USER MOD reduce.3.24.130724 H: found=0, std=0, add=447, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 448 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 171 ASN : amide:sc= -0.0114 X(o=-0.73,f=-0.78) USER MOD Set 1.2: A 181 MET CE :methyl 175:sc= -0.722 (180deg=-0.743) USER MOD Single : A 135 CYS SG : rot 180:sc= 0 USER MOD Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 146 ASN : amide:sc= -1.5 K(o=-1.5,f=-2.1) 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= -2.23 K(o=-2.2,f=-6!) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.0402) USER MOD Single : A 186 TYR OH : rot 180:sc= 0 USER MOD Single : A 189 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 135 1.283 0.398 -0.366 1.00 0.00 N ATOM 2 CA CYS A 135 2.268 0.322 -1.431 1.00 0.00 C ATOM 3 C CYS A 135 2.194 -1.072 -2.056 1.00 0.00 C ATOM 4 O CYS A 135 2.985 -1.403 -2.938 1.00 0.00 O ATOM 5 CB CYS A 135 3.675 0.647 -0.925 1.00 0.00 C ATOM 6 SG CYS A 135 3.777 2.410 -0.446 1.00 0.00 S ATOM 0 HA CYS A 135 2.044 1.071 -2.190 1.00 0.00 H new ATOM 0 HB2 CYS A 135 3.918 0.015 -0.071 1.00 0.00 H new ATOM 0 HB3 CYS A 135 4.409 0.430 -1.701 1.00 0.00 H new ATOM 0 HG CYS A 135 4.975 2.674 -0.016 1.00 0.00 H new ATOM 12 N TYR A 136 1.238 -1.852 -1.574 1.00 0.00 N ATOM 13 CA TYR A 136 1.051 -3.204 -2.074 1.00 0.00 C ATOM 14 C TYR A 136 -0.411 -3.452 -2.447 1.00 0.00 C ATOM 15 O TYR A 136 -1.260 -2.581 -2.262 1.00 0.00 O ATOM 16 CB TYR A 136 1.438 -4.136 -0.924 1.00 0.00 C ATOM 17 CG TYR A 136 2.755 -3.767 -0.240 1.00 0.00 C ATOM 18 CD1 TYR A 136 2.777 -2.787 0.732 1.00 0.00 C ATOM 19 CD2 TYR A 136 3.921 -4.415 -0.593 1.00 0.00 C ATOM 20 CE1 TYR A 136 4.017 -2.440 1.377 1.00 0.00 C ATOM 21 CE2 TYR A 136 5.161 -4.067 0.051 1.00 0.00 C ATOM 22 CZ TYR A 136 5.147 -3.097 1.004 1.00 0.00 C ATOM 23 OH TYR A 136 6.319 -2.769 1.614 1.00 0.00 O ATOM 0 H TYR A 136 0.584 -1.574 -0.842 1.00 0.00 H new ATOM 0 HA TYR A 136 1.653 -3.370 -2.967 1.00 0.00 H new ATOM 0 HB2 TYR A 136 0.641 -4.130 -0.181 1.00 0.00 H new ATOM 0 HB3 TYR A 136 1.511 -5.155 -1.305 1.00 0.00 H new ATOM 0 HD1 TYR A 136 1.864 -2.280 1.009 1.00 0.00 H new ATOM 0 HD2 TYR A 136 3.904 -5.183 -1.352 1.00 0.00 H new ATOM 0 HE1 TYR A 136 4.048 -1.676 2.139 1.00 0.00 H new ATOM 0 HE2 TYR A 136 6.081 -4.565 -0.217 1.00 0.00 H new ATOM 0 HH TYR A 136 7.043 -3.319 1.249 1.00 0.00 H new ATOM 33 N VAL A 137 -0.663 -4.645 -2.966 1.00 0.00 N ATOM 34 CA VAL A 137 -2.008 -5.019 -3.367 1.00 0.00 C ATOM 35 C VAL A 137 -2.182 -6.530 -3.204 1.00 0.00 C ATOM 36 O VAL A 137 -1.205 -7.256 -3.024 1.00 0.00 O ATOM 37 CB VAL A 137 -2.282 -4.537 -4.794 1.00 0.00 C ATOM 38 CG1 VAL A 137 -1.095 -3.741 -5.341 1.00 0.00 C ATOM 39 CG2 VAL A 137 -2.626 -5.711 -5.713 1.00 0.00 C ATOM 0 H VAL A 137 0.043 -5.366 -3.118 1.00 0.00 H new ATOM 0 HA VAL A 137 -2.746 -4.535 -2.727 1.00 0.00 H new ATOM 0 HB VAL A 137 -3.145 -3.872 -4.763 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -1.315 -3.410 -6.356 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -0.916 -2.872 -4.707 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -0.207 -4.373 -5.350 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -2.816 -5.341 -6.720 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -1.792 -6.412 -5.735 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -3.516 -6.218 -5.339 1.00 0.00 H new ATOM 49 N ARG A 138 -3.433 -6.960 -3.272 1.00 0.00 N ATOM 50 CA ARG A 138 -3.748 -8.372 -3.132 1.00 0.00 C ATOM 51 C ARG A 138 -4.618 -8.839 -4.302 1.00 0.00 C ATOM 52 O ARG A 138 -5.744 -8.374 -4.468 1.00 0.00 O ATOM 53 CB ARG A 138 -4.484 -8.645 -1.819 1.00 0.00 C ATOM 54 CG ARG A 138 -4.092 -10.008 -1.245 1.00 0.00 C ATOM 55 CD ARG A 138 -4.480 -10.113 0.232 1.00 0.00 C ATOM 56 NE ARG A 138 -3.441 -10.860 0.976 1.00 0.00 N ATOM 57 CZ ARG A 138 -3.469 -12.183 1.182 1.00 0.00 C ATOM 58 NH1 ARG A 138 -4.484 -12.915 0.701 1.00 0.00 N ATOM 59 NH2 ARG A 138 -2.482 -12.777 1.868 1.00 0.00 N ATOM 0 H ARG A 138 -4.241 -6.356 -3.422 1.00 0.00 H new ATOM 0 HA ARG A 138 -2.808 -8.923 -3.129 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -4.251 -7.862 -1.098 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -5.560 -8.613 -1.988 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -4.583 -10.800 -1.811 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -3.018 -10.157 -1.354 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -4.598 -9.116 0.657 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -5.442 -10.617 0.329 1.00 0.00 H new ATOM 0 HE ARG A 138 -2.654 -10.334 1.356 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -5.235 -12.464 0.178 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -4.505 -13.923 0.858 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -1.709 -12.221 2.234 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -2.504 -13.785 2.024 1.00 0.00 H new ATOM 73 N ALA A 139 -4.060 -9.754 -5.083 1.00 0.00 N ATOM 74 CA ALA A 139 -4.769 -10.289 -6.232 1.00 0.00 C ATOM 75 C ALA A 139 -5.688 -11.425 -5.775 1.00 0.00 C ATOM 76 O ALA A 139 -5.217 -12.512 -5.444 1.00 0.00 O ATOM 77 CB ALA A 139 -3.761 -10.744 -7.288 1.00 0.00 C ATOM 0 H ALA A 139 -3.125 -10.138 -4.942 1.00 0.00 H new ATOM 0 HA ALA A 139 -5.394 -9.522 -6.688 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -4.294 -11.145 -8.150 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -3.153 -9.895 -7.600 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -3.117 -11.516 -6.867 1.00 0.00 H new ATOM 83 N LEU A 140 -6.980 -11.133 -5.772 1.00 0.00 N ATOM 84 CA LEU A 140 -7.968 -12.117 -5.362 1.00 0.00 C ATOM 85 C LEU A 140 -8.393 -12.945 -6.576 1.00 0.00 C ATOM 86 O LEU A 140 -9.504 -13.472 -6.615 1.00 0.00 O ATOM 87 CB LEU A 140 -9.134 -11.437 -4.642 1.00 0.00 C ATOM 88 CG LEU A 140 -8.791 -10.726 -3.333 1.00 0.00 C ATOM 89 CD1 LEU A 140 -9.090 -9.228 -3.427 1.00 0.00 C ATOM 90 CD2 LEU A 140 -9.507 -11.379 -2.149 1.00 0.00 C ATOM 0 H LEU A 140 -7.366 -10.230 -6.047 1.00 0.00 H new ATOM 0 HA LEU A 140 -7.538 -12.810 -4.639 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -9.580 -10.710 -5.321 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -9.895 -12.189 -4.435 1.00 0.00 H new ATOM 0 HG LEU A 140 -7.720 -10.831 -3.159 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -8.837 -8.746 -2.482 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -8.497 -8.788 -4.229 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -10.149 -9.081 -3.637 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -9.245 -10.853 -1.231 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -10.585 -11.327 -2.302 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -9.202 -12.422 -2.070 1.00 0.00 H new ATOM 102 N PHE A 141 -7.487 -13.033 -7.540 1.00 0.00 N ATOM 103 CA PHE A 141 -7.754 -13.787 -8.752 1.00 0.00 C ATOM 104 C PHE A 141 -6.454 -14.297 -9.378 1.00 0.00 C ATOM 105 O PHE A 141 -5.420 -13.637 -9.294 1.00 0.00 O ATOM 106 CB PHE A 141 -8.436 -12.830 -9.732 1.00 0.00 C ATOM 107 CG PHE A 141 -9.845 -12.410 -9.311 1.00 0.00 C ATOM 108 CD1 PHE A 141 -10.015 -11.391 -8.427 1.00 0.00 C ATOM 109 CD2 PHE A 141 -10.929 -13.054 -9.822 1.00 0.00 C ATOM 110 CE1 PHE A 141 -11.324 -11.000 -8.036 1.00 0.00 C ATOM 111 CE2 PHE A 141 -12.237 -12.664 -9.431 1.00 0.00 C ATOM 112 CZ PHE A 141 -12.407 -11.645 -8.546 1.00 0.00 C ATOM 0 H PHE A 141 -6.567 -12.594 -7.505 1.00 0.00 H new ATOM 0 HA PHE A 141 -8.379 -14.650 -8.523 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -7.819 -11.938 -9.842 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -8.487 -13.305 -10.712 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -9.155 -10.879 -8.022 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -10.794 -13.862 -10.525 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -11.459 -10.191 -7.334 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -13.097 -13.176 -9.836 1.00 0.00 H new ATOM 0 HZ PHE A 141 -13.402 -11.348 -8.248 1.00 0.00 H new ATOM 122 N ASP A 142 -6.550 -15.468 -9.990 1.00 0.00 N ATOM 123 CA ASP A 142 -5.395 -16.075 -10.629 1.00 0.00 C ATOM 124 C ASP A 142 -5.130 -15.376 -11.964 1.00 0.00 C ATOM 125 O ASP A 142 -6.047 -14.825 -12.572 1.00 0.00 O ATOM 126 CB ASP A 142 -5.638 -17.559 -10.913 1.00 0.00 C ATOM 127 CG ASP A 142 -4.873 -18.123 -12.112 1.00 0.00 C ATOM 128 OD1 ASP A 142 -5.298 -17.821 -13.249 1.00 0.00 O ATOM 129 OD2 ASP A 142 -3.881 -18.841 -11.865 1.00 0.00 O ATOM 0 H ASP A 142 -7.410 -16.013 -10.057 1.00 0.00 H new ATOM 0 HA ASP A 142 -4.544 -15.971 -9.955 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -5.367 -18.132 -10.026 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -6.705 -17.712 -11.077 1.00 0.00 H new ATOM 134 N PHE A 143 -3.874 -15.422 -12.381 1.00 0.00 N ATOM 135 CA PHE A 143 -3.478 -14.801 -13.633 1.00 0.00 C ATOM 136 C PHE A 143 -2.091 -15.279 -14.069 1.00 0.00 C ATOM 137 O PHE A 143 -1.198 -15.446 -13.238 1.00 0.00 O ATOM 138 CB PHE A 143 -3.429 -13.291 -13.388 1.00 0.00 C ATOM 139 CG PHE A 143 -4.117 -12.461 -14.473 1.00 0.00 C ATOM 140 CD1 PHE A 143 -5.397 -12.745 -14.836 1.00 0.00 C ATOM 141 CD2 PHE A 143 -3.450 -11.440 -15.074 1.00 0.00 C ATOM 142 CE1 PHE A 143 -6.036 -11.974 -15.843 1.00 0.00 C ATOM 143 CE2 PHE A 143 -4.089 -10.670 -16.081 1.00 0.00 C ATOM 144 CZ PHE A 143 -5.369 -10.953 -16.445 1.00 0.00 C ATOM 0 H PHE A 143 -3.117 -15.880 -11.874 1.00 0.00 H new ATOM 0 HA PHE A 143 -4.187 -15.064 -14.418 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -3.897 -13.074 -12.428 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -2.387 -12.979 -13.313 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -5.927 -13.556 -14.359 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -2.434 -11.215 -14.785 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -7.052 -12.199 -16.131 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -3.559 -9.859 -16.558 1.00 0.00 H new ATOM 0 HZ PHE A 143 -5.855 -10.367 -17.211 1.00 0.00 H new ATOM 154 N ASN A 144 -1.953 -15.487 -15.370 1.00 0.00 N ATOM 155 CA ASN A 144 -0.690 -15.944 -15.926 1.00 0.00 C ATOM 156 C ASN A 144 -0.324 -15.074 -17.129 1.00 0.00 C ATOM 157 O ASN A 144 0.823 -14.651 -17.269 1.00 0.00 O ATOM 158 CB ASN A 144 -0.790 -17.394 -16.402 1.00 0.00 C ATOM 159 CG ASN A 144 -0.442 -18.367 -15.275 1.00 0.00 C ATOM 160 OD1 ASN A 144 -1.299 -18.874 -14.571 1.00 0.00 O ATOM 161 ND2 ASN A 144 0.861 -18.598 -15.144 1.00 0.00 N ATOM 0 H ASN A 144 -2.695 -15.348 -16.056 1.00 0.00 H new ATOM 0 HA ASN A 144 0.068 -15.873 -15.146 1.00 0.00 H new ATOM 0 HB2 ASN A 144 -1.800 -17.594 -16.761 1.00 0.00 H new ATOM 0 HB3 ASN A 144 -0.116 -17.551 -17.244 1.00 0.00 H new ATOM 0 HD21 ASN A 144 1.196 -19.233 -14.420 1.00 0.00 H new ATOM 0 HD22 ASN A 144 1.525 -18.140 -15.768 1.00 0.00 H new ATOM 168 N GLY A 145 -1.320 -14.832 -17.969 1.00 0.00 N ATOM 169 CA GLY A 145 -1.116 -14.020 -19.157 1.00 0.00 C ATOM 170 C GLY A 145 -2.454 -13.603 -19.772 1.00 0.00 C ATOM 171 O GLY A 145 -3.270 -14.453 -20.127 1.00 0.00 O ATOM 0 H GLY A 145 -2.270 -15.184 -17.851 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -0.537 -13.133 -18.901 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -0.534 -14.580 -19.889 1.00 0.00 H new ATOM 175 N ASN A 146 -2.638 -12.296 -19.880 1.00 0.00 N ATOM 176 CA ASN A 146 -3.863 -11.756 -20.445 1.00 0.00 C ATOM 177 C ASN A 146 -3.532 -10.983 -21.723 1.00 0.00 C ATOM 178 O ASN A 146 -4.181 -11.168 -22.751 1.00 0.00 O ATOM 179 CB ASN A 146 -4.542 -10.791 -19.471 1.00 0.00 C ATOM 180 CG ASN A 146 -6.064 -10.935 -19.527 1.00 0.00 C ATOM 181 OD1 ASN A 146 -6.608 -12.025 -19.594 1.00 0.00 O ATOM 182 ND2 ASN A 146 -6.718 -9.778 -19.497 1.00 0.00 N ATOM 0 H ASN A 146 -1.959 -11.594 -19.586 1.00 0.00 H new ATOM 0 HA ASN A 146 -4.534 -12.589 -20.652 1.00 0.00 H new ATOM 0 HB2 ASN A 146 -4.192 -10.986 -18.457 1.00 0.00 H new ATOM 0 HB3 ASN A 146 -4.261 -9.766 -19.714 1.00 0.00 H new ATOM 0 HD21 ASN A 146 -7.737 -9.767 -19.531 1.00 0.00 H new ATOM 0 HD22 ASN A 146 -6.200 -8.901 -19.440 1.00 0.00 H new ATOM 189 N ASP A 147 -2.522 -10.132 -21.617 1.00 0.00 N ATOM 190 CA ASP A 147 -2.097 -9.330 -22.752 1.00 0.00 C ATOM 191 C ASP A 147 -0.692 -9.761 -23.177 1.00 0.00 C ATOM 192 O ASP A 147 -0.501 -10.258 -24.286 1.00 0.00 O ATOM 193 CB ASP A 147 -2.046 -7.844 -22.387 1.00 0.00 C ATOM 194 CG ASP A 147 -2.721 -6.909 -23.392 1.00 0.00 C ATOM 195 OD1 ASP A 147 -2.534 -7.148 -24.605 1.00 0.00 O ATOM 196 OD2 ASP A 147 -3.408 -5.976 -22.925 1.00 0.00 O ATOM 0 H ASP A 147 -1.986 -9.980 -20.763 1.00 0.00 H new ATOM 0 HA ASP A 147 -2.814 -9.479 -23.559 1.00 0.00 H new ATOM 0 HB2 ASP A 147 -2.517 -7.708 -21.413 1.00 0.00 H new ATOM 0 HB3 ASP A 147 -1.003 -7.547 -22.281 1.00 0.00 H new ATOM 201 N GLU A 148 0.255 -9.555 -22.275 1.00 0.00 N ATOM 202 CA GLU A 148 1.636 -9.915 -22.543 1.00 0.00 C ATOM 203 C GLU A 148 2.577 -9.151 -21.609 1.00 0.00 C ATOM 204 O GLU A 148 3.682 -9.609 -21.325 1.00 0.00 O ATOM 205 CB GLU A 148 1.995 -9.662 -24.008 1.00 0.00 C ATOM 206 CG GLU A 148 1.997 -10.968 -24.806 1.00 0.00 C ATOM 207 CD GLU A 148 1.456 -10.748 -26.220 1.00 0.00 C ATOM 208 OE1 GLU A 148 2.079 -9.944 -26.947 1.00 0.00 O ATOM 209 OE2 GLU A 148 0.433 -11.389 -26.543 1.00 0.00 O ATOM 0 H GLU A 148 0.093 -9.143 -21.356 1.00 0.00 H new ATOM 0 HA GLU A 148 1.754 -10.982 -22.353 1.00 0.00 H new ATOM 0 HB2 GLU A 148 1.280 -8.965 -24.446 1.00 0.00 H new ATOM 0 HB3 GLU A 148 2.977 -9.193 -24.070 1.00 0.00 H new ATOM 0 HG2 GLU A 148 3.011 -11.365 -24.858 1.00 0.00 H new ATOM 0 HG3 GLU A 148 1.389 -11.713 -24.292 1.00 0.00 H new ATOM 216 N GLU A 149 2.102 -8.000 -21.156 1.00 0.00 N ATOM 217 CA GLU A 149 2.885 -7.167 -20.261 1.00 0.00 C ATOM 218 C GLU A 149 2.237 -7.122 -18.875 1.00 0.00 C ATOM 219 O GLU A 149 2.798 -6.546 -17.942 1.00 0.00 O ATOM 220 CB GLU A 149 3.059 -5.759 -20.832 1.00 0.00 C ATOM 221 CG GLU A 149 1.727 -5.006 -20.849 1.00 0.00 C ATOM 222 CD GLU A 149 1.776 -3.827 -21.823 1.00 0.00 C ATOM 223 OE1 GLU A 149 2.869 -3.233 -21.940 1.00 0.00 O ATOM 