATOM 0 HA ALA A 172 9.024 0.820 -5.617 1.00 0.00 H new ATOM 0 HB1 ALA A 172 9.926 1.405 -3.418 1.00 0.00 H new ATOM 0 HB2 ALA A 172 9.281 -0.254 -3.430 1.00 0.00 H new ATOM 0 HB3 ALA A 172 11.038 0.018 -3.495 1.00 0.00 H new ATOM 645 N GLU A 173 10.810 2.657 -5.803 1.00 0.00 N ATOM 646 CA GLU A 173 11.724 3.657 -6.330 1.00 0.00 C ATOM 647 C GLU A 173 12.503 4.316 -5.190 1.00 0.00 C ATOM 648 O GLU A 173 11.936 4.618 -4.141 1.00 0.00 O ATOM 649 CB GLU A 173 10.976 4.702 -7.159 1.00 0.00 C ATOM 650 CG GLU A 173 11.183 4.466 -8.656 1.00 0.00 C ATOM 651 CD GLU A 173 10.188 5.282 -9.483 1.00 0.00 C ATOM 652 OE1 GLU A 173 10.396 6.512 -9.569 1.00 0.00 O ATOM 653 OE2 GLU A 173 9.242 4.657 -10.010 1.00 0.00 O ATOM 0 H GLU A 173 9.989 3.036 -5.332 1.00 0.00 H new ATOM 0 HA GLU A 173 12.435 3.160 -6.990 1.00 0.00 H new ATOM 0 HB2 GLU A 173 9.912 4.663 -6.925 1.00 0.00 H new ATOM 0 HB3 GLU A 173 11.325 5.700 -6.893 1.00 0.00 H new ATOM 0 HG2 GLU A 173 12.201 4.739 -8.933 1.00 0.00 H new ATOM 0 HG3 GLU A 173 11.064 3.406 -8.880 1.00 0.00 H new ATOM 660 N ASP A 174 13.789 4.519 -5.434 1.00 0.00 N ATOM 661 CA ASP A 174 14.651 5.136 -4.441 1.00 0.00 C ATOM 662 C ASP A 174 14.465 6.655 -4.484 1.00 0.00 C ATOM 663 O ASP A 174 13.956 7.193 -5.465 1.00 0.00 O ATOM 664 CB ASP A 174 16.124 4.833 -4.724 1.00 0.00 C ATOM 665 CG ASP A 174 17.011 4.719 -3.482 1.00 0.00 C ATOM 666 OD1 ASP A 174 16.490 5.011 -2.384 1.00 0.00 O ATOM 667 OD2 ASP A 174 18.190 4.344 -3.660 1.00 0.00 O ATOM 0 H ASP A 174 14.255 4.267 -6.306 1.00 0.00 H new ATOM 0 HA ASP A 174 14.381 4.734 -3.465 1.00 0.00 H new ATOM 0 HB2 ASP A 174 16.186 3.900 -5.283 1.00 0.00 H new ATOM 0 HB3 ASP A 174 16.524 5.617 -5.367 1.00 0.00 H new ATOM 672 N SER A 175 14.887 7.301 -3.407 1.00 0.00 N ATOM 673 CA SER A 175 14.774 8.746 -3.309 1.00 0.00 C ATOM 674 C SER A 175 15.368 9.404 -4.557 1.00 0.00 C ATOM 675 O SER A 175 15.045 10.547 -4.873 1.00 0.00 O ATOM 676 CB SER A 175 15.468 9.270 -2.051 1.00 0.00 C ATOM 677 OG SER A 175 15.429 10.692 -1.971 1.00 0.00 O ATOM 0 H SER A 175 15.308 6.850 -2.595 1.00 0.00 H new ATOM 0 HA SER A 175 13.717 9.001 -3.240 1.00 0.00 H new ATOM 0 HB2 SER A 175 14.989 8.844 -1.169 1.00 0.00 H new ATOM 0 HB3 SER A 175 16.505 8.935 -2.043 1.00 0.00 H new ATOM 0 HG SER A 175 15.881 10.986 -1.153 1.00 0.00 H new ATOM 683 N GLU A 176 16.227 8.652 -5.230 1.00 0.00 N ATOM 684 