USER MOD reduce.3.24.130724 H: found=0, std=0, add=521, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 524 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 180 SER OG : rot 180:sc= 0 USER MOD Single : A 186 MET CE :methyl -170:sc= -0.0386 (180deg=-0.244) USER MOD Single : A 187 TYR OH : rot 180:sc= 0 USER MOD Single : A 190 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 192 THR OG1 : rot 180:sc= 0 USER MOD Single : A 195 HIS : no HD1:sc= 0.751 K(o=0.75,f=-5!) USER MOD Single : A 203 GLN : amide:sc= -0.0667 K(o=-0.067,f=-1) USER MOD Single : A 205 TYR OH : rot -63:sc= 0.0932 USER MOD Single : A 210 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 211 ASN : amide:sc= -0.135 K(o=-0.13,f=-2.1) USER MOD Single : A 214 HIS : no HD1:sc= -0.0106 X(o=-0.011,f=0) USER MOD Single : A 221 LYS NZ :NH3+ -179:sc= 1.26 (180deg=1.25) USER MOD Single : A 222 TYR OH : rot 180:sc= 0 USER MOD Single : A 224 SER OG : rot 180:sc= 0 USER MOD Single : A 227 TYR OH : rot 180:sc= 0 USER MOD Single : A 230 SER OG : rot 148:sc= 0.719 USER MOD Single : A 231 ASN : amide:sc= 0 X(o=0,f=-0.0021) USER MOD Single : A 232 TYR OH : rot 180:sc= 0 USER MOD Single : A 234 THR OG1 : rot 7:sc= 0.256 USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 237 LYS NZ :NH3+ -121:sc= -0.519 (180deg=-3.26!) USER MOD Single : A 238 SER OG : rot 180:sc= 0.00838 USER MOD Single : A 239 ASN : amide:sc= 0.836 K(o=0.84,f=-6.3!) USER MOD Single : A 240 ASN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 243 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 244 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 179 -11.623 0.451 -9.725 1.00 0.00 N ATOM 2 CA GLY A 179 -11.147 0.662 -8.341 1.00 0.00 C ATOM 3 C GLY A 179 -9.786 1.320 -8.308 1.00 0.00 C ATOM 4 O GLY A 179 -9.050 1.297 -9.298 1.00 0.00 O ATOM 0 HA2 GLY A 179 -11.863 1.281 -7.801 1.00 0.00 H new ATOM 0 HA3 GLY A 179 -11.100 -0.296 -7.823 1.00 0.00 H new ATOM 10 N SER A 180 -9.440 1.914 -7.179 1.00 0.00 N ATOM 11 CA SER A 180 -8.157 2.575 -7.042 1.00 0.00 C ATOM 12 C SER A 180 -7.097 1.586 -6.569 1.00 0.00 C ATOM 13 O SER A 180 -7.164 1.085 -5.441 1.00 0.00 O ATOM 14 CB SER A 180 -8.262 3.744 -6.059 1.00 0.00 C ATOM 15 OG SER A 180 -9.233 4.689 -6.485 1.00 0.00 O ATOM 0 H SER A 180 -10.029 1.951 -6.347 1.00 0.00 H new ATOM 0 HA SER A 180 -7.863 2.963 -8.017 1.00 0.00 H new ATOM 0 HB2 SER A 180 -8.526 3.368 -5.070 1.00 0.00 H new ATOM 0 HB3 SER A 180 -7.292 4.232 -5.966 1.00 0.00 H new ATOM 0 HG SER A 180 -9.280 5.424 -5.838 1.00 0.00 H new ATOM 21 N GLU A 181 -6.126 1.311 -7.435 1.00 0.00 N ATOM 22 CA GLU A 181 -5.046 0.388 -7.111 1.00 0.00 C ATOM 23 C GLU A 181 -4.190 0.950 -5.985 1.00 0.00 C ATOM 24 O GLU A 181 -3.751 2.101 -6.030 1.00 0.00 O ATOM 25 CB GLU A 181 -4.211 0.083 -8.356 1.00 0.00 C ATOM 26 CG GLU A 181 -4.086 1.250 -9.324 1.00 0.00 C ATOM 27 CD GLU A 181 -3.466 0.840 -10.639 1.00 0.00 C ATOM 28 OE1 GLU A 181 -3.195 -0.363 -10.820 1.00 0.00 O ATOM 29 OE2 GLU A 181 -3.260 1.715 -11.499 1.00 0.00 O ATOM 0 H GLU A 181 -6.066 1.716 -8.369 1.00 0.00 H new ATOM 0 HA GLU A 181 -5.475 -0.552 -6.764 1.00 0.00 H new ATOM 0 HB2 GLU A 181 -3.213 -0.224 -8.044 1.00 0.00 H new ATOM 0 HB3 GLU A 181 -4.656 -0.763 -8.880 1.00 0.00 H new ATOM 0 HG2 GLU A 181 -5.073 1.675 -9.507 1.00 0.00 H new ATOM 0 HG3 GLU A 181 -3.481 2.034 -8.868 1.00 0.00 H new ATOM 36 N ILE A 182 -3.990 0.140 -4.958 1.00 0.00 N ATOM 37 CA ILE A 182 -3.228 0.557 -3.798 1.00 0.00 C ATOM 38 C ILE A 182 -1.816 -0.019 -3.772 1.00 0.00 C ATOM 39 O ILE A 182 -1.529 -1.052 -4.379 1.00 0.00 O ATOM 40 CB ILE A 182 -3.962 0.198 -2.484 1.00 0.00 C ATOM 41 CG1 ILE A 182 -4.748 -1.119 -2.603 1.00 0.00 C ATOM 42 CG2 ILE A 182 -4.901 1.322 -2.093 1.00 0.00 C ATOM 43 CD1 ILE A 182 -3.887 -2.358 -2.676 1.00 0.00 C ATOM 0 H ILE A 182 -4.348 -0.814 -4.907 1.00 0.00 H new ATOM 0 HA ILE A 182 -3.138 1.640 -3.877 1.00 0.00 H new ATOM 0 HB ILE A 182 -3.205 0.062 -1.712 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -5.417 -1.207 -1.747 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -5.374 -1.074 -3.494 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -5.414 1.062 -1.167 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -4.330 2.239 -1.946 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -5.635 1.475 -2.884 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -4.523 -3.239 -2.758 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -3.236 -2.298 -3.548 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -3.279 -2.432 -1.774 1.00 0.00 H new ATOM 55 N VAL A 183 -0.952 0.668 -3.042 1.00 0.00 N ATOM 56 CA VAL A 183 0.435 0.268 -2.881 1.00 0.00 C ATOM 57 C VAL A 183 0.768 0.243 -1.396 1.00 0.00 C ATOM 58 O VAL A 183 1.009 1.288 -0.789 1.00 0.00 O ATOM 59 CB VAL A 183 1.402 1.240 -3.597 1.00 0.00 C ATOM 60 CG1 VAL A 183 2.085 0.597 -4.784 1.00 0.00 C ATOM 61 CG2 VAL A 183 0.669 2.470 -4.070 1.00 0.00 C ATOM 0 H VAL A 183 -1.195 1.523 -2.542 1.00 0.00 H new ATOM 0 HA VAL A 183 0.558 -0.719 -3.328 1.00 0.00 H new ATOM 0 HB VAL A 183 2.162 1.514 -2.865 1.00 0.00 H new ATOM 0 HG11 VAL A 183 2.754 1.318 -5.254 1.00 0.00 H new ATOM 0 HG12 VAL A 183 2.660 -0.266 -4.449 1.00 0.00 H new ATOM 0 HG13 VAL A 183 1.334 0.275 -5.505 1.00 0.00 H new ATOM 0 HG21 VAL A 183 1.368 3.140 -4.571 1.00 0.00 H new ATOM 0 HG22 VAL A 183 -0.117 2.180 -4.767 1.00 0.00 H new ATOM 0 HG23 VAL A 183 0.226 2.981 -3.215 1.00 0.00 H new ATOM 71 N VAL A 184 0.760 -0.937 -0.805 1.00 0.00 N ATOM 72 CA VAL A 184 1.039 -1.064 0.614 1.00 0.00 C ATOM 73 C VAL A 184 2.538 -0.989 0.889 1.00 0.00 C ATOM 74 O VAL A 184 3.338 -1.641 0.233 1.00 0.00 O ATOM 75 CB VAL A 184 0.458 -2.382 1.179 1.00 0.00 C ATOM 76 CG1 VAL A 184 -1.025 -2.473 0.864 1.00 0.00 C ATOM 77 CG2 VAL A 184 1.186 -3.595 0.631 1.00 0.00 C ATOM 0 H VAL A 184 0.565 -1.817 -1.282 1.00 0.00 H new ATOM 0 HA VAL A 184 0.554 -0.228 1.119 1.00 0.00 H new ATOM 0 HB VAL A 184 0.598 -2.373 2.260 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -1.426 -3.404 1.265 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -1.546 -1.629 1.316 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -1.170 -2.452 -0.216 1.00 0.00 H new ATOM 0 HG21 VAL A 184 0.750 -4.501 1.051 1.00 0.00 H new ATOM 0 HG22 VAL A 184 1.092 -3.616 -0.455 1.00 0.00 H new ATOM 0 HG23 VAL A 184 2.240 -3.540 0.903 1.00 0.00 H new ATOM 87 N ALA A 185 2.915 -0.182 1.862 1.00 0.00 N ATOM 88 CA ALA A 185 4.318 -0.029 2.220 1.00 0.00 C ATOM 89 C ALA A 185 4.662 -0.986 3.352 1.00 0.00 C ATOM 90 O ALA A 185 3.942 -1.057 4.354 1.00 0.00 O ATOM 91 CB ALA A 185 4.612 1.402 2.641 1.00 0.00 C ATOM 0 