224 OE2 GLU A 149 0.719 -3.547 -22.428 1.00 0.00 O ATOM 0 H GLU A 149 1.183 -7.625 -21.393 1.00 0.00 H new ATOM 0 HA GLU A 149 3.877 -7.607 -20.162 1.00 0.00 H new ATOM 0 HB2 GLU A 149 3.785 -5.208 -20.235 1.00 0.00 H new ATOM 0 HB3 GLU A 149 3.459 -5.820 -21.844 1.00 0.00 H new ATOM 0 HG2 GLU A 149 0.925 -5.686 -21.135 1.00 0.00 H new ATOM 0 HG3 GLU A 149 1.496 -4.645 -19.847 1.00 0.00 H new ATOM 231 N ASP A 150 1.066 -7.734 -18.785 1.00 0.00 N ATOM 232 CA ASP A 150 0.336 -7.770 -17.529 1.00 0.00 C ATOM 233 C ASP A 150 1.130 -8.582 -16.505 1.00 0.00 C ATOM 234 O ASP A 150 1.911 -9.459 -16.873 1.00 0.00 O ATOM 235 CB ASP A 150 -1.030 -8.437 -17.705 1.00 0.00 C ATOM 236 CG ASP A 150 -0.980 -9.917 -18.094 1.00 0.00 C ATOM 237 OD1 ASP A 150 -0.675 -10.183 -19.277 1.00 0.00 O ATOM 238 OD2 ASP A 150 -1.250 -10.748 -17.200 1.00 0.00 O ATOM 0 H ASP A 150 0.604 -8.209 -19.561 1.00 0.00 H new ATOM 0 HA ASP A 150 0.195 -6.743 -17.191 1.00 0.00 H new ATOM 0 HB2 ASP A 150 -1.588 -8.340 -16.774 1.00 0.00 H new ATOM 0 HB3 ASP A 150 -1.587 -7.894 -18.469 1.00 0.00 H new ATOM 243 N LEU A 151 0.905 -8.261 -15.239 1.00 0.00 N ATOM 244 CA LEU A 151 1.591 -8.950 -14.159 1.00 0.00 C ATOM 245 C LEU A 151 0.737 -10.130 -13.689 1.00 0.00 C ATOM 246 O LEU A 151 -0.336 -9.937 -13.121 1.00 0.00 O ATOM 247 CB LEU A 151 1.951 -7.969 -13.042 1.00 0.00 C ATOM 248 CG LEU A 151 3.021 -8.440 -12.055 1.00 0.00 C ATOM 249 CD1 LEU A 151 4.380 -8.576 -12.742 1.00 0.00 C ATOM 250 CD2 LEU A 151 3.085 -7.520 -10.834 1.00 0.00 C ATOM 0 H LEU A 151 0.257 -7.533 -14.937 1.00 0.00 H new ATOM 0 HA LEU A 151 2.538 -9.361 -14.509 1.00 0.00 H new ATOM 0 HB2 LEU A 151 2.290 -7.039 -13.498 1.00 0.00 H new ATOM 0 HB3 LEU A 151 1.045 -7.738 -12.482 1.00 0.00 H new ATOM 0 HG LEU A 151 2.741 -9.431 -11.697 1.00 0.00 H new ATOM 0 HD11 LEU A 151 5.122 -8.912 -12.018 1.00 0.00 H new ATOM 0 HD12 LEU A 151 4.308 -9.303 -13.551 1.00 0.00 H new ATOM 0 HD13 LEU A 151 4.681 -7.610 -13.148 1.00 0.00 H new ATOM 0 HD21 LEU A 151 3.854 -7.878 -10.149 1.00 0.00 H new ATOM 0 HD22 LEU A 151 3.327 -6.507 -11.154 1.00 0.00 H new ATOM 0 HD23 LEU A 151 2.120 -7.519 -10.328 1.00 0.00 H new ATOM 262 N PRO A 152 1.261 -11.358 -13.951 1.00 0.00 N ATOM 263 CA PRO A 152 0.559 -12.568 -13.561 1.00 0.00 C ATOM 264 C PRO A 152 0.668 -12.805 -12.054 1.00 0.00 C ATOM 265 O PRO A 152 1.472 -12.165 -11.379 1.00 0.00 O ATOM 266 CB PRO A 152 1.197 -13.676 -14.385 1.00 0.00 C ATOM 267 CG PRO A 152 2.534 -13.127 -14.856 1.00 0.00 C ATOM 268 CD PRO A 152 2.530 -11.625 -14.622 1.00 0.00 C ATOM 0 HA PRO A 152 -0.512 -12.513 -13.754 1.00 0.00 H new ATOM 0 HB2 PRO A 152 1.333 -14.578 -13.788 1.00 0.00 H new ATOM 0 HB3 PRO A 152 0.566 -13.946 -15.231 1.00 0.00 H new ATOM 0 HG2 PRO A 152 3.353 -13.596 -14.310 1.00 0.00 H new ATOM 0 HG3 PRO A 152 2.687 -13.348 -15.912 1.00 0.00 H new ATOM 0 HD2 PRO A 152 3.376 -11.318 -14.007 1.00 0.00 H new ATOM 0 HD3 PRO A 152 2.604 -11.078 -15.562 1.00 0.00 H new ATOM 276 N PHE A 153 -0.152 -13.727 -11.571 1.00 0.00 N ATOM 277 CA PHE A 153 -0.157 -14.056 -10.156 1.00 0.00 C ATOM 278 C PHE A 153 -1.153 -15.179 -9.858 1.00 0.00 C ATOM 279 O PHE A 153 -1.804 -15.693 -10.766 1.00 0.00 O ATOM 280 CB PHE A 153 -0.588 -12.795 -9.405 1.00 0.00 C ATOM 281 CG PHE A 153 -1.687 -11.997 -10.109 1.00 0.00 C ATOM 282 CD1 PHE A 153 -2.986 -12.387 -10.002 1.00 0.00 C ATOM 283 CD2 PHE A 153 -1.366 -10.897 -10.842 1.00 0.00 C ATOM 284 CE1 PHE A 153 -4.006 -11.646 -10.656 1.00 0.00 C ATOM 285 CE2 PHE A 153 -2.386 -10.157 -11.496 1.00 0.00 C ATOM 286 CZ PHE A 153 -3.684 -10.547 -11.388 1.00 0.00 C ATOM 0 H PHE A 153 -0.817 -14.256 -12.134 1.00 0.00 H new ATOM 0 HA PHE A 153 0.833 -14.394 -9.849 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -0.938 -13.077 -8.412 1.00 0.00 H new ATOM 0 HB3 PHE A 153 0.281 -12.152 -9.266 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -3.242 -13.260 -9.420 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -0.335 -10.587 -10.926 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -5.037 -11.956 -10.572 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -2.131 -9.284 -12.079 1.00 0.00 H new ATOM 0 HZ PHE A 153 -4.460 -9.983 -11.884 1.00 0.00 H new ATOM 296 N LYS A 154 -1.241 -15.526 -8.582 1.00 0.00 N ATOM 297 CA LYS A 154 -2.146 -16.578 -8.152 1.00 0.00 C ATOM 298 C LYS A 154 -3.189 -15.990 -7.201 1.00 0.00 C ATOM 299 O LYS A 154 -2.874 -15.119 -6.391 1.00 0.00 O ATOM 300 CB LYS A 154 -1.362 -17.750 -7.559 1.00 0.00 C ATOM 301 CG LYS A 154 -1.885 -18.110 -6.167 1.00 0.00 C ATOM 302 CD LYS A 154 -0.963 -19.118 -5.478 1.00 0.00 C ATOM 303 CE LYS A 154 -1.577 -19.618 -4.169 1.00 0.00 C ATOM 304 NZ LYS A 154 -1.525 -21.096 -4.103 1.00 0.00 N ATOM 0 H LYS A 154 -0.700 -15.097 -7.832 1.00 0.00 H new ATOM 0 HA LYS A 154 -2.688 -16.987 -9.005 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -1.442 -18.616 -8.217 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -0.305 -17.492 -7.499 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -1.962 -17.208 -5.559 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -2.889 -18.527 -6.248 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -0.779 -19.962 -6.143 1.00 0.00 H new ATOM 0 HD3 LYS A 154 0.003 -18.654 -5.277 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -1.040 -19.191 -3.322 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -2.611 -19.281 -4.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -1.946 -21.419 -3.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -2.057 -21.498 -4.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -0.535 -21.411 -4.153 1.00 0.00 H new ATOM 318 N LYS A 155 -4.410 -16.489 -7.330 1.00 0.00 N ATOM 319 CA LYS A 155 -5.501 -16.024 -6.491 1.00 0.00 C ATOM 320 C LYS A 155 -5.029 -15.962 -5.036 1.00 0.00 C ATOM 321 O LYS A 155 -4.643 -16.978 -4.461 1.00 0.00 O ATOM 322 CB LYS A 155 -6.743 -16.894 -6.697 1.00 0.00 C ATOM 323 CG LYS A 155 -8.000 -16.182 -6.193 1.00 0.00 C ATOM 324 CD LYS A 155 -8.017 -16.113 -4.666 1.00 0.00 C ATOM 325 CE LYS A 155 -7.852 -17.505 -4.052 1.00 0.00 C ATOM 326 NZ LYS A 155 -8.843 -17.716 -2.973 1.00 0.00 N ATOM 0 H LYS A 155 -4.667 -17.211 -8.003 1.00 0.00 H new ATOM 0 HA LYS A 155 -5.796 -15.014 -6.775 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -6.854 -17.131 -7.755 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -6.620 -17.840 -6.170 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -8.042 -15.174 -6.606 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -8.887 -16.708 -6.546 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -7.215 -15.461 -4.319 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -8.955 -15.672 -4.329 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -7.977 -18.266 -4.822 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -6.843 -17.616 -3.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -8.717 -18.665 -2.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -8.705 -17.001 -2.