CA GLU A 176 16.868 9.147 -6.436 1.00 0.00 C ATOM 685 C GLU A 176 15.907 9.063 -7.623 1.00 0.00 C ATOM 686 O GLU A 176 16.057 9.793 -8.601 1.00 0.00 O ATOM 687 CB GLU A 176 18.161 8.381 -6.722 1.00 0.00 C ATOM 688 CG GLU A 176 19.142 8.505 -5.555 1.00 0.00 C ATOM 689 CD GLU A 176 19.566 9.960 -5.346 1.00 0.00 C ATOM 690 OE1 GLU A 176 19.620 10.687 -6.362 1.00 0.00 O ATOM 691 OE2 GLU A 176 19.826 10.314 -4.176 1.00 0.00 O ATOM 0 H GLU A 176 16.494 7.704 -4.963 1.00 0.00 H new ATOM 0 HA GLU A 176 17.130 10.194 -6.281 1.00 0.00 H new ATOM 0 HB2 GLU A 176 17.933 7.330 -6.900 1.00 0.00 H new ATOM 0 HB3 GLU A 176 18.622 8.766 -7.632 1.00 0.00 H new ATOM 0 HG2 GLU A 176 18.680 8.123 -4.645 1.00 0.00 H new ATOM 0 HG3 GLU A 176 20.021 7.891 -5.748 1.00 0.00 H new ATOM 698 N GLY A 177 14.940 8.166 -7.497 1.00 0.00 N ATOM 699 CA GLY A 177 13.954 7.977 -8.548 1.00 0.00 C ATOM 700 C GLY A 177 14.327 6.794 -9.443 1.00 0.00 C ATOM 701 O GLY A 177 14.032 6.797 -10.637 1.00 0.00 O ATOM 0 H GLY A 177 14.818 7.562 -6.684 1.00 0.00 H new ATOM 0 HA2 GLY A 177 12.973 7.807 -8.105 1.00 0.00 H new ATOM 0 HA3 GLY A 177 13.880 8.883 -9.149 1.00 0.00 H new ATOM 705 N LYS A 178 14.971 5.810 -8.832 1.00 0.00 N ATOM 706 CA LYS A 178 15.388 4.623 -9.560 1.00 0.00 C ATOM 707 C LYS A 178 14.437 3.470 -9.235 1.00 0.00 C ATOM 708 O LYS A 178 14.213 3.155 -8.067 1.00 0.00 O ATOM 709 CB LYS A 178 16.857 4.307 -9.273 1.00 0.00 C ATOM 710 CG LYS A 178 17.178 4.495 -7.789 1.00 0.00 C ATOM 711 CD LYS A 178 18.310 3.563 -7.350 1.00 0.00 C ATOM 712 CE LYS A 178 19.437 4.348 -6.676 1.00 0.00 C ATOM 713 NZ LYS A 178 20.683 4.250 -7.470 1.00 0.00 N ATOM 0 H LYS A 178 15.214 5.810 -7.841 1.00 0.00 H new ATOM 0 HA LYS A 178 15.326 4.795 -10.635 1.00 0.00 H new ATOM 0 HB2 LYS A 178 17.077 3.281 -9.569 1.00 0.00 H new ATOM 0 HB3 LYS A 178 17.496 4.956 -9.872 1.00 0.00 H new ATOM 0 HG2 LYS A 178 17.462 5.531 -7.603 1.00 0.00 H new ATOM 0 HG3 LYS A 178 16.287 4.297 -7.193 1.00 0.00 H new ATOM 0 HD2 LYS A 178 17.922 2.813 -6.661 1.00 0.00 H new ATOM 0 HD3 LYS A 178 18.702 3.028 -8.215 1.00 0.00 H new ATOM 0 HE2 LYS A 178 19.147 5.393 -6.570 1.00 0.00 H new ATOM 0 HE3 LYS A 178 19.607 3.961 -5.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 21.438 4.788 -6.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 20.967 3.253 -7.