USER MOD reduce.3.24.130724 H: found=0, std=0, add=602, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 602 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 192 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 235 MET CE :methyl 149:sc= -0.466 (180deg=-4.1!) USER MOD Single : A 173 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 174 ASN : amide:sc= -0.729 X(o=-0.73,f=-0.4) USER MOD Single : A 176 HIS : no HD1:sc= -1.1! K(o=-1.1!,f=-0.17) USER MOD Single : A 177 LYS NZ :NH3+ -166:sc= -0.231 (180deg=-0.565) USER MOD Single : A 178 SER OG : rot 180:sc= 0 USER MOD Single : A 186 GLN : amide:sc= -0.151 X(o=-0.15,f=-0.15) USER MOD Single : A 197 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 202 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 203 CYS SG : rot 180:sc= 0 USER MOD Single : A 204 TYR OH : rot -154:sc= -0.861 USER MOD Single : A 214 HIS : no HD1:sc= -3.8! K(o=-3.8!,f=-2.3) USER MOD Single : A 217 SER OG : rot 180:sc= 0 USER MOD Single : A 220 SER OG : rot 180:sc= 0 USER MOD Single : A 223 THR OG1 : rot 180:sc= 0 USER MOD Single : A 229 GLN : amide:sc= -1.16! K(o=-1.2!,f=0) USER MOD Single : A 230 GLN : amide:sc= -0.256 X(o=-0.26,f=0.042) USER MOD Single : A 239 CYS SG : rot -109:sc= 0.951 USER MOD Single : A 244 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 247 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 173 20.014 11.706 18.492 1.00 0.00 N ATOM 2 CA MET A 173 19.003 12.468 17.718 1.00 0.00 C ATOM 3 C MET A 173 17.837 11.538 17.390 1.00 0.00 C ATOM 4 O MET A 173 17.928 10.339 17.544 1.00 0.00 O ATOM 5 CB MET A 173 19.620 13.002 16.424 1.00 0.00 C ATOM 6 CG MET A 173 20.733 13.980 16.753 1.00 0.00 C ATOM 7 SD MET A 173 21.464 14.608 15.225 1.00 0.00 S ATOM 8 CE MET A 173 22.702 15.658 16.019 1.00 0.00 C ATOM 0 HA MET A 173 18.652 13.314 18.308 1.00 0.00 H new ATOM 0 HB2 MET A 173 20.012 12.177 15.829 1.00 0.00 H new ATOM 0 HB3 MET A 173 18.856 13.494 15.822 1.00 0.00 H new ATOM 0 HG2 MET A 173 20.341 14.806 17.346 1.00 0.00 H new ATOM 0 HG3 MET A 173 21.496 13.488 17.357 1.00 0.00 H new ATOM 0 HE1 MET A 173 23.293 16.164 15.256 1.00 0.00 H new ATOM 0 HE2 MET A 173 22.204 16.400 16.643 1.00 0.00 H new ATOM 0 HE3 MET A 173 23.357 15.044 16.638 1.00 0.00 H new ATOM 20 N ASN A 174 16.762 12.067 16.898 1.00 0.00 N ATOM 21 CA ASN A 174 15.603 11.196 16.531 1.00 0.00 C ATOM 22 C ASN A 174 15.982 10.347 15.298 1.00 0.00 C ATOM 23 O ASN A 174 16.764 10.760 14.453 1.00 0.00 O ATOM 24 CB ASN A 174 14.378 12.092 16.195 1.00 0.00 C ATOM 25 CG ASN A 174 14.863 13.503 15.861 1.00 0.00 C ATOM 26 OD1 ASN A 174 15.122 13.824 14.723 1.00 0.00 O ATOM 27 ND2 ASN A 174 14.970 14.376 16.820 1.00 0.00 N ATOM 0 H ASN A 174 16.627 13.064 16.731 1.00 0.00 H new ATOM 0 HA ASN A 174 15.352 10.538 17.363 1.00 0.00 H new ATOM 0 HB2 ASN A 174 13.828 11.675 15.352 1.00 0.00 H new ATOM 0 HB3 ASN A 174 13.691 12.121 17.041 1.00 0.00 H new ATOM 0 HD21 ASN A 174 15.271 15.328 16.612 1.00 0.00 H new ATOM 0 HD22 ASN A 174 14.752 14.108 17.780 1.00 0.00 H new ATOM 34 N VAL A 175 15.414 9.168 15.195 1.00 0.00 N ATOM 35 CA VAL A 175 15.715 8.289 14.037 1.00 0.00 C ATOM 36 C VAL A 175 15.085 8.920 12.792 1.00 0.00 C ATOM 37 O VAL A 175 14.027 9.523 12.858 1.00 0.00 O ATOM 38 CB VAL A 175 15.098 6.909 14.291 1.00 0.00 C ATOM 39 CG1 VAL A 175 13.572 7.039 14.391 1.00 0.00 C ATOM 40 CG2 VAL A 175 15.447 5.978 13.136 1.00 0.00 C ATOM 0 H VAL A 175 14.753 8.782 15.870 1.00 0.00 H new ATOM 0 HA VAL A 175 16.790 8.179 13.897 1.00 0.00 H new ATOM 0 HB VAL A 175 15.492 6.503 15.223 1.00 0.00 H new ATOM 0 HG11 VAL A 175 13.134 6.057 14.572 1.00 0.00 H new ATOM 0 HG12 VAL A 175 13.317 7.707 15.214 1.00 0.00 H new ATOM 0 HG13 VAL A 175 13.180 7.445 13.459 1.00 0.00 H new ATOM 0 HG21 VAL A 175 15.009 4.996 13.315 1.00 0.00 H new ATOM 0 HG22 VAL A 175 15.052 6.388 12.206 1.00 0.00 H new ATOM 0 HG23 VAL A 175 16.530 5.884 13.059 1.00 0.00 H new ATOM 50 N HIS A 176 15.720 8.789 11.668 1.00 0.00 N ATOM 51 CA HIS A 176 15.185 9.404 10.419 1.00 0.00 C ATOM 52 C HIS A 176 13.918 8.646 9.995 1.00 0.00 C ATOM 53 O HIS A 176 13.770 7.458 10.242 1.00 0.00 O ATOM 54 CB HIS A 176 16.243 9.308 9.289 1.00 0.00 C ATOM 55 CG HIS A 176 17.232 8.242 9.607 1.00 0.00 C ATOM 56 ND1 HIS A 176 17.064 6.942 9.175 1.00 0.00 N ATOM 57 CD2 HIS A 176 18.400 8.259 10.305 1.00 0.00 C ATOM 58 CE1 HIS A 176 18.107 6.238 9.613 1.00 0.00 C ATOM 59 NE2 HIS A 176 18.954 6.990 10.314 1.00 0.00 N ATOM 0 H HIS A 176 16.596 8.278 11.555 1.00 0.00 H new ATOM 0 HA HIS A 176 14.951 10.453 10.600 1.00 0.00 H new ATOM 0 HB2 HIS A 176 15.754 9.090 8.339 1.00 0.00 H new ATOM 0 HB3 HIS A 176 16.752 10.265 9.174 1.00 0.00 H new ATOM 0 HD2 HIS A 176 18.829 9.129 10.779 1.00 0.00 H new ATOM 0 HE1 HIS A 176 18.249 5.184 9.423 1.00 0.00 H new ATOM 0 HE2 HIS A 176 19.822 6.695 10.761 1.00 0.00 H new ATOM 67 N LYS A 177 13.007 9.321 9.356 1.00 0.00 N ATOM 68 CA LYS A 177 11.760 8.643 8.898 1.00 0.00 C ATOM 69 C LYS A 177 12.169 7.688 7.747 1.00 0.00 C ATOM 70 O LYS A 177 13.147 7.929 7.056 1.00 0.00 O ATOM 71 CB LYS A 177 10.713 9.668 8.409 1.00 0.00 C ATOM 72 CG LYS A 177 11.355 11.012 8.053 1.00 0.00 C ATOM 73 CD LYS A 177 11.515 11.892 9.302 1.00 0.00 C ATOM 74 CE LYS A 177 12.401 13.095 8.970 1.00 0.00 C ATOM 75 NZ LYS A 177 13.806 12.650 8.718 1.00 0.00 N ATOM 0 H LYS A 177 13.070 10.314 9.130 1.00 0.00 H new ATOM 0 HA LYS A 177 11.299 8.094 9.719 1.00 0.00 H new ATOM 0 HB2 LYS A 177 10.195 9.270 7.536 1.00 0.00 H new ATOM 0 HB3 LYS A 177 9.962 9.818 9.184 1.00 0.00 H new ATOM 0 HG2 LYS A 177 12.330 10.844 7.595 1.00 0.00 H new ATOM 0 HG3 LYS A 177 10.741 11.529 7.316 1.00 0.00 H new ATOM 0 HD2 LYS A 177 10.539 12.231 9.648 1.00 0.00 H new ATOM 0 HD3 LYS A 177 11.958 11.314 10.113 1.00 0.00 H new ATOM 0 HE2 LYS A 177 12.012 13.610 8.092 1.00 0.00 H new ATOM 0 HE3 LYS A 177 12.380 13.809 9.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 177 14.439 13.475 8.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 177 14.096 11.981 9.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 177 13.861 12.184 7.790 1.00 0.00 H new ATOM 89 N SER A 178 11.484 6.586 7.559 1.00 0.00 N ATOM 90 CA SER A 178 11.882 5.633 6.479 1.00 0.00 C ATOM 91 C SER A 178 11.820 6.293 5.095 1.00 0.00 C ATOM 92 O SER A 178 10.894 7.028 4.788 1.00 0.00 O ATOM 93 CB SER A 178 10.955 4.426 6.537 1.00 0.00 C ATOM 94 OG SER A 178 11.161 3.752 7.778 1.00 0.00 O ATOM 0 H SER A 178 10.669 6.307 8.105 1.00 0.00 H new ATOM 0 HA SER A 178 12.915 5.322 6.638 1.00 0.00 H new ATOM 0 HB2 SER A 178 9.916 4.743 6.447 1.00 0.00 H new ATOM 0 HB3 SER A 178 11.157 3.754 5.703 1.00 0.00 H new ATOM 0 HG SER A 178 10.569 2.973 7.829 1.00 0.00 H new ATOM 100 N GLU A 179 12.778 6.012 4.240 1.00 0.00 N ATOM 101 CA GLU A 179 12.771 6.618 2.871 1.00 0.00 C ATOM 102 C GLU A 179 13.207 5.577 1.843 1.00 0.00 C ATOM 103 O GLU A 179 14.325 5.602 1.361 1.00 0.00 O ATOM 104 CB GLU A 179 13.727 7.819 2.839 1.00 0.00 C ATOM 105 CG GLU A 179 13.037 9.043 3.464 1.00 0.00 C ATOM 106 CD GLU A 179 11.936 9.568 2.523 1.00 0.00 C ATOM 107 OE1 GLU A 179 11.922 9.171 1.367 1.00 0.00 O ATOM 108 OE2 GLU A 179 11.128 10.362 2.975 1.00 0.00 O ATOM 0 H GLU A 179 13.563 5.390 4.433 1.00 0.00 H new ATOM 0 HA GLU A 179 11.763 6.954 2.628 1.00 0.00 H new ATOM 0 HB2 GLU A 179 14.640 7.585 3.386 1.00 0.00 H new ATOM 0 HB3 GLU A 179 14.018 8.038 1.812 1.00 0.00 H new ATOM 0 HG2 GLU A 179 12.605 8.774 4.428 1.00 0.00 H new ATOM 0 HG3 GLU A 179 13.770 9.827 3.652 1.00 0.00 H new ATOM 115 N PHE A 180 12.332 4.660 1.516 1.00 0.00 N ATOM 116 CA PHE A 180 12.669 3.592 0.523 1.00 0.00 C ATOM 117 C PHE A 180 12.156 3.962 -0.877 1.00 0.00 C ATOM 118 O PHE A 180 11.533 4.987 -1.074 1.00 0.00 O ATOM 119 CB PHE A 180 12.056 2.265 0.963 1.00 0.00 C ATOM 120 CG PHE A 180 12.730 1.822 2.245 1.00 0.00 C ATOM 121 CD1 PHE A 180 14.019 1.272 2.207 1.00 0.00 C ATOM 122 CD2 PHE A 180 12.069 1.972 3.475 1.00 0.00 C ATOM 123 CE1 PHE A 180 14.645 0.870 3.390 1.00 0.00 C ATOM 124 CE2 PHE A 180 12.699 1.570 4.661 1.00 0.00 C ATOM 125 CZ PHE A 180 13.986 1.019 4.617 1.00 0.00 C ATOM 0 H PHE A 180 11.388 4.604 1.898 1.00 0.00 H new ATOM 0 HA PHE A 180 13.754 3.496 0.477 1.00 0.00 H new ATOM 0 HB2 PHE A 180 10.983 2.377 1.119 1.00 0.00 H new ATOM 0 HB3 PHE A 180 12.188 1.512 0.186 1.00 0.00 H new ATOM 0 HD1 PHE A 180 14.529 1.159 1.262 1.00 0.00 H new ATOM 0 HD2 PHE A 180 11.076 2.397 3.507 1.00 0.00 H new ATOM 0 HE1 PHE A 180 15.637 0.444 3.358 1.00 0.00 H new ATOM 0 HE2 PHE A 180 12.192 1.685 5.608 1.00 0.00 H new ATOM 0 HZ PHE A 180 14.471 0.709 5.531 1.00 0.00 H new ATOM 135 N ASP A 181 12.429 3.135 -1.852 1.00 0.00 N ATOM 136 CA ASP A 181 11.978 