H ALA A 185 2.272 0.379 2.421 1.00 0.00 H new ATOM 0 HA ALA A 185 4.930 -0.262 1.349 1.00 0.00 H new ATOM 0 HB1 ALA A 185 5.666 1.495 2.904 1.00 0.00 H new ATOM 0 HB2 ALA A 185 4.383 2.078 1.817 1.00 0.00 H new ATOM 0 HB3 ALA A 185 3.998 1.661 3.504 1.00 0.00 H new ATOM 97 N MET A 186 5.751 -1.723 3.197 1.00 0.00 N ATOM 98 CA MET A 186 6.171 -2.676 4.212 1.00 0.00 C ATOM 99 C MET A 186 7.297 -2.108 5.070 1.00 0.00 C ATOM 100 O MET A 186 7.374 -2.386 6.266 1.00 0.00 O ATOM 101 CB MET A 186 6.613 -3.993 3.567 1.00 0.00 C ATOM 102 CG MET A 186 5.544 -4.620 2.676 1.00 0.00 C ATOM 103 SD MET A 186 3.941 -4.764 3.498 1.00 0.00 S ATOM 104 CE MET A 186 4.369 -5.757 4.923 1.00 0.00 C ATOM 0 H MET A 186 6.359 -1.680 2.379 1.00 0.00 H new ATOM 0 HA MET A 186 5.315 -2.871 4.858 1.00 0.00 H new ATOM 0 HB2 MET A 186 7.511 -3.816 2.975 1.00 0.00 H new ATOM 0 HB3 MET A 186 6.883 -4.700 4.351 1.00 0.00 H new ATOM 0 HG2 MET A 186 5.432 -4.019 1.774 1.00 0.00 H new ATOM 0 HG3 MET A 186 5.875 -5.609 2.361 1.00 0.00 H new ATOM 0 HE1 MET A 186 3.459 -6.078 5.429 1.00 0.00 H new ATOM 0 HE2 MET A 186 4.933 -6.632 4.600 1.00 0.00 H new ATOM 0 HE3 MET A 186 4.976 -5.166 5.609 1.00 0.00 H new ATOM 114 N TYR A 187 8.166 -1.310 4.462 1.00 0.00 N ATOM 115 CA TYR A 187 9.279 -0.708 5.192 1.00 0.00 C ATOM 116 C TYR A 187 9.219 0.810 5.121 1.00 0.00 C ATOM 117 O TYR A 187 8.627 1.376 4.204 1.00 0.00 O ATOM 118 CB TYR A 187 10.627 -1.191 4.652 1.00 0.00 C ATOM 119 CG TYR A 187 10.992 -2.606 5.044 1.00 0.00 C ATOM 120 CD1 TYR A 187 10.345 -3.705 4.491 1.00 0.00 C ATOM 121 CD2 TYR A 187 11.993 -2.839 5.978 1.00 0.00 C ATOM 122 CE1 TYR A 187 10.688 -4.993 4.856 1.00 0.00 C ATOM 123 CE2 TYR A 187 12.339 -4.121 6.348 1.00 0.00 C ATOM 124 CZ TYR A 187 11.686 -5.195 5.786 1.00 0.00 C ATOM 125 OH TYR A 187 12.034 -6.475 6.154 1.00 0.00 O ATOM 0 H TYR A 187 8.124 -1.065 3.473 1.00 0.00 H new ATOM 0 HA TYR A 187 9.187 -1.021 6.232 1.00 0.00 H new ATOM 0 HB2 TYR A 187 10.614 -1.121 3.564 1.00 0.00 H new ATOM 0 HB3 TYR A 187 11.408 -0.517 5.005 1.00 0.00 H new ATOM 0 HD1 TYR A 187 9.561 -3.550 3.764 1.00 0.00 H new ATOM 0 HD2 TYR A 187 12.509 -2.001 6.422 1.00 0.00 H new ATOM 0 HE1 TYR A 187 10.177 -5.837 4.415 1.00 0.00 H new ATOM 0 HE2 TYR A 187 13.120 -4.282 7.076 1.00 0.00 H new ATOM 0 HH TYR A 187 12.755 -6.440 6.817 1.00 0.00 H new ATOM 135 N ASP A 188 9.839 1.464 6.096 1.00 0.00 N ATOM 136 CA ASP A 188 9.861 2.924 6.148 1.00 0.00 C ATOM 137 C ASP A 188 11.091 3.487 5.438 1.00 0.00 C ATOM 138 O ASP A 188 12.125 2.822 5.325 1.00 0.00 O ATOM 139 CB ASP A 188 9.807 3.415 7.602 1.00 0.00 C ATOM 140 CG ASP A 188 10.853 2.769 8.484 1.00 0.00 C ATOM 141 OD1 ASP A 188 12.055 3.022 8.281 1.00 0.00 O ATOM 142 OD2 ASP A 188 10.470 1.993 9.379 1.00 0.00 O ATOM 0 H ASP A 188 10.334 1.008 6.862 1.00 0.00 H new ATOM 0 HA ASP A 188 8.977 3.288 5.625 1.00 0.00 H new ATOM 0 HB2 ASP A 188 9.943 4.496 7.620 1.00 0.00 H new ATOM 0 HB3 ASP A 188 8.818 3.211 8.012 1.00 0.00 H new ATOM 147 N PHE A 189 10.963 4.721 4.963 1.00 0.00 N ATOM 148 CA PHE A 189 12.040 5.407 4.255 1.00 0.00 C ATOM 149 C PHE A 189 11.782 6.911 4.254 1.00 0.00 C ATOM 150 O PHE A 189 10.636 7.353 4.162 1.00 0.00 O ATOM 151 CB PHE A 189 12.159 4.884 2.814 1.00 0.00 C ATOM 152 CG PHE A 189 13.186 5.599 1.981 1.00 0.00 C ATOM 153 CD1 PHE A 189 14.518 5.620 2.359 1.00 0.00 C ATOM 154 CD2 PHE A 189 12.810 6.264 0.824 1.00 0.00 C ATOM 155 CE1 PHE A 189 15.456 6.294 1.602 1.00 0.00 C ATOM 156 CE2 PHE A 189 13.743 6.935 0.062 1.00 0.00 C ATOM 157 CZ PHE A 189 15.067 6.952 0.449 1.00 0.00 C ATOM 0 H PHE A 189 10.111 5.274 5.057 1.00 0.00 H new ATOM 0 HA PHE A 189 12.981 5.208 4.769 1.00 0.00 H new ATOM 0 HB2 PHE A 189 12.407 3.823 2.844 1.00 0.00 H new ATOM 0 HB3 PHE A 189 11.188 4.971 2.327 1.00 0.00 H new ATOM 0 HD1 PHE A 189 14.827 5.104 3.256 1.00 0.00 H new ATOM 0 HD2 PHE A 189 11.775 6.256 0.516 1.00 0.00 H new ATOM 0 HE1 PHE A 189 16.491 6.307 1.910 1.00 0.00 H new ATOM 0 HE2 PHE A 189 13.437 7.447 -0.838 1.00 0.00 H new ATOM 0 HZ PHE A 189 15.798 7.478 -0.147 1.00 0.00 H new ATOM 167 N GLN A 190 12.846 7.688 4.357 1.00 0.00 N ATOM 168 CA GLN A 190 12.736 9.136 4.372 1.00 0.00 C ATOM 169 C GLN A 190 13.181 9.736 3.040 1.00 0.00 C ATOM 170 O GLN A 190 14.260 9.419 2.540 1.00 0.00 O ATOM 171 CB GLN A 190 13.574 9.705 5.518 1.00 0.00 C ATOM 172 CG GLN A 190 15.027 9.257 5.488 1.00 0.00 C ATOM 173 CD GLN A 190 15.801 9.706 6.706 1.00 0.00 C ATOM 174 OE1 GLN A 190 15.905 10.901 6.981 1.00 0.00 O ATOM 175 NE2 GLN A 190 16.343 8.749 7.445 1.00 0.00 N ATOM 0 H GLN A 190 13.801 7.338 4.432 1.00 0.00 H new ATOM 0 HA GLN A 190 11.690 9.401 4.524 1.00 0.00 H new ATOM 0 HB2 GLN A 190 13.537 10.794 5.479 1.00 0.00 H new ATOM 0 HB3 GLN A 190 13.129 9.405 6.467 1.00 0.00 H new ATOM 0 HG2 GLN A 190 15.066 8.170 5.418 1.00 0.00 H new ATOM 0 HG3 GLN A 190 15.506 9.652 4.592 1.00 0.00 H new ATOM 0 HE21 GLN A 190 16.230 7.771 7.177 1.00 0.00 H new ATOM 0 HE22 GLN A 190 16.874 8.990 8.282 1.00 0.00 H new ATOM 184 N ALA A 191 12.355 10.612 2.477 1.00 0.00 N ATOM 185 CA ALA A 191 12.681 11.259 1.211 1.00 0.00 C ATOM 186 C ALA A 191 13.835 12.229 1.396 1.00 0.00 C ATOM 187 O ALA A 191 13.678 13.286 2.015 1.00 0.00 O ATOM 188 CB ALA A 191 11.474 11.993 0.642 1.00 0.00 C ATOM 0 H ALA A 191 11.458 10.889 2.876 1.00 0.00 H new ATOM 0 HA ALA A 191 12.975 10.483 0.505 1.00 0.00 H new ATOM 0 HB1 ALA A 191 11.747 12.465 -0.302 1.00 0.00 H new ATOM 0 HB2 ALA A 191 10.664 11.284 0.472 1.00 0.00 H new ATOM 0 HB3 ALA A 191 11.146 12.756 1.348 1.00 0.00 H new ATOM 194 N THR A 192 14.994 11.865 0.876 1.00 0.00 N ATOM 195 CA THR A 192 16.174 12.707 0.995 1.00 0.00 C ATOM 196 C THR A 192 16.136 13.834 -0.034 1.00 0.00 C ATOM 197 O THR A 192 16.853 14.831 0.090 1.00 0.00 O ATOM 198 CB THR A 192 17.439 11.853 0.829 1.00 0.00 C ATOM 199 OG1 THR A 192 18.609 12.648 0.912 1.00 0.00 O ATOM 200 CG2 THR A 192 17.488 11.088 -0.480 1.00 0.00 C ATOM 0 H THR A 192 15.144 10.994 0.368 1.00 0.00 H new ATOM 0 HA THR A 192 16.188 13.162 1.985 1.00 0.00 H new ATOM 0 HB THR A 192 17.399 11.133 1.647 1.00 0.00 H new ATOM 0 HG1 THR A 192 19.400 12.079 0.805 1.00 0.00 H new ATOM 0 HG21 THR A 192 18.409 10.507 -0.528 1.00 0.00 H new ATOM 0 HG22 THR A 192 16.632 10.416 -0.541 1.00 0.00 H new ATOM 0 HG23 THR A 192 17.458 11.790 -1.313 1.00 0.00 H new ATOM 208 N GLU A 193 15.299 13.668 -1.052 1.00 0.00 N ATOM 209 CA GLU A 193 15.173 14.665 -2.105 1.00 0.00 C ATOM 210 C GLU A 193 13.897 15.499 -1.934 1.00 0.00 C ATOM 211 O GLU A 193 13.683 16.123 -0.891 1.00 0.00 O ATOM 212 CB GLU A 193 15.188 13.963 -3.469 1.00 0.00 C ATOM 