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -9.804 -17.630 -3.362 1.00 0.00 H new ATOM 340 N GLY A 156 -5.077 -14.759 -4.484 1.00 0.00 N ATOM 341 CA GLY A 156 -4.659 -14.550 -3.108 1.00 0.00 C ATOM 342 C GLY A 156 -3.161 -14.249 -3.029 1.00 0.00 C ATOM 343 O GLY A 156 -2.472 -14.738 -2.136 1.00 0.00 O ATOM 0 H GLY A 156 -5.399 -13.919 -4.964 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -5.223 -13.724 -2.675 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -4.887 -15.437 -2.516 1.00 0.00 H new ATOM 347 N ASP A 157 -2.701 -13.444 -3.976 1.00 0.00 N ATOM 348 CA ASP A 157 -1.297 -13.072 -4.025 1.00 0.00 C ATOM 349 C ASP A 157 -1.155 -11.587 -3.683 1.00 0.00 C ATOM 350 O ASP A 157 -2.146 -10.858 -3.642 1.00 0.00 O ATOM 351 CB ASP A 157 -0.718 -13.292 -5.424 1.00 0.00 C ATOM 352 CG ASP A 157 0.780 -13.007 -5.555 1.00 0.00 C ATOM 353 OD1 ASP A 157 1.559 -13.779 -4.955 1.00 0.00 O ATOM 354 OD2 ASP A 157 1.112 -12.025 -6.252 1.00 0.00 O ATOM 0 H ASP A 157 -3.276 -13.039 -4.715 1.00 0.00 H new ATOM 0 HA ASP A 157 -0.758 -13.693 -3.309 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -0.903 -14.325 -5.720 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -1.256 -12.657 -6.128 1.00 0.00 H new ATOM 359 N ILE A 158 0.084 -11.183 -3.446 1.00 0.00 N ATOM 360 CA ILE A 158 0.368 -9.798 -3.109 1.00 0.00 C ATOM 361 C ILE A 158 1.248 -9.183 -4.198 1.00 0.00 C ATOM 362 O ILE A 158 2.038 -9.882 -4.831 1.00 0.00 O ATOM 363 CB ILE A 158 0.966 -9.700 -1.704 1.00 0.00 C ATOM 364 CG1 ILE A 158 -0.075 -10.046 -0.639 1.00 0.00 C ATOM 365 CG2 ILE A 158 1.593 -8.324 -1.469 1.00 0.00 C ATOM 366 CD1 ILE A 158 0.298 -11.333 0.098 1.00 0.00 C ATOM 0 H ILE A 158 0.903 -11.790 -3.481 1.00 0.00 H new ATOM 0 HA ILE A 158 -0.553 -9.216 -3.078 1.00 0.00 H new ATOM 0 HB ILE A 158 1.766 -10.436 -1.622 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -0.157 -9.226 0.074 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -1.053 -10.161 -1.106 1.00 0.00 H new ATOM 0 HG21 ILE A 158 2.010 -8.281 -0.463 1.00 0.00 H new ATOM 0 HG22 ILE A 158 2.386 -8.156 -2.198 1.00 0.00 H new ATOM 0 HG23 ILE A 158 0.830 -7.553 -1.578 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -0.460 -11.555 0.849 1.00 0.00 H new ATOM 0 HD12 ILE A 158 0.355 -12.156 -0.614 1.00 0.00 H new ATOM 0 HD13 ILE A 158 1.265 -11.206 0.585 1.00 0.00 H new ATOM 378 N LEU A 159 1.084 -7.881 -4.382 1.00 0.00 N ATOM 379 CA LEU A 159 1.856 -7.164 -5.384 1.00 0.00 C ATOM 380 C LEU A 159 2.234 -5.785 -4.839 1.00 0.00 C ATOM 381 O LEU A 159 1.469 -5.179 -4.089 1.00 0.00 O ATOM 382 CB LEU A 159 1.096 -7.114 -6.711 1.00 0.00 C ATOM 383 CG LEU A 159 0.294 -8.366 -7.070 1.00 0.00 C ATOM 384 CD1 LEU A 159 -0.907 -8.012 -7.951 1.00 0.00 C ATOM 385 CD2 LEU A 159 1.188 -9.423 -7.719 1.00 0.00 C ATOM 0 H LEU A 159 0.429 -7.304 -3.855 1.00 0.00 H new ATOM 0 HA LEU A 159 2.787 -7.690 -5.596 1.00 0.00 H new ATOM 0 HB2 LEU A 159 0.414 -6.264 -6.685 1.00 0.00 H new ATOM 0 HB3 LEU A 159 1.812 -6.923 -7.510 1.00 0.00 H new ATOM 0 HG LEU A 159 -0.097 -8.798 -6.149 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -1.461 -8.919 -8.193 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.559 -7.320 -7.417 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -0.558 -7.544 -8.872 1.00 0.00 H new ATOM 0 HD21 LEU A 159 0.593 -10.302 -7.964 1.00 0.00 H new ATOM 0 HD22 LEU A 159 1.628 -9.018 -8.630 1.00 0.00 H new ATOM 0 HD23 LEU A 159 1.981 -9.704 -7.026 1.00 0.00 H new ATOM 397 N ARG A 160 3.412 -5.329 -5.236 1.00 0.00 N ATOM 398 CA ARG A 160 3.901 -4.033 -4.798 1.00 0.00 C ATOM 399 C ARG A 160 3.536 -2.955 -5.820 1.00 0.00 C ATOM 400 O ARG A 160 4.186 -2.834 -6.858 1.00 0.00 O ATOM 401 CB ARG A 160 5.418 -4.053 -4.605 1.00 0.00 C ATOM 402 CG ARG A 160 5.825 -3.244 -3.372 1.00 0.00 C ATOM 403 CD ARG A 160 7.278 -2.774 -3.478 1.00 0.00 C ATOM 404 NE ARG A 160 8.189 -3.832 -2.988 1.00 0.00 N ATOM 405 CZ ARG A 160 9.395 -3.597 -2.455 1.00 0.00 C ATOM 406 NH1 ARG A 160 9.843 -2.339 -2.340 1.00 0.00 N ATOM 407 NH2 ARG A 160 10.154 -4.619 -2.036 1.00 0.00 N ATOM 0 H ARG A 160 4.043 -5.835 -5.857 1.00 0.00 H new ATOM 0 HA ARG A 160 3.429 -3.806 -3.842 1.00 0.00 H new ATOM 0 HB2 ARG A 160 5.761 -5.082 -4.498 1.00 0.00 H new ATOM 0 HB3 ARG A 160 5.906 -3.644 -5.490 1.00 0.00 H new ATOM 0 HG2 ARG A 160 5.167 -2.381 -3.265 1.00 0.00 H new ATOM 0 HG3 ARG A 160 5.700 -3.852 -2.476 1.00 0.00 H new ATOM 0 HD2 ARG A 160 7.515 -2.529 -4.513 1.00 0.00 H new ATOM 0 HD3 ARG A 160 7.418 -1.864 -2.895 1.00 0.00 H new ATOM 0 HE ARG A 160 7.879 -4.801 -3.061 1.00 0.00 H new ATOM 0 HH11 ARG A 160 9.265 -1.561 -2.658 1.00 0.00 H new ATOM 0 HH12 ARG A 160 10.761 -2.160 -1.934 1.00 0.00 H new ATOM 0 HH21 ARG A 160 9.813 -5.576 -2.123 1.00 0.00 H new ATOM 0 HH22 ARG A 160 11.072 -4.439 -1.630 1.00 0.00 H new ATOM 421 N ILE A 161 2.499 -2.199 -5.492 1.00 0.00 N ATOM 422 CA ILE A 161 2.041 -1.135 -6.368 1.00 0.00 C ATOM 423 C ILE A 161 2.947 0.087 -6.198 1.00 0.00 C ATOM 424 O ILE A 161 3.176 0.541 -5.078 1.00 0.00 O ATOM 425 CB ILE A 161 0.559 -0.841 -6.126 1.00 0.00 C ATOM 426 CG1 ILE A 161 0.018 0.142 -7.166 1.00 0.00 C ATOM 427 CG2 ILE A 161 0.325 -0.350 -4.696 1.00 0.00 C ATOM 428 CD1 ILE A 161 -0.062 -0.509 -8.548 1.00 0.00 C ATOM 0 H ILE A 161 1.963 -2.303 -4.631 1.00 0.00 H new ATOM 0 HA ILE A 161 2.114 -1.443 -7.411 1.00 0.00 H new ATOM 0 HB ILE A 161 0.002 -1.771 -6.243 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -0.971 0.487 -6.865 1.00 0.00 H new ATOM 0 HG13 ILE A 161 0.662 1.020 -7.211 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -0.736 -0.148 -4.550 1.00 0.00 H new ATOM 0 HG22 ILE A 161 0.649 -1.115 -3.991 1.00 0.00 H new ATOM 0 HG23 ILE A 161 0.895 0.564 -4.527 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -0.450 0.212 -9.268 1.00 0.00 H new ATOM 0 HD12 ILE A 161 0.933 -0.831 -8.857 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -0.726 -1.372 -8.506 1.00 0.00 H new ATOM 440 N ARG A 162 3.435 0.585 -7.324 1.00 0.00 N ATOM 441 CA ARG A 162 4.310 1.744 -7.313 1.00 0.00 C ATOM 442 C ARG A 162 3.752 2.838 -8.227 1.00 0.00 C ATOM 443 O ARG A 162 4.024 4.020 -8.023 1.00 0.00 O ATOM 444 CB ARG A 162 5.720 1.374 -7.774 1.00 0.00 C ATOM 445 CG ARG A 162 6.702 2.518 -7.509 1.00 0.00 C ATOM 446 CD ARG A 162 7.880 2.044 -6.657 1.00 0.00 C ATOM 447 NE ARG A 162 7.923 2.803 -5.386 1.00 0.00 N ATOM 448 CZ ARG A 162 8.307 4.083 -5.289 1.00 0.00 C ATOM 449 NH1 ARG A 162 8.682 4.755 -6.385 1.00 0.00 N ATOM 450 NH2 ARG A 162 8.314 4.690 -4.094 1.00 0.00 N ATOM 0 H ARG A 162 3.241 0.206 -8.251 1.00 0.00 H new ATOM 0 HA ARG A 162 4.361 2.112 -6.288 1.00 0.00 H new ATOM 0 HB2 ARG A 162 6.053 0.476 -7.253 1.00 0.00 H new ATOM 0 HB3 ARG A 162 5.709 1.139 -8.838 1.00 0.00 H new ATOM 0 HG2 ARG A 162 7.070 2.913 -8.456 1.00 0.00 H new ATOM 0 HG3 ARG A 162 6.187 3.334 -7.002 1.00 0.00 H new ATOM 0 HD2 ARG A 162 7.785 0.978 -6.451 1.00 0.00 H new ATOM 0 HD3 ARG A 162 8.813 2.181 -7.204 1.00 0.00 H new ATOM 0 HE ARG A 162 7.643 2.321 -4.532 1.00 