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 20.521 4.640 -8.420 1.00 0.00 H new ATOM 727 N ARG A 179 13.900 2.873 -10.289 1.00 0.00 N ATOM 728 CA ARG A 179 12.977 1.762 -10.131 1.00 0.00 C ATOM 729 C ARG A 179 13.747 0.444 -10.017 1.00 0.00 C ATOM 730 O ARG A 179 14.358 -0.007 -10.984 1.00 0.00 O ATOM 731 CB ARG A 179 12.007 1.678 -11.311 1.00 0.00 C ATOM 732 CG ARG A 179 11.506 3.068 -11.708 1.00 0.00 C ATOM 733 CD ARG A 179 10.601 2.993 -12.939 1.00 0.00 C ATOM 734 NE ARG A 179 9.611 1.905 -12.774 1.00 0.00 N ATOM 735 CZ ARG A 179 9.812 0.640 -13.170 1.00 0.00 C ATOM 736 NH1 ARG A 179 10.967 0.297 -13.756 1.00 0.00 N ATOM 737 NH2 ARG A 179 8.858 -0.281 -12.980 1.00 0.00 N ATOM 0 H ARG A 179 14.087 3.138 -11.256 1.00 0.00 H new ATOM 0 HA ARG A 179 12.406 1.933 -9.219 1.00 0.00 H new ATOM 0 HB2 ARG A 179 12.503 1.209 -12.161 1.00 0.00 H new ATOM 0 HB3 ARG A 179 11.161 1.044 -11.046 1.00 0.00 H new ATOM 0 HG2 ARG A 179 10.959 3.513 -10.877 1.00 0.00 H new ATOM 0 HG3 ARG A 179 12.355 3.719 -11.915 1.00 0.00 H new ATOM 0 HD2 ARG A 179 10.088 3.944 -13.082 1.00 0.00 H new ATOM 0 HD3 ARG A 179 11.201 2.817 -13.832 1.00 0.00 H new ATOM 0 HE ARG A 179 8.720 2.132 -12.331 1.00 0.00 H new ATOM 0 HH11 ARG A 179 11.693 0.998 -13.901 1.00 0.00 H new ATOM 0 HH12 ARG A 179 11.120 -0.665 -14.057 1.00 0.00 H new ATOM 0 HH21 ARG A 179 7.979 -0.020 -12.534 1.00 0.00 H new ATOM 0 HH22 ARG A 179 9.011 -1.243 -13.281 1.00 0.00 H new ATOM 751 N GLY A 180 13.692 -0.136 -8.827 1.00 0.00 N ATOM 752 CA GLY A 180 14.376 -1.392 -8.574 1.00 0.00 C ATOM 753 C GLY A 180 13.571 -2.272 -7.615 1.00 0.00 C ATOM 754 O GLY A 180 12.596 -1.817 -7.021 1.00 0.00 O ATOM 0 H GLY A 180 13.184 0.241 -8.027 1.00 0.00 H new ATOM 0 HA2 GLY A 180 14.532 -1.921 -9.514 1.00 0.00 H new ATOM 0 HA3 GLY A 180 15.361 -1.195 -8.152 1.00 0.00 H new ATOM 758 N MET A 181 14.011 -3.516 -7.494 1.00 0.00 N ATOM 759 CA MET A 181 13.344 -4.463 -6.617 1.00 0.00 C ATOM 760 C MET A 181 13.900 -4.379 -5.195 1.00 0.00 C ATOM 761 O MET A 181 15.114 -4.364 -4.998 1.00 0.00 O ATOM 762 CB MET A 181 13.536 -5.882 -7.157 1.00 0.00 C ATOM 763 CG MET A 181 12.684 -6.113 -8.407 1.00 0.00 C ATOM 764 SD MET A 181 11.904 -7.717 -8.326 1.00 0.00 S ATOM 765 CE MET A 181 13.312 -8.725 -7.891 1.00 0.00 C ATOM 0 H MET A 181 14.821 -3.890 -7.989 1.00 0.00 H new ATOM 0 HA MET A 181 12.283 -4.216 -6.587 1.00 0.00 H new ATOM 0 HB2 MET A 181 14.587 -6.046 -7.394 1.00 0.00 H new ATOM 0 HB3 MET A 181 13.266 -6.607 -6.389 1.00 0.00 H new ATOM 0 HG2 MET A 181 11.926 -5.334 -8.489 1.00 0.00 H new ATOM 0 HG3 MET A 181 13.307 -6.047 -9.299 1.00 0.00 H new ATOM 0 HE1 MET A 181 13.119 -9.760 -8.173 1.00 0.00 H new ATOM 0 HE2 MET A 181 14.195 -8.364 -8.418 1.00 0.00 H new ATOM 0 HE3 MET A 181 13.482 -8.667 -6.816 1.00 0.00 H new ATOM 775 N ILE A 182 12.984 -4.326 -4.238 1.00 0.00 N ATOM 776 CA ILE A 182 13.368 -4.244 -2.840 1.00 0.00 C ATOM 777 C ILE A 182 12.643 -5.337 -2.051 1.00 0.00 C ATOM 778 O ILE A 182 11.546 -5.750 -2.420 1.00 0.00 O ATOM 779 CB ILE A 182 13.125 -2.833 -2.299 1.00 0.00 C ATOM 780 CG1 ILE A 182 14.281 -2.382 -1.405 1.00 0.00 C ATOM 781 CG2 ILE A 182 11.777 -2.746 -1.580 1.00 0.00 C ATOM 782 CD1 ILE A 182 14.715 -0.956 -1.750 1.00 0.00 C ATOM 0 H ILE A 182 11.978 -4.338 -4.404 1.00 0.00 H new ATOM 0 HA ILE A 182 14.437 -4.424 -2.728 1.00 0.00 H new ATOM 0 HB ILE A 182 13.084 -2.146 -3.144 1.00 0.00 H new ATOM 0 HG12 ILE A 182 13.977 -2.431 -0.359 1.00 0.00 H new ATOM 0 HG13 ILE A 182 15.125 -3.062 -1.524 1.00 0.00 H new ATOM 0 HG21 ILE A 182 11.629 -1.733 -1.205 1.00 0.00 H new ATOM 0 HG22 ILE A 182 10.976 -2.996 -2.276 1.00 0.00 H new ATOM 0 HG23 ILE A 182 11.764 -3.447 -0.745 1.00 0.00 H new ATOM 0 HD11 ILE A 182 15.538 -0.659 -1.100 1.00 0.00 H new ATOM 0 HD12 ILE A 182 15.041 -0.916 -2.789 1.00 0.00 H new ATOM 0 HD13 ILE A 182 13.876 -0.275 -1.606 1.00 0.00 H new ATOM 794 N PRO A 183 13.305 -5.787 -0.951 1.00 0.00 N ATOM 795 CA PRO A 183 12.737 -6.825 -0.108 1.00 0.00 C ATOM 796 C PRO A 183 11.605 -6.268 0.759 1.00 0.00 C ATOM 797 O PRO A 183 11.691 -5.146 1.254 1.00 0.00 O ATOM 798 CB PRO A 183 13.905 -7.352 0.710 1.00 0.00 C ATOM 799 CG PRO A 183 14.983 -6.284 0.633 1.00 0.00 C ATOM 800 CD PRO A 183 14.608 -5.322 -0.483 1.00 0.00 C ATOM 0 HA PRO A 183 12.276 -7.628 -0.683 1.00 0.00 H new ATOM 0 HB2 PRO A 183 13.608 -7.533 1.743 1.00 0.00 H new ATOM 0 HB3 PRO A 183 14.265 -8.300 0.311 1.00 0.00 H new ATOM 0 HG2 PRO A 183 15.064 -5.754 1.582 1.00 0.00 H new ATOM 0 HG3 PRO A 183 15.955 -6.736 0.436 1.00 0.00 H new ATOM 0 HD2 PRO A 183 14.555 -4.296 -0.120 1.00 0.00 H new ATOM 0 HD3 PRO A 183 15.346 -5.339 -1.285 1.00 0.00 H new ATOM 808 N VAL A 184 10.568 -7.079 0.914 1.00 0.00 N ATOM 809 CA VAL A 184 9.420 -6.681 1.711 1.00 0.00 C ATOM 810 C VAL A 184 9.733 -6.899 