213 CG GLU A 193 16.327 12.962 -3.614 1.00 0.00 C ATOM 214 CD GLU A 193 16.332 12.261 -4.947 1.00 0.00 C ATOM 215 OE1 GLU A 193 16.559 12.932 -5.971 1.00 0.00 O ATOM 216 OE2 GLU A 193 16.113 11.036 -4.973 1.00 0.00 O ATOM 0 H GLU A 193 14.698 12.852 -1.169 1.00 0.00 H new ATOM 0 HA GLU A 193 16.017 15.352 -2.043 1.00 0.00 H new ATOM 0 HB2 GLU A 193 14.239 13.448 -3.616 1.00 0.00 H new ATOM 0 HB3 GLU A 193 15.269 14.713 -4.256 1.00 0.00 H new ATOM 0 HG2 GLU A 193 17.277 13.479 -3.479 1.00 0.00 H new ATOM 0 HG3 GLU A 193 16.253 12.219 -2.820 1.00 0.00 H new ATOM 223 N ALA A 194 13.054 15.499 -2.959 1.00 0.00 N ATOM 224 CA ALA A 194 11.797 16.248 -2.941 1.00 0.00 C ATOM 225 C ALA A 194 10.738 15.499 -3.730 1.00 0.00 C ATOM 226 O ALA A 194 9.628 15.286 -3.249 1.00 0.00 O ATOM 227 CB ALA A 194 11.997 17.645 -3.504 1.00 0.00 C ATOM 0 H ALA A 194 13.218 14.984 -3.824 1.00 0.00 H new ATOM 0 HA ALA A 194 11.462 16.346 -1.909 1.00 0.00 H new ATOM 0 HB1 ALA A 194 11.051 18.185 -3.482 1.00 0.00 H new ATOM 0 HB2 ALA A 194 12.733 18.178 -2.902 1.00 0.00 H new ATOM 0 HB3 ALA A 194 12.351 17.576 -4.533 1.00 0.00 H new ATOM 233 N HIS A 195 11.108 15.062 -4.930 1.00 0.00 N ATOM 234 CA HIS A 195 10.209 14.275 -5.769 1.00 0.00 C ATOM 235 C HIS A 195 10.003 12.936 -5.089 1.00 0.00 C ATOM 236 O HIS A 195 8.952 12.320 -5.208 1.00 0.00 O ATOM 237 CB HIS A 195 10.779 14.082 -7.184 1.00 0.00 C ATOM 238 CG HIS A 195 12.274 14.131 -7.257 1.00 0.00 C ATOM 239 ND1 HIS A 195 12.990 15.307 -7.206 1.00 0.00 N ATOM 240 CD2 HIS A 195 13.189 13.139 -7.346 1.00 0.00 C ATOM 241 CE1 HIS A 195 14.281 15.035 -7.261 1.00 0.00 C ATOM 242 NE2 HIS A 195 14.433 13.725 -7.344 1.00 0.00 N ATOM 0 H HIS A 195 12.023 15.239 -5.343 1.00 0.00 H new ATOM 0 HA HIS A 195 9.260 14.799 -5.884 1.00 0.00 H new ATOM 0 HB2 HIS A 195 10.439 13.122 -7.572 1.00 0.00 H new ATOM 0 HB3 HIS A 195 10.369 14.853 -7.837 1.00 0.00 H new ATOM 0 HD2 HIS A 195 12.981 12.081 -7.407 1.00 0.00 H new ATOM 0 HE1 HIS A 195 15.079 15.762 -7.241 1.00 0.00 H new ATOM 0 HE2 HIS A 195 15.324 13.231 -7.398 1.00 0.00 H new ATOM 251 N ASP A 196 11.017 12.535 -4.331 1.00 0.00 N ATOM 252 CA ASP A 196 10.985 11.308 -3.557 1.00 0.00 C ATOM 253 C ASP A 196 9.901 11.449 -2.488 1.00 0.00 C ATOM 254 O ASP A 196 9.703 12.544 -1.953 1.00 0.00 O ATOM 255 CB ASP A 196 12.357 11.093 -2.908 1.00 0.00 C ATOM 256 CG ASP A 196 12.570 9.692 -2.382 1.00 0.00 C ATOM 257 OD1 ASP A 196 11.756 8.804 -2.692 1.00 0.00 O ATOM 258 OD2 ASP A 196 13.581 9.482 -1.682 1.00 0.00 O ATOM 0 H ASP A 196 11.888 13.058 -4.238 1.00 0.00 H new ATOM 0 HA ASP A 196 10.761 10.450 -4.191 1.00 0.00 H new ATOM 0 HB2 ASP A 196 13.134 11.319 -3.639 1.00 0.00 H new ATOM 0 HB3 ASP A 196 12.476 11.801 -2.088 1.00 0.00 H new ATOM 263 N LEU A 197 9.183 10.377 -2.189 1.00 0.00 N ATOM 264 CA LEU A 197 8.120 10.455 -1.200 1.00 0.00 C ATOM 265 C LEU A 197 8.483 9.690 0.068 1.00 0.00 C ATOM 266 O LEU A 197 9.409 8.880 0.079 1.00 0.00 O ATOM 267 CB LEU A 197 6.802 9.942 -1.795 1.00 0.00 C ATOM 268 CG LEU A 197 5.551 10.745 -1.400 1.00 0.00 C ATOM 269 CD1 LEU A 197 4.912 10.183 -0.141 1.00 0.00 C ATOM 270 CD2 LEU A 197 5.890 12.219 -1.212 1.00 0.00 C ATOM 0 H LEU A 197 9.314 9.457 -2.609 1.00 0.00 H new ATOM 0 HA LEU A 197 7.990 11.501 -0.922 1.00 0.00 H new ATOM 0 HB2 LEU A 197 6.887 9.943 -2.882 1.00 0.00 H new ATOM 0 HB3 LEU A 197 6.662 8.906 -1.487 1.00 0.00 H new ATOM 0 HG LEU A 197 4.831 10.657 -2.214 1.00 0.00 H new ATOM 0 HD11 LEU A 197 4.030 10.771 0.113 1.00 0.00 H new ATOM 0 HD12 LEU A 197 4.620 9.147 -0.313 1.00 0.00 H new ATOM 0 HD13 LEU A 197 5.627 10.227 0.681 1.00 0.00 H new ATOM 0 HD21 LEU A 197 4.990 12.767 -0.933 1.00 0.00 H new ATOM 0 HD22 LEU A 197 6.637 12.323 -0.425 1.00 0.00 H new ATOM 0 HD23 LEU A 197 6.286 12.623 -2.144 1.00 0.00 H new ATOM 282 N ARG A 198 7.752 9.975 1.136 1.00 0.00 N ATOM 283 CA ARG A 198 7.979 9.349 2.429 1.00 0.00 C ATOM 284 C ARG A 198 7.355 7.963 2.523 1.00 0.00 C ATOM 285 O ARG A 198 6.186 7.767 2.192 1.00 0.00 O ATOM 286 CB ARG A 198 7.415 10.232 3.545 1.00 0.00 C ATOM 287 CG ARG A 198 8.410 11.244 4.084 1.00 0.00 C ATOM 288 CD ARG A 198 9.623 10.544 4.680 1.00 0.00 C ATOM 289 NE ARG A 198 9.246 9.424 5.542 1.00 0.00 N ATOM 290 CZ ARG A 198 8.673 9.553 6.737 1.00 0.00 C ATOM 291 NH1 ARG A 198 8.578 10.745 7.315 1.00 0.00 N ATOM 292 NH2 ARG A 198 8.234 8.477 7.368 1.00 0.00 N ATOM 0 H ARG A 198 6.985 10.647 1.130 1.00 0.00 H new ATOM 0 HA ARG A 198 9.057 9.237 2.542 1.00 0.00 H new ATOM 0 HB2 ARG A 198 6.539 10.761 3.170 1.00 0.00 H new ATOM 0 HB3 ARG A 198 7.077 9.596 4.363 1.00 0.00 H new ATOM 0 HG2 ARG A 198 8.727 11.912 3.283 1.00 0.00 H new ATOM 0 HG3 ARG A 198 7.932 11.862 4.844 1.00 0.00 H new ATOM 0 HD2 ARG A 198 10.263 10.182 3.876 1.00 0.00 H new ATOM 0 HD3 ARG A 198 10.209 11.262 5.255 1.00 0.00 H new ATOM 0 HE ARG A 198 9.435 8.480 5.205 1.00 0.00 H new ATOM 0 HH11 ARG A 198 8.946 11.571 6.843 1.00 0.00 H new ATOM 0 HH12 ARG A 198 8.137 10.834 8.231 1.00 0.00 H new ATOM 0 HH21 ARG A 198 8.336 7.557 6.939 1.00 0.00 H new ATOM 0 HH22 ARG A 198 7.794 8.567 8.284 1.00 0.00 H new ATOM 306 N LEU A 199 8.144 7.017 3.014 1.00 0.00 N ATOM 307 CA LEU A 199 7.692 5.647 3.206 1.00 0.00 C ATOM 308 C LEU A 199 7.494 5.383 4.691 1.00 0.00 C ATOM 309 O LEU A 199 8.262 5.879 5.521 1.00 0.00 O ATOM 310 CB LEU A 199 8.714 4.645 2.648 1.00 0.00 C ATOM 311 CG LEU A 199 8.632 4.341 1.147 1.00 0.00 C ATOM 312 CD1 LEU A 199 7.304 3.672 0.821 1.00 0.00 C ATOM 313 CD2 LEU A 199 8.833 5.598 0.314 1.00 0.00 C ATOM 0 H LEU A 199 9.113 7.178 3.290 1.00 0.00 H new ATOM 0 HA LEU A 199 6.751 5.518 2.671 1.00 0.00 H new ATOM 0 HB2 LEU A 199 9.713 5.022 2.865 1.00 0.00 H new ATOM 0 HB3 LEU A 199 8.603 3.707 3.192 1.00 0.00 H new ATOM 0 HG LEU A 199 9.439 3.654 0.892 1.00 0.00 H new ATOM 0 HD11 LEU A 199 7.256 3.460 -0.247 1.00 0.00 H new ATOM 0 HD12 LEU A 199 7.219 2.740 1.380 1.00 0.00 H new ATOM 0 HD13 LEU A 199 6.485 4.336 1.097 1.00 0.00 H new ATOM 0 HD21 LEU A 199 8.769 5.347 -0.745 1.00 0.00 H new ATOM 0 HD22 LEU A 199 8.061 6.326 0.562 1.00 0.00 H new ATOM 0 HD23 LEU A 199 9.814 6.023 0.527 1.00 0.00 H new ATOM 325 N GLU A 200 6.484 4.599 5.023 1.00 0.00 N ATOM 326 CA GLU A 200 6.212 4.263 6.409 1.00 0.00 C ATOM 327 C GLU A 200 5.791 2.804 6.499 1.00 0.00 C ATOM 328 O GLU A 200 5.216 2.260 5.557 1.00 0.00 O ATOM 329 CB GLU A 200 5.128 5.179 6.989 1.00 0.00 C ATOM 330 CG GLU A 200 4.953 5.057 8.498 1.00 0.00 C ATOM 331 CD GLU A 200 6.161 5.526 9.282 1.00 0.00 C ATOM 332 OE1 GLU A 200 7.098 6.081 8.676 1.00 0.00 O ATOM 333 OE2 GLU A 200 6.167 5.350 10.514 1.00 0.00 O ATOM 0 H GLU A 