3.444 -3.245 1.00 0.00 C ATOM 137 C ASP A 181 10.507 3.863 -3.237 1.00 0.00 C ATOM 138 O ASP A 181 9.621 3.077 -2.959 1.00 0.00 O ATOM 139 CB ASP A 181 12.125 2.197 -4.115 1.00 0.00 C ATOM 140 CG ASP A 181 13.605 1.895 -4.359 1.00 0.00 C ATOM 141 OD1 ASP A 181 14.207 1.243 -3.527 1.00 0.00 O ATOM 142 OD2 ASP A 181 14.109 2.317 -5.383 1.00 0.00 O ATOM 0 H ASP A 181 12.943 2.261 -1.746 1.00 0.00 H new ATOM 0 HA ASP A 181 12.589 4.255 -3.642 1.00 0.00 H new ATOM 0 HB2 ASP A 181 11.648 1.346 -3.628 1.00 0.00 H new ATOM 0 HB3 ASP A 181 11.615 2.346 -5.067 1.00 0.00 H new ATOM 147 N GLU A 182 10.245 5.102 -3.551 1.00 0.00 N ATOM 148 CA GLU A 182 8.833 5.588 -3.575 1.00 0.00 C ATOM 149 C GLU A 182 8.018 4.786 -4.593 1.00 0.00 C ATOM 150 O GLU A 182 6.823 4.630 -4.460 1.00 0.00 O ATOM 151 CB GLU A 182 8.783 7.082 -3.935 1.00 0.00 C ATOM 152 CG GLU A 182 9.426 7.324 -5.301 1.00 0.00 C ATOM 153 CD GLU A 182 9.446 8.830 -5.586 1.00 0.00 C ATOM 154 OE1 GLU A 182 8.462 9.485 -5.275 1.00 0.00 O ATOM 155 OE2 GLU A 182 10.443 9.308 -6.108 1.00 0.00 O ATOM 0 H GLU A 182 10.948 5.801 -3.793 1.00 0.00 H new ATOM 0 HA GLU A 182 8.405 5.450 -2.582 1.00 0.00 H new ATOM 0 HB2 GLU A 182 7.748 7.425 -3.947 1.00 0.00 H new ATOM 0 HB3 GLU A 182 9.303 7.664 -3.173 1.00 0.00 H new ATOM 0 HG2 GLU A 182 10.440 6.925 -5.315 1.00 0.00 H new ATOM 0 HG3 GLU A 182 8.867 6.802 -6.078 1.00 0.00 H new ATOM 162 N ASP A 183 8.643 4.289 -5.614 1.00 0.00 N ATOM 163 CA ASP A 183 7.879 3.519 -6.629 1.00 0.00 C ATOM 164 C ASP A 183 7.215 2.308 -5.970 1.00 0.00 C ATOM 165 O ASP A 183 6.078 1.998 -6.243 1.00 0.00 O ATOM 166 CB ASP A 183 8.829 3.046 -7.730 1.00 0.00 C ATOM 167 CG ASP A 183 9.268 4.243 -8.575 1.00 0.00 C ATOM 168 OD1 ASP A 183 8.408 5.014 -8.975 1.00 0.00 O ATOM 169 OD2 ASP A 183 10.453 4.361 -8.816 1.00 0.00 O ATOM 0 H ASP A 183 9.643 4.380 -5.792 1.00 0.00 H new ATOM 0 HA ASP A 183 7.109 4.158 -7.061 1.00 0.00 H new ATOM 0 HB2 ASP A 183 9.699 2.560 -7.290 1.00 0.00 H new ATOM 0 HB3 ASP A 183 8.334 2.306 -8.359 1.00 0.00 H new ATOM 174 N ALA A 184 7.903 1.627 -5.098 1.00 0.00 N ATOM 175 CA ALA A 184 7.291 0.441 -4.432 1.00 0.00 C ATOM 176 C ALA A 184 6.262 0.900 -3.383 1.00 0.00 C ATOM 177 O ALA A 184 5.190 0.339 -3.269 1.00 0.00 O ATOM 178 CB ALA A 184 8.391 -0.374 -3.748 1.00 0.00 C ATOM 0 H ALA A 184 8.860 1.838 -4.817 1.00 0.00 H new ATOM 0 HA ALA A 184 6.787 -0.173 -5.178 1.00 0.00 H new ATOM 0 HB1 ALA A 184 7.950 -1.243 -3.259 1.00 0.00 H new ATOM 0 HB2 ALA A 184 9.115 -0.705 -4.493 1.00 0.00 H new ATOM 0 HB3 ALA A 184 8.893 0.245 -3.004 1.00 0.00 H new ATOM 184 N TRP A 185 6.572 1.920 -2.622 1.00 0.00 N ATOM 185 CA TRP A 185 5.603 2.397 -1.582 1.00 0.00 C ATOM 186 C TRP A 185 4.291 2.818 -2.259 1.00 0.00 C ATOM 187 O TRP A 185 3.220 2.383 -1.879 1.00 0.00 O ATOM 188 CB TRP A 185 6.207 3.610 -0.851 1.00 0.00 C ATOM 189 CG TRP A 185 5.268 4.069 0.217 1.00 0.00 C ATOM 190 CD1 TRP A 185 4.672 5.282 0.244 1.00 0.00 C ATOM 191 CD2 TRP A 185 4.793 3.352 1.404 1.00 0.00 C ATOM 192 NE1 TRP A 185 3.871 5.363 1.368 1.00 0.00 N ATOM 193 CE2 TRP A 185 3.907 4.199 2.108 1.00 0.00 C ATOM 194 CE3 TRP A 185 5.040 2.068 1.931 1.00 0.00 C ATOM 195 CZ2 TRP A 185 3.284 3.790 3.290 1.00 0.00 C ATOM 196 CZ3 TRP A 185 4.414 1.653 3.119 1.00 0.00 C ATOM 197 CH2 TRP A 185 3.535 2.512 3.796 1.00 0.00 C ATOM 0 H TRP A 185 7.447 2.441 -2.673 1.00 0.00 H new ATOM 0 HA TRP A 185 5.405 1.595 -0.871 1.00 0.00 H new ATOM 0 HB2 TRP A 185 7.169 3.342 -0.413 1.00 0.00 H new ATOM 0 HB3 TRP A 185 6.393 4.418 -1.558 1.00 0.00 H new ATOM 0 HD1 TRP A 185 4.801 6.061 -0.493 1.00 0.00 H new ATOM 0 HE1 TRP A 185 3.320 6.184 1.620 1.00 0.00 H new ATOM 0 HE3 TRP A 185 5.715 1.399 1.418 1.00 0.00 H new ATOM 0 HZ2 TRP A 185 2.613 4.458 3.809 1.00 0.00 H new ATOM 0 HZ3 TRP A 185 4.611 0.667 3.513 1.00 0.00 H new ATOM 0 HH2 TRP A 185 3.054 2.186 4.706 1.00 0.00 H new ATOM 208 N GLN A 186 4.370 3.642 -3.273 1.00 0.00 N ATOM 209 CA GLN A 186 3.135 4.087 -4.005 1.00 0.00 C ATOM 210 C GLN A 186 2.421 2.869 -4.603 1.00 0.00 C ATOM 211 O GLN A 186 1.211 2.785 -4.631 1.00 0.00 O ATOM 212 CB GLN A 186 3.524 5.042 -5.130 1.00 0.00 C ATOM 213 CG GLN A 186 4.010 6.352 -4.519 1.00 0.00 C ATOM 214 CD GLN A 186 2.838 7.105 -3.897 1.00 0.00 C ATOM 215 OE1 GLN A 186 1.925 7.516 -4.586 1.00 0.00 O ATOM 216 NE2 GLN A 186 2.834 7.304 -2.611 1.00 0.00 N ATOM 0 H GLN A 186 5.242 4.031 -3.631 1.00 0.00 H new ATOM 0 HA GLN A 186 2.469 4.594 -3.307 1.00 0.00 H new ATOM 0 HB2 GLN A 186 4.307 4.600 -5.746 1.00 0.00 H new ATOM 0 HB3 GLN A 186 2.670 5.224 -5.782 1.00 0.00 H new ATOM 0 HG2 GLN A 186 4.767 6.150 -3.761 1.00 0.00 H new ATOM 0 HG3 GLN A 186 4.482 6.967 -5.285 1.00 0.00 H new ATOM 0 HE21 GLN A 186 3.603 6.956 -2.039 1.00 0.00 H new ATOM 0 HE22 GLN A 186 2.061 7.808 -2.175 1.00 0.00 H new ATOM 225 N PHE A 187 3.172 1.927 -5.101 1.00 0.00 N ATOM 226 CA PHE A 187 2.553 0.722 -5.711 1.00 0.00 C ATOM 227 C PHE A 187 1.669 0.040 -4.676 1.00 0.00 C ATOM 228 O PHE A 187 0.541 -0.316 -4.948 1.00 0.00 O ATOM 229 CB PHE A 187 3.685 -0.217 -6.128 1.00 0.00 C ATOM 230 CG PHE A 187 3.167 -1.273 -7.075 1.00 0.00 C ATOM 231 CD1 PHE A 187 2.344 -2.296 -6.593 1.00 0.00 C ATOM 232 CD2 PHE A 187 3.520 -1.235 -8.433 1.00 0.00 C ATOM 233 CE1 PHE A 187 1.868 -3.279 -7.466 1.00 0.00 C ATOM 234 CE2 PHE A 187 3.044 -2.221 -9.305 1.00 0.00 C ATOM 235 CZ PHE A 187 2.216 -3.243 -8.822 1.00 0.00 C ATOM 0 H PHE A 187 4.192 1.942 -5.111 1.00 0.00 H new ATOM 0 HA PHE A 187 1.944 0.987 -6.575 1.00 0.00 H new ATOM 0 HB2 PHE A 187 4.481 0.352 -6.608 1.00 0.00 H new ATOM 0 HB3 PHE A 187 4.118 -0.690 -5.246 1.00 0.00 H new ATOM 0 HD1 PHE A 187 2.076 -2.327 -5.547 1.00 0.00 H new ATOM 0 HD2 PHE A 187 4.158 -0.446 -8.804 1.00 0.00 H new ATOM 0 HE1 PHE A 187 1.231 -4.068 -7.094 1.00 0.00 H new ATOM 0 HE2 PHE A 187 3.315 -2.194 -10.350 1.00 0.00 H new ATOM 0 HZ PHE A 187 1.846 -4.002 -9.495 1.00 0.00 H new ATOM 245 N LEU A 188 2.176 -0.154 -3.497 1.00 0.00 N ATOM 246 CA LEU A 188 1.374 -0.813 -2.435 1.00 0.00 C ATOM 247 C LEU A 188 0.119 0.010 -2.137 1.00 0.00 C ATOM 248 O LEU A 188 -0.987 -0.488 -2.167 1.00 0.00 O ATOM 249 CB LEU A 188 2.242 -0.913 -1.173 1.00 0.00 C ATOM 250 CG LEU A 188 1.424 -1.440 0.013 1.00 0.00 C ATOM 251 CD1 LEU A 188 0.794 -2.789 -0.325 1.00 0.00 C ATOM 252 CD2 LEU A 188 2.348 -1.617 1.223 1.00 0.00 C ATOM 0 H LEU A 188 3.119 0.117 -3.220 1.00 0.00 H new ATOM 0 HA LEU A 188 1.065 -1.806 -2.762 1.00 0.00 H new ATOM 0 HB2 LEU A 188 3.088 -1.575 -1.360 1.00 0.00 H new ATOM 0 HB3 LEU A 188 2.652 0.067 -0.930 1.00 0.00 H new ATOM 0 HG LEU A 188 0.634 -0.724 0.237 1.00 0.00 H new ATOM 0 HD11 LEU A 188 0.218 -3.146 0.529 1.00 0.00 H new ATOM 0 HD12 LEU A 188 0.135 -2.677 -1.186 1.00 0.00 H new ATOM 0 HD13 LEU A 188 1.579 -3.508 -0.560 1.00 0.00 H new ATOM 0 HD21 LEU A 188 1.772 -1.991 2.069 1.00 0.00 H new ATOM 0 HD22 LEU A 188 3.137 -2.328 0.978 1.00 0.00 H new ATOM 0 HD23 LEU A 188 2.794 -0.657 1.484 1.00 0.00 H new ATOM 264 N ILE A 189 0.296 1.269 -1.844 1.00 0.00 N ATOM 265 CA ILE A 189 -0.868 2.146 -1.528 1.00 0.00 C ATOM 266 C ILE A 189 -1.772 2.355 -2.745 1.00 0.00 C ATOM 267 O ILE A 189 -2.975 2.431 -2.614 1.00 0.00 O ATOM 268 CB ILE A 189 -0.388 3.501 -0.983 1.00 0.00 C ATOM 269 CG1 ILE A 189 0.176 3.291 0.426 1.00 0.00 C ATOM 270 CG2 ILE A 189 -1.557 4.497 -0.939 1.00 0.00 C ATOM 271 CD1 ILE A 189 0.799 4.585 0.938 1.00 0.00 C ATOM 0 H ILE A 189 1.204 1.732 -1.810 1.00 0.00 H new ATOM 0 HA ILE A 189 -1.457 1.642 -0.762 1.00 0.00 H new ATOM 0 HB ILE A 189 0.386 3.907 -1.635 1.00 0.00 H new ATOM 0 HG12 ILE A 189 -0.618 2.969 1.100 1.00 0.00 H new ATOM 0 HG13 ILE A 189 0.924 2.498 0.413 1.00 0.00 H new ATOM 0 HG21 ILE A 189 -1.206 5.453 -0.551 1.00 0.00 H new ATOM 0 HG22 ILE A 189 -1.954 4.637 -1.944 1.00 0.00 H new ATOM 0 HG23 ILE A 189 -2.342 4.109 -0.290 1.00 0.00 H new ATOM 0 HD11 ILE A 189 1.197 4.426 1.940 1.00 0.00 H new ATOM 0 HD12 ILE A 189 1.606 4.889 0.271 1.00 0.00 H new ATOM 0 HD13 ILE A 189 0.040 5.367 0.969 1.00 0.00 H new ATOM 283 N ALA A 190 -1.215 2.510 -3.909 1.00 0.00 N ATOM 284 CA ALA A 190 -2.070 2.774 -5.104 1.00 0.00 C ATOM 285 C ALA A 190 -3.050 1.622 -5.323 1.00 0.00 C ATOM 286 O ALA A 190 -4.209 1.845 -5.590 1.00 0.00 O ATOM 287 CB ALA A 190 -1.188 2.938 -6.351 1.00 0.00 C ATOM 0 H ALA A 190 -0.212 2.467 -4.089 1.00 0.00 H new ATOM 0 HA ALA A 190 -2.633 3.691 -4.932 1.00 0.00 H new ATOM 0 HB1 ALA A 190 -1.818 3.130 -7.219 1.00 0.00 H new ATOM 0 HB2 ALA A 190 -0.505 3.775 -6.206 1.00 0.00 H new ATOM 0 HB3 ALA A 190 -0.615 2.025 -6.514 1.00 0.00 H new ATOM 293 N ASP A 191 -2.612 0.396 -5.203 1.00 0.00 N ATOM 294 CA ASP A 191 -3.554 -0.743 -5.400 1.00 0.00 C ATOM 295 C ASP