0.00 H new ATOM 0 HH11 ARG A 162 8.675 4.292 -7.294 1.00 0.00 H new ATOM 0 HH12 ARG A 162 8.974 5.729 -6.311 1.00 0.00 H new ATOM 0 HH21 ARG A 162 8.027 4.178 -3.260 1.00 0.00 H new ATOM 0 HH22 ARG A 162 8.606 5.664 -4.019 1.00 0.00 H new ATOM 464 N ASP A 163 2.983 2.405 -9.215 1.00 0.00 N ATOM 465 CA ASP A 163 2.385 3.333 -10.159 1.00 0.00 C ATOM 466 C ASP A 163 0.934 2.923 -10.421 1.00 0.00 C ATOM 467 O ASP A 163 0.628 1.736 -10.518 1.00 0.00 O ATOM 468 CB ASP A 163 3.131 3.313 -11.496 1.00 0.00 C ATOM 469 CG ASP A 163 4.582 3.793 -11.435 1.00 0.00 C ATOM 470 OD1 ASP A 163 4.770 4.997 -11.158 1.00 0.00 O ATOM 471 OD2 ASP A 163 5.470 2.945 -11.666 1.00 0.00 O ATOM 0 H ASP A 163 2.760 1.424 -9.382 1.00 0.00 H new ATOM 0 HA ASP A 163 2.439 4.334 -9.730 1.00 0.00 H new ATOM 0 HB2 ASP A 163 3.117 2.296 -11.887 1.00 0.00 H new ATOM 0 HB3 ASP A 163 2.588 3.936 -12.207 1.00 0.00 H new ATOM 476 N LYS A 164 0.080 3.930 -10.528 1.00 0.00 N ATOM 477 CA LYS A 164 -1.331 3.691 -10.777 1.00 0.00 C ATOM 478 C LYS A 164 -1.895 4.827 -11.632 1.00 0.00 C ATOM 479 O LYS A 164 -2.692 5.632 -11.153 1.00 0.00 O ATOM 480 CB LYS A 164 -2.080 3.483 -9.458 1.00 0.00 C ATOM 481 CG LYS A 164 -1.121 3.062 -8.343 1.00 0.00 C ATOM 482 CD LYS A 164 -1.825 3.061 -6.985 1.00 0.00 C ATOM 483 CE LYS A 164 -1.916 4.477 -6.413 1.00 0.00 C ATOM 484 NZ LYS A 164 -3.272 4.734 -5.879 1.00 0.00 N ATOM 0 H LYS A 164 0.338 4.913 -10.447 1.00 0.00 H new ATOM 0 HA LYS A 164 -1.466 2.770 -11.343 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -2.589 4.404 -9.176 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -2.849 2.721 -9.588 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -0.728 2.067 -8.553 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -0.270 3.742 -8.315 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -2.826 2.643 -7.091 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -1.283 2.419 -6.291 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -1.177 4.604 -5.622 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -1.680 5.205 -7.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -3.317 5.699 -5.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -3.971 4.633 -6.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -3.483 4.051 -5.124 1.00 0.00 H new ATOM 498 N PRO A 165 -1.448 4.857 -12.915 1.00 0.00 N ATOM 499 CA PRO A 165 -1.899 5.881 -13.841 1.00 0.00 C ATOM 500 C PRO A 165 -3.329 5.606 -14.310 1.00 0.00 C ATOM 501 O PRO A 165 -4.153 6.517 -14.366 1.00 0.00 O ATOM 502 CB PRO A 165 -0.888 5.859 -14.976 1.00 0.00 C ATOM 503 CG PRO A 165 -0.178 4.518 -14.876 1.00 0.00 C ATOM 504 CD PRO A 165 -0.504 3.919 -13.517 1.00 0.00 C ATOM 0 HA PRO A 165 -1.944 6.870 -13.384 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -1.382 5.968 -15.941 1.00 0.00 H new ATOM 0 HB3 PRO A 165 -0.181 6.683 -14.885 1.00 0.00 H new ATOM 0 HG2 PRO A 165 -0.505 3.852 -15.675 1.00 0.00 H new ATOM 0 HG3 PRO A 165 0.899 4.647 -14.988 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -0.942 2.926 -13.617 1.00 0.00 H new ATOM 0 HD3 PRO A 165 0.392 3.812 -12.906 1.00 0.00 H new ATOM 512 N GLU A 166 -3.580 4.346 -14.634 1.00 0.00 N ATOM 513 CA GLU A 166 -4.896 3.939 -15.095 1.00 0.00 C ATOM 514 C GLU A 166 -5.835 3.734 -13.906 1.00 0.00 C ATOM 515 O GLU A 166 -5.399 3.752 -12.755 1.00 0.00 O ATOM 516 CB GLU A 166 -4.810 2.674 -15.952 1.00 0.00 C ATOM 517 CG GLU A 166 -3.749 2.822 -17.043 1.00 0.00 C ATOM 518 CD GLU A 166 -2.431 2.168 -16.620 1.00 0.00 C ATOM 519 OE1 GLU A 166 -2.054 2.363 -15.444 1.00 0.00 O ATOM 520 OE2 GLU A 166 -1.832 1.488 -17.480 1.00 0.00 O ATOM 0 H GLU A 166 -2.893 3.593 -14.586 1.00 0.00 H new ATOM 0 HA GLU A 166 -5.303 4.734 -15.720 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -4.571 1.818 -15.321 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -5.780 2.473 -16.408 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -4.106 2.365 -17.966 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -3.584 3.879 -17.253 1.00 0.00 H new ATOM 527 N GLU A 167 -7.108 3.543 -14.223 1.00 0.00 N ATOM 528 CA GLU A 167 -8.112 3.334 -13.194 1.00 0.00 C ATOM 529 C GLU A 167 -8.653 1.904 -13.264 1.00 0.00 C ATOM 530 O GLU A 167 -9.864 1.697 -13.324 1.00 0.00 O ATOM 531 CB GLU A 167 -9.244 4.355 -13.319 1.00 0.00 C ATOM 532 CG GLU A 167 -10.014 4.164 -14.627 1.00 0.00 C ATOM 533 CD GLU A 167 -9.660 5.257 -15.637 1.00 0.00 C ATOM 534 OE1 GLU A 167 -8.501 5.723 -15.586 1.00 0.00 O ATOM 535 OE2 GLU A 167 -10.556 5.603 -16.436 1.00 0.00 O ATOM 0 H GLU A 167 -7.466 3.529 -15.178 1.00 0.00 H new ATOM 0 HA GLU A 167 -7.643 3.477 -12.220 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -9.925 4.253 -12.474 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -8.834 5.364 -13.278 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -9.784 3.186 -15.049 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -11.086 4.181 -14.428 1.00 0.00 H new ATOM 542 N GLN A 168 -7.729 0.955 -13.252 1.00 0.00 N ATOM 543 CA GLN A 168 -8.098 -0.450 -13.312 1.00 0.00 C ATOM 544 C GLN A 168 -6.857 -1.316 -13.539 1.00 0.00 C ATOM 545 O GLN A 168 -6.795 -2.451 -13.073 1.00 0.00 O ATOM 546 CB GLN A 168 -9.145 -0.695 -14.401 1.00 0.00 C ATOM 547 CG GLN A 168 -10.542 -0.844 -13.796 1.00 0.00 C ATOM 548 CD GLN A 168 -11.203 -2.144 -14.258 1.00 0.00 C ATOM 549 OE1 GLN A 168 -10.620 -2.951 -14.965 1.00 0.00 O ATOM 550 NE2 GLN A 168 -12.450 -2.302 -13.823 1.00 0.00 N ATOM 0 H GLN A 168 -6.726 1.131 -13.202 1.00 0.00 H new ATOM 0 HA GLN A 168 -8.542 -0.730 -12.357 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -9.138 0.133 -15.110 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -8.889 -1.595 -14.960 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -10.474 -0.833 -12.708 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -11.160 0.006 -14.086 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -12.879 -1.588 -13.234 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -12.977 -3.137 -14.078 1.00 0.00 H new ATOM 559 N TRP A 169 -5.901 -0.745 -14.257 1.00 0.00 N ATOM 560 CA TRP A 169 -4.665 -1.451 -14.552 1.00 0.00 C ATOM 561 C TRP A 169 -3.499 -0.575 -14.089 1.00 0.00 C ATOM 562 O TRP A 169 -3.125 0.377 -14.772 1.00 0.00 O ATOM 563 CB TRP A 169 -4.584 -1.820 -16.035 1.00 0.00 C ATOM 564 CG TRP A 169 -5.380 -3.072 -16.409 1.00 0.00 C ATOM 565 CD1 TRP A 169 -6.544 -3.143 -17.069 1.00 0.00 C ATOM 566 CD2 TRP A 169 -5.020 -4.438 -16.117 1.00 0.00 C ATOM 567 NE1 TRP A 169 -6.959 -4.449 -17.223 1.00 0.00 N ATOM 568 CE2 TRP A 169 -6.003 -5.263 -16.625 1.00 0.00 C ATOM 569 CE3 TRP A 169 -3.901 -4.960 -15.445 1.00 0.00 C ATOM 570 CZ2 TRP A 169 -5.966 -6.658 -16.516 1.00 0.00 C ATOM 571 CZ3 TRP A 169 -3.879 -6.356 -15.343 1.00 0.00 C ATOM 572 CH2 TRP A 169 -4.860 -7.200 -15.851 1.00 0.00 C ATOM 0 H TRP A 169 -5.957 0.198 -14.643 1.00 0.00 H new ATOM 0 HA TRP A 169 -4.624 -2.398 -14.015 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -4.947 -0.981 -16.628 