200 5.838 4.183 4.352 1.00 0.00 H new ATOM 0 HA GLU A 200 7.118 4.411 6.997 1.00 0.00 H new ATOM 0 HB2 GLU A 200 5.372 6.213 6.745 1.00 0.00 H new ATOM 0 HB3 GLU A 200 4.178 4.952 6.504 1.00 0.00 H new ATOM 0 HG2 GLU A 200 4.083 5.637 8.804 1.00 0.00 H new ATOM 0 HG3 GLU A 200 4.747 4.017 8.750 1.00 0.00 H new ATOM 340 N ARG A 201 6.087 2.168 7.622 1.00 0.00 N ATOM 341 CA ARG A 201 5.745 0.766 7.810 1.00 0.00 C ATOM 342 C ARG A 201 4.262 0.604 8.129 1.00 0.00 C ATOM 343 O ARG A 201 3.828 0.820 9.265 1.00 0.00 O ATOM 344 CB ARG A 201 6.600 0.153 8.925 1.00 0.00 C ATOM 345 CG ARG A 201 6.467 -1.356 9.037 1.00 0.00 C ATOM 346 CD ARG A 201 7.378 -1.927 10.114 1.00 0.00 C ATOM 347 NE ARG A 201 8.790 -1.650 9.843 1.00 0.00 N ATOM 348 CZ ARG A 201 9.791 -2.124 10.587 1.00 0.00 C ATOM 349 NH1 ARG A 201 9.525 -2.902 11.628 1.00 0.00 N ATOM 350 NH2 ARG A 201 11.050 -1.847 10.275 1.00 0.00 N ATOM 0 H ARG A 201 6.562 2.599 8.415 1.00 0.00 H new ATOM 0 HA ARG A 201 5.952 0.239 6.879 1.00 0.00 H new ATOM 0 HB2 ARG A 201 7.646 0.405 8.749 1.00 0.00 H new ATOM 0 HB3 ARG A 201 6.319 0.605 9.876 1.00 0.00 H new ATOM 0 HG2 ARG A 201 5.432 -1.614 9.263 1.00 0.00 H new ATOM 0 HG3 ARG A 201 6.708 -1.814 8.078 1.00 0.00 H new ATOM 0 HD2 ARG A 201 7.105 -1.504 11.081 1.00 0.00 H new ATOM 0 HD3 ARG A 201 7.227 -3.004 10.183 1.00 0.00 H new ATOM 0 HE ARG A 201 9.021 -1.063 9.042 1.00 0.00 H new ATOM 0 HH11 ARG A 201 8.559 -3.135 11.857 1.00 0.00 H new ATOM 0 HH12 ARG A 201 10.287 -3.267 12.200 1.00 0.00 H new ATOM 0 HH21 ARG A 201 11.258 -1.268 9.462 1.00 0.00 H new ATOM 0 HH22 ARG A 201 11.810 -2.213 10.849 1.00 0.00 H new ATOM 364 N GLY A 202 3.487 0.217 7.123 1.00 0.00 N ATOM 365 CA GLY A 202 2.064 0.019 7.320 1.00 0.00 C ATOM 366 C GLY A 202 1.221 1.116 6.702 1.00 0.00 C ATOM 367 O GLY A 202 0.352 1.679 7.366 1.00 0.00 O ATOM 0 H GLY A 202 3.818 0.037 6.175 1.00 0.00 H new ATOM 0 HA2 GLY A 202 1.774 -0.940 6.891 1.00 0.00 H new ATOM 0 HA3 GLY A 202 1.855 -0.034 8.388 1.00 0.00 H new ATOM 371 N GLN A 203 1.470 1.414 5.431 1.00 0.00 N ATOM 372 CA GLN A 203 0.720 2.451 4.724 1.00 0.00 C ATOM 373 C GLN A 203 0.016 1.887 3.499 1.00 0.00 C ATOM 374 O GLN A 203 0.481 0.920 2.898 1.00 0.00 O ATOM 375 CB GLN A 203 1.657 3.571 4.265 1.00 0.00 C ATOM 376 CG GLN A 203 2.301 4.365 5.390 1.00 0.00 C ATOM 377 CD GLN A 203 1.334 5.323 6.069 1.00 0.00 C ATOM 378 OE1 GLN A 203 0.399 4.900 6.749 1.00 0.00 O ATOM 379 NE2 GLN A 203 1.538 6.621 5.873 1.00 0.00 N ATOM 0 H GLN A 203 2.185 0.953 4.868 1.00 0.00 H new ATOM 0 HA GLN A 203 -0.022 2.841 5.420 1.00 0.00 H new ATOM 0 HB2 GLN A 203 2.444 3.137 3.649 1.00 0.00 H new ATOM 0 HB3 GLN A 203 1.097 4.257 3.630 1.00 0.00 H new ATOM 0 HG2 GLN A 203 2.701 3.674 6.132 1.00 0.00 H new ATOM 0 HG3 GLN A 203 3.144 4.930 4.993 1.00 0.00 H new ATOM 0 HE21 GLN A 203 2.324 6.933 5.303 1.00 0.00 H new ATOM 0 HE22 GLN A 203 0.909 7.305 6.293 1.00 0.00 H new ATOM 388 N GLU A 204 -1.076 2.531 3.112 1.00 0.00 N ATOM 389 CA GLU A 204 -1.824 2.138 1.926 1.00 0.00 C ATOM 390 C GLU A 204 -1.827 3.287 0.931 1.00 0.00 C ATOM 391 O GLU A 204 -2.711 4.150 0.947 1.00 0.00 O ATOM 392 CB GLU A 204 -3.253 1.728 2.278 1.00 0.00 C ATOM 393 CG GLU A 204 -3.328 0.398 3.007 1.00 0.00 C ATOM 394 CD GLU A 204 -4.743 -0.102 3.175 1.00 0.00 C ATOM 395 OE1 GLU A 204 -5.677 0.601 2.751 1.00 0.00 O ATOM 396 OE2 GLU A 204 -4.922 -1.202 3.732 1.00 0.00 O ATOM 0 H GLU A 204 -1.466 3.334 3.606 1.00 0.00 H new ATOM 0 HA GLU A 204 -1.339 1.270 1.479 1.00 0.00 H new ATOM 0 HB2 GLU A 204 -3.704 2.502 2.899 1.00 0.00 H new ATOM 0 HB3 GLU A 204 -3.843 1.668 1.364 1.00 0.00 H new ATOM 0 HG2 GLU A 204 -2.749 -0.344 2.458 1.00 0.00 H new ATOM 0 HG3 GLU A 204 -2.866 0.501 3.989 1.00 0.00 H new ATOM 403 N TYR A 205 -0.811 3.302 0.086 1.00 0.00 N ATOM 404 CA TYR A 205 -0.642 4.348 -0.911 1.00 0.00 C ATOM 405 C TYR A 205 -1.545 4.138 -2.111 1.00 0.00 C ATOM 406 O TYR A 205 -2.130 3.076 -2.295 1.00 0.00 O ATOM 407 CB TYR A 205 0.815 4.383 -1.380 1.00 0.00 C ATOM 408 CG TYR A 205 1.802 4.720 -0.292 1.00 0.00 C ATOM 409 CD1 TYR A 205 1.664 5.868 0.470 1.00 0.00 C ATOM 410 CD2 TYR A 205 2.882 3.891 -0.037 1.00 0.00 C ATOM 411 CE1 TYR A 205 2.569 6.179 1.461 1.00 0.00 C ATOM 412 CE2 TYR A 205 3.790 4.194 0.953 1.00 0.00 C ATOM 413 CZ TYR A 205 3.634 5.340 1.696 1.00 0.00 C ATOM 414 OH TYR A 205 4.542 5.645 2.681 1.00 0.00 O ATOM 0 H TYR A 205 -0.080 2.591 0.070 1.00 0.00 H new ATOM 0 HA TYR A 205 -0.914 5.294 -0.443 1.00 0.00 H new ATOM 0 HB2 TYR A 205 1.073 3.412 -1.802 1.00 0.00 H new ATOM 0 HB3 TYR A 205 0.910 5.115 -2.182 1.00 0.00 H new ATOM 0 HD1 TYR A 205 0.832 6.531 0.284 1.00 0.00 H new ATOM 0 HD2 TYR A 205 3.014 2.994 -0.623 1.00 0.00 H new ATOM 0 HE1 TYR A 205 2.443 7.076 2.050 1.00 0.00 H new ATOM 0 HE2 TYR A 205 4.622 3.533 1.145 1.00 0.00 H new ATOM 0 HH TYR A 205 4.990 6.489 2.463 1.00 0.00 H new ATOM 424 N ILE A 206 -1.627 5.162 -2.937 1.00 0.00 N ATOM 425 CA ILE A 206 -2.422 5.123 -4.146 1.00 0.00 C ATOM 426 C ILE A 206 -1.484 5.282 -5.335 1.00 0.00 C ATOM 427 O ILE A 206 -1.040 6.387 -5.642 1.00 0.00 O ATOM 428 CB ILE A 206 -3.498 6.244 -4.176 1.00 0.00 C ATOM 429 CG1 ILE A 206 -4.359 6.237 -2.902 1.00 0.00 C ATOM 430 CG2 ILE A 206 -4.383 6.103 -5.405 1.00 0.00 C ATOM 431 CD1 ILE A 206 -3.713 6.927 -1.716 1.00 0.00 C ATOM 0 H ILE A 206 -1.142 6.047 -2.787 1.00 0.00 H new ATOM 0 HA ILE A 206 -2.950 4.170 -4.185 1.00 0.00 H new ATOM 0 HB ILE A 206 -2.974 7.199 -4.222 1.00 0.00 H new ATOM 0 HG12 ILE A 206 -5.311 6.722 -3.117 1.00 0.00 H new ATOM 0 HG13 ILE A 206 -4.581 5.205 -2.632 1.00 0.00 H new ATOM 0 HG21 ILE A 206 -5.130 6.897 -5.408 1.00 0.00 H new ATOM 0 HG22 ILE A 206 -3.771 6.177 -6.304 1.00 0.00 H new ATOM 0 HG23 ILE A 206 -4.883 5.135 -5.384 1.00 0.00 H new ATOM 0 HD11 ILE A 206 -4.383 6.879 -0.858 1.00 0.00 H new ATOM 0 HD12 ILE A 206 -2.775 6.429 -1.472 1.00 0.00 H new ATOM 0 HD13 ILE A 206 -3.516 7.970 -1.965 1.00 0.00 H new ATOM 443 N ILE A 207 -1.138 4.169 -5.964 1.00 0.00 N ATOM 444 CA ILE A 207 -0.209 4.173 -7.080 1.00 0.00 C ATOM 445 C ILE A 207 -0.773 4.923 -8.287 1.00 0.00 C ATOM 446 O ILE A 207 -1.860 4.624 -8.782 1.00 0.00 O ATOM 447 CB ILE A 207 0.184 2.722 -7.443 1.00 0.00 C ATOM 448 CG1 ILE A 207 1.174 2.681 -8.592 1.00 0.00 C ATOM 449 CG2 ILE A 207 -1.031 1.880 -7.772 1.00 0.00 C ATOM 450 CD1 ILE A 207 2.510 3.312 -8.268 1.00 0.00 C ATOM 0 H ILE A 207 -1.491 3.245 -5.716 1.00 0.00 H new ATOM 0 HA ILE A 207 0.690 4.709 -6.776 1.00 0.00 H new ATOM 0 HB ILE A 207 0.665 2.299 -6.561 1.00 0.00 H new ATOM 0 HG12 ILE A 207 1.334 1.643 -8.885 1.00 0.00 H new ATOM 0 HG13 ILE A 207 0.740 3.192 -9.452 1.00 0.00 H new ATOM 0 HG21 ILE A 207 -0.715 0.867 -8.022 1.00 0.00 H new ATOM 0 HG22 ILE A 207 -1.697 1.850 -6.910 1.00 0.00 H new ATOM 0 HG23 ILE A 207 -1.557 2.316 -8.621 1.00 0.00 H new ATOM 0 HD11 ILE A 207 3.164 3.245 -9.137 1.00 0.00 H new ATOM 0 HD12 ILE A 207 2.363 4.359 -8.004 1.00 0.00 H new ATOM 0 HD13 ILE A 207 2.966 2.787 -7.429 1.00 0.00 H new ATOM 462 N LEU A 208 -0.017 5.916 -8.742 1.00 0.00 N ATOM 463 CA LEU A 208 -0.413 6.736 -9.876 1.00 0.00 C ATOM 464 C LEU A 208 0.174 6.174 -11.159 1.00 0.00 C ATOM 465 O LEU A 208 -0.522 5.558 -11.965 1.00 0.00 O ATOM 466 CB LEU A 208 0.087 8.173 -9.700 1.00 0.00 C ATOM 467 CG LEU A 208 -0.095 8.782 -8.309 1.00 0.00 C ATOM 468 CD1 LEU A 208 0.498 10.179 -8.269 1.00 0.00 C ATOM 469 CD2 LEU A 208 -1.565 8.822 -7.921 1.00 0.00 C ATOM 0 H LEU A 208 0.883 6.173 -8.336 1.00 0.00 H new ATOM 0 HA LEU A 208 -1.502 6.731 -9.931 1.00 0.00 H new ATOM 0 HB2 LEU A 208 1.147 8.201 -9.951 1.00 0.00 H new ATOM 0 HB3 LEU A 208 -0.428 8.807 -10.422 1.00 0.00 H new ATOM 0 HG LEU A 208 0.429 8.153 -7.589 1.00 0.00 H new ATOM 0 HD11 LEU A 208 0.363 10.603 -7.274 1.00 0.00 H new ATOM 0 HD12 LEU A 208 1.562 10.129 -8.501 1.00 0.00 H new ATOM 0 HD13 LEU A 208 -0.004 10.809 -9.003 1.00 0.00 H new ATOM 0 HD21 LEU A 208 -1.667 9.259 -6.928 1.00 0.00 H new ATOM 0 HD22 LEU A 208 -2.115 9.426 -8.642 1.00 0.00 H new ATOM 0 HD23 LEU A 208 -1.967 7.809 -7.915 1.00 0.00 H new ATOM 481 N GLU A 209 1.474 6.392 -11.328 1.00 0.00 N ATOM 482 CA GLU A 209 2.200 5.924 -12.500 1.00 0.00 C ATOM 483 C GLU A 209 3.318 4.982 -12.076 1.00 0.00 C ATOM 484 O GLU A 209 3.660 4.905 -10.897 1.00 0.00 O ATOM 485 CB GLU A 209 2.792 7.120 -13.260 1.00 0.00 C ATOM 486 CG GLU A 209 1.773 8.206 -13.587 1.00 0.00 C ATOM 487 CD GLU A 209 0.841 7.813 -14.705 1.00 0.00 C ATOM 488 OE1 GLU A 209 1.320 7.646 -15.844 1.00 0.00 O ATOM 489 OE2 GLU A 209 -0.367 7.668 -14.450 1.00 0.00 O ATOM 0 H GLU A 209 2.052 6.897 -10.657 1.00 0.00 H new ATOM 0 HA GLU A 209 1.510 5.390 -13.153 1.00 0.00 H new ATOM 0 HB2 GLU A 209 3.595 7.555 -12.665 1.00 0.00 H new ATOM 0 HB3 GLU A 209 3.240 6.764 -14.188 1.00 0.00 H new ATOM 0 HG2 GLU A 209 1.189 8.431 -12.695 1.00 0.00 H new ATOM 0 HG3 GLU A 209 2.299 9.120 -13.862 1.00 0.00 H new ATOM 496 N LYS A 210 3.891 4.276 -13.033 1.00 0.00 N ATOM 497 CA LYS A 210 4.974 3.356 -12.743 1.00 0.00 C ATOM 498 C LYS A 210 6.312 3.966 -13.147 1.00 0.00 C ATOM 499 O LYS A 210 7.157 4.221 -12.293 1.00 0.00 O ATOM 500 CB LYS A 210 4.767 2.028 -13.472 1.00 0.00 C ATOM 501 CG LYS A 210 5.807 0.970 -13.123 1.00 0.00 C ATOM 502 CD LYS A 210 5.839 -0.152 -14.147 1.00 0.00 C ATOM 503 CE LYS A 210 6.226 0.368 -15.525 1.00 0.00 C ATOM 504 NZ LYS A 210 6.225 -0.704 -16.552 1.00 0.00 N ATOM 0 H LYS A 210 3.625 4.322 -14.017 1.00 0.00 H new ATOM 0 HA LYS A 210 4.979 3.167 -11.670 1.00 0.00 H new ATOM 0 HB2 LYS A 210 3.776 1.643 -13.233 1.00 0.00 H new ATOM 0 HB3 LYS A 210 4.789 2.206 -14.547 1.00 0.00 H new ATOM 0 HG2 LYS A 210 6.791 1.434 -13.062 1.00 0.00 H new ATOM 0 HG3 LYS A 210 5.588 0.557 -12.138 1.00 0.00 H new ATOM 0 HD2 LYS A 210 6.550 -0.915 -13.831 1.00 0.00 H new ATOM 0 HD3 LYS A 210 4.860 -0.629 -14.198 1.00 0.00 H new ATOM 0 HE2 LYS A 210 5.532 1.154 -15.823 1.00 0.00 H new ATOM 0 HE3 LYS A 210 7.217 0.820 -15.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 210 6.494 -0.303 -17.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 210 6.906 -1.443 -16.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 210 5.274 -1.119 -16.620 1.00 0.00 H new ATOM 518 N ASN A 211 6.489 4.179 -14.462 1.00 0.00 N ATOM 519 CA ASN A 211 7.724 4.743 -15.027 1.00 0.00 C ATOM 520 C ASN A 211 8.840 3.704 -14.961 1.00 0.00 C ATOM 521 O ASN A 211 9.173 3.073 -15.962 1.00 0.00 O ATOM 522 CB ASN A 211 8.135 6.037 -14.306 1.00 0.00 C ATOM 523 CG ASN A 211 9.327 6.714 -14.954 1.00 0.00 C ATOM 524 OD1 ASN A 211 10.434 6.179 -14.972 1.00 0.00 O ATOM 525 ND2 ASN A 211 9.103 7.902 -15.496 1.00 0.00 N ATOM 0 H ASN A 211 5.779 3.965 -15.162 1.00 0.00 H new ATOM 0 HA ASN A 211 7.539 5.002 -16.070 1.00 0.00 H new ATOM 0 HB2 ASN A 211 7.291 6.727 -14.297 1.00 0.00 H new ATOM 0 HB3 ASN A 211 8.372 5.810 -13.267 1.00 0.00 H new ATOM 0 HD21 ASN A 211 9.864 8.407 -15.950 1.00 0.00 H new ATOM 0 HD22 ASN A 211 8.169 8.311 -15.460 1.00 0.00 H new ATOM 532 N ASP A 212 9.390 3.506 -13.774 1.00 0.00 N ATOM 533 CA ASP A 212 10.438 2.518 -13.574 1.00 0.00 C ATOM 534 C ASP A 212 9.867 1.355 -12.774 1.00 0.00 C ATOM 535 O ASP A 212 8.883 1.520 -12.059 1.00 0.00 O ATOM 536 CB ASP A 212 11.619 3.142 -12.825 1.00 0.00 C ATOM 537 CG ASP A 212 12.851 2.258 -12.814 1.00 0.00 C ATOM 538 OD1 ASP A 212 12.900 1.287 -13.595 1.00 0.00 O ATOM 539 OD2 ASP A 212 13.780 2.551 -12.037 1.00 0.00 O ATOM 0 H ASP A 212 9.127 4.018 -12.932 1.00 0.00 H new ATOM 0 HA ASP A 212 10.796 2.162 -14.540 1.00 0.00 H new ATOM 0 HB2 ASP A 212 11.869 4.098 -13.285 1.00 0.00 H new ATOM 0 HB3 ASP A 212 11.320 3.351 -11.798 1.00 0.00 H new ATOM 544 N LEU A 213 10.476 0.186 -12.879 1.00 0.00 N ATOM 545 CA LEU A 213 9.998 -0.971 -12.136 1.00 0.00 C ATOM 546 C LEU A 213 10.469 -0.894 -10.691 1.00 0.00 C ATOM 547 O LEU A 213 9.917 -1.554 -9.811 1.00 0.00 O ATOM 548 CB LEU A 213 10.462 -2.287 -12.772 1.00 0.00 C ATOM 549 CG LEU A 213 9.797 -2.648 -14.108 1.00 0.00 C ATOM 550 CD1 LEU A 213 10.331 -1.787 -15.241 1.00 0.00 C ATOM 551 CD2 LEU A 213 10.000 -4.120 -14.424 1.00 0.00 C ATOM 0 H LEU A 213 11.293 0.012 -13.464 1.00 0.00 H new ATOM 0 HA LEU A 213 8.908 -0.956 -12.164 1.00 0.00 H new ATOM 0 HB2 LEU A 213 11.540 -2.236 -12.925 1.00 0.00 H new ATOM 0 HB3 LEU A 213 10.279 -3.096 -12.065 1.00 0.00 H new ATOM 0 HG LEU A 213 8.729 -2.453 -14.011 1.00 0.00 H new ATOM 0 HD11 LEU A 213 9.840 -2.067 -16.173 1.00 0.00 H new ATOM 0 HD12 LEU A 213 10.130 -0.737 -15.026 1.00 0.00 H new ATOM 0 HD13 LEU A 213 11.406 -1.938 -15.337 1.00 0.00 H new ATOM 0 HD21 LEU A 213 9.522 -4.357 -15.374 1.00 0.00 H new ATOM 0 HD22 LEU A 213 11.067 -4.334 -14.491 1.00 0.00 H new ATOM 0 HD23 LEU A 213 9.557 -4.726 -13.634 1.00 0.00 H new ATOM 563 N HIS A 214 11.484 -0.071 -10.457 1.00 0.00 N ATOM 564 CA HIS A 214 12.028 0.117 -9.118 1.00 0.00 C ATOM 565 C HIS A 214 11.443 1.375 -8.494 1.00 0.00 C ATOM 566 O HIS A 214 10.856 1.332 -7.410 1.00 0.00 O ATOM 567 CB HIS A 214 13.557 0.225 -9.161 1.00 0.00 C ATOM 568 CG HIS A 214 14.254 -1.026 -9.605 1.00 0.00 C ATOM 569 ND1 HIS A 214 15.621 -1.100 -9.774 1.00 0.00 N ATOM 570 CD2 HIS A 214 13.775 -2.260 -9.904 1.00 0.00 C ATOM 571 CE1 HIS A 214 15.952 -2.322 -10.158 1.00 0.00 C ATOM 572 NE2 HIS A 214 14.851 -3.046 -10.240 1.00 0.00 N ATOM 0 H HIS A 214 11.948 0.479 -11.180 1.00 0.00 H new ATOM 0 HA HIS A 214 11.758 -0.749 -8.513 1.00 0.00 H new ATOM 0 HB2 HIS A 214 13.833 1.038 -9.833 1.00 0.00 H new ATOM 0 HB3 HIS A 214 13.918 0.495 -8.169 1.00 0.00 H new ATOM 0 HD2 HIS A 214 12.740 -2.567 -9.882 1.00 0.00 H new ATOM 0 HE1 HIS A 214 16.953 -2.669 -10.369 1.00 0.00 H new ATOM 0 HE2 HIS A 214 14.806 -4.029 -10.509 1.00 0.00 H new ATOM 581 N TRP A 215 11.601 2.487 -9.193 1.00 0.00 N ATOM 582 CA TRP A 215 11.086 3.768 -8.733 1.00 0.00 C ATOM 583 C TRP A 215 9.693 4.019 -9.286 1.00 0.00 C ATOM 584 O TRP A 215 9.534 4.326 -10.464 1.00 0.00 O ATOM 585 CB TRP A 215 12.011 4.906 -9.154 1.00 0.00 C ATOM 586 CG TRP A 215 13.303 4.937 -8.398 1.00 0.00 C ATOM 587 CD1 TRP A 215 14.472 4.305 -8.711 1.00 0.00 C ATOM 588 CD2 TRP A 215 13.535 5.617 -7.167 1.00 0.00 C ATOM 589 NE1 TRP A 215 15.429 4.589 -7.763 1.00 0.00 N ATOM 590 CE2 TRP A 215 14.873 5.387 -6.799 1.00 0.00 C ATOM 591 CE3 TRP A 215 12.738 6.412 -6.348 1.00 0.00 C ATOM 592 CZ2 TRP A 215 15.426 5.924 -5.640 1.00 0.00 C ATOM 593 CZ3 TRP A 215 13.279 6.939 -5.202 1.00 0.00 C ATOM 594 CH2 TRP A 215 14.617 6.697 -4.854 1.00 0.00 C ATOM 0 H TRP A 215 12.086 2.529 -10.089 1.00 0.00 H new ATOM 0 HA TRP A 215 11.037 3.733 -7.645 1.00 0.00 H new ATOM 0 HB2 TRP A 215 12.225 4.815 -10.219 1.00 0.00 H new ATOM 0 HB3 TRP A 215 11.494 5.855 -9.013 1.00 0.00 H new ATOM 0 HD1 TRP A 215 14.624 3.675 -9.575 1.00 0.00 H new ATOM 0 HE1 TRP A 215 16.394 4.259 -7.776 1.00 0.00 H new ATOM 0 HE3 TRP A 215 11.709 6.611 -6.610 1.00 0.00 H new ATOM 0 HZ2 TRP A 215 16.455 5.737 -5.372 1.00 0.00 H new ATOM 0 HZ3 TRP A 215 12.665 7.550 -4.557 1.00 0.00 H new ATOM 0 HH2 TRP A 215 15.015 7.130 -3.948 1.00 0.00 H new ATOM 605 N TRP A 216 8.691 3.886 -8.432 1.00 0.00 N ATOM 606 CA TRP A 216 7.303 4.097 -8.837 1.00 0.00 C ATOM 607 C TRP A 216 6.845 5.512 -8.507 1.00 0.00 C ATOM 608 O TRP A 216 7.592 6.309 -7.943 1.00 0.00 O ATOM 609 CB TRP A 216 6.374 3.102 -8.132 1.00 0.00 C ATOM 610 CG TRP A 216 6.513 1.676 -8.593 1.00 0.00 C ATOM 611 CD1 TRP A 216 7.441 1.162 -9.447 1.00 0.00 C ATOM 612 CD2 TRP A 216 5.682 0.582 -8.206 1.00 0.00 C ATOM 613 NE1 TRP A 216 7.234 -0.188 -9.612 1.00 0.00 N ATOM 614 CE2 TRP A 216 6.161 -0.567 -8.858 1.00 0.00 C ATOM 615 CE3 TRP A 216 4.581 0.469 -7.364 1.00 0.00 C ATOM 616 CZ2 TRP A 216 5.566 -1.817 -8.695 1.00 0.00 C ATOM 617 CZ3 TRP A 216 3.994 -0.766 -7.201 1.00 0.00 C ATOM 618 CH2 TRP A 216 4.484 -1.894 -7.861 1.00 0.00 C ATOM 0 H TRP A 216 8.809 3.632 -7.451 1.00 0.00 H new ATOM 0 HA TRP A 216 7.254 3.944 -9.915 1.00 0.00 H new ATOM 0 HB2 TRP A 216 6.566 3.143 -7.060 1.00 0.00 H new ATOM 0 HB3 TRP A 216 5.342 3.419 -8.283 1.00 0.00 H new ATOM 0 HD1 TRP A 216 8.225 1.731 -9.925 1.00 0.00 H new ATOM 0 HE1 TRP A 216 7.792 -0.805 -10.202 1.00 0.00 H new ATOM 0 HE3 TRP A 216 4.193 1.334 -6.847 1.00 0.00 H new ATOM 0 HZ2 TRP A 216 5.944 -2.690 -9.207 1.00 0.00 H new ATOM 0 HZ3 TRP A 216 3.138 -0.864 -6.550 1.00 0.00 H new ATOM 0 HH2 TRP A 216 3.999 -2.847 -7.710 1.00 0.00 H new ATOM 629 N ARG A 217 5.596 5.805 -8.840 1.00 0.00 N ATOM 630 CA ARG A 217 5.009 7.105 -8.563 1.00 0.00 C ATOM 631 C ARG A 217 3.670 6.897 -7.874 1.00 0.00 C ATOM 632 O ARG A 217 2.669 6.611 -8.530 1.00 0.00 O ATOM 633 CB ARG A 217 4.808 7.881 -9.861 1.00 0.00 C ATOM 634 CG ARG A 217 5.294 9.318 -9.807 1.00 0.00 C ATOM 635 CD ARG A 217 4.547 10.153 -8.780 1.00 0.00 C ATOM 636 NE ARG A 217 4.759 11.583 -9.020 1.00 0.00 N ATOM 637 CZ ARG A 217 4.157 12.258 -10.003 1.00 0.00 C ATOM 638 NH1 ARG A 217 3.247 11.654 -10.761 1.00 0.00 N ATOM 639 NH2 ARG A 217 4.459 13.531 -10.227 1.00 0.00 N ATOM 0 H ARG A 217 4.966 5.152 -9.306 1.00 0.00 H new ATOM 0 HA ARG A 217 5.676 7.678 -7.919 1.00 0.00 H new ATOM 0 HB2 ARG A 217 5.329 7.363 -10.666 1.00 0.00 H new ATOM 0 HB3 ARG A 217 3.748 7.877 -10.113 1.00 0.00 H new ATOM 0 HG2 ARG A 217 6.358 9.328 -9.572 1.00 0.00 H new ATOM 0 HG3 ARG A 217 5.180 9.773 -10.791 1.00 0.00 H new ATOM 0 HD2 ARG A 217 3.482 9.926 -8.825 1.00 0.00 H new ATOM 0 HD3 ARG A 217 4.886 9.894 -7.777 1.00 0.00 H new ATOM 0 HE ARG A 217 5.398 12.088 -8.406 1.00 0.00 H new ATOM 0 HH11 ARG A 217 3.009 10.677 -10.592 1.00 0.00 H new ATOM 0 HH12 ARG A 217 2.786 12.168 -11.512 1.00 0.00 H new ATOM 0 HH21 ARG A 217 5.155 14.000 -9.647 1.00 0.00 H new ATOM 0 HH22 ARG A 217 3.995 14.040 -10.979 1.00 0.00 H new ATOM 653 N ALA A 218 3.650 7.014 -6.554 1.00 0.00 N ATOM 654 CA ALA A 218 2.419 6.808 -5.798 1.00 0.00 C ATOM 655 C ALA A 218 2.057 8.033 -4.969 1.00 0.00 C ATOM 656 O ALA A 218 2.914 8.852 -4.644 1.00 0.00 O ATOM 657 CB ALA A 218 2.537 5.590 -4.894 1.00 0.00 C ATOM 0 H ALA A 218 4.464 7.249 -5.986 1.00 0.00 H new ATOM 0 HA ALA A 218 1.622 6.639 -6.522 1.00 0.00 H new ATOM 0 HB1 ALA A 218 1.608 5.456 -4.340 1.00 0.00 H new ATOM 0 HB2 ALA A 218 2.729 4.704 -5.500 1.00 0.00 H new ATOM 0 HB3 ALA A 218 3.359 5.735 -4.193 1.00 0.00 H new ATOM 663 N ARG A 219 0.783 8.134 -4.622 1.00 0.00 N ATOM 664 CA ARG A 219 0.281 9.235 -3.813 1.00 0.00 C ATOM 665 C ARG A 219 -0.027 8.719 -2.415 1.00 0.00 C ATOM 666 O ARG A 219 -0.520 7.603 -2.261 1.00 0.00 O ATOM 667 CB ARG A 219 -0.981 9.826 -4.462 1.00 0.00 C ATOM 668 CG ARG A 219 -1.305 11.249 -4.048 1.00 0.00 C ATOM 669 CD ARG A 219 -1.983 11.310 -2.691 1.00 0.00 C ATOM 670 NE ARG A 219 -3.245 10.565 -2.646 1.00 0.00 N ATOM 671 CZ ARG A 219 -4.353 10.897 -3.325 1.00 0.00 C ATOM 672 NH1 ARG A 219 -4.349 11.915 -4.177 1.00 0.00 N ATOM 673 NH2 ARG A 219 -5.469 10.198 -3.158 1.00 0.00 N ATOM 0 H ARG A 219 0.069 7.457 -4.892 1.00 0.00 H new ATOM 0 HA ARG A 219 1.032 10.022 -3.747 1.00 0.00 H new ATOM 0 HB2 ARG A 219 -0.863 9.796 -5.545 1.00 0.00 H new ATOM 0 HB3 ARG A 219 -1.831 9.189 -4.216 1.00 0.00 H new ATOM 0 HG2 ARG A 219 -0.387 11.836 -4.020 1.00 0.00 H new ATOM 0 HG3 ARG A 219 -1.952 11.705 -4.797 1.00 0.00 H new ATOM 0 HD2 ARG A 219 -1.306 10.913 -1.935 1.00 0.00 H new ATOM 0 HD3 ARG A 219 -2.173 12.352 -2.433 1.00 0.00 H new ATOM 0 HE ARG A 219 -3.283 9.734 -2.056 1.00 0.00 H new ATOM 0 HH11 ARG A 219 -3.496 12.456 -4.322 1.00 0.00 H new ATOM 0 HH12 ARG A 219 -5.199 12.157 -4.687 1.00 0.00 H new ATOM 0 HH21 ARG A 219 -5.484 9.408 -2.513 1.00 0.00 H new ATOM 0 HH22 ARG A 219 -6.311 10.451 -3.675 1.00 0.00 H new ATOM 687 N ASP A 220 0.272 9.514 -1.404 1.00 0.00 N ATOM 688 CA ASP A 220 0.031 9.102 -0.028 1.00 0.00 C ATOM 689 C ASP A 220 -1.210 9.762 0.561 1.00 0.00 C ATOM 690 O ASP A 220 -2.284 9.167 0.612 1.00 0.00 O ATOM 691 CB ASP A 220 1.249 9.428 0.849 1.00 0.00 C ATOM 692 CG ASP A 220 1.100 8.946 2.282 1.00 0.00 C ATOM 