USER MOD reduce.3.24.130724 H: found=0, std=0, add=449, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 452 hydrogens (2 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 184 HIS : no HD1:sc= 0.443 K(o=1,f=0.15) USER MOD Set 1.2: A 188 THR OG1 : rot 142:sc= 0.589 USER MOD Set 2.1: A 159 HIS : no HD1:sc= -0.287 K(o=-0.028,f=-3.3) USER MOD Set 2.2: A 164 ASN : amide:sc= 0.258 X(o=-0.028,f=0.14) USER MOD Single : A 143 LYS NZ :NH3+ -134:sc= 0 (180deg=-0.0731) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 146 SER OG : rot -42:sc= 0.485 USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 156 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 160 LYS NZ :NH3+ 152:sc= 1.19 (180deg=-1.09) USER MOD Single : A 171 LYS NZ :NH3+ -175:sc= 2.46 (180deg=2.33) USER MOD Single : A 177 THR OG1 : rot 180:sc= 0.257 USER MOD Single : A 179 ASN : amide:sc= 0.642 K(o=0.64,f=0) USER MOD Single : A 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 183 ASN :FLIP amide:sc= 0.791 F(o=0,f=0.79) USER MOD Single : A 186 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 187 SER OG : rot 180:sc= 0 USER MOD Single : A 189 MET CE :methyl -113:sc= -0.448 (180deg=-1.46) USER MOD Single : A 192 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0554) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 142 14.750 -0.683 -7.223 1.00 0.00 N ATOM 2 CA VAL A 142 14.281 -1.761 -8.110 1.00 0.00 C ATOM 3 C VAL A 142 14.005 -1.204 -9.508 1.00 0.00 C ATOM 4 O VAL A 142 13.632 -0.040 -9.644 1.00 0.00 O ATOM 5 CB VAL A 142 13.025 -2.432 -7.519 1.00 0.00 C ATOM 6 CG1 VAL A 142 11.844 -1.453 -7.513 1.00 0.00 C ATOM 7 CG2 VAL A 142 12.653 -3.672 -8.340 1.00 0.00 C ATOM 0 HA VAL A 142 15.059 -2.520 -8.193 1.00 0.00 H new ATOM 0 HB VAL A 142 13.247 -2.728 -6.494 1.00 0.00 H new ATOM 0 HG11 VAL A 142 10.966 -1.944 -7.092 1.00 0.00 H new ATOM 0 HG12 VAL A 142 12.097 -0.582 -6.909 1.00 0.00 H new ATOM 0 HG13 VAL A 142 11.629 -1.137 -8.534 1.00 0.00 H new ATOM 0 HG21 VAL A 142 11.765 -4.138 -7.913 1.00 0.00 H new ATOM 0 HG22 VAL A 142 12.450 -3.379 -9.370 1.00 0.00 H new ATOM 0 HG23 VAL A 142 13.480 -4.382 -8.321 1.00 0.00 H new ATOM 19 N LYS A 143 14.190 -2.041 -10.538 1.00 0.00 N ATOM 20 CA LYS A 143 13.934 -1.654 -11.920 1.00 0.00 C ATOM 21 C LYS A 143 12.675 -2.363 -12.405 1.00 0.00 C ATOM 22 O LYS A 143 11.631 -1.734 -12.565 1.00 0.00 O ATOM 23 CB LYS A 143 15.141 -2.029 -12.791 1.00 0.00 C ATOM 24 CG LYS A 143 16.164 -0.890 -12.787 1.00 0.00 C ATOM 25 CD LYS A 143 15.812 0.121 -13.886 1.00 0.00 C ATOM 26 CE LYS A 143 16.765 1.320 -13.824 1.00 0.00 C ATOM 27 NZ LYS A 143 16.431 2.210 -12.697 1.00 0.00 N ATOM 0 H LYS A 143 14.520 -3.000 -10.431 1.00 0.00 H new ATOM 0 HA LYS A 143 13.784 -0.577 -11.989 1.00 0.00 H new ATOM 0 HB2 LYS A 143 15.601 -2.943 -12.415 1.00 0.00 H new ATOM 0 HB3 LYS A 143 14.815 -2.232 -13.811 1.00 0.00 H new ATOM 0 HG2 LYS A 143 16.171 -0.398 -11.815 1.00 0.00 H new ATOM 0 HG3 LYS A 143 17.166 -1.287 -12.951 1.00 0.00 H new ATOM 0 HD2 LYS A 143 15.878 -0.356 -14.864 1.00 0.00 H new ATOM 0 HD3 LYS A 143 14.783 0.458 -13.765 1.00 0.00 H new ATOM 0 HE2 LYS A 143 17.791 0.967 -13.720 1.00 0.00 H new ATOM 0 HE3 LYS A 143 16.713 1.878 -14.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 16.433 3.198 -13.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 15.488 1.968 -12.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 17.136 2.093 -11.942 1.00 0.00 H new ATOM 41 N LYS A 144 12.782 -3.678 -12.634 1.00 0.00 N ATOM 42 CA LYS A 144 11.664 -4.491 -13.089 1.00 0.00 C ATOM 43 C LYS A 144 11.477 -5.673 -12.140 1.00 0.00 C ATOM 44 O LYS A 144 12.456 -6.247 -11.652 1.00 0.00 O ATOM 45 CB LYS A 144 11.937 -4.984 -14.513 1.00 0.00 C ATOM 46 CG LYS A 144 11.862 -3.816 -15.510 1.00 0.00 C ATOM 47 CD LYS A 144 10.549 -3.873 -16.305 1.00 0.00 C ATOM 48 CE LYS A 144 9.356 -3.602 -15.380 1.00 0.00 C ATOM 49 NZ LYS A 144 8.109 -3.458 -16.153 1.00 0.00 N ATOM 0 H LYS A 144 13.648 -4.201 -12.507 1.00 0.00 H new ATOM 0 HA LYS A 144 10.751 -3.896 -13.094 1.00 0.00 H new ATOM 0 HB2 LYS A 144 12.922 -5.448 -14.561 1.00 0.00 H new ATOM 0 HB3 LYS A 144 11.210 -5.749 -14.785 1.00 0.00 H new ATOM 0 HG2 LYS A 144 11.930 -2.869 -14.975 1.00 0.00 H new ATOM 0 HG3 LYS A 144 12.710 -3.858 -16.193 1.00 0.00 H new ATOM 0 HD2 LYS A 144 10.570 -3.137 -17.108 1.00 0.00 H new ATOM 0 HD3 LYS A 144 10.441 -4.852 -16.772 1.00 0.00 H new ATOM 0 HE2 LYS A 144 9.253 -4.419 -14.665 1.00 0.00 H new ATOM 0 HE3 LYS A 144 9.537 -2.695 -14.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 7.317 -3.275 -15.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 8.202 -2.663 -16.818 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 7.926 -4.334 -16.684 1.00 0.00 H new ATOM 63 N THR A 145 10.216 -6.031 -11.880 1.00 0.00 N ATOM 64 CA THR A 145 9.887 -7.131 -10.992 1.00 0.00 C ATOM 65 C THR A 145 10.363 -8.453 -11.594 1.00 0.00 C ATOM 66 O THR A 145 10.195 -8.688 -12.789 1.00 0.00 O ATOM 67 CB THR A 145 8.369 -7.150 -10.769 1.00 0.00 C ATOM 68 OG1 THR A 145 7.921 -5.842 -10.479 1.00 0.00 O ATOM 69 CG2 THR A 145 8.024 -8.076 -9.600 1.00 0.00 C ATOM 0 H THR A 145 9.403 -5.564 -12.281 1.00 0.00 H new ATOM 0 HA THR A 145 10.390 -6.998 -10.034 1.00 0.00 H new ATOM 0 HB THR A 145 7.879 -7.515 -11.672 1.00 0.00 H new ATOM 0 HG1 THR A 145 6.951 -5.852 -10.338 1.00 0.00 H new ATOM 0 HG21 THR A 145 6.945 -8.084 -9.448 1.00 0.00 H new ATOM 0 HG22 THR A 145 8.366 -9.087 -9.823 1.00 0.00 H new ATOM 0 HG23 THR A 145 8.515 -7.718 -8.695 1.00 0.00 H new ATOM 77 N SER A 146 10.957 -9.311 -10.751 1.00 0.00 N ATOM 78 CA SER A 146 11.451 -10.623 -11.164 1.00 0.00 C ATOM 79 C SER A 146 12.533 -10.496 -12.244 1.00 0.00 C ATOM 80 O SER A 146 12.747 -11.437 -13.008 1.00 0.00 O ATOM 81 CB SER A 146 10.280 -11.482 -11.660 1.00 0.00 C ATOM 82 OG SER A 146 10.696 -12.826 -11.773 1.00 0.00 O ATOM 0 H SER A 146 11.106 -9.109 -9.762 1.00 0.00 H new ATOM 0 HA SER A 146 11.909 -11.110 -10.303 1.00 0.00 H new ATOM 0 HB2 SER A 146 9.441 -11.407 -10.968 1.00 0.00 H new ATOM 0 HB3 SER A 146 9.930 -11.116 -12.625 1.00 0.00 H new ATOM 0 HG SER A 146 11.592 -12.859 -12.168 1.00 0.00 H new ATOM 88 N TRP A 147 13.214 -9.336 -12.293 1.00 0.00 N ATOM 89 CA TRP A 147 14.290 -9.080 -13.255 1.00 0.00 C ATOM 90 C TRP A 147 13.790 -9.216 -14.702 1.00 0.00 C ATOM 91 O TRP A 147 12.620 -9.519 -14.941 1.00 0.00 O ATOM 92 CB TRP A 147 15.466 -10.027 -12.973 1.00 0.00 C ATOM 93 CG TRP A 147 16.278 -9.658 -11.772 1.00 0.00 C ATOM 94 CD1 TRP A 147 16.148 -10.176 -10.539 1.00 0.00 C ATOM 95 CD2 TRP A 147 17.355 -8.684 -11.668 