A 191 -4.533 -0.807 -4.224 1.00 0.00 C ATOM 296 O ASP A 191 -5.710 -1.066 -4.389 1.00 0.00 O ATOM 297 CB ASP A 191 -2.758 -2.043 -5.466 1.00 0.00 C ATOM 298 CG ASP A 191 -1.959 -2.091 -6.768 1.00 0.00 C ATOM 299 OD1 ASP A 191 -2.481 -1.646 -7.778 1.00 0.00 O ATOM 300 OD2 ASP A 191 -0.839 -2.579 -6.731 1.00 0.00 O ATOM 0 H ASP A 191 -1.651 0.136 -4.979 1.00 0.00 H new ATOM 0 HA ASP A 191 -4.110 -0.602 -6.327 1.00 0.00 H new ATOM 0 HB2 ASP A 191 -2.085 -2.112 -4.612 1.00 0.00 H new ATOM 0 HB3 ASP A 191 -3.433 -2.897 -5.410 1.00 0.00 H new ATOM 305 N TYR A 192 -4.040 -0.576 -3.043 1.00 0.00 N ATOM 306 CA TYR A 192 -4.903 -0.609 -1.836 1.00 0.00 C ATOM 307 C TYR A 192 -6.023 0.436 -1.939 1.00 0.00 C ATOM 308 O TYR A 192 -7.120 0.214 -1.476 1.00 0.00 O ATOM 309 CB TYR A 192 -4.043 -0.351 -0.608 1.00 0.00 C ATOM 310 CG TYR A 192 -4.915 -0.339 0.618 1.00 0.00 C ATOM 311 CD1 TYR A 192 -5.481 0.859 1.042 1.00 0.00 C ATOM 312 CD2 TYR A 192 -5.155 -1.520 1.329 1.00 0.00 C ATOM 313 CE1 TYR A 192 -6.285 0.887 2.173 1.00 0.00 C ATOM 314 CE2 TYR A 192 -5.962 -1.495 2.469 1.00 0.00 C ATOM 315 CZ TYR A 192 -6.528 -0.287 2.891 1.00 0.00 C ATOM 316 OH TYR A 192 -7.323 -0.251 4.012 1.00 0.00 O ATOM 0 H TYR A 192 -3.059 -0.362 -2.861 1.00 0.00 H new ATOM 0 HA TYR A 192 -5.372 -1.590 -1.754 1.00 0.00 H new ATOM 0 HB2 TYR A 192 -3.279 -1.123 -0.517 1.00 0.00 H new ATOM 0 HB3 TYR A 192 -3.523 0.602 -0.708 1.00 0.00 H new ATOM 0 HD1 TYR A 192 -5.295 1.769 0.490 1.00 0.00 H new ATOM 0 HD2 TYR A 192 -4.717 -2.450 0.997 1.00 0.00 H new ATOM 0 HE1 TYR A 192 -6.724 1.818 2.499 1.00 0.00 H new ATOM 0 HE2 TYR A 192 -6.148 -2.404 3.022 1.00 0.00 H new ATOM 0 HH TYR A 192 -7.392 -1.151 4.393 1.00 0.00 H new ATOM 326 N LEU A 193 -5.763 1.587 -2.514 1.00 0.00 N ATOM 327 CA LEU A 193 -6.844 2.626 -2.589 1.00 0.00 C ATOM 328 C LEU A 193 -7.845 2.302 -3.712 1.00 0.00 C ATOM 329 O LEU A 193 -8.879 2.937 -3.825 1.00 0.00 O ATOM 330 CB LEU A 193 -6.234 4.008 -2.848 1.00 0.00 C ATOM 331 CG LEU A 193 -5.352 4.430 -1.658 1.00 0.00 C ATOM 332 CD1 LEU A 193 -4.563 5.694 -2.032 1.00 0.00 C ATOM 333 CD2 LEU A 193 -6.218 4.714 -0.411 1.00 0.00 C ATOM 0 H LEU A 193 -4.868 1.850 -2.927 1.00 0.00 H new ATOM 0 HA LEU A 193 -7.370 2.627 -1.634 1.00 0.00 H new ATOM 0 HB2 LEU A 193 -5.639 3.986 -3.761 1.00 0.00 H new ATOM 0 HB3 LEU A 193 -7.026 4.741 -3.001 1.00 0.00 H new ATOM 0 HG LEU A 193 -4.664 3.617 -1.426 1.00 0.00 H new ATOM 0 HD11 LEU A 193 -3.938 5.995 -1.191 1.00 0.00 H new ATOM 0 HD12 LEU A 193 -3.933 5.487 -2.897 1.00 0.00 H new ATOM 0 HD13 LEU A 193 -5.258 6.498 -2.274 1.00 0.00 H new ATOM 0 HD21 LEU A 193 -5.576 5.010 0.418 1.00 0.00 H new ATOM 0 HD22 LEU A 193 -6.920 5.518 -0.631 1.00 0.00 H new ATOM 0 HD23 LEU A 193 -6.770 3.814 -0.139 1.00 0.00 H new ATOM 345 N ARG A 194 -7.569 1.317 -4.527 1.00 0.00 N ATOM 346 CA ARG A 194 -8.527 0.962 -5.617 1.00 0.00 C ATOM 347 C ARG A 194 -9.730 0.242 -4.991 1.00 0.00 C ATOM 348 O ARG A 194 -9.598 -0.398 -3.970 1.00 0.00 O ATOM 349 CB ARG A 194 -7.837 0.022 -6.622 1.00 0.00 C ATOM 350 CG ARG A 194 -6.800 0.784 -7.458 1.00 0.00 C ATOM 351 CD ARG A 194 -6.414 -0.056 -8.682 1.00 0.00 C ATOM 352 NE ARG A 194 -5.286 0.606 -9.391 1.00 0.00 N ATOM 353 CZ ARG A 194 -4.570 -0.058 -10.255 1.00 0.00 C ATOM 354 NH1 ARG A 194 -4.834 -1.309 -10.510 1.00 0.00 N ATOM 355 NH2 ARG A 194 -3.579 0.541 -10.861 1.00 0.00 N ATOM 0 H ARG A 194 -6.725 0.745 -4.486 1.00 0.00 H new ATOM 0 HA ARG A 194 -8.854 1.863 -6.136 1.00 0.00 H new ATOM 0 HB2 ARG A 194 -7.351 -0.795 -6.088 1.00 0.00 H new ATOM 0 HB3 ARG A 194 -8.583 -0.426 -7.279 1.00 0.00 H new ATOM 0 HG2 ARG A 194 -7.207 1.744 -7.776 1.00 0.00 H new ATOM 0 HG3 ARG A 194 -5.917 0.996 -6.856 1.00 0.00 H new ATOM 0 HD2 ARG A 194 -6.126 -1.061 -8.373 1.00 0.00 H new ATOM 0 HD3 ARG A 194 -7.268 -0.161 -9.351 1.00 0.00 H new ATOM 0 HE ARG A 194 -5.072 1.585 -9.200 1.00 0.00 H new ATOM 0 HH11 ARG A 194 -5.605 -1.775 -10.032 1.00 0.00 H new ATOM 0 HH12 ARG A 194 -4.269 -1.822 -11.187 1.00 0.00 H new ATOM 0 HH21 ARG A 194 -3.372 1.519 -10.656 1.00 0.00 H new ATOM 0 HH22 ARG A 194 -3.012 0.031 -11.539 1.00 0.00 H new ATOM 369 N PRO A 195 -10.898 0.336 -5.584 1.00 0.00 N ATOM 370 CA PRO A 195 -12.116 -0.334 -5.031 1.00 0.00 C ATOM 371 C PRO A 195 -11.916 -1.848 -4.908 1.00 0.00 C ATOM 372 O PRO A 195 -12.755 -2.549 -4.376 1.00 0.00 O ATOM 373 CB PRO A 195 -13.229 -0.001 -6.053 1.00 0.00 C ATOM 374 CG PRO A 195 -12.514 0.451 -7.297 1.00 0.00 C ATOM 375 CD PRO A 195 -11.197 1.071 -6.829 1.00 0.00 C ATOM 0 HA PRO A 195 -12.355 0.010 -4.025 1.00 0.00 H new ATOM 0 HB2 PRO A 195 -13.851 -0.873 -6.253 1.00 0.00 H new ATOM 0 HB3 PRO A 195 -13.888 0.780 -5.674 1.00 0.00 H new ATOM 0 HG2 PRO A 195 -12.333 -0.388 -7.969 1.00 0.00 H new ATOM 0 HG3 PRO A 195 -13.112 1.177 -7.848 1.00 0.00 H new ATOM 0 HD2 PRO A 195 -10.408 0.945 -7.570 1.00 0.00 H new ATOM 0 HD3 PRO A 195 -11.298 2.141 -6.650 1.00 0.00 H new ATOM 383 N GLU A 196 -10.813 -2.355 -5.391 1.00 0.00 N ATOM 384 CA GLU A 196 -10.578 -3.821 -5.287 1.00 0.00 C ATOM 385 C GLU A 196 -10.332 -4.165 -3.815 1.00 0.00 C ATOM 386 O GLU A 196 -10.834 -5.150 -3.303 1.00 0.00 O ATOM 387 CB GLU A 196 -9.356 -4.207 -6.136 1.00 0.00 C ATOM 388 CG GLU A 196 -9.699 -4.070 -7.623 1.00 0.00 C ATOM 389 CD GLU A 196 -8.484 -4.448 -8.473 1.00 0.00 C ATOM 390 OE1 GLU A 196 -7.432 -4.673 -7.899 1.00 0.00 O ATOM 391 OE2 GLU A 196 -8.630 -4.511 -9.684 1.00 0.00 O ATOM 0 H GLU A 196 -10.073 -1.823 -5.848 1.00 0.00 H new ATOM 0 HA GLU A 196 -11.443 -4.373 -5.655 1.00 0.00 H new ATOM 0 HB2 GLU A 196 -8.510 -3.566 -5.887 1.00 0.00 H new ATOM 0 HB3 GLU A 196 -9.056 -5.231 -5.915 1.00 0.00 H new ATOM 0 HG2 GLU A 196 -10.543 -4.714 -7.872 1.00 0.00 H new ATOM 0 HG3 GLU A 196 -10.004 -3.047 -7.842 1.00 0.00 H new ATOM 398 N LYS A 197 -9.586 -3.338 -3.121 1.00 0.00 N ATOM 399 CA LYS A 197 -9.327 -3.592 -1.675 1.00 0.00 C ATOM 400 C LYS A 197 -9.020 -5.086 -1.459 1.00 0.00 C ATOM 401 O LYS A 197 -9.667 -5.760 -0.682 1.00 0.00 O ATOM 402 CB LYS A 197 -10.566 -3.142 -0.854 1.00 0.00 C ATOM 403 CG LYS A 197 -10.131 -2.343 0.399 1.00 0.00 C ATOM 404 CD LYS A 197 -9.472 -3.278 1.428 1.00 0.00 C ATOM 405 CE LYS A 197 -10.539 -3.888 2.348 1.00 0.00 C ATOM 406 NZ LYS A 197 -10.853 -2.928 3.447 1.00 0.00 N ATOM 0 H LYS A 197 -9.147 -2.498 -3.498 1.00 0.00 H new ATOM 0 HA LYS A 197 -8.462 -3.021 -1.338 1.00 0.00 H new ATOM 0 HB2 LYS A 197 -11.217 -2.527 -1.476 1.00 0.00 H new ATOM 0 HB3 LYS A 197 -11.145 -4.015 -0.552 1.00 0.00 H new ATOM 0 HG2 LYS A 197 -9.433 -1.557 0.113 1.00 0.00 H new ATOM 0 HG3 LYS A 197 -10.997 -1.853 0.845 1.00 0.00 H new ATOM 0 HD2 LYS A 197 -8.928 -4.071 0.914 1.00 0.00 H new ATOM 0 HD3 LYS A 197 -8.744 -2.724 2.020 1.00 0.00 H new ATOM 0 HE2 LYS A 197 -11.441 -4.113 1.778 1.00 0.00 H new ATOM 0 HE3 LYS A 197 -10.181 -4.830 2.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 -11.576 -3.339 4.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 -9.991 -2.734 3.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 -11.211 -2.040 3.041 1.00 0.00 H new ATOM 420 N PRO A 198 -8.033 -5.593 -2.147 1.00 0.00 N ATOM 421 CA PRO A 198 -7.630 -7.027 -2.028 1.00 0.00 C ATOM 422 C PRO A 198 -7.011 -7.331 -0.655 1.00 0.00 C ATOM 423 O PRO A 198 -6.891 -6.466 0.188 1.00 0.00 O ATOM 424 CB PRO A 198 -6.596 -7.202 -3.153 1.00 0.00 C ATOM 425 CG PRO A 198 -6.035 -5.836 -3.381 1.00 0.00 C ATOM 426 CD PRO A 198 -7.185 -4.862 -3.112 1.00 0.00 C ATOM 0 HA PRO A 198 -8.477 -7.708 -2.115 1.00 0.00 H new ATOM 0 HB2 PRO A 198 -5.815 -7.906 -2.865 1.00 0.00 H new ATOM 0 HB3 PRO A 198 -7.060 -7.594 -4.058 1.00 0.00 H new ATOM 0 HG2 PRO A 198 -5.195 -5.642 -2.714 1.00 0.00 H new ATOM 0 HG3 PRO A 198 -5.664 -5.731 -4.401 1.00 0.00 H new ATOM 0 HD2 PRO A 198 -6.825 -3.920 -2.698 1.00 0.00 H new ATOM 0 HD3 PRO A 198 -7.730 -4.622 -4.025 1.00 0.00 H new ATOM 434 N ALA A 199 -6.618 -8.550 -0.427 1.00 0.00 N ATOM 435 CA ALA A 199 -6.010 -8.897 0.885 1.00 0.00 C ATOM 436 C ALA A 199 -4.661 -8.178 1.026 1.00 0.00 C ATOM 437 O ALA A 199 -3.801 -8.268 0.171 1.00 0.00 O ATOM 438 CB ALA A 199 -5.808 -10.414 0.953 1.00 0.00 C ATOM 0 H ALA A 199 -6.691 -9.321 -1.091 1.00 0.00 H new ATOM 0 HA ALA A 199 -6.665 -8.583 1.697 1.00 0.00 H new ATOM 0 HB1 ALA A 199 -5.362 -10.679 1.912 1.00 0.00 H new ATOM 0 HB2 ALA A 199 -6.771 -10.914 0.850 1.00 0.00 H new ATOM 0 HB3 ALA A 199 -5.147 -10.730 0.146 1.00 0.00 H new ATOM 444 N PHE A 200 -4.477 -7.465 2.104 1.00 0.00 N ATOM 445 CA PHE A 200 -3.194 -6.730 2.308 1.00 0.00 C ATOM 446 C PHE A 200 -2.031 -7.719 2.325 1.00 0.00 C ATOM 447 O PHE A 200 -1.023 -7.524 1.668 1.00 0.00 O ATOM 448 CB PHE A 200 -3.241 -5.987 3.649 1.00 0.00 C ATOM 449 CG