3.193 1.00 0.00 C ATOM 811 O VAL A 184 9.258 -6.153 4.047 1.00 0.00 O ATOM 812 CB VAL A 184 8.173 -7.436 1.247 1.00 0.00 C ATOM 813 CG1 VAL A 184 7.001 -7.198 2.200 1.00 0.00 C ATOM 814 CG2 VAL A 184 7.802 -7.052 -0.187 1.00 0.00 C ATOM 0 H VAL A 184 10.499 -8.009 0.501 1.00 0.00 H new ATOM 0 HA VAL A 184 9.211 -5.620 1.575 1.00 0.00 H new ATOM 0 HB VAL A 184 8.402 -8.502 1.260 1.00 0.00 H new ATOM 0 HG11 VAL A 184 6.128 -7.746 1.847 1.00 0.00 H new ATOM 0 HG12 VAL A 184 7.268 -7.545 3.198 1.00 0.00 H new ATOM 0 HG13 VAL A 184 6.771 -6.133 2.235 1.00 0.00 H new ATOM 0 HG21 VAL A 184 6.912 -7.603 -0.493 1.00 0.00 H new ATOM 0 HG22 VAL A 184 7.601 -5.982 -0.237 1.00 0.00 H new ATOM 0 HG23 VAL A 184 8.628 -7.298 -0.855 1.00 0.00 H new ATOM 824 N PRO A 185 10.553 -7.951 3.458 1.00 0.00 N ATOM 825 CA PRO A 185 10.936 -8.276 4.821 1.00 0.00 C ATOM 826 C PRO A 185 11.977 -7.289 5.349 1.00 0.00 C ATOM 827 O PRO A 185 11.945 -6.914 6.520 1.00 0.00 O ATOM 828 CB PRO A 185 11.452 -9.705 4.756 1.00 0.00 C ATOM 829 CG PRO A 185 11.773 -9.964 3.293 1.00 0.00 C ATOM 830 CD PRO A 185 11.134 -8.856 2.471 1.00 0.00 C ATOM 0 HA PRO A 185 10.104 -8.199 5.520 1.00 0.00 H new ATOM 0 HB2 PRO A 185 12.338 -9.829 5.379 1.00 0.00 H new ATOM 0 HB3 PRO A 185 10.704 -10.408 5.122 1.00 0.00 H new ATOM 0 HG2 PRO A 185 12.852 -9.982 3.136 1.00 0.00 H new ATOM 0 HG3 PRO A 185 11.390 -10.937 2.985 1.00 0.00 H new ATOM 0 HD2 PRO A 185 11.872 -8.346 1.852 1.00 0.00 H new ATOM 0 HD3 PRO A 185 10.372 -9.251 1.799 1.00 0.00 H new ATOM 838 N TYR A 186 12.877 -6.894 4.459 1.00 0.00 N ATOM 839 CA TYR A 186 13.926 -5.956 4.820 1.00 0.00 C ATOM 840 C TYR A 186 13.452 -4.512 4.652 1.00 0.00 C ATOM 841 O TYR A 186 14.266 -3.601 4.502 1.00 0.00 O ATOM 842 CB TYR A 186 15.079 -6.219 3.850 1.00 0.00 C ATOM 843 CG TYR A 186 16.189 -7.099 4.426 1.00 0.00 C ATOM 844 CD1 TYR A 186 15.882 -8.327 4.977 1.00 0.00 C ATOM 845 CD2 TYR A 186 17.500 -6.665 4.396 1.00 0.00 C ATOM 846 CE1 TYR A 186 16.928 -9.155 5.519 1.00 0.00 C ATOM 847 CE2 TYR A 186 18.545 -7.493 4.939 1.00 0.00 C ATOM 848 CZ TYR A 186 18.208 -8.697 5.473 1.00 0.00 C ATOM 849 OH TYR A 186 19.195 -9.479 5.987 1.00 0.00 O ATOM 0 H TYR A 186 12.901 -7.207 3.489 1.00 0.00 H new ATOM 0 HA TYR A 186 14.218 -6.089 5.862 1.00 0.00 H new ATOM 0 HB2 TYR A 186 14.683 -6.693 2.952 1.00 0.00 H new ATOM 0 HB3 TYR A 186 15.508 -5.265 3.545 