1.00 0.00 C ATOM 96 NE1 TRP A 147 17.056 -9.612 -9.672 1.00 0.00 N ATOM 97 CE2 TRP A 147 17.836 -8.677 -10.322 1.00 0.00 C ATOM 98 CE3 TRP A 147 17.978 -7.803 -12.573 1.00 0.00 C ATOM 99 CZ2 TRP A 147 18.880 -7.848 -9.905 1.00 0.00 C ATOM 100 CZ3 TRP A 147 19.029 -6.961 -12.156 1.00 0.00 C ATOM 101 CH2 TRP A 147 19.480 -6.987 -10.829 1.00 0.00 C ATOM 0 H TRP A 147 13.030 -8.553 -11.665 1.00 0.00 H new ATOM 0 HA TRP A 147 14.633 -8.052 -13.136 1.00 0.00 H new ATOM 0 HB2 TRP A 147 15.080 -11.038 -12.840 1.00 0.00 H new ATOM 0 HB3 TRP A 147 16.118 -10.048 -13.846 1.00 0.00 H new ATOM 0 HD1 TRP A 147 15.428 -10.933 -10.265 1.00 0.00 H new ATOM 0 HE1 TRP A 147 17.141 -9.852 -8.684 1.00 0.00 H new ATOM 0 HE3 TRP A 147 17.646 -7.772 -13.600 1.00 0.00 H new ATOM 0 HZ2 TRP A 147 19.220 -7.872 -8.880 1.00 0.00 H new ATOM 0 HZ3 TRP A 147 19.491 -6.290 -12.865 1.00 0.00 H new ATOM 0 HH2 TRP A 147 20.290 -6.343 -10.521 1.00 0.00 H new ATOM 112 N THR A 148 14.690 -8.977 -15.670 1.00 0.00 N ATOM 113 CA THR A 148 14.360 -9.054 -17.088 1.00 0.00 C ATOM 114 C THR A 148 15.567 -9.554 -17.875 1.00 0.00 C ATOM 115 O THR A 148 16.703 -9.429 -17.425 1.00 0.00 O ATOM 116 CB THR A 148 13.941 -7.669 -17.603 1.00 0.00 C ATOM 117 OG1 THR A 148 14.896 -6.709 -17.204 1.00 0.00 O ATOM 118 CG2 THR A 148 12.569 -7.291 -17.046 1.00 0.00 C ATOM 0 H THR A 148 15.661 -8.726 -15.485 1.00 0.00 H new ATOM 0 HA THR A 148 13.532 -9.750 -17.223 1.00 0.00 H new ATOM 0 HB THR A 148 13.884 -7.697 -18.691 1.00 0.00 H new ATOM 0 HG1 THR A 148 14.629 -5.826 -17.534 1.00 0.00 H new ATOM 0 HG21 THR A 148 12.284 -6.307 -17.419 1.00 0.00 H new ATOM 0 HG22 THR A 148 11.831 -8.028 -17.364 1.00 0.00 H new ATOM 0 HG23 THR A 148 12.612 -7.268 -15.957 1.00 0.00 H new ATOM 126 N GLU A 149 15.305 -10.113 -19.063 1.00 0.00 N ATOM 127 CA GLU A 149 16.343 -10.629 -19.945 1.00 0.00 C ATOM 128 C GLU A 149 17.434 -9.572 -20.165 1.00 0.00 C ATOM 129 O GLU A 149 18.623 -9.888 -20.146 1.00 0.00 O ATOM 130 CB GLU A 149 15.681 -11.028 -21.276 1.00 0.00 C ATOM 131 CG GLU A 149 16.727 -11.509 -22.290 1.00 0.00 C ATOM 132 CD GLU A 149 17.496 -12.719 -21.771 1.00 0.00 C ATOM 133 OE1 GLU A 149 16.837 -13.603 -21.183 1.00 0.00 O ATOM 134 OE2 GLU A 149 18.728 -12.736 -21.977 1.00 0.00 O ATOM 0 H GLU A 149 14.361 -10.217 -19.435 1.00 0.00 H new ATOM 0 HA GLU A 149 16.823 -11.500 -19.498 1.00 0.00 H new ATOM 0 HB2 GLU A 149 14.950 -11.818 -21.100 1.00 0.00 H new ATOM 0 HB3 GLU A 149 15.138 -10.176 -21.685 1.00 0.00 H new ATOM 0 HG2 GLU A 149 16.235 -11.765 -23.228 1.00 0.00 H new ATOM 0 HG3 GLU A 149 17.424 -10.699 -22.506 1.00 0.00 H new ATOM 141 N GLU A 150 17.021 -8.316 -20.376 1.00 0.00 N ATOM 142 CA GLU A 150 17.949 -7.222 -20.617 1.00 0.00 C ATOM 143 C GLU A 150 18.925 -7.078 -19.445 1.00 0.00 C ATOM 144 O GLU A 150 20.139 -7.116 -19.642 1.00 0.00 O ATOM 145 CB GLU A 150 17.149 -5.927 -20.832 1.00 0.00 C ATOM 146 CG GLU A 150 18.018 -4.874 -21.534 1.00 0.00 C ATOM 147 CD GLU A 150 18.324 -5.269 -22.978 1.00 0.00 C ATOM 148 OE1 GLU A 150 17.487 -5.989 -23.567 1.00 0.00 O ATOM 149 OE2 GLU A 150 19.393 -4.849 -23.470 1.00 0.00 O ATOM 0 H GLU A 150 16.040 -8.038 -20.383 1.00 0.00 H new ATOM 0 HA GLU A 150 18.538 -7.430 -21.510 1.00 0.00 H new ATOM 0 HB2 GLU A 150 16.262 -6.135 -21.431 1.00 0.00 H new ATOM 0 HB3 GLU A 150 16.803 -5.542 -19.873 1.00 0.00 H new ATOM 0 HG2 GLU A 150 17.507 -3.911 -21.520 1.00 0.00 H new ATOM 0 HG3 GLU A 150 18.951 -4.747 -20.985 1.00 0.00 H new ATOM 156 N GLU A 151 18.395 -6.908 -18.228 1.00 0.00 N ATOM 157 CA GLU A 151 19.224 -6.733 -17.043 1.00 0.00 C ATOM 158 C GLU A 151 20.106 -7.965 -16.815 1.00 0.00 C ATOM 159 O GLU A 151 21.291 -7.828 -16.510 1.00 0.00 O ATOM 160 CB GLU A 151 18.332 -6.483 -15.828 1.00 0.00 C ATOM 161 CG GLU A 151 17.721 -5.079 -15.896 1.00 0.00 C ATOM 162 CD GLU A 151 16.984 -4.749 -14.601 1.00 0.00 C ATOM 163 OE1 GLU A 151 17.656 -4.251 -13.671 1.00 0.00 O ATOM 164 OE2 GLU A 151 15.760 -5.002 -14.558 1.00 0.00 O ATOM 0 H GLU A 151 17.392 -6.889 -18.044 1.00 0.00 H new ATOM 0 HA GLU A 151 19.877 -5.873 -17.191 1.00 0.00 H new ATOM 0 HB2 GLU A 151 17.539 -7.230 -15.790 1.00 0.00 H new ATOM 0 HB3 GLU A 151 18.914 -6.590 -14.913 1.00 0.00 H new ATOM 0 HG2 GLU A 151 18.506 -4.343 -16.071 1.00 0.00 H new ATOM 0 HG3 GLU A 151 17.032 -5.017 -16.738 1.00 0.00 H new ATOM 171 N ASP A 152 19.534 -9.166 -16.961 1.00 0.00 N ATOM 172 CA ASP A 152 20.282 -10.403 -16.776 1.00 0.00 C ATOM 173 C ASP A 152 21.514 -10.400 -17.681 1.00 0.00 C ATOM 174 O ASP A 152 22.613 -10.717 -17.232 1.00 0.00 O ATOM 175 CB ASP A 152 19.384 -11.606 -17.088 1.00 0.00 C ATOM 176 CG ASP A 152 18.513 -11.972 -15.889 1.00 0.00 C ATOM 177 OD1 ASP A 152 17.879 -11.046 -15.339 1.00 0.00 O ATOM 178 OD2 ASP A 152 18.499 -13.174 -15.544 1.00 0.00 O ATOM 0 H ASP A 152 18.553 -9.302 -17.207 1.00 0.00 H new ATOM 0 HA ASP A 152 20.611 -10.477 -15.740 1.00 0.00 H new ATOM 0 HB2 ASP A 152 18.750 -11.377 -17.945 1.00 0.00 H new ATOM 0 HB3 ASP A 152 20.001 -12.460 -17.367 1.00 0.00 H new ATOM 183 N ARG A 153 21.328 -10.036 -18.956 1.00 0.00 N ATOM 184 CA ARG A 153 22.423 -9.987 -19.917 1.00 0.00 C ATOM 185 C ARG A 153 23.507 -9.012 -19.452 1.00 0.00 C ATOM 186 O ARG A 153 24.692 -9.316 -19.567 1.00 0.00 O ATOM 187 CB ARG A 153 21.881 -9.577 -21.289 1.00 0.00 C ATOM 188 CG ARG A 153 21.521 -10.829 -22.096 1.00 0.00 C ATOM 189 CD ARG A 153 20.544 -10.460 -23.212 1.00 0.00 C ATOM 190 NE ARG A 153 20.984 -9.245 -23.917 1.00 0.00 N ATOM 191 CZ ARG A 153 20.189 -8.176 -24.114 1.00 0.00 C ATOM 192 NH1 ARG A 153 18.859 -8.289 -24.008 1.00 0.00 N ATOM 193 NH2 ARG A 153 20.734 -6.992 -24.415 1.00 0.00 N ATOM 0 H ARG A 153 20.422 -9.771 -19.342 1.00 0.00 H new ATOM 0 HA ARG A 153 22.874 -10.977 -19.993 1.00 0.00 H new ATOM 0 HB2 ARG A 153 21.002 -8.944 -21.169 1.00 0.00 H new ATOM 0 HB3 ARG A 153 22.626 -8.989 -21.825 1.00 0.00 H new ATOM 0 HG2 ARG A 153 22.422 -11.271 -22.520 1.00 0.00 H new ATOM 0 HG3 ARG A 153 21.075 -11.579 -21.442 1.00 0.00 H new ATOM 0 HD2 ARG A 153 20.464 -11.286 -23.919 1.00 0.00 H new ATOM 0 HD3 ARG A 153 19.550 -10.302 -22.793 1.00 0.00 H new ATOM 0 HE ARG A 153 21.939 -9.211 -24.274 1.00 0.00 H new ATOM 0 HH11 ARG A 153 18.441 -9.190 -23.776 1.00 0.00 H new ATOM 0 HH12 ARG A 153 18.264 -7.474 -24.159 1.00 0.00 H new ATOM 0 HH21 ARG A 153 21.747 -6.902 -24.494 1.00 0.00 H new ATOM 0 HH22 ARG A 153 20.137 -6.179 -24.565 1.00 0.00 H new ATOM 207 N ILE A 154 23.111 -7.841 -18.928 1.00 0.00 N ATOM 208 CA ILE A 154 24.074 -6.849 -18.453 1.00 0.00 C ATOM 209 C ILE A 154 24.968 -7.479 -17.385 1.00 