PHE A 200 -1.927 -5.274 3.878 1.00 0.00 C ATOM 450 CD1 PHE A 200 -0.871 -5.945 4.507 1.00 0.00 C ATOM 451 CD2 PHE A 200 -1.763 -3.945 3.466 1.00 0.00 C ATOM 452 CE1 PHE A 200 0.349 -5.292 4.723 1.00 0.00 C ATOM 453 CE2 PHE A 200 -0.542 -3.286 3.679 1.00 0.00 C ATOM 454 CZ PHE A 200 0.516 -3.960 4.309 1.00 0.00 C ATOM 0 H PHE A 200 -5.160 -7.359 2.854 1.00 0.00 H new ATOM 0 HA PHE A 200 -3.054 -6.018 1.495 1.00 0.00 H new ATOM 0 HB2 PHE A 200 -4.061 -5.269 3.650 1.00 0.00 H new ATOM 0 HB3 PHE A 200 -3.431 -6.690 4.460 1.00 0.00 H new ATOM 0 HD1 PHE A 200 -0.998 -6.969 4.826 1.00 0.00 H new ATOM 0 HD2 PHE A 200 -2.578 -3.426 2.983 1.00 0.00 H new ATOM 0 HE1 PHE A 200 1.162 -5.813 5.208 1.00 0.00 H new ATOM 0 HE2 PHE A 200 -0.417 -2.262 3.359 1.00 0.00 H new ATOM 0 HZ PHE A 200 1.456 -3.456 4.475 1.00 0.00 H new ATOM 464 N ARG A 201 -2.161 -8.777 3.073 1.00 0.00 N ATOM 465 CA ARG A 201 -1.066 -9.782 3.146 1.00 0.00 C ATOM 466 C ARG A 201 -0.789 -10.382 1.760 1.00 0.00 C ATOM 467 O ARG A 201 0.350 -10.586 1.385 1.00 0.00 O ATOM 468 CB ARG A 201 -1.485 -10.890 4.115 1.00 0.00 C ATOM 469 CG ARG A 201 -1.491 -10.332 5.544 1.00 0.00 C ATOM 470 CD ARG A 201 -1.943 -11.414 6.523 1.00 0.00 C ATOM 471 NE ARG A 201 -3.329 -11.835 6.179 1.00 0.00 N ATOM 472 CZ ARG A 201 -3.813 -12.942 6.661 1.00 0.00 C ATOM 473 NH1 ARG A 201 -3.088 -13.670 7.457 1.00 0.00 N ATOM 474 NH2 ARG A 201 -5.025 -13.310 6.362 1.00 0.00 N ATOM 0 H ARG A 201 -2.982 -8.990 3.639 1.00 0.00 H new ATOM 0 HA ARG A 201 -0.154 -9.299 3.496 1.00 0.00 H new ATOM 0 HB2 ARG A 201 -2.475 -11.264 3.853 1.00 0.00 H new ATOM 0 HB3 ARG A 201 -0.797 -11.732 4.043 1.00 0.00 H new ATOM 0 HG2 ARG A 201 -0.494 -9.981 5.811 1.00 0.00 H new ATOM 0 HG3 ARG A 201 -2.158 -9.472 5.605 1.00 0.00 H new ATOM 0 HD2 ARG A 201 -1.268 -12.269 6.477 1.00 0.00 H new ATOM 0 HD3 ARG A 201 -1.908 -11.035 7.544 1.00 0.00 H new ATOM 0 HE ARG A 201 -3.900 -11.255 5.564 1.00 0.00 H new ATOM 0 HH11 ARG A 201 -2.143 -13.373 7.701 1.00 0.00 H new ATOM 0 HH12 ARG A 201 -3.464 -14.539 7.837 1.00 0.00 H new ATOM 0 HH21 ARG A 201 -5.597 -12.730 5.749 1.00 0.00 H new ATOM 0 HH22 ARG A 201 -5.402 -14.178 6.741 1.00 0.00 H new ATOM 488 N LYS A 202 -1.818 -10.665 1.000 1.00 0.00 N ATOM 489 CA LYS A 202 -1.608 -11.261 -0.355 1.00 0.00 C ATOM 490 C LYS A 202 -1.047 -10.194 -1.297 1.00 0.00 C ATOM 491 O LYS A 202 -0.178 -10.457 -2.107 1.00 0.00 O ATOM 492 CB LYS A 202 -2.949 -11.756 -0.905 1.00 0.00 C ATOM 493 CG LYS A 202 -2.717 -12.592 -2.162 1.00 0.00 C ATOM 494 CD LYS A 202 -4.058 -13.086 -2.717 1.00 0.00 C ATOM 495 CE LYS A 202 -3.803 -13.957 -3.954 1.00 0.00 C ATOM 496 NZ LYS A 202 -5.041 -14.707 -4.316 1.00 0.00 N ATOM 0 H LYS A 202 -2.792 -10.509 1.259 1.00 0.00 H new ATOM 0 HA LYS A 202 -0.908 -12.094 -0.281 1.00 0.00 H new ATOM 0 HB2 LYS A 202 -3.464 -12.352 -0.151 1.00 0.00 H new ATOM 0 HB3 LYS A 202 -3.593 -10.908 -1.135 1.00 0.00 H new ATOM 0 HG2 LYS A 202 -2.200 -11.997 -2.914 1.00 0.00 H new ATOM 0 HG3 LYS A 202 -2.075 -13.442 -1.930 1.00 0.00 H new ATOM 0 HD2 LYS A 202 -4.590 -13.659 -1.958 1.00 0.00 H new ATOM 0 HD3 LYS A 202 -4.691 -12.238 -2.979 1.00 0.00 H new ATOM 0 HE2 LYS A 202 -3.489 -13.332 -4.790 1.00 0.00 H new ATOM 0 HE3 LYS A 202 -2.990 -14.655 -3.755 1.00 0.00 H new ATOM 0 HZ1 LYS A 202 -4.858 -15.294 -5.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 202 -5.323 -15.316 -3.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 202 -5.806 -14.034 -4.524 1.00 0.00 H new ATOM 510 N CYS A 203 -1.543 -8.991 -1.195 1.00 0.00 N ATOM 511 CA CYS A 203 -1.044 -7.902 -2.073 1.00 0.00 C ATOM 512 C CYS A 203 0.452 -7.695 -1.809 1.00 0.00 C ATOM 513 O CYS A 203 1.232 -7.457 -2.713 1.00 0.00 O ATOM 514 CB CYS A 203 -1.805 -6.619 -1.761 1.00 0.00 C ATOM 515 SG CYS A 203 -1.163 -5.276 -2.789 1.00 0.00 S ATOM 0 H CYS A 203 -2.274 -8.718 -0.539 1.00 0.00 H new ATOM 0 HA CYS A 203 -1.196 -8.165 -3.120 1.00 0.00 H new ATOM 0 HB2 CYS A 203 -2.869 -6.759 -1.949 1.00 0.00 H new ATOM 0 HB3 CYS A 203 -1.699 -6.367 -0.706 1.00 0.00 H new ATOM 0 HG CYS A 203 -1.812 -4.180 -2.527 1.00 0.00 H new ATOM 521 N TYR A 204 0.861 -7.769 -0.570 1.00 0.00 N ATOM 522 CA TYR A 204 2.300 -7.564 -0.258 1.00 0.00 C ATOM 523 C TYR A 204 3.137 -8.611 -0.989 1.00 0.00 C ATOM 524 O TYR A 204 4.198 -8.321 -1.496 1.00 0.00 O ATOM 525 CB TYR A 204 2.542 -7.706 1.252 1.00 0.00 C ATOM 526 CG TYR A 204 3.954 -7.266 1.583 1.00 0.00 C ATOM 527 CD1 TYR A 204 5.047 -8.113 1.334 1.00 0.00 C ATOM 528 CD2 TYR A 204 4.167 -5.999 2.136 1.00 0.00 C ATOM 529 CE1 TYR A 204 6.349 -7.687 1.644 1.00 0.00 C ATOM 530 CE2 TYR A 204 5.468 -5.574 2.441 1.00 0.00 C ATOM 531 CZ TYR A 204 6.555 -6.416 2.197 1.00 0.00 C ATOM 532 OH TYR A 204 7.833 -5.991 2.498 1.00 0.00 O ATOM 0 H TYR A 204 0.263 -7.962 0.233 1.00 0.00 H new ATOM 0 HA TYR A 204 2.587 -6.563 -0.580 1.00 0.00 H new ATOM 0 HB2 TYR A 204 1.823 -7.101 1.804 1.00 0.00 H new ATOM 0 HB3 TYR A 204 2.391 -8.741 1.559 1.00 0.00 H new ATOM 0 HD1 TYR A 204 4.886 -9.091 0.905 1.00 0.00 H new ATOM 0 HD2 TYR A 204 3.328 -5.347 2.328 1.00 0.00 H new ATOM 0 HE1 TYR A 204 7.190 -8.338 1.456 1.00 0.00 H new ATOM 0 HE2 TYR A 204 5.630 -4.594 2.865 1.00 0.00 H new ATOM 0 HH TYR A 204 7.795 -5.321 3.212 1.00 0.00 H new ATOM 542 N GLU A 205 2.680 -9.833 -1.042 1.00 0.00 N ATOM 543 CA GLU A 205 3.477 -10.881 -1.731 1.00 0.00 C ATOM 544 C GLU A 205 3.670 -10.475 -3.196 1.00 0.00 C ATOM 545 O GLU A 205 4.738 -10.627 -3.762 1.00 0.00 O ATOM 546 CB GLU A 205 2.701 -12.198 -1.670 1.00 0.00 C ATOM 547 CG GLU A 205 2.675 -12.704 -0.229 1.00 0.00 C ATOM 548 CD GLU A 205 4.058 -13.231 0.156 1.00 0.00 C ATOM 549 OE1 GLU A 205 4.612 -14.003 -0.612 1.00 0.00 O ATOM 550 OE2 GLU A 205 4.543 -12.847 1.209 1.00 0.00 O ATOM 0 H GLU A 205 1.796 -10.147 -0.641 1.00 0.00 H new ATOM 0 HA GLU A 205 4.449 -10.997 -1.252 1.00 0.00 H new ATOM 0 HB2 GLU A 205 1.684 -12.051 -2.034 1.00 0.00 H new ATOM 0 HB3 GLU A 205 3.168 -12.939 -2.319 1.00 0.00 H new ATOM 0 HG2 GLU A 205 2.381 -11.899 0.444 1.00 0.00 H new ATOM 0 HG3 GLU A 205 1.932 -13.494 -0.124 1.00 0.00 H new ATOM 557 N ARG A 206 2.642 -9.942 -3.813 1.00 0.00 N ATOM 558 CA ARG A 206 2.771 -9.512 -5.239 1.00 0.00 C ATOM 559 C ARG A 206 3.840 -8.424 -5.330 1.00 0.00 C ATOM 560 O ARG A 206 4.644 -8.395 -6.240 1.00 0.00 O ATOM 561 CB ARG A 206 1.429 -8.957 -5.731 1.00 0.00 C ATOM 562 CG ARG A 206 0.388 -10.083 -5.784 1.00 0.00 C ATOM 563 CD ARG A 206 0.516 -10.885 -7.087 1.00 0.00 C ATOM 564 NE ARG A 206 -0.556 -11.922 -7.116 1.00 0.00 N ATOM 565 CZ ARG A 206 -0.850 -12.524 -8.231 1.00 0.00 C ATOM 566 NH1 ARG A 206 -0.251 -12.169 -9.333 1.00 0.00 N ATOM 567 NH2 ARG A 206 -1.767 -13.455 -8.246 1.00 0.00 N ATOM 0 H ARG A 206 1.725 -9.787 -3.393 1.00 0.00 H new ATOM 0 HA ARG A 206 3.054 -10.362 -5.859 1.00 0.00 H new ATOM 0 HB2 ARG A 206 1.087 -8.164 -5.065 1.00 0.00 H new ATOM 0 HB3 ARG A 206 1.549 -8.514 -6.719 1.00 0.00 H new ATOM 0 HG2 ARG A 206 0.520 -10.746 -4.929 1.00 0.00 H new ATOM 0 HG3 ARG A 206 -0.614 -9.661 -5.709 1.00 0.00 H new ATOM 0 HD2 ARG A 206 0.426 -10.223 -7.949 1.00 0.00 H new ATOM 0 HD3 ARG A 206 1.498 -11.354 -7.147 1.00 0.00 H new ATOM 0 HE ARG A 206 -1.059 -12.159 -6.261 1.00 0.00 H new ATOM 0 HH11 ARG A 206 0.444 -11.423 -9.318 1.00 0.00 H new ATOM 0 HH12 ARG A 206 -0.477 -12.637 -10.210 1.00 0.00 H new ATOM 0 HH21 ARG A 206 -2.251 -13.708 -7.384 1.00 0.00 H new ATOM 0 HH22 ARG A 206 -1.999 -13.928 -9.119 1.00 0.00 H new ATOM 581 N LEU A 207 3.861 -7.532 -4.379 1.00 0.00 N ATOM 582 CA LEU A 207 4.877 -6.451 -4.397 1.00 0.00 C ATOM 583 C LEU A 207 6.270 -7.067 -4.328 1.00 0.00 C ATOM 584 O LEU A 207 7.191 -6.609 -4.972 1.00 0.00 O ATOM 585 CB LEU A 207 4.667 -5.524 -3.204 1.00 0.00 C ATOM 586 CG LEU A 207 5.649 -4.339 -3.270 1.00 0.00 C ATOM 587 CD1 LEU A 207 5.287 -3.401 -4.437 1.00 0.00 C ATOM 588 CD2 LEU A 207 5.564 -3.578 -1.949 1.00 0.00 C ATOM 0 H LEU A 207 3.215 -7.508 -3.590 1.00 0.00 H new ATOM 0 HA LEU A 207 4.777 -5.876 -5.317 1.00 0.00 H new ATOM 0 HB2 LEU A 207 3.641 -5.155 -3.197 1.00 0.00 H new ATOM 0 HB3 LEU A 207 4.814 -6.076 -2.275 1.00 0.00 H new ATOM 0 HG LEU A 207 6.662 -4.708 -3.434 1.00 0.00 H new ATOM 0 HD11 LEU A 207 5.992 -2.570 -4.468 1.00 0.00 H new ATOM 0 HD12 LEU A 207 5.335 -3.953 -5.376 1.00 0.00 H new ATOM 0 HD13 LEU A 207 4.277 -3.016 -4.294 1.00 0.00 H new ATOM 0 HD21 LEU A 207 6.252 -2.733 -1.971 1.00 0.00 H new ATOM 0 HD22 LEU A 207 4.547 -3.215 -1.803 1.00 0.00 H new ATOM 0 HD23 LEU A 207 5.833 -4.243 -1.128 1.00 0.00 H new ATOM 600 N GLU A 208 6.446 -8.089 -3.539 1.00 0.00 N ATOM 601 CA GLU A 208 7.801 -8.699 -3.431 1.00 0.00 C ATOM 602 C GLU A 208 8.223 -9.176 -4.822 1.00 0.00 C ATOM 603 O GLU A 