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -3.539 -1.972 -16.304 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -7.089 -2.285 -17.434 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -7.811 -4.761 -17.690 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -3.120 -4.334 -15.040 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -6.748 -7.282 -16.923 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -3.041 -6.809 -14.834 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -4.769 -8.270 -15.733 1.00 0.00 H new ATOM 583 N TRP A 170 -2.957 -0.929 -12.934 1.00 0.00 N ATOM 584 CA TRP A 170 -1.841 -0.188 -12.371 1.00 0.00 C ATOM 585 C TRP A 170 -0.580 -1.040 -12.530 1.00 0.00 C ATOM 586 O TRP A 170 -0.652 -2.185 -12.973 1.00 0.00 O ATOM 587 CB TRP A 170 -2.119 0.204 -10.919 1.00 0.00 C ATOM 588 CG TRP A 170 -3.517 0.781 -10.687 1.00 0.00 C ATOM 589 CD1 TRP A 170 -4.300 1.425 -11.563 1.00 0.00 C ATOM 590 CD2 TRP A 170 -4.271 0.739 -9.458 1.00 0.00 C ATOM 591 NE1 TRP A 170 -5.498 1.800 -10.990 1.00 0.00 N ATOM 592 CE2 TRP A 170 -5.480 1.369 -9.669 1.00 0.00 C ATOM 593 CE3 TRP A 170 -3.942 0.187 -8.207 1.00 0.00 C ATOM 594 CZ2 TRP A 170 -6.458 1.506 -8.676 1.00 0.00 C ATOM 595 CZ3 TRP A 170 -4.930 0.332 -7.225 1.00 0.00 C ATOM 596 CH2 TRP A 170 -6.151 0.964 -7.423 1.00 0.00 C ATOM 0 H TRP A 170 -3.270 -1.720 -12.372 1.00 0.00 H new ATOM 0 HA TRP A 170 -1.695 0.752 -12.902 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -1.990 -0.673 -10.285 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -1.377 0.938 -10.603 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -4.028 1.625 -12.589 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -6.257 2.301 -11.451 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -3.002 -0.310 -8.018 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -7.398 2.003 -8.867 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -4.729 -0.076 -6.246 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -6.861 1.037 -6.613 1.00 0.00 H new ATOM 607 N ASN A 171 0.547 -0.447 -12.159 1.00 0.00 N ATOM 608 CA ASN A 171 1.821 -1.137 -12.255 1.00 0.00 C ATOM 609 C ASN A 171 2.319 -1.477 -10.848 1.00 0.00 C ATOM 610 O ASN A 171 2.641 -0.582 -10.068 1.00 0.00 O ATOM 611 CB ASN A 171 2.875 -0.257 -12.929 1.00 0.00 C ATOM 612 CG ASN A 171 3.642 -1.040 -13.996 1.00 0.00 C ATOM 613 OD1 ASN A 171 4.344 -1.999 -13.716 1.00 0.00 O ATOM 614 ND2 ASN A 171 3.471 -0.581 -15.232 1.00 0.00 N ATOM 0 H ASN A 171 0.603 0.503 -11.792 1.00 0.00 H new ATOM 0 HA ASN A 171 1.672 -2.039 -12.848 1.00 0.00 H new ATOM 0 HB2 ASN A 171 2.394 0.609 -13.384 1.00 0.00 H new ATOM 0 HB3 ASN A 171 3.571 0.121 -12.180 1.00 0.00 H new ATOM 0 HD21 ASN A 171 3.941 -1.036 -16.015 1.00 0.00 H new ATOM 0 HD22 ASN A 171 2.870 0.226 -15.398 1.00 0.00 H new ATOM 621 N ALA A 172 2.365 -2.770 -10.567 1.00 0.00 N ATOM 622 CA ALA A 172 2.819 -3.239 -9.269 1.00 0.00 C ATOM 623 C ALA A 172 3.754 -4.434 -9.460 1.00 0.00 C ATOM 624 O ALA A 172 3.789 -5.034 -10.534 1.00 0.00 O ATOM 625 CB ALA A 172 1.608 -3.579 -8.397 1.00 0.00 C ATOM 0 H ALA A 172 2.095 -3.509 -11.217 1.00 0.00 H new ATOM 0 HA ALA A 172 3.382 -2.460 -8.756 1.00 0.00 H new ATOM 0 HB1 ALA A 172 1.948 -3.931 -7.423 1.00 0.00 H new ATOM 0 HB2 ALA A 172 0.992 -2.689 -8.266 1.00 0.00 H new ATOM 0 HB3 ALA A 172 1.020 -4.360 -8.880 1.00 0.00 H new ATOM 631 N GLU A 173 4.490 -4.745 -8.403 1.00 0.00 N ATOM 632 CA GLU A 173 5.422 -5.858 -8.440 1.00 0.00 C ATOM 633 C GLU A 173 4.725 -7.150 -8.009 1.00 0.00 C ATOM 634 O GLU A 173 3.752 -7.113 -7.257 1.00 0.00 O ATOM 635 CB GLU A 173 6.646 -5.578 -7.567 1.00 0.00 C ATOM 636 CG GLU A 173 7.701 -4.783 -8.340 1.00 0.00 C ATOM 637 CD GLU A 173 7.519 -3.278 -8.126 1.00 0.00 C ATOM 638 OE1 GLU A 173 6.349 -2.863 -7.980 1.00 0.00 O ATOM 639 OE2 GLU A 173 8.553 -2.578 -8.114 1.00 0.00 O ATOM 0 H GLU A 173 4.459 -4.244 -7.515 1.00 0.00 H new ATOM 0 HA GLU A 173 5.769 -5.981 -9.466 1.00 0.00 H new ATOM 0 HB2 GLU A 173 6.344 -5.022 -6.679 1.00 0.00 H new ATOM 0 HB3 GLU A 173 7.075 -6.519 -7.223 1.00 0.00 H new ATOM 0 HG2 GLU A 173 8.697 -5.082 -8.015 1.00 0.00 H new ATOM 0 HG3 GLU A 173 7.629 -5.014 -9.403 1.00 0.00 H new ATOM 646 N ASP A 174 5.250 -8.262 -8.504 1.00 0.00 N ATOM 647 CA ASP A 174 4.691 -9.562 -8.178 1.00 0.00 C ATOM 648 C ASP A 174 5.342 -10.087 -6.897 1.00 0.00 C ATOM 649 O ASP A 174 5.899 -9.315 -6.118 1.00 0.00 O ATOM 650 CB ASP A 174 4.961 -10.573 -9.294 1.00 0.00 C ATOM 651 CG ASP A 174 3.735 -11.353 -9.772 1.00 0.00 C ATOM 652 OD1 ASP A 174 2.616 -10.919 -9.424 1.00 0.00 O ATOM 653 OD2 ASP A 174 3.945 -12.366 -10.475 1.00 0.00 O ATOM 0 H ASP A 174 6.056 -8.289 -9.128 1.00 0.00 H new ATOM 0 HA ASP A 174 3.615 -9.443 -8.051 1.00 0.00 H new ATOM 0 HB2 ASP A 174 5.391 -10.045 -10.145 1.00 0.00 H new ATOM 0 HB3 ASP A 174 5.712 -11.283 -8.946 1.00 0.00 H new ATOM 658 N SER A 175 5.249 -11.397 -6.717 1.00 0.00 N ATOM 659 CA SER A 175 5.822 -12.034 -5.544 1.00 0.00 C ATOM 660 C SER A 175 7.321 -12.262 -5.752 1.00 0.00 C ATOM 661 O SER A 175 7.963 -12.949 -4.960 1.00 0.00 O ATOM 662 CB SER A 175 5.121 -13.358 -5.238 1.00 0.00 C ATOM 663 OG SER A 175 5.296 -14.309 -6.284 1.00 0.00 O ATOM 0 H SER A 175 4.785 -12.034 -7.364 1.00 0.00 H new ATOM 0 HA SER A 175 5.677 -11.372 -4.690 1.00 0.00 H new ATOM 0 HB2 SER A 175 5.511 -13.768 -4.306 1.00 0.00 H new ATOM 0 HB3 SER A 175 4.057 -13.178 -5.086 1.00 0.00 H new ATOM 0 HG SER A 175 4.835 -15.141 -6.050 1.00 0.00 H new ATOM 669 N GLU A 176 7.834 -11.673 -6.822 1.00 0.00 N ATOM 670 CA GLU A 176 9.245 -11.805 -7.145 1.00 0.00 C ATOM 671 C GLU A 176 9.852 -10.431 -7.437 1.00 0.00 C ATOM 672 O GLU A 176 11.059 -10.313 -7.637 1.00 0.00 O ATOM 673 CB GLU A 176 9.451 -12.759 -8.322 1.00 0.00 C ATOM 674 CG GLU A 176 9.090 -14.194 -7.937 1.00 0.00 C ATOM 675 CD GLU A 176 10.216 -14.845 -7.130 1.00 0.00 C ATOM 676 OE1 GLU A 176 11.119 -15.417 -7.777 1.00 0.00 O ATOM 677 OE2 GLU A 176 10.148 -14.755 -5.886 1.00 0.00 O ATOM 0 H GLU A 176 7.298 -11.103 -7.477 1.00 0.00 H new ATOM 0 HA GLU A 176 9.758 -12.231 -6.283 1.00 0.00 H new ATOM 0 HB2 GLU A 176 8.837 -12.440 -9.164 1.00 0.00 H new ATOM 0 HB3 GLU A 176 10.490 -12.718 -8.650 1.00 0.00 H new ATOM 0 HG2 GLU A 176 8.170 -14.197 -7.352 1.00 0.00 H new ATOM 0 HG3 GLU A 176 8.898 -14.778 -8.837 1.00 0.00 H new ATOM 684 N GLY A 177 8.986 -9.428 -7.453 1.00 0.00 N ATOM 685 CA GLY A 177 9.423 -8.068 -7.717 1.00 0.00 C ATOM 686 C GLY A 177 9.125 -7.668 -9.165 1.00 0.00 C ATOM 687 O GLY A 177 9.231 -6.497 -9.523 1.00 0.00 O ATOM 0 H GLY A 177 7.985 -9.530 -7.288 1.00 0.00 H new ATOM 0 HA2 GLY A 177 8.920 -7.382 -7.035 1.00 0.00 H new ATOM 0 HA3 GLY A 177 10.492 -7.982 -7.525 1.00 0.00 H new ATOM 691 N LYS A 178 8.757 -8.665 -9.957 1.00 0.00 N ATOM 692 CA LYS A 178 8.445 -8.433 -11.356 1.00 0.00 C ATOM 693 C LYS A 178 7.374 -7.344 -11.460 1.00 0.00 C ATOM 694 O LYS A 178 6.242 -7.536 -11.020 1.00 0.00 O ATOM 695 CB LYS A 178 8.056 -9.743 -12.043 1.00 0.00 C ATOM 696 CG LYS A 178 9.272 -10.657 -12.211 1.00 0.00 C ATOM 697 CD LYS A 178 9.386 -11.160 -13.650 1.00 0.00 C ATOM 698 CE LYS A 178 9.679 -12.660 -13.686 1.00 0.00 C ATOM 699 NZ LYS A 178 8.478 -13.433 -13.297 1.00 0.00 N ATOM 0 H LYS A 178 8.668 -9.635 -9.656 1.00 0.00 H new ATOM 0 HA LYS A 178 9.325 -8.070 -11.887 1.00 0.00 H new ATOM 0 HB2 LYS A 178 7.292 -10.253 -11.456 1.00 0.00 H new ATOM 0 HB3 LYS A 178 7.619 -9.530 -13.019 1.00 0.00 H new ATOM 0 HG2 LYS A 178 10.178 -10.116 -11.938 1.00 0.00 H new ATOM 0 HG3 LYS A 178 9.190 -11.505 -11.531 1.00 0.00 H new ATOM 0 HD2 LYS A 178 8.459 -10.954 -14.185 1.00 0.00 H new ATOM 0 HD3 LYS A 178 10.179 -10.619 -14.166 1.00 0.00 H new ATOM 0 HE2 LYS A 178 9.997 -12.950 -14.687 1.00 0.00 H new ATOM 0 HE3 LYS A 178 10.502 -12.892 -13.