0.00 C ATOM 210 O ILE A 154 26.195 -7.390 -17.466 1.00 0.00 O ATOM 211 CB ILE A 154 23.335 -5.616 -17.889 1.00 0.00 C ATOM 212 CG1 ILE A 154 22.575 -4.884 -19.017 1.00 0.00 C ATOM 213 CG2 ILE A 154 24.340 -4.662 -17.228 1.00 0.00 C ATOM 214 CD1 ILE A 154 23.531 -4.043 -19.874 1.00 0.00 C ATOM 0 H ILE A 154 22.135 -7.564 -18.825 1.00 0.00 H new ATOM 0 HA ILE A 154 24.696 -6.520 -19.285 1.00 0.00 H new ATOM 0 HB ILE A 154 22.615 -5.949 -17.142 1.00 0.00 H new ATOM 0 HG12 ILE A 154 22.063 -5.612 -19.646 1.00 0.00 H new ATOM 0 HG13 ILE A 154 21.808 -4.241 -18.585 1.00 0.00 H new ATOM 0 HG21 ILE A 154 23.812 -3.794 -16.832 1.00 0.00 H new ATOM 0 HG22 ILE A 154 24.851 -5.178 -16.415 1.00 0.00 H new ATOM 0 HG23 ILE A 154 25.072 -4.335 -17.967 1.00 0.00 H new ATOM 0 HD11 ILE A 154 22.968 -3.539 -20.660 1.00 0.00 H new ATOM 0 HD12 ILE A 154 24.023 -3.300 -19.247 1.00 0.00 H new ATOM 0 HD13 ILE A 154 24.282 -4.692 -20.325 1.00 0.00 H new ATOM 226 N ILE A 155 24.350 -8.116 -16.384 1.00 0.00 N ATOM 227 CA ILE A 155 25.087 -8.752 -15.302 1.00 0.00 C ATOM 228 C ILE A 155 25.959 -9.878 -15.860 1.00 0.00 C ATOM 229 O ILE A 155 27.099 -10.028 -15.450 1.00 0.00 O ATOM 230 CB ILE A 155 24.103 -9.291 -14.248 1.00 0.00 C ATOM 231 CG1 ILE A 155 23.304 -8.127 -13.641 1.00 0.00 C ATOM 232 CG2 ILE A 155 24.881 -10.009 -13.132 1.00 0.00 C ATOM 233 CD1 ILE A 155 22.004 -8.651 -13.030 1.00 0.00 C ATOM 0 H ILE A 155 23.337 -8.201 -16.307 1.00 0.00 H new ATOM 0 HA ILE A 155 25.737 -8.019 -14.824 1.00 0.00 H new ATOM 0 HB ILE A 155 23.419 -9.993 -14.725 1.00 0.00 H new ATOM 0 HG12 ILE A 155 23.899 -7.625 -12.877 1.00 0.00 H new ATOM 0 HG13 ILE A 155 23.082 -7.387 -14.410 1.00 0.00 H new ATOM 0 HG21 ILE A 155 24.182 -10.389 -12.388 1.00 0.00 H new ATOM 0 HG22 ILE A 155 25.445 -10.839 -13.558 1.00 0.00 H new ATOM 0 HG23 ILE A 155 25.569 -9.308 -12.659 1.00 0.00 H new ATOM 0 HD11 ILE A 155 21.443 -7.821 -12.602 1.00 0.00 H new ATOM 0 HD12 ILE A 155 21.406 -9.132 -13.804 1.00 0.00 H new ATOM 0 HD13 ILE A 155 22.235 -9.374 -12.248 1.00 0.00 H new ATOM 245 N TYR A 156 25.415 -10.669 -16.792 1.00 0.00 N ATOM 246 CA TYR A 156 26.137 -11.790 -17.383 1.00 0.00 C ATOM 247 C TYR A 156 27.424 -11.308 -18.052 1.00 0.00 C ATOM 248 O TYR A 156 28.500 -11.839 -17.779 1.00 0.00 O ATOM 249 CB TYR A 156 25.225 -12.500 -18.390 1.00 0.00 C ATOM 250 CG TYR A 156 25.685 -13.900 -18.738 1.00 0.00 C ATOM 251 CD1 TYR A 156 25.449 -14.958 -17.842 1.00 0.00 C ATOM 252 CD2 TYR A 156 26.341 -14.147 -19.958 1.00 0.00 C ATOM 253 CE1 TYR A 156 25.867 -16.260 -18.164 1.00 0.00 C ATOM 254 CE2 TYR A 156 26.756 -15.450 -20.281 1.00 0.00 C ATOM 255 CZ TYR A 156 26.518 -16.507 -19.384 1.00 0.00 C ATOM 256 OH TYR A 156 26.922 -17.772 -19.696 1.00 0.00 O ATOM 0 H TYR A 156 24.469 -10.548 -17.152 1.00 0.00 H new ATOM 0 HA TYR A 156 26.418 -12.495 -16.600 1.00 0.00 H new ATOM 0 HB2 TYR A 156 24.215 -12.549 -17.982 1.00 0.00 H new ATOM 0 HB3 TYR A 156 25.172 -11.906 -19.302 1.00 0.00 H new ATOM 0 HD1 TYR A 156 24.946 -14.769 -16.905 1.00 0.00 H new ATOM 0 HD2 TYR A 156 26.526 -13.335 -20.646 1.00 0.00 H new ATOM 0 HE1 TYR A 156 25.688 -17.071 -17.474 1.00 0.00 H new ATOM 0 HE2 TYR A 156 27.258 -15.640 -21.218 1.00 0.00 H new ATOM 0 HH TYR A 156 27.354 -17.770 -20.575 1.00 0.00 H new ATOM 266 N GLN A 157 27.313 -10.306 -18.928 1.00 0.00 N ATOM 267 CA GLN A 157 28.461 -9.768 -19.640 1.00 0.00 C ATOM 268 C GLN A 157 29.494 -9.233 -18.647 1.00 0.00 C ATOM 269 O GLN A 157 30.672 -9.584 -18.724 1.00 0.00 O ATOM 270 CB GLN A 157 27.986 -8.658 -20.584 1.00 0.00 C ATOM 271 CG GLN A 157 29.153 -8.175 -21.450 1.00 0.00 C ATOM 272 CD GLN A 157 28.699 -7.084 -22.412 1.00 0.00 C ATOM 273 OE1 GLN A 157 28.615 -7.310 -23.616 1.00 0.00 O ATOM 274 NE2 GLN A 157 28.406 -5.898 -21.879 1.00 0.00 N ATOM 0 H GLN A 157 26.429 -9.852 -19.158 1.00 0.00 H new ATOM 0 HA GLN A 157 28.935 -10.556 -20.225 1.00 0.00 H new ATOM 0 HB2 GLN A 157 27.180 -9.028 -21.218 1.00 0.00 H new ATOM 0 HB3 GLN A 157 27.581 -7.826 -20.007 1.00 0.00 H new ATOM 0 HG2 GLN A 157 29.951 -7.795 -20.813 1.00 0.00 H new ATOM 0 HG3 GLN A 157 29.566 -9.013 -22.012 1.00 0.00 H new ATOM 0 HE21 GLN A 157 28.491 -5.756 -20.872 1.00 0.00 H new ATOM 0 HE22 GLN A 157 28.097 -5.132 -22.478 1.00 0.00 H new ATOM 283 N ALA A 158 29.049 -8.380 -17.719 1.00 0.00 N ATOM 284 CA ALA A 158 29.934 -7.781 -16.731 1.00 0.00 C ATOM 285 C ALA A 158 30.597 -8.863 -15.873 1.00 0.00 C ATOM 286 O ALA A 158 31.775 -8.754 -15.547 1.00 0.00 O ATOM 287 CB ALA A 158 29.131 -6.815 -15.862 1.00 0.00 C ATOM 0 H ALA A 158 28.074 -8.091 -17.636 1.00 0.00 H new ATOM 0 HA ALA A 158 30.726 -7.232 -17.240 1.00 0.00 H new ATOM 0 HB1 ALA A 158 29.788 -6.362 -15.119 1.00 0.00 H new ATOM 0 HB2 ALA A 158 28.699 -6.035 -16.489 1.00 0.00 H new ATOM 0 HB3 ALA A 158 28.332 -7.358 -15.357 1.00 0.00 H new ATOM 293 N HIS A 159 29.839 -9.903 -15.509 1.00 0.00 N ATOM 294 CA HIS A 159 30.353 -10.989 -14.688 1.00 0.00 C ATOM 295 C HIS A 159 31.431 -11.757 -15.447 1.00 0.00 C ATOM 296 O HIS A 159 32.429 -12.159 -14.864 1.00 0.00 O ATOM 297 CB HIS A 159 29.202 -11.920 -14.289 1.00 0.00 C ATOM 298 CG HIS A 159 29.628 -12.991 -13.317 1.00 0.00 C ATOM 299 ND1 HIS A 159 30.476 -14.035 -13.666 1.00 0.00 N ATOM 300 CD2 HIS A 159 29.337 -13.203 -11.995 1.00 0.00 C ATOM 301 CE1 HIS A 159 30.638 -14.790 -12.561 1.00 0.00 C ATOM 302 NE2 HIS A 159 29.968 -14.336 -11.505 1.00 0.00 N ATOM 0 H HIS A 159 28.860 -10.010 -15.776 1.00 0.00 H new ATOM 0 HA HIS A 159 30.801 -10.578 -13.784 1.00 0.00 H new ATOM 0 HB2 HIS A 159 28.401 -11.330 -13.844 1.00 0.00 H new ATOM 0 HB3 HIS A 159 28.793 -12.389 -15.184 1.00 0.00 H new ATOM 0 HD2 HIS A 159 28.694 -12.565 -11.406 1.00 0.00 H new ATOM 0 HE1 HIS A 159 31.252 -15.678 -12.535 1.00 0.00 H new ATOM 0 HE2 HIS A 159 29.928 -14.727 -10.564 1.00 0.00 H new ATOM 310 N LYS A 160 31.234 -11.965 -16.748 1.00 0.00 N ATOM 311 CA LYS A 160 32.205 -12.685 -17.557 1.00 0.00 C ATOM 312 C LYS A 160 33.517 -11.899 -17.632 1.00 0.00 C ATOM 313 O LYS A 160 34.584 -12.496 -17.765 1.00 0.00 O ATOM 314 CB LYS A 160 31.633 -12.922 -18.965 1.00 0.00 C ATOM 315 CG LYS A 160 31.333 -14.412 -19.174 1.00 0.00 C ATOM 316 CD LYS A 160 30.189 -14.854 -18.252 1.00 0.00 C ATOM 317 CE LYS A 160 29.780 -16.296 -18.576 1.00 0.00 C ATOM 318 NZ LYS A 160 30.922 -17.221 -18.458 1.00 0.00 N ATOM 0 H LYS A 160 30.412 -11.644 -17.260 1.00 0.00 H new ATOM 0 HA LYS A 160 32.411 -13.651 -17.096 1.00 0.00 H new ATOM 0 HB2 LYS A 160 30.722 -12.339 -19.098 1.00 0.00 H new ATOM 0 HB3 LYS A 160 32.344 -12.578 -19.716 1.00 0.00 H new ATOM 0 HG2 LYS A 160 31.063 -14.594 -20.214 1.00 0.00 H new ATOM 0 HG3 LYS A 160 32.225 -15.003 -18.968 1.00 0.00 H new ATOM 0 HD2 LYS A 160 30.502 -14.782 -17.210 1.00 0.00 H new ATOM 0 HD3 LYS A 160 29.334 -14.189 -18.375 1.00 0.00 H new ATOM 0 HE2 LYS A 160 28.985 -16.610 -17.900 1.00 0.00 H new ATOM 0 HE3 LYS A 160 29.376 -16.342 -19.