208 9.350 -8.989 -5.242 1.00 0.00 O ATOM 604 CB GLU A 208 7.744 -9.891 -2.474 1.00 0.00 C ATOM 605 CG GLU A 208 7.516 -9.375 -1.053 1.00 0.00 C ATOM 606 CD GLU A 208 7.486 -10.553 -0.076 1.00 0.00 C ATOM 607 OE1 GLU A 208 6.499 -11.263 -0.078 1.00 0.00 O ATOM 608 OE2 GLU A 208 8.451 -10.727 0.655 1.00 0.00 O ATOM 0 H GLU A 208 5.720 -8.525 -2.970 1.00 0.00 H new ATOM 0 HA GLU A 208 8.518 -7.971 -3.051 1.00 0.00 H new ATOM 0 HB2 GLU A 208 6.940 -10.568 -2.763 1.00 0.00 H new ATOM 0 HB3 GLU A 208 8.673 -10.459 -2.524 1.00 0.00 H new ATOM 0 HG2 GLU A 208 8.309 -8.680 -0.776 1.00 0.00 H new ATOM 0 HG3 GLU A 208 6.577 -8.824 -1.002 1.00 0.00 H new ATOM 615 N LEU A 209 7.314 -9.750 -5.555 1.00 0.00 N ATOM 616 CA LEU A 209 7.656 -10.190 -6.932 1.00 0.00 C ATOM 617 C LEU A 209 8.046 -8.938 -7.724 1.00 0.00 C ATOM 618 O LEU A 209 8.983 -8.931 -8.499 1.00 0.00 O ATOM 619 CB LEU A 209 6.430 -10.871 -7.568 1.00 0.00 C ATOM 620 CG LEU A 209 6.742 -11.344 -8.997 1.00 0.00 C ATOM 621 CD1 LEU A 209 7.880 -12.382 -8.986 1.00 0.00 C ATOM 622 CD2 LEU A 209 5.476 -11.985 -9.589 1.00 0.00 C ATOM 0 H LEU A 209 6.354 -9.933 -5.262 1.00 0.00 H new ATOM 0 HA LEU A 209 8.478 -10.905 -6.929 1.00 0.00 H new ATOM 0 HB2 LEU A 209 6.125 -11.721 -6.958 1.00 0.00 H new ATOM 0 HB3 LEU A 209 5.592 -10.175 -7.586 1.00 0.00 H new ATOM 0 HG LEU A 209 7.055 -10.491 -9.598 1.00 0.00 H new ATOM 0 HD11 LEU A 209 8.087 -12.706 -10.006 1.00 0.00 H new ATOM 0 HD12 LEU A 209 8.777 -11.934 -8.558 1.00 0.00 H new ATOM 0 HD13 LEU A 209 7.582 -13.242 -8.386 1.00 0.00 H new ATOM 0 HD21 LEU A 209 5.681 -12.326 -10.604 1.00 0.00 H new ATOM 0 HD22 LEU A 209 5.177 -12.834 -8.974 1.00 0.00 H new ATOM 0 HD23 LEU A 209 4.671 -11.250 -9.609 1.00 0.00 H new ATOM 634 N ALA A 210 7.329 -7.871 -7.511 1.00 0.00 N ATOM 635 CA ALA A 210 7.640 -6.597 -8.221 1.00 0.00 C ATOM 636 C ALA A 210 8.982 -6.043 -7.734 1.00 0.00 C ATOM 637 O ALA A 210 9.802 -5.598 -8.511 1.00 0.00 O ATOM 638 CB ALA A 210 6.549 -5.577 -7.926 1.00 0.00 C ATOM 0 H ALA A 210 6.536 -7.825 -6.872 1.00 0.00 H new ATOM 0 HA ALA A 210 7.693 -6.789 -9.293 1.00 0.00 H new ATOM 0 HB1 ALA A 210 6.773 -4.644 -8.444 1.00 0.00 H new ATOM 0 HB2 ALA A 210 5.589 -5.961 -8.270 1.00 0.00 H new ATOM 0 HB3 ALA A 210 6.503 -5.394 -6.852 1.00 0.00 H new ATOM 644 N ALA A 211 9.202 -6.059 -6.447 1.00 0.00 N ATOM 645 CA ALA A 211 10.480 -5.532 -5.897 1.00 0.00 C ATOM 646 C ALA A 211 11.651 -6.323 -6.479 1.00 0.00 C ATOM 647 O ALA A 211 12.678 -5.774 -6.804 1.00 0.00 O ATOM 648 CB ALA A 211 10.473 -5.657 -4.372 1.00 0.00 C ATOM 0 H ALA A 211 8.547 -6.416 -5.751 1.00 0.00 H new ATOM 0 HA ALA A 211 10.587 -4.482 -6.168 1.00 0.00 H new ATOM 0 HB1 ALA A 211 11.410 -5.270 -3.971 1.00 0.00 H new ATOM 0 HB2 ALA A 211 9.640 -5.085 -3.964 1.00 0.00 H new ATOM 0 HB3 ALA A 211 10.364 -6.705 -4.093 1.00 0.00 H new ATOM 654 N ARG A 212 11.514 -7.606 -6.615 1.00 0.00 N ATOM 655 CA ARG A 212 12.633 -8.396 -7.185 1.00 0.00 C ATOM 656 C ARG A 212 12.829 -7.973 -8.640 1.00 0.00 C ATOM 657 O ARG A 212 13.942 -7.842 -9.111 1.00 0.00 O ATOM 658 CB ARG A 212 12.307 -9.891 -7.116 1.00 0.00 C ATOM 659 CG ARG A 212 13.572 -10.689 -7.453 1.00 0.00 C ATOM 660 CD ARG A 212 13.267 -12.186 -7.410 1.00 0.00 C ATOM 661 NE ARG A 212 14.557 -12.965 -7.393 1.00 0.00 N ATOM 662 CZ ARG A 212 15.448 -12.849 -8.341 1.00 0.00 C ATOM 663 NH1 ARG A 212 15.170 -12.178 -9.422 1.00 0.00 N ATOM 664 NH2 ARG A 212 16.608 -13.439 -8.213 1.00 0.00 N ATOM 0 H ARG A 212 10.683 -8.140 -6.359 1.00 0.00 H new ATOM 0 HA ARG A 212 13.545 -8.215 -6.616 1.00 0.00 H new ATOM 0 HB2 ARG A 212 11.949 -10.154 -6.120 1.00 0.00 H new ATOM 0 HB3 ARG A 212 11.509 -10.136 -7.816 1.00 0.00 H new ATOM 0 HG2 ARG A 212 13.936 -10.411 -8.442 1.00 0.00 H new ATOM 0 HG3 ARG A 212 14.364 -10.449 -6.743 1.00 0.00 H new ATOM 0 HD2 ARG A 212 12.677 -12.422 -6.525 1.00 0.00 H new ATOM 0 HD3 ARG A 212 12.670 -12.471 -8.276 1.00 0.00 H new ATOM 0 HE ARG A 212 14.740 -13.602 -6.618 1.00 0.00 H new ATOM 0 HH11 ARG A 212 14.255 -11.741 -9.530 1.00 0.00 H new ATOM 0 HH12 ARG A 212 15.868 -12.089 -10.161 1.00 0.00 H new ATOM 0 HH21 ARG A 212 16.813 -13.986 -7.377 1.00 0.00 H new ATOM 0 HH22 ARG A 212 17.308 -13.352 -8.950 1.00 0.00 H new ATOM 678 N GLU A 213 11.760 -7.748 -9.361 1.00 0.00 N ATOM 679 CA GLU A 213 11.914 -7.334 -10.785 1.00 0.00 C ATOM 680 C GLU A 213 12.522 -5.931 -10.859 1.00 0.00 C ATOM 681 O GLU A 213 13.398 -5.664 -11.657 1.00 0.00 O ATOM 682 CB GLU A 213 10.545 -7.321 -11.458 1.00 0.00 C ATOM 683 CG GLU A 213 10.043 -8.755 -11.605 1.00 0.00 C ATOM 684 CD GLU A 213 10.892 -9.496 -12.637 1.00 0.00 C ATOM 685 OE1 GLU A 213 11.153 -8.924 -13.678 1.00 0.00 O ATOM 686 OE2 GLU A 213 11.261 -10.626 -12.367 1.00 0.00 O ATOM 0 H GLU A 213 10.799 -7.832 -9.029 1.00 0.00 H new ATOM 0 HA GLU A 213 12.572 -8.040 -11.293 1.00 0.00 H new ATOM 0 HB2 GLU A 213 9.841 -6.736 -10.866 1.00 0.00 H new ATOM 0 HB3 GLU A 213 10.612 -6.845 -12.436 1.00 0.00 H new ATOM 0 HG2 GLU A 213 10.092 -9.268 -10.644 1.00 0.00 H new ATOM 0 HG3 GLU A 213 8.997 -8.754 -11.913 1.00 0.00 H new ATOM 693 N HIS A 214 12.062 -5.028 -10.041 1.00 0.00 N ATOM 694 CA HIS A 214 12.613 -3.638 -10.067 1.00 0.00 C ATOM 695 C HIS A 214 13.816 -3.524 -9.128 1.00 0.00 C ATOM 696 O HIS A 214 14.581 -2.583 -9.199 1.00 0.00 O ATOM 697 CB HIS A 214 11.527 -2.666 -9.610 1.00 0.00 C ATOM 698 CG HIS A 214 10.435 -2.620 -10.640 1.00 0.00 C ATOM 699 ND1 HIS A 214 10.574 -1.912 -11.815 1.00 0.00 N ATOM 700 CD2 HIS A 214 9.182 -3.176 -10.682 1.00 0.00 C ATOM 701 CE1 HIS A 214 9.432 -2.050 -12.512 1.00 0.00 C ATOM 702 NE2 HIS A 214 8.546 -2.812 -11.865 1.00 0.00 N ATOM 0 H HIS A 214 11.327 -5.189 -9.353 1.00 0.00 H new ATOM 0 HA HIS A 214 12.933 -3.400 -11.081 1.00 0.00 H new ATOM 0 HB2 HIS A 214 11.122 -2.981 -8.648 1.00 0.00 H new ATOM 0 HB3 HIS A 214 11.950 -1.672 -9.467 1.00 0.00 H new ATOM 0 HD2 HIS A 214 8.754 -3.802 -9.913 1.00 0.00 H new ATOM 0 HE1 HIS A 214 9.253 -1.600 -13.477 1.00 0.00 H new ATOM 0 HE2 HIS A 214 7.608 -3.071 -12.171 1.00 0.00 H new ATOM 710 N GLY A 215 13.979 -4.459 -8.231 1.00 0.00 N ATOM 711 CA GLY A 215 15.117 -4.383 -7.269 1.00 0.00 C ATOM 712 C GLY A 215 14.776 -3.379 -6.162 1.00 0.00 C ATOM 713 O GLY A 215 15.648 -2.853 -5.501 1.00 0.00 O ATOM 0 H GLY A 215 13.373 -5.273 -8.123 1.00 0.00 H new ATOM 0 HA2 GLY A 215 15.311 -5.365 -6.838 1.00 0.00 H new ATOM 0 HA3 GLY A 215 16.026 -4.077 -7.786 1.00 0.00 H new ATOM 717 N TRP A 216 13.513 -3.096 -5.962 1.00 0.00 N ATOM 718 CA TRP A 216 13.129 -2.112 -4.910 1.00 0.00 C ATOM 719 C TRP A 216 13.397 -2.678 -3.517 1.00 0.00 C ATOM 720 O TRP A 216 13.122 -3.827 -3.230 1.00 0.00 O ATOM 721 CB TRP A 216 11.630 -1.778 -4.981 1.00 0.00 C ATOM 722 CG TRP A 216 11.250 -1.069 -6.252 1.00 0.00 C ATOM 723 CD1 TRP A 216 11.968 -0.106 -6.886 1.00 0.00 C ATOM 724 CD2 TRP A 216 10.030 -1.242 -7.031 1.00 0.00 C ATOM 725 NE1 TRP A 216 11.260 0.313 -8.003 1.00 0.00 N ATOM 726 CE2 TRP A 216 10.061 -0.360 -8.132 1.00 0.00 C ATOM 727 CE3 TRP A 216 8.909 -2.079 -6.886 1.00 0.00 C ATOM 728 CZ2 TRP A 216 9.013 -0.309 -9.055 1.00 0.00 C ATOM 729 CZ3 TRP A 216 7.855 -2.024 -7.813 1.00 0.00 C ATOM 730 CH2 TRP A 216 7.909 -1.141 -8.892 1.00 0.00 C ATOM 0 H TRP A 216 12.735 -3.503 -6.481 1.00 0.00 H new ATOM 0 HA TRP A 216 13.725 -1.217 -5.086 1.00 0.00 H new ATOM 0 HB2 TRP A 216 11.053 -2.699 -4.898 1.00 0.00 H new ATOM 0 HB3 TRP A 216 11.361 -1.155 -4.128 1.00 0.00 H new ATOM 0 HD1 TRP A 216 12.930 0.271 -6.573 1.00 0.00 H new ATOM 0 HE1 TRP A 216 11.585 1.031 -8.650 1.00 0.00 H new ATOM 0 HE3 TRP A 216 8.858 -2.769 -6.056 1.00 0.00 H new ATOM 0 HZ2 TRP A 216 9.059 0.373 -9.891 1.00 0.00 H new ATOM 0 HZ3 TRP A 216 6.998 -2.669 -7.690 1.00 0.00 H new ATOM 0 HH2 TRP A 216 7.095 -1.103 -9.600 1.00 0.00 H new ATOM 741 N SER A 217 13.876 -1.848 -2.633 1.00 0.00 N ATOM 742 CA SER A 217 14.102 -2.281 -1.231 1.00 0.00 C ATOM 743 C SER A 217 12.815 -1.951 -0.471 1.00 0.00 C ATOM 744 O SER A 217 12.463 -0.799 -0.318 1.00 0.00 O ATOM 745 CB SER A 217 15.261 -1.492 -0.636 1.00 0.00 C ATOM 746 OG SER A 217 16.427 -1.679 -1.431 1.00 0.00 O ATOM 0 H SER A 217 14.123 -0.877 -2.827 1.00 0.00 H new ATOM 0 HA SER A 217 14.342 -3.343 -1.172 1.00 0.00 H new ATOM 0 HB2 SER A 217 15.007 -0.433 -0.590 1.00 0.00 H new ATOM 0 HB3 SER A 217 15.450 -1.820 0.386 1.00 0.00 H new ATOM 0 HG SER A 217 17.170 -1.169 -1.047 1.00 0.00 H new ATOM 752 N ILE A 218 12.093 -2.945 -0.027 1.00 0.00 N ATOM 753 CA ILE A 218 10.797 -2.696 0.686 1.00 0.00 C ATOM 754 C ILE A 218 10.994 -2.795 2.209 1.00 0.00 C ATOM 755 O ILE A 218 11.812 -3.558 2.679 1.00 0.00 O ATOM 756 CB ILE A 218 9.786 -3.759 0.234 1.00 0.00 C ATOM 757 CG1 ILE A 218 10.195 -5.138 0.807 1.00 0.00 C ATOM 758 CG2 ILE A 218 9.756 -3.808 -1.301 1.00 0.00 C ATOM 759 CD1 ILE A 218 9.434 -6.265 0.099 1.00 0.00 C ATOM 0 H ILE A 218 12.344 -3.929 -0.127 1.00 0.00 H new ATOM 0 HA ILE A 218 10.436 -1.696 0.448 1.00 0.00 H new ATOM 0 HB ILE A 218 8.792 -3.506 0.602 1.00 0.00 H new ATOM 0 HG12 ILE A 218 11.268 -5.284 0.685 1.00 0.00 H new ATOM 0 HG13 ILE A 218 9.988 -5.169 1.877 1.00 0.00 H new ATOM 0 HG21 ILE A 218 9.039 -4.562 -1.627 1.00 0.00 H new ATOM 0 HG22 ILE A 218 9.461 -2.834 -1.690 1.00 0.00 H new ATOM 0 HG23 ILE A 218 10.747 -4.063 -1.676 1.00 0.00 H new ATOM 0 HD11 ILE A 218 9.736 -7.226 0.516 1.00 0.00 H new ATOM 0 HD12 ILE A 218 8.362 -6.127 0.243 1.00 0.00 H new ATOM 0 HD13 ILE A 218 9.662 -6.244 -0.967 1.00 0.00 H new ATOM 771 N PRO A 219 10.246 -2.041 2.983 1.00 0.00 N ATOM 772 CA PRO A 219 10.357 -2.073 4.467 1.00 0.00 C ATOM 773 C PRO A 219 9.698 -3.327 5.049 1.00 0.00 C ATOM 774 O PRO A 219 9.008 -4.056 4.363 1.00 0.00 O ATOM 775 CB PRO A 219 9.603 -0.812 4.901 1.00 0.00 C ATOM 776 CG PRO A 219 8.558 -0.639 3.855 1.00 0.00 C ATOM 777 CD PRO A 219 9.218 -1.073 2.548 1.00 0.00 C ATOM 0 HA PRO A 219 11.390 -2.100 4.813 1.00 0.00 H new ATOM 0 HB2 PRO A 219 9.161 -0.932 5.890 1.00 0.00 H new ATOM 0 HB3 PRO A 219 10.266 0.052 4.950 1.00 0.00 H new ATOM 0 HG2 PRO A 219 7.680 -1.247 4.073 1.00 0.00 H new ATOM 0 HG3 PRO A 219 8.223 0.397 3.801 1.00 0.00 H new ATOM 0 HD2 PRO A 219 8.499 -1.530 1.868 1.00 0.00 H new ATOM 0 HD3 PRO A 219 9.661 -0.227 2.022 1.00 0.00 H new ATOM 785 N SER A 220 9.898 -3.580 6.304 1.00 0.00 N ATOM 786 CA SER A 220 9.281 -4.780 6.917 1.00 0.00 C ATOM 787 C SER A 220 7.759 -4.700 6.806 1.00 0.00 C ATOM 788 O SER A 220 7.169 -3.641 6.926 1.00 0.00 O ATOM 789 CB SER A 220 9.669 -4.864 8.388 1.00 0.00 C ATOM 790 OG SER A 220 9.028 -5.993 8.975 1.00 0.00 O ATOM 0 H SER A 220 10.462 -3.009 6.933 1.00 0.00 H new ATOM 0 HA SER A 220 9.638 -5.666 6.391 1.00 0.00 H new ATOM 0 HB2 SER A 220 10.751 -4.952 8.487 1.00 0.00 H new ATOM 0 HB3 SER A 220 9.374 -3.952 8.907 1.00 0.00 H new ATOM 0 HG SER A 220 9.275 -6.054 9.921 1.00 0.00 H new ATOM 796 N ARG A 221 7.123 -5.817 6.579 1.00 0.00 N ATOM 797 CA ARG A 221 5.640 -5.828 6.456 1.00 0.00 C ATOM 798 C ARG A 221 5.016 -5.174 7.689 1.00 0.00 C ATOM 799 O ARG A 221 4.051 -4.441 7.594 1.00 0.00 O ATOM 800 CB ARG A 221 5.148 -7.279 6.370 1.00 0.00 C ATOM 801 CG ARG A 221 5.582 -7.900 5.051 1.00 0.00 C ATOM 802 CD ARG A 221 5.208 -9.388 5.051 1.00 0.00 C ATOM 803 NE ARG A 221 3.731 -9.518 5.237 1.00 0.00 N ATOM 804 CZ ARG A 221 3.131 -10.648 4.985 1.00 0.00 C ATOM 805 NH1 ARG A 221 3.807 -11.671 4.545 1.00 0.00 N ATOM 806 NH2 ARG A 221 1.841 -10.753 5.152 1.00 0.00 N ATOM 0 H ARG A 221 7.571 -6.727 6.473 1.00 0.00 H new ATOM 0 HA ARG A 221 5.352 -5.279 5.560 1.00 0.00 H new ATOM 0 HB2 ARG A 221 5.549 -7.857 7.203 1.00 0.00 H new ATOM 0 HB3 ARG A 221 4.062 -7.309 6.455 1.00 0.00 H new ATOM 0 HG2 ARG A 221 5.098 -7.390 4.218 1.00 0.00 H new ATOM 0 HG3 ARG A 221 6.657 -7.782 4.915 1.00 0.00 H new ATOM 0 HD2 ARG A 221 5.512 -9.853 4.113 1.00 0.00 H new ATOM 0 HD3 ARG A 221 5.735 -9.909 5.850 1.00 0.00 H new ATOM 0 HE ARG A 221 3.189 -8.718 5.563 1.00 0.00 H new ATOM 0 HH11 ARG A 221 4.813 -11.591 4.395 1.00 0.00 H new ATOM 0 HH12 ARG A 221 3.330 -12.552 4.350 1.00 0.00 H new ATOM 0 HH21 ARG A 221 1.302 -9.951 5.480 1.00 0.00 H new ATOM 0 HH22 ARG A 221 1.372 -11.637 4.955 1.00 0.00 H new ATOM 820 N ALA A 222 5.551 -5.434 8.844 1.00 0.00 N ATOM 821 CA ALA A 222 4.989 -4.820 10.072 1.00 0.00 C ATOM 822 C ALA A 222 5.094 -3.302 9.955 1.00 0.00 C ATOM 823 O ALA A 222 4.191 -2.577 10.320 1.00 0.00 O ATOM 824 CB ALA A 222 5.790 -5.306 11.284 1.00 0.00 C ATOM 0 H ALA A 222 6.354 -6.046 8.991 1.00 0.00 H new ATOM 0 HA ALA A 222 3.944 -5.104 10.194 1.00 0.00 H new ATOM 0 HB1 ALA A 222 5.384 -4.859 12.192 1.00 0.00 H new ATOM 0 HB2 ALA A 222 5.723 -6.392 11.353 1.00 0.00 H new ATOM 0 HB3 ALA A 222 6.834 -5.013 11.171 1.00 0.00 H new ATOM 830 N THR A 223 6.182 -2.815 9.434 1.00 0.00 N ATOM 831 CA THR A 223 6.330 -1.345 9.280 1.00 0.00 C ATOM 832 C THR A 223 5.333 -0.842 8.231 1.00 0.00 C ATOM 833 O THR A 223 4.732 0.208 8.377 1.00 0.00 O ATOM 834 CB THR A 223 7.760 -1.011 8.831 1.00 0.00 C ATOM 835 OG1 THR A 223 8.683 -1.445 9.824 1.00 0.00 O ATOM 836 CG2 THR A 223 7.900 0.503 8.612 1.00 0.00 C ATOM 0 H THR A 223 6.974 -3.370 9.109 1.00 0.00 H new ATOM 0 HA THR A 223 6.132 -0.859 10.236 1.00 0.00 H new ATOM 0 HB THR A 223 7.972 -1.524 7.893 1.00 0.00 H new ATOM 0 HG1 THR A 223 9.596 -1.234 9.537 1.00 0.00 H new ATOM 0 HG21 THR A 223 8.917 0.732 8.294 1.00 0.00 H new ATOM 0 HG22 THR A 223 7.198 0.826 7.843 1.00 0.00 H new ATOM 0 HG23 THR A 223 7.685 1.027 9.543 1.00 0.00 H new ATOM 844 N ALA A 224 5.152 -1.581 7.166 1.00 0.00 N ATOM 845 CA ALA A 224 4.201 -1.129 6.119 1.00 0.00 C ATOM 846 C ALA A 224 2.785 -1.098 6.680 1.00 0.00 C ATOM 847 O ALA A 224 2.145 -0.075 6.691 1.00 0.00 O ATOM 848 CB ALA A 224 4.246 -2.079 4.930 1.00 0.00 C ATOM 0 H ALA A 224 5.619 -2.469 6.981 1.00 0.00 H new ATOM 0 HA ALA A 224 4.487 -0.128 5.797 1.00 0.00 H new ATOM 0 HB1 ALA A 224 3.545 -1.740 4.167 1.00 0.00 H new ATOM 0 HB2 ALA A 224 5.254 -2.096 4.516 1.00 0.00 H new ATOM 0 HB3 ALA A 224 3.971 -3.082 5.255 1.00 0.00 H new ATOM 854 N PHE A 225 2.285 -2.204 7.147 1.00 0.00 N ATOM 855 CA PHE A 225 0.900 -2.204 7.688 1.00 0.00 C ATOM 856 C PHE A 225 0.791 -1.225 8.859 1.00 0.00 C ATOM 857 O PHE A 225 -0.154 -0.470 8.954 1.00 0.00 O ATOM 858 CB PHE A 225 0.549 -3.612 8.162 1.00 0.00 C ATOM 859 CG PHE A 225 -0.834 -3.614 8.778 1.00 0.00 C ATOM 860 CD1 PHE A 225 -1.948 -3.299 7.995 1.00 0.00 C ATOM 861 CD2 PHE A 225 -1.003 -3.945 10.132 1.00 0.00 C ATOM 862 CE1 PHE A 225 -3.227 -3.311 8.558 1.00 0.00 C ATOM 863 CE2 PHE A 225 -2.290 -3.953 10.697 1.00 0.00 C ATOM 864 CZ PHE A 225 -3.402 -3.635 9.908 1.00 0.00 C ATOM 0 H PHE A 225 2.770 -3.101 7.178 1.00 0.00 H new ATOM 0 HA PHE A 225 0.207 -1.894 6.906 1.00 0.00 H new ATOM 0 HB2 PHE A 225 0.585 -4.308 7.324 1.00 0.00 H new ATOM 0 HB3 PHE A 225 1.283 -3.954 8.892 1.00 0.00 H new ATOM 0 HD1 PHE A 225 -1.820 -3.046 6.953 1.00 0.00 H new ATOM 0 HD2 PHE A 225 -0.145 -4.193 10.739 1.00 0.00 H new ATOM 0 HE1 PHE A 225 -4.085 -3.069 7.948 1.00 0.00 H new ATOM 0 HE2 PHE A 225 -2.421 -4.204 11.739 1.00 0.00 H new ATOM 0 HZ PHE A 225 -4.392 -3.640 10.340 1.00 0.00 H new ATOM 874 N ARG A 226 1.743 -1.212 9.746 1.00 0.00 N ATOM 875 CA ARG A 226 1.653 -0.260 10.886 1.00 0.00 C ATOM 876 C ARG A 226 1.606 1.168 10.340 1.00 0.00 C ATOM 877 O ARG A 226 0.818 1.985 10.777 1.00 0.00 O ATOM 878 CB ARG A 226 2.862 -0.438 11.820 1.00 0.00 C ATOM 879 CG ARG A 226 2.744 0.556 12.981 1.00 0.00 C ATOM 880 CD ARG A 226 3.856 0.309 14.007 1.00 0.00 C ATOM 881 NE ARG A 226 3.729 -1.066 14.595 1.00 0.00 N ATOM 882 CZ ARG A 226 4.748 -1.608 15.212 1.00 0.00 C ATOM 883 NH1 ARG A 226 5.852 -0.926 15.352 1.00 0.00 N ATOM 884 NH2 ARG A 226 4.661 -2.822 15.702 1.00 0.00 N ATOM 0 H ARG A 226 2.569 -1.810 9.733 1.00 0.00 H new ATOM 0 HA ARG A 226 0.747 -0.458 11.459 1.00 0.00 H new ATOM 0 HB2 ARG A 226 2.897 -1.459 12.200 1.00 0.00 H new ATOM 0 HB3 ARG A 226 3.789 -0.269 11.272 1.00 0.00 H new ATOM 0 HG2 ARG A 226 2.808 1.576 12.603 1.00 0.00 H new ATOM 0 HG3 ARG A 226 1.770 0.454 13.459 1.00 0.00 H new ATOM 0 HD2 ARG A 226 4.830 0.419 13.531 1.00 0.00 H new ATOM 0 HD3 ARG A 226 3.802 1.056 14.799 1.00 0.00 H new ATOM 0 HE ARG A 226 2.850 -1.577 14.514 1.00 0.00 H new ATOM 0 HH11 ARG A 226 5.916 0.022 14.982 1.00 0.00 H new ATOM 0 HH12 ARG A 226 6.651 -1.341 15.832 1.00 0.00 H new ATOM 0 HH21 ARG A 226 3.794 -3.351 15.603 1.00 0.00 H new ATOM 0 HH22 ARG A 226 5.460 -3.237 16.181 1.00 0.00 H new ATOM 898 N ARG A 227 2.425 1.465 9.370 1.00 0.00 N ATOM 899 CA ARG A 227 2.417 2.828 8.776 1.00 0.00 C ATOM 900 C ARG A 227 1.055 3.077 8.114 1.00 0.00 C ATOM 901 O ARG A 227 0.496 4.153 8.204 1.00 0.00 O ATOM 902 CB ARG A 227 3.536 2.912 7.730 1.00 0.00 C ATOM 903 CG ARG A 227 3.564 4.292 7.043 1.00 0.00 C ATOM 904 CD ARG A 227 3.930 5.384 8.046 1.00 0.00 C ATOM 905 NE ARG A 227 4.229 6.639 7.300 1.00 0.00 N ATOM 906 CZ ARG A 227 4.347 7.770 7.937 1.00 0.00 C ATOM 907 NH1 ARG A 227 4.160 7.818 9.227 1.00 0.00 N ATOM 908 NH2 ARG A 227 4.633 8.863 7.283 1.00 0.00 N ATOM 0 H ARG A 227 3.101 0.819 8.963 1.00 0.00 H new ATOM 0 HA ARG A 227 2.582 3.582 9.545 1.00 0.00 H new ATOM 0 HB2 ARG A 227 4.497 2.723 8.208 1.00 0.00 H new ATOM 0 HB3 ARG A 227 3.394 2.134 6.980 1.00 0.00 H new ATOM 0 HG2 ARG A 227 4.286 4.283 6.227 1.00 0.00 H new ATOM 0 HG3 ARG A 227 2.589 4.506 6.604 1.00 0.00 H new ATOM 0 HD2 ARG A 227 3.109 5.546 8.744 1.00 0.00 H new