693 OD1 ASP A 220 0.145 8.196 2.570 1.00 0.00 O ATOM 694 OD2 ASP A 220 1.949 9.305 3.119 1.00 0.00 O ATOM 0 H ASP A 220 0.680 10.443 -1.505 1.00 0.00 H new ATOM 0 HA ASP A 220 -0.136 8.025 -0.043 1.00 0.00 H new ATOM 0 HB2 ASP A 220 2.137 8.973 0.410 1.00 0.00 H new ATOM 0 HB3 ASP A 220 1.410 10.506 0.850 1.00 0.00 H new ATOM 699 N LYS A 221 -1.024 10.974 1.053 1.00 0.00 N ATOM 700 CA LYS A 221 -2.085 11.720 1.713 1.00 0.00 C ATOM 701 C LYS A 221 -3.036 12.447 0.753 1.00 0.00 C ATOM 702 O LYS A 221 -3.654 11.842 -0.117 1.00 0.00 O ATOM 703 CB LYS A 221 -1.466 12.712 2.707 1.00 0.00 C ATOM 704 CG LYS A 221 -0.149 13.332 2.241 1.00 0.00 C ATOM 705 CD LYS A 221 1.062 12.524 2.692 1.00 0.00 C ATOM 706 CE LYS A 221 1.138 12.395 4.207 1.00 0.00 C ATOM 707 NZ LYS A 221 2.246 11.496 4.624 1.00 0.00 N ATOM 0 H LYS A 221 -0.134 11.470 1.007 1.00 0.00 H new ATOM 0 HA LYS A 221 -2.703 10.988 2.233 1.00 0.00 H new ATOM 0 HB2 LYS A 221 -2.182 13.511 2.898 1.00 0.00 H new ATOM 0 HB3 LYS A 221 -1.298 12.201 3.655 1.00 0.00 H new ATOM 0 HG2 LYS A 221 -0.149 13.406 1.153 1.00 0.00 H new ATOM 0 HG3 LYS A 221 -0.071 14.347 2.629 1.00 0.00 H new ATOM 0 HD2 LYS A 221 1.019 11.530 2.247 1.00 0.00 H new ATOM 0 HD3 LYS A 221 1.971 13.000 2.324 1.00 0.00 H new ATOM 0 HE2 LYS A 221 1.282 13.380 4.650 1.00 0.00 H new ATOM 0 HE3 LYS A 221 0.192 12.009 4.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 221 2.258 11.418 5.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 221 2.104 10.554 4.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 221 3.152 11.887 4.296 1.00 0.00 H new ATOM 721 N TYR A 222 -3.183 13.749 0.970 1.00 0.00 N ATOM 722 CA TYR A 222 -4.094 14.592 0.197 1.00 0.00 C ATOM 723 C TYR A 222 -3.449 15.209 -1.040 1.00 0.00 C ATOM 724 O TYR A 222 -3.547 16.415 -1.262 1.00 0.00 O ATOM 725 CB TYR A 222 -4.621 15.697 1.117 1.00 0.00 C ATOM 726 CG TYR A 222 -3.537 16.352 1.956 1.00 0.00 C ATOM 727 CD1 TYR A 222 -2.653 17.268 1.401 1.00 0.00 C ATOM 728 CD2 TYR A 222 -3.385 16.031 3.296 1.00 0.00 C ATOM 729 CE1 TYR A 222 -1.654 17.849 2.156 1.00 0.00 C ATOM 730 CE2 TYR A 222 -2.391 16.609 4.061 1.00 0.00 C ATOM 731 CZ TYR A 222 -1.527 17.516 3.487 1.00 0.00 C ATOM 732 OH TYR A 222 -0.532 18.088 4.245 1.00 0.00 O ATOM 0 H TYR A 222 -2.671 14.255 1.692 1.00 0.00 H new ATOM 0 HA TYR A 222 -4.902 13.959 -0.170 1.00 0.00 H new ATOM 0 HB2 TYR A 222 -5.112 16.459 0.512 1.00 0.00 H new ATOM 0 HB3 TYR A 222 -5.379 15.278 1.779 1.00 0.00 H new ATOM 0 HD1 TYR A 222 -2.749 17.531 0.358 1.00 0.00 H new ATOM 0 HD2 TYR A 222 -4.056 15.316 3.750 1.00 0.00 H new ATOM 0 HE1 TYR A 222 -0.976 18.560 1.706 1.00 0.00 H new ATOM 0 HE2 TYR A 222 -2.291 16.351 5.105 1.00 0.00 H new ATOM 0 HH TYR A 222 -0.582 17.746 5.162 1.00 0.00 H new ATOM 742 N GLY A 223 -2.807 14.399 -1.858 1.00 0.00 N ATOM 743 CA GLY A 223 -2.195 14.943 -3.052 1.00 0.00 C ATOM 744 C GLY A 223 -0.688 14.896 -3.010 1.00 0.00 C ATOM 745 O GLY A 223 -0.035 15.122 -4.023 1.00 0.00 O ATOM 0 H GLY A 223 -2.697 13.394 -1.725 1.00 0.00 H new ATOM 0 HA2 GLY A 223 -2.547 14.387 -3.921 1.00 0.00 H new ATOM 0 HA3 GLY A 223 -2.518 15.976 -3.182 1.00 0.00 H new ATOM 749 N SER A 224 -0.133 14.597 -1.845 1.00 0.00 N ATOM 750 CA SER A 224 1.310 14.513 -1.702 1.00 0.00 C ATOM 751 C SER A 224 1.800 13.201 -2.297 1.00 0.00 C ATOM 752 O SER A 224 1.724 12.150 -1.662 1.00 0.00 O ATOM 753 CB SER A 224 1.707 14.611 -0.230 1.00 0.00 C ATOM 754 OG SER A 224 1.023 15.678 0.409 1.00 0.00 O ATOM 0 H SER A 224 -0.657 14.410 -0.990 1.00 0.00 H new ATOM 0 HA SER A 224 1.772 15.344 -2.234 1.00 0.00 H new ATOM 0 HB2 SER A 224 1.479 13.673 0.276 1.00 0.00 H new ATOM 0 HB3 SER A 224 2.783 14.763 -0.149 1.00 0.00 H new ATOM 0 HG SER A 224 1.291 15.721 1.351 1.00 0.00 H new ATOM 760 N GLU A 225 2.264 13.266 -3.533 1.00 0.00 N ATOM 761 CA GLU A 225 2.740 12.091 -4.243 1.00 0.00 C ATOM 762 C GLU A 225 4.222 12.208 -4.568 1.00 0.00 C ATOM 763 O GLU A 225 4.885 13.140 -4.115 1.00 0.00 O ATOM 764 CB GLU A 225 1.937 11.918 -5.529 1.00 0.00 C ATOM 765 CG GLU A 225 1.382 13.227 -6.071 1.00 0.00 C ATOM 766 CD GLU A 225 2.452 14.174 -6.573 1.00 0.00 C ATOM 767 OE1 GLU A 225 3.026 13.905 -7.640 1.00 0.00 O ATOM 768 OE2 GLU A 225 2.727 15.184 -5.895 1.00 0.00 O ATOM 0 H GLU A 225 2.321 14.131 -4.071 1.00 0.00 H new ATOM 0 HA GLU A 225 2.604 11.220 -3.602 1.00 0.00 H new ATOM 0 HB2 GLU A 225 2.572 11.459 -6.287 1.00 0.00 H new ATOM 0 HB3 GLU A 225 1.112 11.230 -5.345 1.00 0.00 H new ATOM 0 HG2 GLU A 225 0.689 13.010 -6.884 1.00 0.00 H new ATOM 0 HG3 GLU A 225 0.808 13.722 -5.287 1.00 0.00 H new ATOM 775 N GLY A 226 4.738 11.273 -5.363 1.00 0.00 N ATOM 776 CA GLY A 226 6.138 11.321 -5.727 1.00 0.00 C ATOM 777 C GLY A 226 6.735 9.955 -5.998 1.00 0.00 C ATOM 778 O GLY A 226 6.015 8.953 -6.088 1.00 0.00 O ATOM 0 H GLY A 226 4.214 10.491 -5.757 1.00 0.00 H new ATOM 0 HA2 GLY A 226 6.254 11.943 -6.615 1.00 0.00 H new ATOM 0 HA3 GLY A 226 6.698 11.802 -4.925 1.00 0.00 H new ATOM 782 N TYR A 227 8.059 9.930 -6.132 1.00 0.00 N ATOM 783 CA TYR A 227 8.804 8.704 -6.396 1.00 0.00 C ATOM 784 C TYR A 227 8.825 7.822 -5.165 1.00 0.00 C ATOM 785 O TYR A 227 9.015 8.306 -4.055 1.00 0.00 O ATOM 786 CB TYR A 227 10.250 9.020 -6.800 1.00 0.00 C ATOM 787 CG TYR A 227 10.405 9.721 -8.131 1.00 0.00 C ATOM 788 CD1 TYR A 227 9.310 10.011 -8.933 1.00 0.00 C ATOM 789 CD2 TYR A 227 11.663 10.094 -8.579 1.00 0.00 C ATOM 790 CE1 TYR A 227 9.464 10.652 -10.146 1.00 0.00 C ATOM 791 CE2 TYR A 227 11.827 10.736 -9.792 1.00 0.00 C ATOM 792 CZ TYR A 227 10.726 11.015 -10.570 1.00 0.00 C ATOM 793 OH TYR A 227 10.888 11.651 -11.776 1.00 0.00 O ATOM 0 H TYR A 227 8.645 10.761 -6.060 1.00 0.00 H new ATOM 0 HA TYR A 227 8.305 8.184 -7.214 1.00 0.00 H new ATOM 0 HB2 TYR A 227 10.700 9.641 -6.025 1.00 0.00 H new ATOM 0 HB3 TYR A 227 10.815 8.088 -6.830 1.00 0.00 H new ATOM 0 HD1 TYR A 227 8.321 9.730 -8.603 1.00 0.00 H new ATOM 0 HD2 TYR A 227 12.529 9.879 -7.970 1.00 0.00 H new ATOM 0 HE1 TYR A 227 8.602 10.868 -10.759 1.00 0.00 H new ATOM 0 HE2 TYR A 227 12.814 11.017 -10.128 1.00 0.00 H new ATOM 0 HH TYR A 227 11.839 11.837 -11.922 1.00 0.00 H new ATOM 803 N ILE A 228 8.633 6.535 -5.357 1.00 0.00 N ATOM 804 CA ILE A 228 8.638 5.607 -4.247 1.00 0.00 C ATOM 805 C ILE A 228 9.354 4.330 -4.622 1.00 0.00 C ATOM 806 O ILE A 228 8.943 3.638 -5.554 1.00 0.00 O ATOM 807 CB ILE A 228 7.207 5.233 -3.801 1.00 0.00 C ATOM 808 CG1 ILE A 228 6.403 6.483 -3.423 1.00 0.00 C ATOM 809 CG2 ILE A 228 7.238 4.251 -2.639 1.00 0.00 C ATOM 810 CD1 ILE A 228 5.087 6.187 -2.733 1.00 0.00 C ATOM 0 H ILE A 228 8.472 6.108 -6.269 1.00 0.00 H new ATOM 0 