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 30.576 -18.170 -18.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 31.430 -17.263 -19.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 31.567 -16.883 -17.715 1.00 0.00 H new ATOM 332 N ARG A 161 33.438 -10.565 -17.555 1.00 0.00 N ATOM 333 CA ARG A 161 34.616 -9.715 -17.647 1.00 0.00 C ATOM 334 C ARG A 161 35.268 -9.520 -16.271 1.00 0.00 C ATOM 335 O ARG A 161 36.493 -9.434 -16.184 1.00 0.00 O ATOM 336 CB ARG A 161 34.207 -8.365 -18.254 1.00 0.00 C ATOM 337 CG ARG A 161 35.453 -7.575 -18.681 1.00 0.00 C ATOM 338 CD ARG A 161 35.804 -6.527 -17.619 1.00 0.00 C ATOM 339 NE ARG A 161 37.074 -5.858 -17.936 1.00 0.00 N ATOM 340 CZ ARG A 161 38.282 -6.394 -17.670 1.00 0.00 C ATOM 341 NH1 ARG A 161 38.381 -7.606 -17.102 1.00 0.00 N ATOM 342 NH2 ARG A 161 39.393 -5.711 -17.976 1.00 0.00 N ATOM 0 H ARG A 161 32.563 -10.056 -17.429 1.00 0.00 H new ATOM 0 HA ARG A 161 35.356 -10.195 -18.288 1.00 0.00 H new ATOM 0 HB2 ARG A 161 33.558 -8.527 -19.114 1.00 0.00 H new ATOM 0 HB3 ARG A 161 33.634 -7.790 -17.526 1.00 0.00 H new ATOM 0 HG2 ARG A 161 36.293 -8.255 -18.823 1.00 0.00 H new ATOM 0 HG3 ARG A 161 35.273 -7.087 -19.639 1.00 0.00 H new ATOM 0 HD2 ARG A 161 35.006 -5.788 -17.555 1.00 0.00 H new ATOM 0 HD3 ARG A 161 35.875 -7.004 -16.642 1.00 0.00 H new ATOM 0 HE ARG A 161 37.039 -4.941 -18.380 1.00 0.00 H new ATOM 0 HH11 ARG A 161 37.538 -8.130 -16.868 1.00 0.00 H new ATOM 0 HH12 ARG A 161 39.300 -8.003 -16.905 1.00 0.00 H new ATOM 0 HH21 ARG A 161 39.323 -4.790 -18.408 1.00 0.00 H new ATOM 0 HH22 ARG A 161 40.309 -6.112 -17.777 1.00 0.00 H new ATOM 356 N LEU A 162 34.455 -9.432 -15.205 1.00 0.00 N ATOM 357 CA LEU A 162 34.961 -9.182 -13.853 1.00 0.00 C ATOM 358 C LEU A 162 34.830 -10.428 -12.975 1.00 0.00 C ATOM 359 O LEU A 162 35.830 -10.944 -12.482 1.00 0.00 O ATOM 360 CB LEU A 162 34.177 -8.016 -13.225 1.00 0.00 C ATOM 361 CG LEU A 162 34.354 -6.729 -14.047 1.00 0.00 C ATOM 362 CD1 LEU A 162 33.349 -5.681 -13.562 1.00 0.00 C ATOM 363 CD2 LEU A 162 35.776 -6.182 -13.874 1.00 0.00 C ATOM 0 H LEU A 162 33.441 -9.531 -15.258 1.00 0.00 H new ATOM 0 HA LEU A 162 36.018 -8.926 -13.919 1.00 0.00 H new ATOM 0 HB2 LEU A 162 33.119 -8.273 -13.168 1.00 0.00 H new ATOM 0 HB3 LEU A 162 34.520 -7.850 -12.204 1.00 0.00 H new ATOM 0 HG LEU A 162 34.184 -6.952 -15.100 1.00 0.00 H new ATOM 0 HD11 LEU A 162 33.470 -4.766 -14.141 1.00 0.00 H new ATOM 0 HD12 LEU A 162 32.336 -6.061 -13.691 1.00 0.00 H new ATOM 0 HD13 LEU A 162 33.525 -5.469 -12.507 1.00 0.00 H new ATOM 0 HD21 LEU A 162 35.889 -5.271 -14.461 1.00 0.00 H new ATOM 0 HD22 LEU A 162 35.955 -5.961 -12.822 1.00 0.00 H new ATOM 0 HD23 LEU A 162 36.496 -6.925 -14.216 1.00 0.00 H new ATOM 375 N GLY A 163 33.592 -10.893 -12.770 1.00 0.00 N ATOM 376 CA GLY A 163 33.307 -12.033 -11.906 1.00 0.00 C ATOM 377 C GLY A 163 32.179 -11.662 -10.950 1.00 0.00 C ATOM 378 O GLY A 163 31.251 -10.954 -11.335 1.00 0.00 O ATOM 0 H GLY A 163 32.762 -10.486 -13.201 1.00 0.00 H new ATOM 0 HA2 GLY A 163 33.023 -12.898 -12.505 1.00 0.00 H new ATOM 0 HA3 GLY A 163 34.199 -12.313 -11.345 1.00 0.00 H new ATOM 382 N ASN A 164 32.259 -12.126 -9.694 1.00 0.00 N ATOM 383 CA ASN A 164 31.242 -11.818 -8.689 1.00 0.00 C ATOM 384 C ASN A 164 31.515 -10.443 -8.070 1.00 0.00 C ATOM 385 O ASN A 164 31.231 -10.225 -6.893 1.00 0.00 O ATOM 386 CB ASN A 164 31.241 -12.896 -7.596 1.00 0.00 C ATOM 387 CG ASN A 164 31.120 -14.297 -8.192 1.00 0.00 C ATOM 388 OD1 ASN A 164 30.018 -14.771 -8.449 1.00 0.00 O ATOM 389 ND2 ASN A 164 32.258 -14.961 -8.408 1.00 0.00 N ATOM 0 H ASN A 164 33.019 -12.715 -9.354 1.00 0.00 H new ATOM 0 HA ASN A 164 30.264 -11.801 -9.170 1.00 0.00 H new ATOM 0 HB2 ASN A 164 32.159 -12.825 -7.013 1.00 0.00 H new ATOM 0 HB3 ASN A 164 30.413 -12.719 -6.909 1.00 0.00 H new ATOM 0 HD21 ASN A 164 32.233 -15.902 -8.802 1.00 0.00 H new ATOM 0 HD22 ASN A 164 33.153 -14.528 -8.179 1.00 0.00 H new ATOM 396 N ARG A 165 32.068 -9.514 -8.862 1.00 0.00 N ATOM 397 CA ARG A 165 32.380 -8.178 -8.387 1.00 0.00 C ATOM 398 C ARG A 165 31.119 -7.311 -8.462 1.00 0.00 C ATOM 399 O ARG A 165 31.053 -6.344 -9.225 1.00 0.00 O ATOM 400 CB ARG A 165 33.544 -7.601 -9.223 1.00 0.00 C ATOM 401 CG ARG A 165 34.721 -7.264 -8.303 1.00 0.00 C ATOM 402 CD ARG A 165 35.879 -6.696 -9.129 1.00 0.00 C ATOM 403 NE ARG A 165 36.708 -5.795 -8.309 1.00 0.00 N ATOM 404 CZ ARG A 165 37.025 -4.538 -8.677 1.00 0.00 C ATOM 405 NH1 ARG A 165 36.934 -4.161 -9.958 1.00 0.00 N ATOM 406 NH2 ARG A 165 37.431 -3.657 -7.755 1.00 0.00 N ATOM 0 H ARG A 165 32.306 -9.675 -9.841 1.00 0.00 H new ATOM 0 HA ARG A 165 32.703 -8.200 -7.346 1.00 0.00 H new ATOM 0 HB2 ARG A 165 33.855 -8.323 -9.978 1.00 0.00 H new ATOM 0 HB3 ARG A 165 33.216 -6.707 -9.753 1.00 0.00 H new ATOM 0 HG2 ARG A 165 34.410 -6.540 -7.550 1.00 0.00 H new ATOM 0 HG3 ARG A 165 35.046 -8.158 -7.771 1.00 0.00 H new ATOM 0 HD2 ARG A 165 36.491 -7.511 -9.516 1.00 0.00 H new ATOM 0 HD3 ARG A 165 35.487 -6.155 -9.990 1.00 0.00 H new ATOM 0 HE ARG A 165 37.060 -6.141 -7.416 1.00 0.00 H new ATOM 0 HH11 ARG A 165 36.623 -4.827 -10.665 1.00 0.00 H new ATOM 0 HH12 ARG A 165 37.176 -3.207 -10.227 1.00 0.00 H new ATOM 0 HH21 ARG A 165 37.500 -3.938 -6.777 1.00 0.00 H new ATOM 0 HH22 ARG A 165 37.672 -2.705 -8.031 1.00 0.00 H new ATOM 420 N TRP A 166 30.107 -7.664 -7.659 1.00 0.00 N ATOM 421 CA TRP A 166 28.854 -6.923 -7.637 1.00 0.00 C ATOM 422 C TRP A 166 29.106 -5.494 -7.187 1.00 0.00 C ATOM 423 O TRP A 166 28.349 -4.610 -7.526 1.00 0.00 O ATOM 424 CB TRP A 166 27.842 -7.593 -6.715 1.00 0.00 C ATOM 425 CG TRP A 166 27.956 -9.071 -6.620 1.00 0.00 C ATOM 426 CD1 TRP A 166 28.374 -9.727 -5.542 1.00 0.00 C ATOM 427 CD2 TRP A 166 27.664 -10.095 -7.615 1.00 0.00 C ATOM 428 NE1 TRP A 166 28.373 -11.083 -5.754 1.00 0.00 N ATOM 429 CE2 TRP A 166 27.936 -11.373 -7.033 1.00 0.00 C ATOM 430 CE3 TRP A 166 27.198 -10.085 -8.949 1.00 0.00 C ATOM 431 CZ2 TRP A 166 27.756 -12.567 -7.732 1.00 0.00 C ATOM 432 CZ3 TRP A 166 27.016 -11.291 -9.659 1.00 0.00 C ATOM 433 CH2 TRP A 166 27.299 -12.526 -9.051 1.00 0.00 C ATOM 0 H TRP A 166 30.138 -8.458 -7.019 1.00 0.00 H new ATOM 0 HA TRP A 166 28.441 -6.914 -8.646 1.00 0.00 H new ATOM 0 HB2 TRP A 166 27.950 -7.171 -5.716 1.00 0.00 H new ATOM 0 HB3 TRP A 166 26.839 -7.343 -7.060 1.00 0.00 H new ATOM 0 HD1 TRP A 166 28.675 -9.254 -4.619 1.00 0.00 H new ATOM 0 HE1 TRP A 166 28.655 -11.779 -5.064 1.00 0.00 H new ATOM 0 HE3 TRP A 166 26.979 -9.144 -9.431 1.00 0.00 H new ATOM 0 HZ2 TRP A 166 27.968 -13.514 -7.258 1.00 0.00 H new ATOM 0 HZ3 TRP A 166 26.657 -11.265 -10.677 1.00 0.00 H new ATOM 0 HH2 TRP A 166 27.163 -13.444 -9.604 1.00 0.00 H new ATOM 444 N ALA A 167 30.177 -5.265 -6.424 1.00 0.00 N ATOM 445 CA ALA A 167 30.517 -3.926 -5.979 1.00 0.00 C ATOM 446 C ALA A 167 30.666 -3.004 -7.191 1.00 0.00 C ATOM 447 O ALA A 167 30.401 -1.810 -7.092 1.00 0.00 O ATOM 448 CB ALA A 167 31.813 -3.973 -5.170 1.00 0.00 C ATOM 0 H ALA A 167 30.818 -5.992 -6.106 1.00 0.00 H new ATOM 0 HA ALA A 167 29.723 -3.534 -5.343 1.00 0.00 H new ATOM 0 HB1 ALA A 167 32.070 -2.968 -4.835 1.00 0.00 H new ATOM 0 HB2 ALA A 167 31.678 -4.621 -4.304 1.00 0.00 H new ATOM 0 HB3 ALA A 167 32.617 -4.364 -5.793 1.00 0.00 H new ATOM 454 N GLU A 168 31.087 -3.570 -8.335 1.00 0.00 N ATOM 455 CA GLU A 168 31.272 -2.812 -9.564 1.00 0.00 C ATOM 456 C GLU A 168 30.007 -2.895 -10.421 1.00 0.00 C ATOM 457 O GLU A 168 29.509 -1.876 -10.885 1.00 0.00 O ATOM 458 CB GLU A 168 32.475 -3.373 -10.336 1.00 0.00 C ATOM 459 CG GLU A 168 33.729 -3.413 -9.448 1.00 0.00 C ATOM 460 CD GLU A 168 34.365 -2.033 -9.305 1.00 0.00 C ATOM 461 OE1 GLU A 168 33.721 -1.168 -8.670 1.00 0.00 O ATOM 462 OE2 GLU A 168 35.491 -1.869 -9.830 1.00 0.00 O ATOM 0 H GLU A 168 31.305 -4.562 -8.424 1.00 0.00 H new ATOM 0 HA GLU A 168 31.461 -1.766 -9.321 1.00 0.00 H new ATOM 0 HB2 GLU A 168 32.246 -4.377 -10.694 1.00 0.00 H new ATOM 0 HB3 GLU A 168 32.667 -2.757 -11.215 1.00 0.00 H new ATOM 0 HG2 GLU A 168 33.465 -3.795 -8.462 1.00 0.00 H new ATOM 0 HG3 GLU A 168 34.455 -4.106 -9.874 1.00 0.00 H new ATOM 469 N ILE A 169 29.491 -4.115 -10.635 1.00 0.00 N ATOM 470 CA ILE A 169 28.294 -4.322 -11.454 1.00 0.00 C ATOM 471 C ILE A 169 27.135 -3.485 -10.902 1.00 0.00 C ATOM 472 O ILE A 169 26.356 -2.915 -11.663 1.00 0.00 O ATOM 473 CB ILE A 169 27.921 -5.816 -11.464 1.00 0.00 C ATOM 474 CG1 ILE A 169 29.074 -6.653 -12.047 1.00 0.00 C ATOM 475 CG2 ILE A 169 26.664 -6.025 -12.320 1.00 0.00 C ATOM 476 CD1 ILE A 169 29.022 -8.079 -11.488 1.00 0.00 C ATOM 0 H ILE A 169 29.887 -4.972 -10.250 1.00 0.00 H new ATOM 0 HA ILE A 169 28.497 -4.005 -12.477 1.00 0.00 H new ATOM 0 HB ILE A 169 27.731 -6.136 -10.439 1.00 0.00 H new ATOM 0 HG12 ILE A 169 29.003 -6.677 -13.134 1.00 0.00 H new ATOM 0 HG13 ILE A 169 30.030 -6.192 -11.800 1.00 0.00 H new ATOM 0 HG21 ILE A 169 26.400 -7.083 -12.327 1.00 0.00 H new ATOM 0 HG22 ILE A 169 25.839 -5.448 -11.902 1.00 0.00 H new ATOM 0 HG23 ILE A 169 26.859 -5.693 -13.340 1.00 0.00 H new ATOM 0 HD11 ILE A 169 29.841 -8.664 -11.906 1.00 0.00 H new ATOM 0 HD12 ILE A 169 29.115 -8.048 -10.402 1.00 0.00 H new ATOM 0 HD13 ILE A 169 28.072 -8.541 -11.757 1.00 0.00 H new ATOM 488 N ALA A 170 27.030 -3.422 -9.574 1.00 0.00 N ATOM 489 CA ALA A 170 25.978 -2.682 -8.898 1.00 0.00 C ATOM 490 C ALA A 170 26.016 -1.202 -9.305 1.00 0.00 C ATOM 491 O ALA A 170 24.969 -0.569 -9.397 1.00 0.00 O ATOM 492 CB ALA A 170 26.139 -2.852 -7.380 1.00 0.00 C ATOM 0 H ALA A 170 27.679 -3.887 -8.939 1.00 0.00 H new ATOM 0 HA ALA A 170 25.005 -3.074 -9.192 1.00 0.00 H new ATOM 0 HB1 ALA A 170 25.352 -2.299 -6.867 1.00 0.00 H new ATOM 0 HB2 ALA A 170 26.067 -3.909 -7.123 1.00 0.00 H new ATOM 0 HB3 ALA A 170 27.112 -2.469 -7.072 1.00 0.00 H new ATOM 498 N LYS A 171 27.216 -0.649 -9.560 1.00 0.00 N ATOM 499 CA LYS A 171 27.338 0.745 -9.986 1.00 0.00 C ATOM 500 C LYS A 171 26.643 0.936 -11.336 1.00 0.00 C ATOM 501 O LYS A 171 26.039 1.978 -11.581 1.00 0.00 O ATOM 502 CB LYS A 171 28.814 1.152 -10.105 1.00 0.00 C ATOM 503 CG LYS A 171 29.510 1.066 -8.745 1.00 0.00 C ATOM 504 CD LYS A 171 30.919 1.664 -8.864 1.00 0.00 C ATOM 505 CE LYS A 171 31.615 1.664 -7.499 1.00 0.00 C ATOM 506 NZ LYS A 171 32.085 0.316 -7.137 1.00 0.00 N ATOM 0 H LYS A 171 28.103 -1.146 -9.478 1.00 0.00 H new ATOM 0 HA LYS A 171 26.863 1.377 -9.236 1.00 0.00 H new ATOM 0 HB2 LYS A 171 29.319 0.502 -10.819 1.00 0.00 H new ATOM 0 HB3 LYS A 171 28.886 2.168 -10.492 1.00 0.00 H new ATOM 0 HG2 LYS A 171 28.934 1.606 -7.993 1.00 0.00 H new ATOM 0 HG3 LYS A 171 29.568 0.028 -8.417 1.00 0.00 H new ATOM 0 HD2 LYS A 171 31.506 1.088 -9.579 1.00 0.00 H new ATOM 0 HD3 LYS A 171 30.858 2.682 -9.248 1.00 0.00 H new ATOM 0 HE2 LYS A 171 32.460 2.353 -7.519 1.00 0.00 H new ATOM 0 HE3 LYS A 171 30.926 2.028 -6.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 171 32.475 0.332 -6.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 171 31.289 -0.352 -7.177 1.00 0.00 H new ATOM 0 HZ3 LYS A 171 32.823 0.015 -7.805 1.00 0.00 H new ATOM 520 N LEU A 172 26.735 -0.076 -12.214 1.00 0.00 N ATOM 521 CA LEU A 172 26.130 -0.012 -13.540 1.00 0.00 C ATOM 522 C LEU A 172 24.605 -0.059 -13.428 1.00 0.00 C ATOM 523 O LEU A 172 23.908 0.425 -14.319 1.00 0.00 O ATOM 524 CB LEU A 172 26.635 -1.179 -14.404 1.00 0.00 C ATOM 525 CG LEU A 172 28.173 -1.237 -14.410 1.00 0.00 C ATOM 526 CD1 LEU A 172 28.629 -2.402 -15.290 1.00 0.00 C ATOM 527 CD2 LEU A 172 28.750 0.071 -14.961 1.00 0.00 C ATOM 0 H LEU A 172 27.226 -0.949 -12.021 1.00 0.00 H new ATOM 0 HA LEU A 172 26.416 0.927 -14.013 1.00 0.00 H new ATOM 0 HB2 LEU A 172 26.234 -2.118 -14.023 1.00 0.00 H new ATOM 0 HB3 LEU A 172 26.268 -1.066 -15.424 1.00 0.00 H new ATOM 0 HG LEU A 172 28.529 -1.379 -13.390 1.00 0.00 H new ATOM 0 HD11 LEU A 172 29.718 -2.448 -15.298 1.00 0.00 H new ATOM 0 HD12 LEU A 172 28.230 -3.335 -14.894 1.00 0.00 H new ATOM 0 HD13 LEU A 172 28.265 -2.254 -16.307 1.00 0.00 H new ATOM 0 HD21 LEU A 172 29.839 0.017 -14.960 1.00 0.00 H new ATOM 0 HD22 LEU A 172 28.395 0.224 -15.980 1.00 0.00 H new ATOM 0 HD23 LEU A 172 28.427 0.903 -14.335 1.00 0.00 H new ATOM 539 N LEU A 173 24.090 -0.642 -12.333 1.00 0.00 N ATOM 540 CA LEU A 173 22.654 -0.751 -12.103 1.00 0.00 C ATOM 541 C LEU A 173 22.298 -0.087 -10.766 1.00 0.00 C ATOM 542 O LEU A 173 22.081 -0.783 -9.776 1.00 0.00 O ATOM 543 CB LEU A 173 22.256 -2.236 -12.088 1.00 0.00 C ATOM 544 CG LEU A 173 22.489 -2.877 -13.468 1.00 0.00 C ATOM 545 CD1 LEU A 173 22.414 -4.400 -13.336 1.00 0.00 C ATOM 546 CD2 LEU A 173 21.418 -2.403 -14.458 1.00 0.00 C ATOM 0 H LEU A 173 24.660 -1.047 -11.590 1.00 0.00 H new ATOM 0 HA LEU A 173 22.109 -0.245 -12.901 1.00 0.00 H new ATOM 0 HB2 LEU A 173 22.837 -2.766 -11.333 1.00 0.00 H new ATOM 0 HB3 LEU A 173 21.207 -2.333 -11.809 1.00 0.00 H new ATOM 0 HG LEU A 173 23.472 -2.582 -13.837 1.00 0.00 H new ATOM 0 HD11 LEU A 173 22.578 -4.858 -14.311 1.00 0.00 H new ATOM 0 HD12 LEU A 173 23.180 -4.743 -12.640 1.00 0.00 H new ATOM 0 HD13 LEU A 173 21.430 -4.685 -12.963 1.00 0.00 H new ATOM 0 HD21 LEU A 173 21.593 -2.863 -15.431 1.00 0.00 H new ATOM 0 HD22 LEU A 173 20.432 -2.690 -14.093 1.00 0.00 H new ATOM 0 HD23 LEU A 173 21.467 -1.318 -14.555 1.00 0.00 H new ATOM 558 N PRO A 174 22.233 1.265 -10.728 1.00 0.00 N ATOM 559 CA PRO A 174 21.917 2.001 -9.515 1.00 0.00 C ATOM 560 C PRO A 174 20.541 1.609 -8.972 1.00 0.00 C ATOM 561 O PRO A 174 20.318 1.650 -7.765 1.00 0.00 O ATOM 562 CB PRO A 174 21.960 3.483 -9.899 1.00 0.00 C ATOM 563 CG PRO A 174 22.271 3.550 -11.399 1.00 0.00 C ATOM 564 CD PRO A 174 22.472 2.112 -11.878 1.00 0.00 C ATOM 0 HA PRO A 174 22.629 1.778 -8.720 1.00 0.00 H new ATOM 0 HB2 PRO A 174 21.007 3.965 -9.681 1.00 0.00 H new ATOM 0 HB3 PRO A 174 22.722 4.008 -9.324 1.00 0.00 H new ATOM 0 HG2 PRO A 174 21.454 4.027 -11.941 1.00 0.00 H new ATOM 0 HG3 PRO A 174 23.165 4.146 -11.581 1.00 0.00 H new ATOM 0 HD2 PRO A 174 21.783 1.872 -12.688 1.00 0.00 H new ATOM 0 HD3 PRO A 174 23.481 1.968 -12.264 1.00 0.00 H new ATOM 572 N GLY A 175 19.619 1.227 -9.866 1.00 0.00 N ATOM 573 CA GLY A 175 18.279 0.820 -9.471 1.00 0.00 C ATOM 574 C GLY A 175 18.318 -0.503 -8.699 1.00 0.00 C ATOM 575 O GLY A 175 17.350 -0.848 -8.021 1.00 0.00 O ATOM 0 H GLY A 175 19.786 1.194 -10.872 1.00 0.00 H new ATOM 0 HA2 GLY A 175 17.826 1.594 -8.852 1.00 0.00 H new ATOM 0 HA3 GLY A 175 17.651 0.712 -10.356 1.00 0.00 H new ATOM 579 N ARG A 176 19.435 -1.238 -8.807 1.00 0.00 N ATOM 580 CA ARG A 176 19.615 -2.514 -8.129 1.00 0.00 C ATOM 581 C ARG A 176 20.651 -2.349 -7.015 1.00 0.00 C ATOM 582 O ARG A 176 21.146 -1.246 -6.788 1.00 0.00 O ATOM 583 CB ARG A 176 20.082 -3.564 -9.149 1.00 0.00 C ATOM 584 CG ARG A 176 19.094 -3.657 -10.325 1.00 0.00 C ATOM 585 CD ARG A 176 17.791 -4.316 -9.866 1.00 0.00 C ATOM 586 NE ARG A 176 16.997 -4.753 -11.022 1.00 0.00 N ATOM 587 CZ ARG A 176 15.862 -5.461 -10.908 1.00 0.00 C ATOM 588 NH1 ARG A 176 15.440 -5.873 -9.706 1.00 0.00 N ATOM 589 NH2 ARG A 176 15.147 -5.754 -11.997 1.00 0.00 N ATOM 0 H ARG A 176 20.237 -0.956 -9.371 1.00 0.00 H new ATOM 0 HA ARG A 176 18.674 -2.844 -7.688 1.00 0.00 H new ATOM 0 HB2 ARG A 176 21.073 -3.302 -9.520 1.00 0.00 H new ATOM 0 HB3 ARG A 176 20.170 -4.536 -8.664 1.00 0.00 H new ATOM 0 HG2 ARG A 176 18.888 -2.661 -10.717 1.00 0.00 H new ATOM 0 HG3 ARG A 176 19.536 -4.234 -11.137 1.00 0.00 H new ATOM 0 HD2 ARG A 176 18.015 -5.171 -9.228 1.00 0.00 H new ATOM 0 HD3 ARG A 176 17.213 -3.613 -9.266 1.00 0.00 H new ATOM 0 HE ARG A 176 17.324 -4.507 -11.956 1.00 0.00 H new ATOM 0 HH11 ARG A 176 15.982 -5.649 -8.871 1.00 0.00 H new ATOM 0 HH12 ARG A 176 14.577 -6.411 -9.625 1.00 0.00 H new ATOM 0 HH21 ARG A 176 15.463 -5.440 -12.914 1.00 0.00 H new ATOM 0 HH22 ARG A 176 14.285 -6.292 -11.911 1.00 0.00 H new ATOM 603 N THR A 177 20.981 -3.449 -6.324 1.00 0.00 N ATOM 604 CA THR A 177 21.969 -3.429 -5.249 1.00 0.00 C ATOM 605 C THR A 177 22.880 -4.647 -5.373 1.00 0.00 C ATOM 606 O THR A 177 22.515 -5.638 -6.006 1.00 0.00 O ATOM 607 CB THR A 177 21.265 -3.423 -3.883 1.00 0.00 C ATOM 608 OG1 THR A 177 20.532 -4.618 -3.719 1.00 0.00 O ATOM 609 CG2 THR A 177 20.317 -2.224 -3.784 1.00 0.00 C ATOM 0 H THR A 177 20.572 -4.367 -6.496 1.00 0.00 H new ATOM 0 HA THR A 177 22.571 -2.524 -5.329 1.00 0.00 H new ATOM 0 HB THR A 177 22.018 -3.348 -3.099 1.00 0.00 H new ATOM 0 HG1 THR A 177 20.086 -4.611 -2.846 1.00 0.00 H new ATOM 0 HG21 THR A 177 19.823 -2.230 -2.812 1.00 0.00 H new ATOM 0 HG22 THR A 177 20.885 -1.301 -3.897 1.00 0.00 H new ATOM 0 HG23 THR A 177 19.567 -2.287 -4.572 1.00 0.00 H new ATOM 617 N ASP A 178 24.066 -4.569 -4.761 1.00 0.00 N ATOM 618 CA ASP A 178 25.031 -5.657 -4.787 1.00 0.00 C ATOM 619 C ASP A 178 24.398 -6.934 -4.226 1.00 0.00 C ATOM 620 O ASP A 178 24.556 -8.010 -4.800 1.00 0.00 O ATOM 621 CB ASP A 178 26.278 -5.250 -3.981 1.00 0.00 C ATOM 622 CG ASP A 178 25.979 -5.092 -2.488 1.00 0.00 C ATOM 623 OD1 ASP A 178 24.888 -4.559 -2.168 1.00 0.00 O ATOM 624 OD2 ASP A 178 26.846 -5.510 -1.693 1.00 0.00 O ATOM 0 H ASP A 178 24.377 -3.751 -4.237 1.00 0.00 H new ATOM 0 HA ASP A 178 25.333 -5.859 -5.815 1.00 0.00 H new ATOM 0 HB2 ASP A 178 27.056 -6.001 -4.116 1.00 0.00 H new ATOM 0 HB3 ASP A 178 26.670 -4.311 -4.372 1.00 0.00 H new ATOM 629 N ASN A 179 23.681 -6.805 -3.106 1.00 0.00 N ATOM 630 CA ASN A 179 23.024 -7.931 -2.463 1.00 0.00 C ATOM 631 C ASN A 179 21.958 -8.516 -3.388 1.00 0.00 C ATOM 632 O ASN A 179 21.922 -9.726 -3.601 1.00 0.00 O ATOM 633 CB ASN A 179 22.398 -7.470 -1.143 1.00 0.00 C ATOM 634 CG ASN A 179 23.443 -7.401 -0.032 1.00 0.00 C ATOM 635 OD1 ASN A 179 23.462 -8.251 0.854 1.00 0.00 O ATOM 636 ND2 ASN A 179 24.312 -6.391 -0.076 1.00 0.00 N ATOM 0 H ASN A 179 23.544 -5.916 -2.625 1.00 0.00 H new ATOM 0 HA ASN A 179 23.759 -8.709 -2.254 1.00 0.00 H new ATOM 0 HB2 ASN A 179 21.940 -6.490 -1.277 1.00 0.00 H new ATOM 0 HB3 ASN A 179 21.602 -8.157 -0.855 1.00 0.00 H new ATOM 0 HD21 ASN A 179 25.028 -6.303 0.645 1.00 0.00 H new ATOM 0 HD22 ASN A 179 24.261 -5.706 -0.830 1.00 0.00 H new ATOM 643 N ALA A 180 21.087 -7.656 -3.935 1.00 0.00 N ATOM 644 CA ALA A 180 20.018 -8.102 -4.818 1.00 0.00 C ATOM 645 C ALA A 180 20.595 -8.894 -5.989 1.00 0.00 C ATOM 646 O ALA A 180 20.126 -9.991 -6.282 1.00 0.00 O ATOM 647 CB ALA A 180 19.230 -6.892 -5.322 1.00 0.00 C ATOM 0 H ALA A 180 21.108 -6.649 -3.777 1.00 0.00 H new ATOM 0 HA ALA A 180 19.344 -8.756 -4.264 1.00 0.00 H new ATOM 0 HB1 ALA A 180 18.431 -7.228 -5.983 1.00 0.00 H new ATOM 0 HB2 ALA A 180 18.800 -6.359 -4.474 1.00 0.00 H new ATOM 0 HB3 ALA A 180 19.897 -6.226 -5.869 1.00 0.00 H new ATOM 653 N ILE A 181 21.612 -8.334 -6.658 1.00 0.00 N ATOM 654 CA ILE A 181 22.236 -8.986 -7.801 1.00 0.00 C ATOM 655 C ILE A 181 22.851 -10.320 -7.375 1.00 0.00 C ATOM 656 O ILE A 181 22.664 -11.326 -8.049 1.00 0.00 O ATOM 657 CB ILE A 181 23.309 -8.066 -8.407 1.00 0.00 C ATOM 658 CG1 ILE A 181 22.655 -6.798 -8.976 1.00 0.00 C ATOM 659 CG2 ILE A 181 24.026 -8.809 -9.539 1.00 0.00 C ATOM 660 CD1 ILE A 181 23.688 -5.672 -9.067 1.00 0.00 C ATOM 0 H ILE A 181 22.016 -7.428 -6.421 1.00 0.00 H new ATOM 0 HA ILE A 181 21.477 -9.182 -8.558 1.00 0.00 H new ATOM 0 HB ILE A 181 24.021 -7.786 -7.630 1.00 0.00 H new ATOM 0 HG12 ILE A 181 22.241 -7.004 -9.963 1.00 0.00 H new ATOM 0 HG13 ILE A 181 21.825 -6.490 -8.340 1.00 0.00 H new ATOM 0 HG21 ILE A 181 24.788 -8.162 -9.973 1.00 0.00 H new ATOM 0 HG22 ILE A 181 24.496 -9.709 -9.143 1.00 0.00 H new ATOM 0 HG23 ILE A 181 23.304 -9.085 -10.307 1.00 0.00 H new ATOM 0 HD11 ILE A 181 23.216 -4.777 -9.471 1.00 0.00 H new ATOM 0 HD12 ILE A 181 24.081 -5.458 -8.073 1.00 0.00 H new ATOM 0 HD13 ILE A 181 24.504 -5.979 -9.721 1.00 0.00 H new ATOM 672 N LYS A 182 23.591 -10.323 -6.258 1.00 0.00 N ATOM 673 CA LYS A 182 24.248 -11.526 -5.761 1.00 0.00 C ATOM 674 C LYS A 182 23.228 -12.651 -5.561 1.00 0.00 C ATOM 675 O LYS A 182 23.400 -13.747 -6.095 1.00 0.00 O ATOM 676 CB LYS A 182 24.964 -11.195 -4.447 1.00 0.00 C ATOM 677 CG LYS A 182 25.701 -12.430 -3.921 1.00 0.00 C ATOM 678 CD LYS A 182 26.469 -12.058 -2.650 1.00 0.00 C ATOM 679 CE LYS A 182 27.178 -13.296 -2.094 1.00 0.00 C ATOM 680 NZ LYS A 182 27.891 -12.980 -0.843 1.00 0.00 N ATOM 0 H LYS A 182 23.747 -9.496 -5.682 1.00 0.00 H new ATOM 0 HA LYS A 182 24.980 -11.872 -6.491 1.00 0.00 H new ATOM 0 HB2 LYS A 182 25.671 -10.380 -4.605 1.00 0.00 H new ATOM 0 HB3 LYS A 182 24.241 -10.851 -3.707 1.00 0.00 H new ATOM 0 HG2 LYS A 182 24.990 -13.229 -3.710 1.00 0.00 H new ATOM 0 HG3 LYS A 182 26.389 -12.807 -4.678 1.00 0.00 H new ATOM 0 HD2 LYS A 182 27.198 -11.278 -2.869 1.00 0.00 H new ATOM 0 HD3 LYS A 182 25.784 -11.654 -1.905 1.00 0.00 H new ATOM 0 HE2 LYS A 182 26.449 -14.086 -1.912 1.00 0.00 H new ATOM 0 HE3 LYS A 182 27.883 -13.678 -2.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 28.363 -13.836 -0.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 28.602 -12.243 -1.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 27.212 -12.638 -0.133 1.00 0.00 H new ATOM 694 N ASN A 183 22.170 -12.380 -4.787 1.00 0.00 N ATOM 695 CA ASN A 183 21.140 -13.373 -4.507 1.00 0.00 C ATOM 696 C ASN A 183 20.482 -13.834 -5.807 1.00 0.00 C ATOM 697 O ASN A 183 20.345 -15.036 -6.039 1.00 0.00 O ATOM 698 CB ASN A 183 20.099 -12.775 -3.555 1.00 0.00 C ATOM 699 CG ASN A 183 20.615 -12.769 -2.118 1.00 0.00 C ATOM 700 OD1 ASN A 183 20.366 -13.856 -1.387 1.00 0.00 O flip ATOM 701 ND2 ASN A 183 21.226 -11.800 -1.679 1.00 0.00 N flip ATOM 0 H ASN A 183 22.010 -11.475 -4.344 1.00 0.00 H new ATOM 0 HA ASN A 183 21.595 -14.242 -4.031 1.00 0.00 H new ATOM 0 HB2 ASN A 183 19.860 -11.757 -3.864 1.00 0.00 H new ATOM 0 HB3 ASN A 183 19.175 -13.351 -3.612 1.00 0.00 H new ATOM 0 HD21 ASN A 183 21.393 -10.990 -2.275 1.00 0.00 H new ATOM 0 HD22 ASN A 183 21.567 -11.805 -0.718 1.00 0.00 H new ATOM 708 N HIS A 184 20.075 -12.879 -6.652 1.00 0.00 N ATOM 709 CA HIS A 184 19.429 -13.187 -7.921 1.00 0.00 C ATOM 710 C HIS A 184 20.311 -14.113 -8.752 1.00 0.00 C ATOM 711 O HIS A 184 19.827 -15.104 -9.286 1.00 0.00 O ATOM 712 CB HIS A 184 19.152 -11.884 -8.679 1.00 0.00 C ATOM 713 CG HIS A 184 19.108 -12.070 -10.177 1.00 0.00 C ATOM 714 ND1 HIS A 184 18.275 -12.992 -10.805 1.00 0.00 N ATOM 715 CD2 HIS A 184 19.798 -11.468 -11.198 1.00 0.00 C ATOM 716 CE1 HIS A 184 18.513 -12.890 -12.129 1.00 0.00 C ATOM 717 NE2 HIS A 184 19.435 -11.976 -12.434 1.00 0.00 N ATOM 0 H HIS A 184 20.186 -11.881 -6.472 1.00 0.00 H new ATOM 0 HA HIS A 184 18.485 -13.697 -7.732 1.00 0.00 H new ATOM 0 HB2 HIS A 184 18.202 -11.469 -8.342 1.00 0.00 H new ATOM 0 HB3 HIS A 184 19.924 -11.155 -8.432 1.00 0.00 H new ATOM 0 HD2 HIS A 184 20.535 -10.692 -11.055 1.00 0.00 H new ATOM 0 HE1 HIS A 184 18.006 -13.490 -12.870 1.00 0.00 H new ATOM 0 HE2 HIS A 184 19.787 -11.714 -13.355 1.00 0.00 H new ATOM 725 N TRP A 185 21.596 -13.783 -8.867 1.00 0.00 N ATOM 726 CA TRP A 185 22.527 -14.567 -9.654 1.00 0.00 C ATOM 727 C TRP A 185 22.627 -15.986 -9.103 1.00 0.00 C ATOM 728 O TRP A 185 22.403 -16.944 -9.826 1.00 0.00 O ATOM 729 CB TRP A 185 23.897 -13.888 -9.641 1.00 0.00 C ATOM 730 CG TRP A 185 24.943 -14.595 -10.442 1.00 0.00 C ATOM 731 CD1 TRP A 185 25.713 -15.604 -10.008 1.00 0.00 C ATOM 732 CD2 TRP A 185 25.349 -14.368 -11.821 1.00 0.00 C ATOM 733 NE1 TRP A 185 26.567 -16.032 -10.994 1.00 0.00 N ATOM 734 CE2 TRP A 185 26.388 -15.295 -12.148 1.00 0.00 C ATOM 735 CE3 TRP A 185 24.949 -13.475 -12.835 1.00 0.00 C ATOM 736 CZ2 TRP A 185 26.993 -15.329 -13.406 1.00 0.00 C ATOM 737 CZ3 TRP A 185 25.553 -13.508 -14.108 1.00 0.00 C ATOM 738 CH2 TRP A 185 26.575 -14.432 -14.392 1.00 0.00 C ATOM 0 H TRP A 185 22.013 -12.968 -8.417 1.00 0.00 H new ATOM 0 HA TRP A 185 22.168 -14.629 -10.681 1.00 0.00 H new ATOM 0 HB2 TRP A 185 23.789 -12.872 -10.022 1.00 0.00 H new ATOM 0 HB3 TRP A 185 24.239 -13.807 -8.609 1.00 0.00 H new ATOM 0 HD1 TRP A 185 25.667 -16.024 -9.014 1.00 0.00 H new ATOM 0 HE1 TRP A 185 27.241 -16.790 -10.889 1.00 0.00 H new ATOM 0 HE3 TRP A 185 24.169 -12.756 -12.634 1.00 0.00 H new ATOM 0 HZ2 TRP A 185 27.777 -16.042 -13.615 1.00 0.00 H new ATOM 0 HZ3 TRP A 185 25.228 -12.818 -14.872 1.00 0.00 H new ATOM 0 HH2 TRP A 185 27.035 -14.448 -15.369 1.00 0.00 H new ATOM 749 N ASN A 186 22.973 -16.116 -7.824 1.00 0.00 N ATOM 750 CA ASN A 186 23.153 -17.421 -7.201 1.00 0.00 C ATOM 751 C ASN A 186 21.893 -18.280 -7.335 1.00 0.00 C ATOM 752 O ASN A 186 21.992 -19.490 -7.525 1.00 0.00 O ATOM 753 CB ASN A 186 23.510 -17.233 -5.721 1.00 0.00 C ATOM 754 CG ASN A 186 24.865 -16.548 -5.551 1.00 0.00 C ATOM 755 OD1 ASN A 186 25.670 -16.508 -6.477 1.00 0.00 O ATOM 756 ND2 ASN A 186 25.116 -16.010 -4.357 1.00 0.00 N ATOM 0 H ASN A 186 23.135 -15.327 -7.198 1.00 0.00 H new ATOM 0 HA ASN A 186 23.964 -17.940 -7.712 1.00 0.00 H new ATOM 0 HB2 ASN A 186 22.738 -16.639 -5.233 1.00 0.00 H new ATOM 0 HB3 ASN A 186 23.527 -18.203 -5.224 1.00 0.00 H new ATOM 0 HD21 ASN A 186 26.006 -15.542 -4.185 1.00 0.00 H new ATOM 0 HD22 ASN A 186 24.418 -16.066 -3.615 1.00 0.00 H new ATOM 763 N SER A 187 20.716 -17.661 -7.223 1.00 0.00 N ATOM 764 CA SER A 187 19.454 -18.385 -7.282 1.00 0.00 C ATOM 765 C SER A 187 19.054 -18.707 -8.728 1.00 0.00 C ATOM 766 O SER A 187 18.544 -19.794 -8.995 1.00 0.00 O ATOM 767 CB SER A 187 18.372 -17.540 -6.603 1.00 0.00 C ATOM 768 OG SER A 187 17.164 -18.268 -6.546 1.00 0.00 O ATOM 0 H SER A 187 20.615 -16.655 -7.090 1.00 0.00 H new ATOM 0 HA SER A 187 19.568 -19.336 -6.762 1.00 0.00 H new ATOM 0 HB2 SER A 187 18.690 -17.265 -5.597 1.00 0.00 H new ATOM 0 HB3 SER A 187 18.223 -16.612 -7.155 1.00 0.00 H new ATOM 0 HG SER A 187 16.475 -17.725 -6.110 1.00 0.00 H new ATOM 774 N THR A 188 19.264 -17.759 -9.649 1.00 0.00 N ATOM 775 CA THR A 188 18.837 -17.912 -11.038 1.00 0.00 C ATOM 776 C THR A 188 19.986 -18.397 -11.924 1.00 0.00 C ATOM 777 O THR A 188 19.929 -19.503 -12.460 1.00 0.00 O ATOM 778 CB THR A 188 18.293 -16.564 -11.545 1.00 0.00 C ATOM 779 OG1 THR A 188 17.471 -15.980 -10.556 1.00 0.00 O ATOM 780 CG2 THR A 188 17.475 -16.783 -12.819 