ATOM 0 HD3 ARG A 227 4.795 5.080 8.636 1.00 0.00 H new ATOM 0 HE ARG A 227 4.342 6.613 6.287 1.00 0.00 H new ATOM 0 HH11 ARG A 227 3.921 6.969 9.740 1.00 0.00 H new ATOM 0 HH12 ARG A 227 4.253 8.704 9.723 1.00 0.00 H new ATOM 0 HH21 ARG A 227 4.764 8.833 6.272 1.00 0.00 H new ATOM 0 HH22 ARG A 227 4.725 9.747 7.783 1.00 0.00 H new ATOM 922 N ILE A 228 0.525 2.078 7.452 1.00 0.00 N ATOM 923 CA ILE A 228 -0.797 2.214 6.768 1.00 0.00 C ATOM 924 C ILE A 228 -1.894 2.501 7.799 1.00 0.00 C ATOM 925 O ILE A 228 -2.788 3.293 7.561 1.00 0.00 O ATOM 926 CB ILE A 228 -1.106 0.908 6.021 1.00 0.00 C ATOM 927 CG1 ILE A 228 -0.033 0.664 4.923 1.00 0.00 C ATOM 928 CG2 ILE A 228 -2.507 0.990 5.400 1.00 0.00 C ATOM 929 CD1 ILE A 228 -0.445 1.286 3.588 1.00 0.00 C ATOM 0 H ILE A 228 0.960 1.160 7.356 1.00 0.00 H new ATOM 0 HA ILE A 228 -0.761 3.042 6.060 1.00 0.00 H new ATOM 0 HB ILE A 228 -1.082 0.072 6.720 1.00 0.00 H new ATOM 0 HG12 ILE A 228 0.919 1.086 5.244 1.00 0.00 H new ATOM 0 HG13 ILE A 228 0.120 -0.407 4.794 1.00 0.00 H new ATOM 0 HG21 ILE A 228 -2.725 0.063 4.870 1.00 0.00 H new ATOM 0 HG22 ILE A 228 -3.246 1.140 6.187 1.00 0.00 H new ATOM 0 HG23 ILE A 228 -2.547 1.825 4.701 1.00 0.00 H new ATOM 0 HD11 ILE A 228 0.328 1.096 2.844 1.00 0.00 H new ATOM 0 HD12 ILE A 228 -1.385 0.845 3.256 1.00 0.00 H new ATOM 0 HD13 ILE A 228 -0.573 2.361 3.712 1.00 0.00 H new ATOM 941 N GLN A 229 -1.838 1.858 8.935 1.00 0.00 N ATOM 942 CA GLN A 229 -2.872 2.082 9.979 1.00 0.00 C ATOM 943 C GLN A 229 -2.708 3.482 10.570 1.00 0.00 C ATOM 944 O GLN A 229 -3.634 4.049 11.116 1.00 0.00 O ATOM 945 CB GLN A 229 -2.723 1.025 11.082 1.00 0.00 C ATOM 946 CG GLN A 229 -3.814 1.234 12.144 1.00 0.00 C ATOM 947 CD GLN A 229 -3.703 0.162 13.237 1.00 0.00 C ATOM 948 OE1 GLN A 229 -4.354 0.252 14.259 1.00 0.00 O ATOM 949 NE2 GLN A 229 -2.914 -0.863 13.061 1.00 0.00 N ATOM 0 H GLN A 229 -1.114 1.183 9.183 1.00 0.00 H new ATOM 0 HA GLN A 229 -3.864 1.998 9.535 1.00 0.00 H new ATOM 0 HB2 GLN A 229 -2.803 0.025 10.655 1.00 0.00 H new ATOM 0 HB3 GLN A 229 -1.736 1.098 11.540 1.00 0.00 H new ATOM 0 HG2 GLN A 229 -3.716 2.226 12.586 1.00 0.00 H new ATOM 0 HG3 GLN A 229 -4.798 1.188 11.678 1.00 0.00 H new ATOM 0 HE21 GLN A 229 -2.365 -0.943 12.205 1.00 0.00 H new ATOM 0 HE22 GLN A 229 -2.846 -1.584 13.780 1.00 0.00 H new ATOM 958 N GLN A 230 -1.536 4.037 10.473 1.00 0.00 N ATOM 959 CA GLN A 230 -1.305 5.386 11.037 1.00 0.00 C ATOM 960 C GLN A 230 -1.885 6.434 10.091 1.00 0.00 C ATOM 961 O GLN A 230 -1.994 7.591 10.430 1.00 0.00 O ATOM 962 CB GLN A 230 0.208 5.591 11.196 1.00 0.00 C ATOM 963 CG GLN A 230 0.511 6.980 11.768 1.00 0.00 C ATOM 964 CD GLN A 230 -0.250 7.173 13.084 1.00 0.00 C ATOM 965 OE1 GLN A 230 -1.233 7.887 13.136 1.00 0.00 O ATOM 966 NE2 GLN A 230 0.157 6.545 14.153 1.00 0.00 N ATOM 0 H GLN A 230 -0.726 3.610 10.024 1.00 0.00 H new ATOM 0 HA GLN A 230 -1.791 5.485 12.008 1.00 0.00 H new ATOM 0 HB2 GLN A 230 0.616 4.824 11.855 1.00 0.00 H new ATOM 0 HB3 GLN A 230 0.699 5.476 10.230 1.00 0.00 H new ATOM 0 HG2 GLN A 230 1.582 7.089 11.937 1.00 0.00 H new ATOM 0 HG3 GLN A 230 0.221 7.750 11.053 1.00 0.00 H new ATOM 0 HE21 GLN A 230 0.981 5.946 14.110 1.00 0.00 H new ATOM 0 HE22 GLN A 230 -0.349 6.653 15.032 1.00 0.00 H new ATOM 975 N LEU A 231 -2.276 6.045 8.907 1.00 0.00 N ATOM 976 CA LEU A 231 -2.851 7.049 7.970 1.00 0.00 C ATOM 977 C LEU A 231 -4.162 7.589 8.547 1.00 0.00 C ATOM 978 O LEU A 231 -4.191 8.635 9.172 1.00 0.00 O ATOM 979 CB LEU A 231 -3.140 6.386 6.615 1.00 0.00 C ATOM 980 CG LEU A 231 -1.832 6.061 5.877 1.00 0.00 C ATOM 981 CD1 LEU A 231 -2.106 5.013 4.799 1.00 0.00 C ATOM 982 CD2 LEU A 231 -1.253 7.310 5.200 1.00 0.00 C ATOM 0 H LEU A 231 -2.223 5.090 8.553 1.00 0.00 H new ATOM 0 HA LEU A 231 -2.139 7.863 7.836 1.00 0.00 H new ATOM 0 HB2 LEU A 231 -3.714 5.472 6.767 1.00 0.00 H new ATOM 0 HB3 LEU A 231 -3.753 7.049 6.004 1.00 0.00 H new ATOM 0 HG LEU A 231 -1.115 5.688 6.608 1.00 0.00 H new ATOM 0 HD11 LEU A 231 -1.180 4.781 4.274 1.00 0.00 H new ATOM 0 HD12 LEU A 231 -2.497 4.108 5.263 1.00 0.00 H new ATOM 0 HD13 LEU A 231 -2.837 5.402 4.090 1.00 0.00 H new ATOM 0 HD21 LEU A 231 -0.328 7.049 4.686 1.00 0.00 H new ATOM 0 HD22 LEU A 231 -1.972 7.699 4.479 1.00 0.00 H new ATOM 0 HD23 LEU A 231 -1.047 8.070 5.954 1.00 0.00 H new ATOM 994 N ASP A 232 -5.244 6.883 8.349 1.00 0.00 N ATOM 995 CA ASP A 232 -6.553 7.367 8.883 1.00 0.00 C ATOM 996 C ASP A 232 -7.661 6.339 8.634 1.00 0.00 C ATOM 997 O ASP A 232 -7.713 5.711 7.600 1.00 0.00 O ATOM 998 CB ASP A 232 -6.943 8.671 8.170 1.00 0.00 C ATOM 999 CG ASP A 232 -7.964 9.428 9.019 1.00 0.00 C ATOM 1000 OD1 ASP A 232 -8.940 8.813 9.419 1.00 0.00 O ATOM 1001 OD2 ASP A 232 -7.750 10.604 9.262 1.00 0.00 O ATOM 0 H ASP A 232 -5.279 5.998 7.844 1.00 0.00 H new ATOM 0 HA ASP A 232 -6.443 7.527 9.956 1.00 0.00 H new ATOM 0 HB2 ASP A 232 -6.059 9.288 8.008 1.00 0.00 H new ATOM 0 HB3 ASP A 232 -7.362 8.450 7.188 1.00 0.00 H new ATOM 1006 N GLU A 233 -8.572 6.194 9.563 1.00 0.00 N ATOM 1007 CA GLU A 233 -9.704 5.240 9.354 1.00 0.00 C ATOM 1008 C GLU A 233 -10.476 5.691 8.125 1.00 0.00 C ATOM 1009 O GLU A 233 -11.014 4.891 7.386 1.00 0.00 O ATOM 1010 CB GLU A 233 -10.635 5.215 10.570 1.00 0.00 C ATOM 1011 CG GLU A 233 -9.928 4.544 11.751 1.00 0.00 C ATOM 1012 CD GLU A 233 -10.878 4.474 12.951 1.00 0.00 C ATOM 1013 OE1 GLU A 233 -11.957 5.033 12.858 1.00 0.00 O ATOM 1014 OE2 GLU A 233 -10.505 3.866 13.942 1.00 0.00 O ATOM 0 H GLU A 233 -8.581 6.692 10.453 1.00 0.00 H new ATOM 0 HA GLU A 233 -9.311 4.233 9.217 1.00 0.00 H new ATOM 0 HB2 GLU A 233 -10.926 6.231 10.838 1.00 0.00 H new ATOM 0 HB3 GLU A 233 -11.550 4.675 10.328 1.00 0.00 H new ATOM 0 HG2 GLU A 233 -9.605 3.541 11.472 1.00 0.00 H new ATOM 0 HG3 GLU A 233 -9.032 5.105 12.017 1.00 0.00 H new ATOM 1021 N ALA A 234 -10.513 6.974 7.893 1.00 0.00 N ATOM 1022 CA ALA A 234 -11.220 7.508 6.698 1.00 0.00 C ATOM 1023 C ALA A 234 -10.572 6.910 5.453 1.00 0.00 C ATOM 1024 O ALA A 234 -11.167 6.847 4.403 1.00 0.00 O ATOM 1025 CB ALA A 234 -11.078 9.027 6.665 1.00 0.00 C ATOM 0 H ALA A 234 -10.079 7.681 8.487 1.00 0.00 H new ATOM 0 HA ALA A 234 -12.278 7.248 6.735 1.00 0.00 H new ATOM 0 HB1 ALA A 234 -11.595 9.422 5.790 1.00 0.00 H new ATOM 0 HB2 ALA A 234 -11.515 9.453 7.568 1.00 0.00 H new ATOM 0 HB3 ALA A 234 -10.022 9.293 6.613 1.00 0.00 H new ATOM 1031 N MET A 235 -9.355 6.459 5.575 1.00 0.00 N ATOM 1032 CA MET A 235 -8.660 5.837 4.416 1.00 0.00 C ATOM 1033 C MET A 235 -9.463 4.614 3.953 1.00 0.00 C ATOM 1034 O MET A 235 -9.598 4.354 2.780 1.00 0.00 O ATOM 1035 CB MET A 235 -7.262 5.399 4.839 1.00 0.00 C ATOM 1036 CG MET A 235 -6.490 4.873 3.623 1.00 0.00 C ATOM 1037 SD MET A 235 -5.025 3.964 4.175 1.00 0.00 S ATOM 1038 CE MET A 235 -5.878 2.626 5.053 1.00 0.00 C ATOM 0 H MET A 235 -8.808 6.495 6.435 1.00 0.00 H new ATOM 0 HA MET A 235 -8.580 6.556 3.601 1.00 0.00 H new ATOM 0 HB2 MET A 235 -6.728 6.238 5.285 1.00 0.00 H new ATOM 0 HB3 MET A 235 -7.330 4.623 5.601 1.00 0.00 H new ATOM 0 HG2 MET A 235 -7.130 4.222 3.028 1.00 0.00 H new ATOM 0 HG3 MET A 235 -6.194 5.703 2.981 1.00 0.00 H new ATOM 0 HE1 MET A 235 -5.282 1.715 4.996 1.00 0.00 H new ATOM 0 HE2 MET A 235 -6.015 2.905 6.098 1.00 0.00 H new ATOM 0 HE3 MET A 235 -6.851 2.452 4.594 1.00 0.00 H new ATOM 1048 N VAL A 236 -9.986 3.847 4.865 1.00 0.00 N ATOM 1049 CA VAL A 236 -10.763 2.649 4.449 1.00 0.00 C ATOM 1050 C VAL A 236 -11.938 3.117 3.596 1.00 0.00 C ATOM 1051 O VAL A 236 -12.284 2.518 2.601 1.00 0.00 O ATOM 1052 CB VAL A 236 -11.264 1.901 5.681 1.00 0.00 C ATOM 1053 CG1 VAL A 236 -12.197 0.764 5.251 1.00 0.00 C ATOM 1054 CG2 VAL A 236 -10.067 1.322 6.439 1.00 0.00 C ATOM 0 H VAL A 236 -9.911 3.995 5.871 1.00 0.00 H new ATOM 0 HA VAL A 236 -10.134 1.970 3.873 1.00 0.00 H new ATOM 0 HB VAL A 236 -11.811 2.588 6.327 1.00 0.00 H new ATOM 0 HG11 VAL A 236 -12.553 0.232 6.133 1.00 0.00 H new ATOM 0 HG12 VAL A 236 -13.048 1.177 4.709 1.00 0.00 H new ATOM 0 HG13 VAL A 236 -11.655 0.073 4.605 1.00 0.00 H new ATOM 0 HG21 VAL A 236 -10.419 0.786 7.321 1.00 0.00 H new ATOM 0 HG22 VAL A 236 -9.523 0.635 5.790 1.00 0.00 H new ATOM 0 HG23 VAL A 236 -9.405 2.131 6.747 1.00 0.00 H new ATOM 1064 N VAL A 237 -12.535 4.200 3.962 1.00 0.00 N ATOM 1065 CA VAL A 237 -13.660 4.729 3.150 1.00 0.00 C ATOM 1066 C VAL A 237 -13.109 5.126 1.778 1.00 0.00 C ATOM 1067 O VAL A 237 -13.811 5.105 0.785 1.00 0.00 O ATOM 1068 CB VAL A 237 -14.262 5.951 3.847 1.00 0.00 C ATOM 1069 CG1 VAL A 237 -15.235 6.659 2.906 1.00 0.00 C ATOM 1070 CG2 VAL A 237 -15.006 5.493 5.100 1.00 0.00 C ATOM 0 H VAL A 237 -12.297 4.748 4.789 1.00 0.00 H new ATOM 0 HA VAL A 237 -14.439 3.975 3.036 1.00 0.00 H new ATOM 0 HB VAL