1.00 0.00 H new ATOM 0 HD1 TYR A 186 14.857 -8.667 5.002 1.00 0.00 H new ATOM 0 HD2 TYR A 186 17.741 -5.704 3.965 1.00 0.00 H new ATOM 0 HE1 TYR A 186 16.701 -10.118 5.952 1.00 0.00 H new ATOM 0 HE2 TYR A 186 19.574 -7.165 4.923 1.00 0.00 H new ATOM 0 HH TYR A 186 20.058 -9.026 5.885 1.00 0.00 H new ATOM 859 N VAL A 187 12.138 -4.346 4.682 1.00 0.00 N ATOM 860 CA VAL A 187 11.547 -3.027 4.535 1.00 0.00 C ATOM 861 C VAL A 187 10.195 -2.995 5.251 1.00 0.00 C ATOM 862 O VAL A 187 9.639 -4.042 5.581 1.00 0.00 O ATOM 863 CB VAL A 187 11.445 -2.662 3.052 1.00 0.00 C ATOM 864 CG1 VAL A 187 12.761 -2.947 2.326 1.00 0.00 C ATOM 865 CG2 VAL A 187 10.281 -3.396 2.385 1.00 0.00 C ATOM 0 H VAL A 187 11.466 -5.103 4.806 1.00 0.00 H new ATOM 0 HA VAL A 187 12.180 -2.272 5.001 1.00 0.00 H new ATOM 0 HB VAL A 187 11.249 -1.592 2.983 1.00 0.00 H new ATOM 0 HG11 VAL A 187 12.662 -2.679 1.274 1.00 0.00 H new ATOM 0 HG12 VAL A 187 13.560 -2.358 2.777 1.00 0.00 H new ATOM 0 HG13 VAL A 187 13.000 -4.007 2.409 1.00 0.00 H new ATOM 0 HG21 VAL A 187 10.231 -3.119 1.332 1.00 0.00 H new ATOM 0 HG22 VAL A 187 10.433 -4.472 2.470 1.00 0.00 H new ATOM 0 HG23 VAL A 187 9.348 -3.121 2.877 1.00 0.00 H new ATOM 875 N GLU A 188 9.706 -1.785 5.473 1.00 0.00 N ATOM 876 CA GLU A 188 8.430 -1.603 6.144 1.00 0.00 C ATOM 877 C GLU A 188 7.498 -0.742 5.290 1.00 0.00 C ATOM 878 O GLU A 188 7.716 -0.587 4.090 1.00 0.00 O ATOM 879 CB GLU A 188 8.624 -0.990 7.532 1.00 0.00 C ATOM 880 CG GLU A 188 9.892 -1.529 8.197 1.00 0.00 C ATOM 881 CD GLU A 188 9.588 -2.083 9.591 1.00 0.00 C ATOM 882 OE1 GLU A 188 9.331 -1.250 10.488 1.00 0.00 O ATOM 883 OE2 GLU A 188 9.620 -3.324 9.728 1.00 0.00 O ATOM 0 H GLU A 188 10.171 -0.919 5.200 1.00 0.00 H new ATOM 0 HA GLU A 188 7.968 -2.582 6.276 1.00 0.00 H new ATOM 0 HB2 GLU A 188 8.686 0.095 7.449 1.00 0.00 H new ATOM 0 HB3 GLU A 188 7.759 -1.213 8.156 1.00 0.00 H new ATOM 0 HG2 GLU A 188 10.327 -2.313 7.577 1.00 0.00 H new ATOM 0 HG3 GLU A 188 10.634 -0.734 8.272 1.00 0.00 H new ATOM 890 N LYS A 189 6.478 -0.204 5.942 1.00 0.00 N ATOM 891 CA LYS A 189 5.511 0.638 5.258 1.00 0.00 C ATOM 892 C LYS A 189 5.383 1.968 6.002 1.00 0.00 C ATOM 893 O LYS A 189 5.323 1.993 7.231 1.00 0.00 O ATOM 894 CB LYS A 189 4.184 -0.103 5.085 1.00 0.00 C ATOM 895 CG LYS A 189 4.024 -0.616 3.653 1.00 0.00 C ATOM 896 CD LYS A 189 4.705 -1.975 3.479 1.00 0.00 C