1.00 0.00 C ATOM 0 H THR A 188 19.730 -16.874 -9.452 1.00 0.00 H new ATOM 0 HA THR A 188 18.052 -18.667 -11.086 1.00 0.00 H new ATOM 0 HB THR A 188 19.130 -15.900 -11.761 1.00 0.00 H new ATOM 0 HG1 THR A 188 17.619 -15.011 -10.538 1.00 0.00 H new ATOM 0 HG21 THR A 188 17.092 -15.826 -13.174 1.00 0.00 H new ATOM 0 HG22 THR A 188 18.109 -17.228 -13.586 1.00 0.00 H new ATOM 0 HG23 THR A 188 16.641 -17.451 -12.605 1.00 0.00 H new ATOM 788 N MET A 189 21.020 -17.562 -12.091 1.00 0.00 N ATOM 789 CA MET A 189 22.146 -17.873 -12.962 1.00 0.00 C ATOM 790 C MET A 189 23.338 -18.305 -12.118 1.00 0.00 C ATOM 791 O MET A 189 24.361 -17.628 -12.095 1.00 0.00 O ATOM 792 CB MET A 189 22.491 -16.637 -13.800 1.00 0.00 C ATOM 793 CG MET A 189 21.304 -16.261 -14.695 1.00 0.00 C ATOM 794 SD MET A 189 21.694 -15.010 -15.947 1.00 0.00 S ATOM 795 CE MET A 189 21.971 -13.594 -14.858 1.00 0.00 C ATOM 0 H MET A 189 21.094 -16.657 -11.626 1.00 0.00 H new ATOM 0 HA MET A 189 21.885 -18.691 -13.634 1.00 0.00 H new ATOM 0 HB2 MET A 189 22.742 -15.802 -13.145 1.00 0.00 H new ATOM 0 HB3 MET A 189 23.370 -16.837 -14.413 1.00 0.00 H new ATOM 0 HG2 MET A 189 20.940 -17.159 -15.194 1.00 0.00 H new ATOM 0 HG3 MET A 189 20.492 -15.893 -14.068 1.00 0.00 H new ATOM 0 HE1 MET A 189 21.188 -12.853 -15.018 1.00 0.00 H new ATOM 0 HE2 MET A 189 21.951 -13.924 -13.819 1.00 0.00 H new ATOM 0 HE3 MET A 189 22.942 -13.150 -15.079 1.00 0.00 H new ATOM 805 N ARG A 190 23.199 -19.433 -11.420 1.00 0.00 N ATOM 806 CA ARG A 190 24.252 -19.940 -10.558 1.00 0.00 C ATOM 807 C ARG A 190 25.504 -20.242 -11.383 1.00 0.00 C ATOM 808 O ARG A 190 25.404 -20.780 -12.486 1.00 0.00 O ATOM 809 CB ARG A 190 23.747 -21.192 -9.837 1.00 0.00 C ATOM 810 CG ARG A 190 24.561 -21.426 -8.564 1.00 0.00 C ATOM 811 CD ARG A 190 23.851 -22.464 -7.693 1.00 0.00 C ATOM 812 NE ARG A 190 24.552 -22.653 -6.418 1.00 0.00 N ATOM 813 CZ ARG A 190 24.041 -23.371 -5.402 1.00 0.00 C ATOM 814 NH1 ARG A 190 22.840 -23.953 -5.526 1.00 0.00 N ATOM 815 NH2 ARG A 190 24.734 -23.506 -4.264 1.00 0.00 N ATOM 0 H ARG A 190 22.359 -20.012 -11.440 1.00 0.00 H new ATOM 0 HA ARG A 190 24.518 -19.190 -9.813 1.00 0.00 H new ATOM 0 HB2 ARG A 190 22.692 -21.078 -9.588 1.00 0.00 H new ATOM 0 HB3 ARG A 190 23.828 -22.058 -10.494 1.00 0.00 H new ATOM 0 HG2 ARG A 190 25.563 -21.772 -8.818 1.00 0.00 H new ATOM 0 HG3 ARG A 190 24.676 -20.491 -8.015 1.00 0.00 H new ATOM 0 HD2 ARG A 190 22.826 -22.145 -7.504 1.00 0.00 H new ATOM 0 HD3 ARG A 190 23.796 -23.414 -8.225 1.00 0.00 H new ATOM 0 HE ARG A 190 25.468 -22.221 -6.297 1.00 0.00 H new ATOM 0 HH11 ARG A 190 22.311 -23.852 -6.392 1.00 0.00 H new ATOM 0 HH12 ARG A 190 22.455 -24.497 -4.754 1.00 0.00 H new ATOM 0 HH21 ARG A 190 25.648 -23.064 -4.168 1.00 0.00 H new ATOM 0 HH22 ARG A 190 24.347 -24.050 -3.493 1.00 0.00 H new ATOM 829 N ARG A 191 26.682 -19.885 -10.837 1.00 0.00 N ATOM 830 CA ARG A 191 27.969 -20.089 -11.508 1.00 0.00 C ATOM 831 C ARG A 191 28.001 -19.301 -12.826 1.00 0.00 C ATOM 832 O ARG A 191 27.103 -18.510 -13.099 1.00 0.00 O ATOM 833 CB ARG A 191 28.220 -21.594 -11.735 1.00 0.00 C ATOM 834 CG ARG A 191 28.444 -22.298 -10.390 1.00 0.00 C ATOM 835 CD ARG A 191 29.921 -22.196 -9.991 1.00 0.00 C ATOM 836 NE ARG A 191 30.136 -22.681 -8.619 1.00 0.00 N ATOM 837 CZ ARG A 191 29.936 -21.920 -7.525 1.00 0.00 C ATOM 838 NH1 ARG A 191 29.440 -20.680 -7.643 1.00 0.00 N ATOM 839 NH2 ARG A 191 30.236 -22.406 -6.314 1.00 0.00 N ATOM 0 H ARG A 191 26.763 -19.448 -9.919 1.00 0.00 H new ATOM 0 HA ARG A 191 28.773 -19.715 -10.874 1.00 0.00 H new ATOM 0 HB2 ARG A 191 27.369 -22.039 -12.250 1.00 0.00 H new ATOM 0 HB3 ARG A 191 29.090 -21.733 -12.377 1.00 0.00 H new ATOM 0 HG2 ARG A 191 27.818 -21.843 -9.622 1.00 0.00 H new ATOM 0 HG3 ARG A 191 28.149 -23.345 -10.463 1.00 0.00 H new ATOM 0 HD2 ARG A 191 30.529 -22.777 -10.684 1.00 0.00 H new ATOM 0 HD3 ARG A 191 30.251 -21.160 -10.069 1.00 0.00 H new ATOM 0 HE ARG A 191 30.452 -23.642 -8.489 1.00 0.00 H new ATOM 0 HH11 ARG A 191 29.212 -20.308 -8.565 1.00 0.00 H new ATOM 0 HH12 ARG A 191 29.291 -20.109 -6.811 1.00 0.00 H new ATOM 0 HH21 ARG A 191 30.614 -23.349 -6.222 1.00 0.00 H new ATOM 0 HH22 ARG A 191 30.086 -21.833 -5.483 1.00 0.00 H new ATOM 853 N LYS A 192 29.051 -19.513 -13.636 1.00 0.00 N ATOM 854 CA LYS A 192 29.211 -18.809 -14.906 1.00 0.00 C ATOM 855 C LYS A 192 29.465 -19.804 -16.044 1.00 0.00 C ATOM 856 O LYS A 192 30.023 -19.437 -17.080 1.00 0.00 O ATOM 857 CB LYS A 192 30.353 -17.775 -14.786 1.00 0.00 C ATOM 858 CG LYS A 192 31.582 -18.353 -14.051 1.00 0.00 C ATOM 859 CD LYS A 192 32.223 -19.486 -14.866 1.00 0.00 C ATOM 860 CE LYS A 192 33.666 -19.716 -14.399 1.00 0.00 C ATOM 861 NZ LYS A 192 33.717 -20.112 -12.979 1.00 0.00 N ATOM 0 H LYS A 192 29.802 -20.171 -13.427 1.00 0.00 H new ATOM 0 HA LYS A 192 28.291 -18.275 -15.143 1.00 0.00 H new ATOM 0 HB2 LYS A 192 30.649 -17.444 -15.782 1.00 0.00 H new ATOM 0 HB3 LYS A 192 29.992 -16.896 -14.252 1.00 0.00 H new ATOM 0 HG2 LYS A 192 32.314 -17.563 -13.880 1.00 0.00 H new ATOM 0 HG3 LYS A 192 31.283 -18.728 -13.072 1.00 0.00 H new ATOM 0 HD2 LYS A 192 31.644 -20.402 -14.749 1.00 0.00 H new ATOM 0 HD3 LYS A 192 32.211 -19.234 -15.926 1.00 0.00 H new ATOM 0 HE2 LYS A 192 34.129 -20.490 -15.011 1.00 0.00 H new ATOM 0 HE3 LYS A 192 34.247 -18.805 -14.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 192 34.680 -20.423 -12.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 192 33.457 -19.301 -12.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 192 33.050 -20.892 -12.812 1.00 0.00 H new ATOM 875 N VAL A 193 29.051 -21.063 -15.853 1.00 0.00 N ATOM 876 CA VAL A 193 29.232 -22.098 -16.863 1.00 0.00 C ATOM 877 C VAL A 193 28.300 -21.840 -18.052 1.00 0.00 C ATOM 878 O VAL A 193 28.625 -22.191 -19.182 1.00 0.00 O ATOM 879 CB VAL A 193 28.978 -23.488 -16.248 1.00 0.00 C ATOM 880 CG1 VAL A 193 29.978 -23.740 -15.116 1.00 0.00 C ATOM 881 CG2 VAL A 193 27.547 -23.588 -15.698 1.00 0.00 C ATOM 0 H VAL A 193 28.587 -21.384 -15.003 1.00 0.00 H new ATOM 0 HA VAL A 193 30.260 -22.071 -17.225 1.00 0.00 H new ATOM 0 HB VAL A 193 29.105 -24.239 -17.028 1.00 0.00 H new ATOM 0 HG11 VAL A 193 29.797 -24.723 -14.682 1.00 0.00 H new ATOM 0 HG12 VAL A 193 30.993 -23.699 -15.511 1.00 0.00 H new ATOM 0 HG13 VAL A 193 29.857 -22.977 -14.347 1.00 0.00 H new ATOM 0 HG21 VAL A 193 27.390 -24.578 -15.269 1.00 0.00 H new ATOM 0 HG22 VAL A 193 27.400 -22.831 -14.928 1.00 0.00 H new ATOM 0 HG23 VAL A 193 26.834 -23.426 -16.507 1.00 0.00 H new HETATM 891 N NH2 A 194 27.142 -21.225 -17.796 1.00 0.00 N TER 894 NH2 A 194