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 8.612 -14.433 -13.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 8.331 -13.352 -12.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 7.647 -13.058 -13.796 1.00 0.00 H new ATOM 713 N ARG A 179 7.771 -6.223 -12.046 1.00 0.00 N ATOM 714 CA ARG A 179 6.862 -5.103 -12.214 1.00 0.00 C ATOM 715 C ARG A 179 6.059 -5.261 -13.507 1.00 0.00 C ATOM 716 O ARG A 179 6.633 -5.395 -14.586 1.00 0.00 O ATOM 717 CB ARG A 179 7.622 -3.776 -12.253 1.00 0.00 C ATOM 718 CG ARG A 179 7.626 -3.107 -10.878 1.00 0.00 C ATOM 719 CD ARG A 179 7.714 -1.584 -11.008 1.00 0.00 C ATOM 720 NE ARG A 179 9.123 -1.147 -10.884 1.00 0.00 N ATOM 721 CZ ARG A 179 9.510 -0.040 -10.235 1.00 0.00 C ATOM 722 NH1 ARG A 179 8.599 0.746 -9.648 1.00 0.00 N ATOM 723 NH2 ARG A 179 10.811 0.278 -10.173 1.00 0.00 N ATOM 0 H ARG A 179 8.711 -6.067 -12.410 1.00 0.00 H new ATOM 0 HA ARG A 179 6.185 -5.095 -11.360 1.00 0.00 H new ATOM 0 HB2 ARG A 179 8.647 -3.949 -12.580 1.00 0.00 H new ATOM 0 HB3 ARG A 179 7.162 -3.111 -12.984 1.00 0.00 H new ATOM 0 HG2 ARG A 179 6.720 -3.377 -10.336 1.00 0.00 H new ATOM 0 HG3 ARG A 179 8.469 -3.475 -10.293 1.00 0.00 H new ATOM 0 HD2 ARG A 179 7.310 -1.269 -11.970 1.00 0.00 H new ATOM 0 HD3 ARG A 179 7.108 -1.109 -10.237 1.00 0.00 H new ATOM 0 HE ARG A 179 9.843 -1.724 -11.319 1.00 0.00 H new ATOM 0 HH11 ARG A 179 7.610 0.503 -9.694 1.00 0.00 H new ATOM 0 HH12 ARG A 179 8.894 1.588 -9.154 1.00 0.00 H new ATOM 0 HH21 ARG A 179 11.505 -0.322 -10.619 1.00 0.00 H new ATOM 0 HH22 ARG A 179 11.107 1.120 -9.680 1.00 0.00 H new ATOM 737 N GLY A 180 4.743 -5.241 -13.355 1.00 0.00 N ATOM 738 CA GLY A 180 3.855 -5.379 -14.497 1.00 0.00 C ATOM 739 C GLY A 180 2.496 -4.733 -14.217 1.00 0.00 C ATOM 740 O GLY A 180 2.336 -4.020 -13.228 1.00 0.00 O ATOM 0 H GLY A 180 4.270 -5.131 -12.458 1.00 0.00 H new ATOM 0 HA2 GLY A 180 4.309 -4.915 -15.373 1.00 0.00 H new ATOM 0 HA3 GLY A 180 3.718 -6.435 -14.730 1.00 0.00 H new ATOM 744 N MET A 181 1.553 -5.004 -15.108 1.00 0.00 N ATOM 745 CA MET A 181 0.214 -4.459 -14.969 1.00 0.00 C ATOM 746 C MET A 181 -0.668 -5.378 -14.121 1.00 0.00 C ATOM 747 O MET A 181 -0.896 -6.531 -14.482 1.00 0.00 O ATOM 748 CB MET A 181 -0.412 -4.285 -16.354 1.00 0.00 C ATOM 749 CG MET A 181 -1.433 -3.145 -16.356 1.00 0.00 C ATOM 750 SD MET A 181 -0.764 -1.730 -17.214 1.00 0.00 S ATOM 751 CE MET A 181 -0.127 -0.799 -15.831 1.00 0.00 C ATOM 0 H MET A 181 1.690 -5.594 -15.929 1.00 0.00 H new ATOM 0 HA MET A 181 0.285 -3.493 -14.468 1.00 0.00 H new ATOM 0 HB2 MET A 181 0.369 -4.080 -17.087 1.00 0.00 H new ATOM 0 HB3 MET A 181 -0.897 -5.213 -16.657 1.00 0.00 H new ATOM 0 HG2 MET A 181 -2.354 -3.471 -16.839 1.00 0.00 H new ATOM 0 HG3 MET A 181 -1.689 -2.873 -15.332 1.00 0.00 H new ATOM 0 HE1 MET A 181 0.406 0.078 -16.198 1.00 0.00 H new ATOM 0 HE2 MET A 181 -0.953 -0.482 -15.195 1.00 0.00 H new ATOM 0 HE3 MET A 181 0.555 -1.424 -15.255 1.00 0.00 H new ATOM 761 N ILE A 182 -1.140 -4.832 -13.010 1.00 0.00 N ATOM 762 CA ILE A 182 -1.992 -5.588 -12.108 1.00 0.00 C ATOM 763 C ILE A 182 -3.421 -5.050 -12.192 1.00 0.00 C ATOM 764 O ILE A 182 -3.635 -3.839 -12.159 1.00 0.00 O ATOM 765 CB ILE A 182 -1.413 -5.581 -10.692 1.00 0.00 C ATOM 766 CG1 ILE A 182 -1.307 -4.152 -10.151 1.00 0.00 C ATOM 767 CG2 ILE A 182 -0.071 -6.313 -10.643 1.00 0.00 C ATOM 768 CD1 ILE A 182 -2.324 -3.912 -9.035 1.00 0.00 C ATOM 0 H ILE A 182 -0.949 -3.875 -12.714 1.00 0.00 H new ATOM 0 HA ILE A 182 -2.028 -6.636 -12.407 1.00 0.00 H new ATOM 0 HB ILE A 182 -2.098 -6.123 -10.040 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -0.300 -3.976 -9.774 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -1.474 -3.440 -10.959 1.00 0.00 H new ATOM 0 HG21 ILE A 182 0.318 -6.293 -9.625 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -0.209 -7.347 -10.958 1.00 0.00 H new ATOM 0 HG23 ILE A 182 0.636 -5.821 -11.311 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -2.228 -2.890 -8.668 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -3.331 -4.065 -9.422 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -2.139 -4.609 -8.218 1.00 0.00 H new ATOM 780 N PRO A 183 -4.388 -5.999 -12.300 1.00 0.00 N ATOM 781 CA PRO A 183 -5.791 -5.633 -12.389 1.00 0.00 C ATOM 782 C PRO A 183 -6.329 -5.192 -11.026 1.00 0.00 C ATOM 783 O PRO A 183 -6.205 -5.918 -10.040 1.00 0.00 O ATOM 784 CB PRO A 183 -6.488 -6.870 -12.930 1.00 0.00 C ATOM 785 CG PRO A 183 -5.532 -8.027 -12.687 1.00 0.00 C ATOM 786 CD PRO A 183 -4.172 -7.443 -12.342 1.00 0.00 C ATOM 0 HA PRO A 183 -5.962 -4.778 -13.044 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -7.439 -7.036 -12.423 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -6.708 -6.761 -13.992 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -5.894 -8.657 -11.875 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -5.463 -8.658 -13.573 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -3.812 -7.817 -11.384 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -3.425 -7.710 -13.090 1.00 0.00 H new ATOM 794 N VAL A 184 -6.916 -4.004 -11.013 1.00 0.00 N ATOM 795 CA VAL A 184 -7.473 -3.457 -9.787 1.00 0.00 C ATOM 796 C VAL A 184 -8.741 -4.231 -9.420 1.00 0.00 C ATOM 797 O VAL A 184 -9.078 -4.355 -8.243 1.00 0.00 O ATOM 798 CB VAL A 184 -7.715 -1.955 -9.947 1.00 0.00 C ATOM 799 CG1 VAL A 184 -8.275 -1.350 -8.659 1.00 0.00 C ATOM 800 CG2 VAL A 184 -6.435 -1.237 -10.377 1.00 0.00 C ATOM 0 H VAL A 184 -7.018 -3.405 -11.832 1.00 0.00 H new ATOM 0 HA VAL A 184 -6.770 -3.573 -8.962 1.00 0.00 H new ATOM 0 HB VAL A 184 -8.458 -1.817 -10.733 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -8.438 -0.281 -8.800 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -9.221 -1.832 -8.412 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -7.566 -1.505 -7.846 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -6.634 -0.171 -10.484 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -5.662 -1.388 -9.623 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -6.095 -1.640 -11.331 1.00 0.00 H new ATOM 810 N PRO A 185 -9.428 -4.744 -10.475 1.00 0.00 N ATOM 811 CA PRO A 185 -10.652 -5.502 -10.276 1.00 0.00 C ATOM 812 C PRO A 185 -10.348 -6.905 -9.748 1.00 0.00 C