A 237 -13.466 6.643 4.121 1.00 0.00 H new ATOM 0 HG11 VAL A 237 -15.660 7.528 3.408 1.00 0.00 H new ATOM 0 HG12 VAL A 237 -14.705 6.981 2.010 1.00 0.00 H new ATOM 0 HG13 VAL A 237 -16.035 5.974 2.627 1.00 0.00 H new ATOM 0 HG21 VAL A 237 -15.438 6.358 5.603 1.00 0.00 H new ATOM 0 HG22 VAL A 237 -15.801 4.802 4.819 1.00 0.00 H new ATOM 0 HG23 VAL A 237 -14.311 4.992 5.773 1.00 0.00 H new ATOM 1080 N ALA A 238 -11.854 5.491 1.726 1.00 0.00 N ATOM 1081 CA ALA A 238 -11.237 5.899 0.435 1.00 0.00 C ATOM 1082 C ALA A 238 -11.354 4.748 -0.567 1.00 0.00 C ATOM 1083 O ALA A 238 -11.632 4.960 -1.728 1.00 0.00 O ATOM 1084 CB ALA A 238 -9.750 6.231 0.646 1.00 0.00 C ATOM 0 H ALA A 238 -11.228 5.523 2.531 1.00 0.00 H new ATOM 0 HA ALA A 238 -11.754 6.780 0.054 1.00 0.00 H new ATOM 0 HB1 ALA A 238 -9.305 6.529 -0.304 1.00 0.00 H new ATOM 0 HB2 ALA A 238 -9.658 7.048 1.362 1.00 0.00 H new ATOM 0 HB3 ALA A 238 -9.232 5.352 1.029 1.00 0.00 H new ATOM 1090 N CYS A 239 -11.163 3.533 -0.137 1.00 0.00 N ATOM 1091 CA CYS A 239 -11.291 2.401 -1.092 1.00 0.00 C ATOM 1092 C CYS A 239 -12.776 2.156 -1.353 1.00 0.00 C ATOM 1093 O CYS A 239 -13.260 2.321 -2.455 1.00 0.00 O ATOM 1094 CB CYS A 239 -10.648 1.138 -0.501 1.00 0.00 C ATOM 1095 SG CYS A 239 -9.123 1.580 0.365 1.00 0.00 S ATOM 0 H CYS A 239 -10.927 3.277 0.822 1.00 0.00 H new ATOM 0 HA CYS A 239 -10.782 2.642 -2.025 1.00 0.00 H new ATOM 0 HB2 CYS A 239 -11.341 0.653 0.187 1.00 0.00 H new ATOM 0 HB3 CYS A 239 -10.433 0.422 -1.294 1.00 0.00 H new ATOM 0 HG CYS A 239 -8.099 1.154 -0.314 1.00 0.00 H new ATOM 1101 N ARG A 240 -13.510 1.779 -0.340 1.00 0.00 N ATOM 1102 CA ARG A 240 -14.962 1.531 -0.520 1.00 0.00 C ATOM 1103 C ARG A 240 -15.721 2.813 -0.217 1.00 0.00 C ATOM 1104 O ARG A 240 -16.347 2.943 0.814 1.00 0.00 O ATOM 1105 CB ARG A 240 -15.421 0.435 0.444 1.00 0.00 C ATOM 1106 CG ARG A 240 -14.632 -0.858 0.197 1.00 0.00 C ATOM 1107 CD ARG A 240 -15.201 -1.610 -1.008 1.00 0.00 C ATOM 1108 NE ARG A 240 -14.436 -2.876 -1.173 1.00 0.00 N ATOM 1109 CZ ARG A 240 -14.860 -3.794 -1.988 1.00 0.00 C ATOM 1110 NH1 ARG A 240 -15.983 -3.637 -2.636 1.00 0.00 N ATOM 1111 NH2 ARG A 240 -14.165 -4.881 -2.153 1.00 0.00 N ATOM 0 H ARG A 240 -13.161 1.633 0.607 1.00 0.00 H new ATOM 0 HA ARG A 240 -15.155 1.214 -1.545 1.00 0.00 H new ATOM 0 HB2 ARG A 240 -15.279 0.764 1.473 1.00 0.00 H new ATOM 0 HB3 ARG A 240 -16.487 0.249 0.313 1.00 0.00 H new ATOM 0 HG2 ARG A 240 -13.582 -0.623 0.024 1.00 0.00 H new ATOM 0 HG3 ARG A 240 -14.675 -1.492 1.082 1.00 0.00 H new ATOM 0 HD2 ARG A 240 -16.259 -1.823 -0.857 1.00 0.00 H new ATOM 0 HD3 ARG A 240 -15.123 -1.000 -1.908 1.00 0.00 H new ATOM 0 HE ARG A 240 -13.576 -3.023 -0.644 1.00 0.00 H new ATOM 0 HH11 ARG A 240 -16.534 -2.789 -2.504 1.00 0.00 H new ATOM 0 HH12 ARG A 240 -16.309 -4.363 -3.274 1.00 0.00 H new ATOM 0 HH21 ARG A 240 -13.291 -5.010 -1.643 1.00 0.00 H new ATOM 0 HH22 ARG A 240 -14.494 -5.605 -2.792 1.00 0.00 H new ATOM 1125 N GLU A 241 -15.667 3.761 -1.109 1.00 0.00 N ATOM 1126 CA GLU A 241 -16.389 5.051 -0.880 1.00 0.00 C ATOM 1127 C GLU A 241 -17.889 4.787 -0.734 1.00 0.00 C ATOM 1128 O GLU A 241 -18.498 4.135 -1.559 1.00 0.00 O ATOM 1129 CB GLU A 241 -16.156 5.981 -2.068 1.00 0.00 C ATOM 1130 CG GLU A 241 -16.746 7.360 -1.765 1.00 0.00 C ATOM 1131 CD GLU A 241 -16.487 8.296 -2.951 1.00 0.00 C ATOM 1132 OE1 GLU A 241 -15.604 7.995 -3.740 1.00 0.00 O ATOM 1133 OE2 GLU A 241 -17.176 9.296 -3.053 1.00 0.00 O ATOM 0 H GLU A 241 -15.155 3.702 -1.989 1.00 0.00 H new ATOM 0 HA GLU A 241 -16.013 5.515 0.032 1.00 0.00 H new ATOM 0 HB2 GLU A 241 -15.089 6.068 -2.271 1.00 0.00 H new ATOM 0 HB3 GLU A 241 -16.618 5.566 -2.964 1.00 0.00 H new ATOM 0 HG2 GLU A 241 -17.817 7.277 -1.580 1.00 0.00 H new ATOM 0 HG3 GLU A 241 -16.297 7.769 -0.860 1.00 0.00 H new ATOM 1140 N GLY A 242 -18.486 5.294 0.312 1.00 0.00 N ATOM 1141 CA GLY A 242 -19.945 5.084 0.529 1.00 0.00 C ATOM 1142 C GLY A 242 -20.752 6.109 -0.279 1.00 0.00 C ATOM 1143 O GLY A 242 -20.242 7.128 -0.708 1.00 0.00 O ATOM 0 H GLY A 242 -18.020 5.849 1.030 1.00 0.00 H new ATOM 0 HA2 GLY A 242 -20.223 4.073 0.230 1.00 0.00 H new ATOM 0 HA3 GLY A 242 -20.180 5.179 1.589 1.00 0.00 H new ATOM 1147 N GLU A 243 -22.014 5.842 -0.490 1.00 0.00 N ATOM 1148 CA GLU A 243 -22.871 6.787 -1.259 1.00 0.00 C ATOM 1149 C GLU A 243 -24.345 6.509 -0.939 1.00 0.00 C ATOM 1150 O GLU A 243 -24.699 5.446 -0.464 1.00 0.00 O ATOM 1151 CB GLU A 243 -22.620 6.602 -2.761 1.00 0.00 C ATOM 1152 CG GLU A 243 -22.980 5.169 -3.162 1.00 0.00 C ATOM 1153 CD GLU A 243 -22.554 4.910 -4.609 1.00 0.00 C ATOM 1154 OE1 GLU A 243 -21.364 4.787 -4.845 1.00 0.00 O ATOM 1155 OE2 GLU A 243 -23.425 4.830 -5.455 1.00 0.00 O ATOM 0 H GLU A 243 -22.490 5.003 -0.159 1.00 0.00 H new ATOM 0 HA GLU A 243 -22.628 7.812 -0.981 1.00 0.00 H new ATOM 0 HB2 GLU A 243 -23.218 7.313 -3.331 1.00 0.00 H new ATOM 0 HB3 GLU A 243 -21.575 6.805 -2.994 1.00 0.00 H new ATOM 0 HG2 GLU A 243 -22.486 4.461 -2.496 1.00 0.00 H new ATOM 0 HG3 GLU A 243 -24.053 5.011 -3.056 1.00 0.00 H new ATOM 1162 N HIS A 244 -25.206 7.462 -1.190 1.00 0.00 N ATOM 1163 CA HIS A 244 -26.665 7.278 -0.908 1.00 0.00 C ATOM 1164 C HIS A 244 -27.437 7.327 -2.228 1.00 0.00 C ATOM 1165 O HIS A 244 -27.192 8.168 -3.071 1.00 0.00 O ATOM 1166 CB HIS A 244 -27.150 8.406 0.004 1.00 0.00 C ATOM 1167 CG HIS A 244 -26.511 8.276 1.360 1.00 0.00 C ATOM 1168 ND1 HIS A 244 -27.093 7.547 2.388 1.00 0.00 N ATOM 1169 CD2 HIS A 244 -25.342 8.781 1.875 1.00 0.00 C ATOM 1170 CE1 HIS A 244 -26.281 7.634 3.455 1.00 0.00 C ATOM 1171 NE2 HIS A 244 -25.199 8.373 3.197 1.00 0.00 N ATOM 0 H HIS A 244 -24.959 8.370 -1.583 1.00 0.00 H new ATOM 0 HA HIS A 244 -26.829 6.318 -0.419 1.00 0.00 H new ATOM 0 HB2 HIS A 244 -26.901 9.373 -0.434 1.00 0.00 H new ATOM 0 HB3 HIS A 244 -28.235 8.369 0.098 1.00 0.00 H new ATOM 0 HD2 HIS A 244 -24.641 9.400 1.336 1.00 0.00 H new ATOM 0 HE1 HIS A 244 -26.479 7.163 4.406 1.00 0.00 H new ATOM 0 HE2 HIS A 244 -24.432 8.591 3.833 1.00 0.00 H new ATOM 1179 N ALA A 245 -28.369 6.431 -2.409 1.00 0.00 N ATOM 1180 CA ALA A 245 -29.172 6.406 -3.668 1.00 0.00 C ATOM 1181 C ALA A 245 -30.158 7.570 -3.659 1.00 0.00 C ATOM 1182 O ALA A 245 -29.788 8.701 -3.433 1.00 0.00 O ATOM 1183 CB ALA A 245 -29.940 5.084 -3.752 1.00 0.00 C ATOM 0 H ALA A 245 -28.612 5.707 -1.732 1.00 0.00 H new ATOM 0 HA ALA A 245 -28.510 6.497 -4.529 1.00 0.00 H new ATOM 0 HB1 ALA A 245 -30.527 5.062 -4.670 1.00 0.00 H new ATOM 0 HB2 ALA A 245 -29.235 4.253 -3.753 1.00 0.00 H new ATOM 0 HB3 ALA A 245 -30.605 4.995 -2.893 1.00 0.00 H new ATOM 1189 N LEU A 246 -31.411 7.305 -3.909 1.00 0.00 N ATOM 1190 CA LEU A 246 -32.421 8.405 -3.917 1.00 0.00 C ATOM 1191 C LEU A 246 -32.871 8.680 -2.478 1.00 0.00 C ATOM 1192 O LEU A 246 -32.572 9.710 -1.910 1.00 0.00 O ATOM 1193 CB LEU A 246 -33.628 7.979 -4.758 1.00 0.00 C ATOM 1194 CG LEU A 246 -33.316 8.149 -6.249 1.00 0.00 C ATOM 1195 CD1 LEU A 246 -32.261 7.126 -6.686 1.00 0.00 C ATOM 1196 CD2 LEU A 246 -34.601 7.933 -7.056 1.00 0.00 C ATOM 0 H LEU A 246 -31.780 6.375 -4.108 1.00 0.00 H new ATOM 0 HA LEU A 246 -31.983 9.307 -4.344 1.00 0.00 H new ATOM 0 HB2 LEU A 246 -33.880 6.940 -4.547 1.00 0.00 H new ATOM 0 HB3 LEU A 246 -34.498 8.578 -4.490 1.00 0.00 H new ATOM 0 HG LEU A 246 -32.930 9.153 -6.425 1.00 0.00 H new ATOM 0 HD11 LEU A 246 -32.046 7.255 -7.747 1.00 0.00 H new ATOM 0 HD12 LEU A 246 -31.348 7.276 -6.110 1.00 0.00 H new ATOM 0 HD13 LEU A 246 -32.638 6.118 -6.512 1.00 0.00 H new ATOM 0 HD21 LEU A 246 -34.388 8.052 -8.118 1.00 0.00 H new ATOM 0 HD22 LEU A 246 -34.981 6.928 -6.873 1.00 0.00 H new ATOM 0 HD23 LEU A 246 -35.349 8.665 -6.752 1.00 0.00 H new ATOM 1208 N MET A 247 -33.590 7.767 -1.889 1.00 0.00 N ATOM 1209 CA MET A 247 -34.055 7.975 -0.487 1.00 0.00 C ATOM 1210 C MET A 247 -34.756 9.329 -0.396 1.00 0.00 C ATOM 1211 O MET A 247 -35.870 9.432 -0.879 1.00 0.00 O ATOM 1212 CB MET A 247 -32.848 7.963 0.473 1.00 0.00 C ATOM 1213 CG MET A 247 -32.486 6.522 0.861 1.00 0.00 C ATOM 1214 SD MET A 247 -31.786 5.680 -0.580 1.00 0.00 S ATOM 1215 CE MET A 247 -32.433 4.031 -0.219 1.00 0.00 C ATOM 1216 OXT MET A 247 -34.160 10.241 0.151 1.00 0.00 O ATOM 0 H MET A 247 -33.876 6.886 -2.316 1.00 0.00 H new ATOM 0 HA MET A 247 -34.742 7.176 -0.208 1.00 0.00 H new ATOM 0 HB2 MET A 247 -31.993 8.444 -0.002 1.00 0.00 H new ATOM 0 HB3 MET A 247 -33.082 8.539 1.368 1.00 0.00 H new ATOM 0 HG2 MET A 247 -31.769 6.522 1.682 1.00 0.00 H new ATOM 0 HG3 MET A 247 -33.372 5.993 1.212 1.00 0.00 H new ATOM 0 HE1 MET A 247 -32.116 3.337 -0.997 1.00 0.00 H new ATOM 0 HE2 MET A 247 -32.052 3.694 0.745 1.00 0.00 H new ATOM 0 HE3 MET A 247 -33.522 4.066 -0.187 1.00 0.00 H new TER 1226 MET A 247