ATOM 897 CE LYS A 189 3.908 -2.869 2.525 1.00 0.00 C ATOM 898 NZ LYS A 189 2.642 -3.302 3.156 1.00 0.00 N ATOM 0 H LYS A 189 6.300 -0.335 6.938 1.00 0.00 H new ATOM 0 HA LYS A 189 5.853 0.870 4.249 1.00 0.00 H new ATOM 0 HB2 LYS A 189 4.137 -0.940 5.782 1.00 0.00 H new ATOM 0 HB3 LYS A 189 3.357 0.563 5.331 1.00 0.00 H new ATOM 0 HG2 LYS A 189 2.965 -0.702 3.410 1.00 0.00 H new ATOM 0 HG3 LYS A 189 4.454 0.102 2.955 1.00 0.00 H new ATOM 0 HD2 LYS A 189 5.714 -1.833 3.093 1.00 0.00 H new ATOM 0 HD3 LYS A 189 4.800 -2.465 4.448 1.00 0.00 H new ATOM 0 HE2 LYS A 189 3.695 -2.328 1.603 1.00 0.00 H new ATOM 0 HE3 LYS A 189 4.502 -3.741 2.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 2.309 -4.176 2.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 2.801 -3.477 4.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 1.925 -2.558 3.042 1.00 0.00 H new ATOM 912 N TYR A 190 5.342 3.042 5.226 1.00 0.00 N ATOM 913 CA TYR A 190 5.221 4.372 5.798 1.00 0.00 C ATOM 914 C TYR A 190 3.840 4.577 6.423 1.00 0.00 C ATOM 915 O TYR A 190 3.732 4.978 7.581 1.00 0.00 O ATOM 916 CB TYR A 190 5.389 5.349 4.631 1.00 0.00 C ATOM 917 CG TYR A 190 4.696 6.696 4.842 1.00 0.00 C ATOM 918 CD1 TYR A 190 5.305 7.673 5.603 1.00 0.00 C ATOM 919 CD2 TYR A 190 3.462 6.934 4.272 1.00 0.00 C ATOM 920 CE1 TYR A 190 4.652 8.941 5.802 1.00 0.00 C ATOM 921 CE2 TYR A 190 2.809 8.202 4.471 1.00 0.00 C ATOM 922 CZ TYR A 190 3.437 9.143 5.226 1.00 0.00 C ATOM 923 OH TYR A 190 2.820 10.341 5.413 1.00 0.00 O ATOM 0 H TYR A 190 5.390 3.018 4.207 1.00 0.00 H new ATOM 0 HA TYR A 190 5.965 4.522 6.581 1.00 0.00 H new ATOM 0 HB2 TYR A 190 6.452 5.521 4.465 1.00 0.00 H new ATOM 0 HB3 TYR A 190 4.996 4.888 3.725 1.00 0.00 H new ATOM 0 HD1 TYR A 190 6.271 7.487 6.049 1.00 0.00 H new ATOM 0 HD2 TYR A 190 2.986 6.169 3.677 1.00 0.00 H new ATOM 0 HE1 TYR A 190 5.117 9.714 6.396 1.00 0.00 H new ATOM 0 HE2 TYR A 190 1.843 8.401 4.031 1.00 0.00 H new ATOM 0 HH TYR A 190 1.960 10.343 4.943 1.00 0.00 H new ATOM 933 N GLY A 191 2.818 4.292 5.630 1.00 0.00 N ATOM 934 CA GLY A 191 1.448 4.439 6.091 1.00 0.00 C ATOM 935 C GLY A 191 1.026 5.910 6.094 1.00 0.00 C ATOM 936 O GLY A 191 1.056 6.566 7.133 1.00 0.00 O ATOM 0 H GLY A 191 2.911 3.960 4.670 1.00 0.00 H new ATOM 0 HA2 GLY A 191 0.780 3.867 5.447 1.00 0.00 H new ATOM 0 HA3 GLY A 191 1.352 4.027 7.096 1.00 0.00 H new TER 940 GLY A 191