ATOM 813 O PRO A 185 -11.157 -7.491 -9.030 1.00 0.00 O ATOM 814 CB PRO A 185 -11.333 -5.514 -11.635 1.00 0.00 C ATOM 815 CG PRO A 185 -10.254 -5.166 -12.646 1.00 0.00 C ATOM 816 CD PRO A 185 -9.060 -4.616 -11.883 1.00 0.00 C ATOM 0 HA PRO A 185 -11.303 -5.059 -9.523 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -11.765 -6.492 -11.846 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -12.148 -4.791 -11.670 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -9.968 -6.049 -13.218 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -10.623 -4.430 -13.360 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -8.153 -5.178 -12.108 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -8.865 -3.577 -12.148 1.00 0.00 H new ATOM 824 N TYR A 186 -9.178 -7.403 -10.124 1.00 0.00 N ATOM 825 CA TYR A 186 -8.758 -8.727 -9.697 1.00 0.00 C ATOM 826 C TYR A 186 -7.776 -8.639 -8.526 1.00 0.00 C ATOM 827 O TYR A 186 -7.318 -9.661 -8.017 1.00 0.00 O ATOM 828 CB TYR A 186 -8.045 -9.350 -10.899 1.00 0.00 C ATOM 829 CG TYR A 186 -8.990 -9.951 -11.940 1.00 0.00 C ATOM 830 CD1 TYR A 186 -10.024 -9.193 -12.452 1.00 0.00 C ATOM 831 CD2 TYR A 186 -8.809 -11.250 -12.369 1.00 0.00 C ATOM 832 CE1 TYR A 186 -10.914 -9.759 -13.433 1.00 0.00 C ATOM 833 CE2 TYR A 186 -9.698 -11.815 -13.350 1.00 0.00 C ATOM 834 CZ TYR A 186 -10.708 -11.041 -13.833 1.00 0.00 C ATOM 835 OH TYR A 186 -11.549 -11.576 -14.760 1.00 0.00 O ATOM 0 H TYR A 186 -8.509 -6.914 -10.719 1.00 0.00 H new ATOM 0 HA TYR A 186 -9.615 -9.315 -9.368 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -7.430 -8.588 -11.378 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -7.369 -10.128 -10.544 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -10.166 -8.176 -12.117 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -8.000 -11.843 -11.969 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -11.727 -9.177 -13.842 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -9.567 -12.830 -13.695 1.00 0.00 H new ATOM 0 HH TYR A 186 -11.281 -12.499 -14.951 1.00 0.00 H new ATOM 845 N VAL A 187 -7.483 -7.409 -8.133 1.00 0.00 N ATOM 846 CA VAL A 187 -6.565 -7.174 -7.031 1.00 0.00 C ATOM 847 C VAL A 187 -7.126 -6.071 -6.131 1.00 0.00 C ATOM 848 O VAL A 187 -7.988 -5.301 -6.551 1.00 0.00 O ATOM 849 CB VAL A 187 -5.171 -6.851 -7.572 1.00 0.00 C ATOM 850 CG1 VAL A 187 -4.862 -7.679 -8.821 1.00 0.00 C ATOM 851 CG2 VAL A 187 -5.024 -5.355 -7.857 1.00 0.00 C ATOM 0 H VAL A 187 -7.865 -6.564 -8.558 1.00 0.00 H new ATOM 0 HA VAL A 187 -6.464 -8.072 -6.421 1.00 0.00 H new ATOM 0 HB VAL A 187 -4.445 -7.118 -6.804 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -3.865 -7.430 -9.185 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -4.903 -8.740 -8.574 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -5.597 -7.458 -9.595 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -4.024 -5.154 -8.240 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -5.764 -5.051 -8.597 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -5.179 -4.792 -6.937 1.00 0.00 H new ATOM 861 N GLU A 188 -6.616 -6.033 -4.909 1.00 0.00 N ATOM 862 CA GLU A 188 -7.056 -5.037 -3.945 1.00 0.00 C ATOM 863 C GLU A 188 -5.893 -4.120 -3.563 1.00 0.00 C ATOM 864 O GLU A 188 -4.737 -4.539 -3.572 1.00 0.00 O ATOM 865 CB GLU A 188 -7.660 -5.703 -2.707 1.00 0.00 C ATOM 866 CG GLU A 188 -8.781 -4.846 -2.116 1.00 0.00 C ATOM 867 CD GLU A 188 -9.950 -4.721 -3.095 1.00 0.00 C ATOM 868 OE1 GLU A 188 -10.355 -5.774 -3.633 1.00 0.00 O ATOM 869 OE2 GLU A 188 -10.413 -3.575 -3.282 1.00 0.00 O ATOM 0 H GLU A 188 -5.903 -6.675 -4.564 1.00 0.00 H new ATOM 0 HA GLU A 188 -7.835 -4.430 -4.407 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -8.050 -6.686 -2.972 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -6.883 -5.859 -1.958 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -9.129 -5.289 -1.183 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -8.397 -3.855 -1.874 1.00 0.00 H new ATOM 876 N LYS A 189 -6.240 -2.884 -3.235 1.00 0.00 N ATOM 877 CA LYS A 189 -5.240 -1.902 -2.849 1.00 0.00 C ATOM 878 C LYS A 189 -4.945 -2.042 -1.355 1.00 0.00 C ATOM 879 O LYS A 189 -5.790 -1.721 -0.519 1.00 0.00 O ATOM 880 CB LYS A 189 -5.682 -0.497 -3.261 1.00 0.00 C ATOM 881 CG LYS A 189 -6.897 -0.044 -2.449 1.00 0.00 C ATOM 882 CD LYS A 189 -6.502 1.005 -1.407 1.00 0.00 C ATOM 883 CE LYS A 189 -7.312 2.289 -1.587 1.00 0.00 C ATOM 884 NZ LYS A 189 -7.152 3.172 -0.409 1.00 0.00 N ATOM 0 H LYS A 189 -7.200 -2.540 -3.229 1.00 0.00 H new ATOM 0 HA LYS A 189 -4.304 -2.083 -3.377 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -4.860 0.204 -3.115 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -5.925 -0.485 -4.323 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -7.652 0.369 -3.118 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -7.347 -0.903 -1.952 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -6.664 0.606 -0.405 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -5.438 1.227 -1.494 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -6.984 2.810 -2.487 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -8.365 2.045 -1.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -7.709 4.040 -0.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -7.487 2.678 0.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -6.148 3.419 -0.294 1.00 0.00 H new ATOM 898 N TYR A 190 -3.745 -2.520 -1.063 1.00 0.00 N ATOM 899 CA TYR A 190 -3.329 -2.704 0.317 1.00 0.00 C ATOM 900 C TYR A 190 -2.026 -1.954 0.602 1.00 0.00 C ATOM 901 O TYR A 190 -0.976 -2.571 0.782 1.00 0.00 O ATOM 902 CB TYR A 190 -3.086 -4.205 0.487 1.00 0.00 C ATOM 903 CG TYR A 190 -3.190 -4.693 1.934 1.00 0.00 C ATOM 904 CD1 TYR A 190 -2.477 -4.056 2.929 1.00 0.00 C ATOM 905 CD2 TYR A 190 -3.995 -5.770 2.243 1.00 0.00 C ATOM 906 CE1 TYR A 190 -2.574 -4.515 4.291 1.00 0.00 C ATOM 907 CE2 TYR A 190 -4.093 -6.228 3.604 1.00 0.00 C ATOM 908 CZ TYR A 190 -3.377 -5.579 4.560 1.00 0.00 C ATOM 909 OH TYR A 190 -3.470 -6.012 5.847 1.00 0.00 O ATOM 0 H TYR A 190 -3.047 -2.786 -1.758 1.00 0.00 H new ATOM 0 HA TYR A 190 -4.088 -2.322 1.000 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -3.807 -4.750 -0.122 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -2.095 -4.448 0.103 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -1.846 -3.213 2.687 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -4.552 -6.269 1.464 1.00 0.00 H new ATOM 0 HE1 TYR A 190 -2.022 -4.026 5.080 1.00 0.00 H new ATOM 0 HE2 TYR A 190 -4.721 -7.068 3.860 1.00 0.00 H new ATOM 0 HH TYR A 190 -4.079 -6.778 5.891 1.00 0.00 H new ATOM 919 N GLY A 191 -2.135 -0.634 0.635 1.00 0.00 N ATOM 920 CA GLY A 191 -0.979 0.206 0.895 1.00 0.00 C ATOM 921 C GLY A 191 -0.213 0.501 -0.396 1.00 0.00 C ATOM 922 O GLY A 191 -0.782 1.028 -1.352 1.00 0.00 O ATOM 0 H GLY A 191 -3.007 -0.126 0.486 1.00 0.00 H new ATOM 0 HA2 GLY A 191 -1.301 1.141 1.353 1.00 0.00 H new ATOM 0 HA3 GLY A 191 -0.319 -0.288 1.608 1.00 0.00 H new TER 926 GLY A 191