HA ILE A 228 9.152 6.109 -3.428 1.00 0.00 H new ATOM 0 HB ILE A 228 6.713 4.751 -4.645 1.00 0.00 H new ATOM 0 HG12 ILE A 228 7.011 7.109 -2.770 1.00 0.00 H new ATOM 0 HG13 ILE A 228 6.206 7.062 -4.325 1.00 0.00 H new ATOM 0 HG21 ILE A 228 6.218 4.004 -2.344 1.00 0.00 H new ATOM 0 HG22 ILE A 228 7.758 3.343 -2.944 1.00 0.00 H new ATOM 0 HG23 ILE A 228 7.760 4.702 -1.795 1.00 0.00 H new ATOM 0 HD11 ILE A 228 4.580 7.123 -2.499 1.00 0.00 H new ATOM 0 HD12 ILE A 228 4.458 5.588 -3.391 1.00 0.00 H new ATOM 0 HD13 ILE A 228 5.275 5.636 -1.811 1.00 0.00 H new ATOM 822 N PRO A 229 10.409 3.971 -3.887 1.00 0.00 N ATOM 823 CA PRO A 229 11.127 2.740 -4.143 1.00 0.00 C ATOM 824 C PRO A 229 10.251 1.548 -3.809 1.00 0.00 C ATOM 825 O PRO A 229 10.080 1.206 -2.638 1.00 0.00 O ATOM 826 CB PRO A 229 12.335 2.772 -3.202 1.00 0.00 C ATOM 827 CG PRO A 229 12.321 4.119 -2.541 1.00 0.00 C ATOM 828 CD PRO A 229 10.949 4.710 -2.741 1.00 0.00 C ATOM 0 HA PRO A 229 11.421 2.652 -5.189 1.00 0.00 H new ATOM 0 HB2 PRO A 229 12.271 1.975 -2.461 1.00 0.00 H new ATOM 0 HB3 PRO A 229 13.262 2.620 -3.755 1.00 0.00 H new ATOM 0 HG2 PRO A 229 12.547 4.027 -1.479 1.00 0.00 H new ATOM 0 HG3 PRO A 229 13.084 4.766 -2.974 1.00 0.00 H new ATOM 0 HD2 PRO A 229 10.327 4.583 -1.855 1.00 0.00 H new ATOM 0 HD3 PRO A 229 11.001 5.780 -2.944 1.00 0.00 H new ATOM 836 N SER A 230 9.683 0.934 -4.840 1.00 0.00 N ATOM 837 CA SER A 230 8.810 -0.229 -4.679 1.00 0.00 C ATOM 838 C SER A 230 9.485 -1.328 -3.853 1.00 0.00 C ATOM 839 O SER A 230 8.821 -2.251 -3.390 1.00 0.00 O ATOM 840 CB SER A 230 8.402 -0.774 -6.053 1.00 0.00 C ATOM 841 OG SER A 230 7.415 -1.784 -5.944 1.00 0.00 O ATOM 0 H SER A 230 9.812 1.225 -5.809 1.00 0.00 H new ATOM 0 HA SER A 230 7.919 0.092 -4.140 1.00 0.00 H new ATOM 0 HB2 SER A 230 8.022 0.041 -6.670 1.00 0.00 H new ATOM 0 HB3 SER A 230 9.279 -1.176 -6.560 1.00 0.00 H new ATOM 0 HG SER A 230 6.832 -1.758 -6.731 1.00 0.00 H new ATOM 847 N ASN A 231 10.794 -1.202 -3.631 1.00 0.00 N ATOM 848 CA ASN A 231 11.528 -2.160 -2.819 1.00 0.00 C ATOM 849 C ASN A 231 11.021 -2.131 -1.381 1.00 0.00 C ATOM 850 O ASN A 231 11.239 -3.064 -0.614 1.00 0.00 O ATOM 851 CB ASN A 231 13.029 -1.860 -2.838 1.00 0.00 C ATOM 852 CG ASN A 231 13.624 -1.961 -4.224 1.00 0.00 C ATOM 853 OD1 ASN A 231 13.500 -2.987 -4.893 1.00 0.00 O ATOM 854 ND2 ASN A 231 14.284 -0.899 -4.661 1.00 0.00 N ATOM 0 H ASN A 231 11.364 -0.443 -4.005 1.00 0.00 H new ATOM 0 HA ASN A 231 11.365 -3.151 -3.242 1.00 0.00 H new ATOM 0 HB2 ASN A 231 13.201 -0.858 -2.445 1.00 0.00 H new ATOM 0 HB3 ASN A 231 13.543 -2.555 -2.174 1.00 0.00 H new ATOM 0 HD21 ASN A 231 14.714 -0.911 -5.586 1.00 0.00 H new ATOM 0 HD22 ASN A 231 14.362 -0.069 -4.073 1.00 0.00 H new ATOM 861 N TYR A 232 10.345 -1.038 -1.030 1.00 0.00 N ATOM 862 CA TYR A 232 9.800 -0.860 0.310 1.00 0.00 C ATOM 863 C TYR A 232 8.281 -1.020 0.324 1.00 0.00 C ATOM 864 O TYR A 232 7.670 -0.997 1.392 1.00 0.00 O ATOM 865 CB TYR A 232 10.173 0.520 0.865 1.00 0.00 C ATOM 866 CG TYR A 232 11.654 0.712 1.111 1.00 0.00 C ATOM 867 CD1 TYR A 232 12.568 0.704 0.063 1.00 0.00 C ATOM 868 CD2 TYR A 232 12.142 0.897 2.397 1.00 0.00 C ATOM 869 CE1 TYR A 232 13.919 0.875 0.291 1.00 0.00 C ATOM 870 CE2 TYR A 232 13.490 1.069 2.633 1.00 0.00 C ATOM 871 CZ TYR A 232 14.377 1.056 1.577 1.00 0.00 C ATOM 872 OH TYR A 232 15.721 1.224 1.810 1.00 0.00 O ATOM 0 H TYR A 232 10.162 -0.259 -1.662 1.00 0.00 H new ATOM 0 HA TYR A 232 10.234 -1.635 0.941 1.00 0.00 H new ATOM 0 HB2 TYR A 232 9.830 1.284 0.167 1.00 0.00 H new ATOM 0 HB3 TYR A 232 9.637 0.679 1.801 1.00 0.00 H new ATOM 0 HD1 TYR A 232 12.215 0.561 -0.948 1.00 0.00 H new ATOM 0 HD2 TYR A 232 11.453 0.906 3.229 1.00 0.00 H new ATOM 0 HE1 TYR A 232 14.614 0.867 -0.536 1.00 0.00 H new ATOM 0 HE2 TYR A 232 13.850 1.213 3.641 1.00 0.00 H new ATOM 0 HH TYR A 232 15.874 1.340 2.771 1.00 0.00 H new ATOM 882 N VAL A 233 7.671 -1.186 -0.855 1.00 0.00 N ATOM 883 CA VAL A 233 6.219 -1.358 -0.940 1.00 0.00 C ATOM 884 C VAL A 233 5.849 -2.721 -1.520 1.00 0.00 C ATOM 885 O VAL A 233 6.714 -3.546 -1.818 1.00 0.00 O ATOM 886 CB VAL A 233 5.522 -0.247 -1.763 1.00 0.00 C ATOM 887 CG1 VAL A 233 5.769 1.105 -1.131 1.00 0.00 C ATOM 888 CG2 VAL A 233 5.986 -0.248 -3.203 1.00 0.00 C ATOM 0 H VAL A 233 8.155 -1.205 -1.753 1.00 0.00 H new ATOM 0 HA VAL A 233 5.859 -1.289 0.087 1.00 0.00 H new ATOM 0 HB VAL A 233 4.451 -0.451 -1.760 1.00 0.00 H new ATOM 0 HG11 VAL A 233 5.274 1.878 -1.719 1.00 0.00 H new ATOM 0 HG12 VAL A 233 5.371 1.110 -0.116 1.00 0.00 H new ATOM 0 HG13 VAL A 233 6.841 1.303 -1.102 1.00 0.00 H new ATOM 0 HG21 VAL A 233 5.476 0.545 -3.750 1.00 0.00 H new ATOM 0 HG22 VAL A 233 7.062 -0.079 -3.239 1.00 0.00 H new ATOM 0 HG23 VAL A 233 5.755 -1.211 -3.659 1.00 0.00 H new ATOM 898 N THR A 234 4.549 -2.938 -1.642 1.00 0.00 N ATOM 899 CA THR A 234 3.968 -4.174 -2.145 1.00 0.00 C ATOM 900 C THR A 234 2.564 -3.854 -2.685 1.00 0.00 C ATOM 901 O THR A 234 2.077 -2.738 -2.507 1.00 0.00 O ATOM 902 CB THR A 234 3.929 -5.199 -0.990 1.00 0.00 C ATOM 903 OG1 THR A 234 5.241 -5.572 -0.613 1.00 0.00 O ATOM 904 CG2 THR A 234 3.180 -6.478 -1.282 1.00 0.00 C ATOM 0 H THR A 234 3.849 -2.241 -1.387 1.00 0.00 H new ATOM 0 HA THR A 234 4.557 -4.604 -2.955 1.00 0.00 H new ATOM 0 HB THR A 234 3.393 -4.675 -0.198 1.00 0.00 H new ATOM 0 HG1 THR A 234 5.890 -5.018 -1.095 1.00 0.00 H new ATOM 0 HG21 THR A 234 3.213 -7.127 -0.407 1.00 0.00 H new ATOM 0 HG22 THR A 234 2.142 -6.245 -1.522 1.00 0.00 H new ATOM 0 HG23 THR A 234 3.643 -6.986 -2.128 1.00 0.00 H new ATOM 912 N GLY A 235 1.921 -4.808 -3.353 1.00 0.00 N ATOM 913 CA GLY A 235 0.594 -4.561 -3.892 1.00 0.00 C ATOM 914 C GLY A 235 -0.499 -4.755 -2.852 1.00 0.00 C ATOM 915 O GLY A 235 -0.756 -3.874 -2.035 1.00 0.00 O ATOM 0 H GLY A 235 2.292 -5.742 -3.530 1.00 0.00 H new ATOM 0 HA2 GLY A 235 0.546 -3.544 -4.280 1.00 0.00 H new ATOM 0 HA3 GLY A 235 0.415 -5.232 -4.732 1.00 0.00 H new ATOM 919 N LYS A 236 -1.142 -5.914 -2.884 1.00 0.00 N ATOM 920 CA LYS A 236 -2.212 -6.235 -1.946 1.00 0.00 C ATOM 921 C LYS A 236 -1.667 -7.122 -0.816 1.00 0.00 C ATOM 922 O LYS A 236 -2.361 -7.999 -0.305 1.00 0.00 O ATOM 923 CB LYS A 236 -3.355 -6.940 -2.702 1.00 0.00 C ATOM 924 CG LYS A 236 -4.593 -7.234 -1.867 1.00 0.00 C ATOM 925 CD LYS A 236 -5.435 -8.323 -2.507 1.00 0.00 C ATOM 926 CE LYS A 236 -6.370 -8.977 -1.499 1.00 0.00 C ATOM 927 NZ LYS A 236 -6.620 -10.408 -1.823 1.00 0.00 N ATOM 0 H LYS A 236 -0.940 -6.655 -3.556 1.00 0.00 H new ATOM 0 HA LYS A 236 -2.601 -5.320 -1.499 1.00 0.00 H new ATOM 0 HB2 LYS A 236 -3.646 -6.320 -3.550 1.00 0.00 H new ATOM 0 HB3 LYS A 236 -2.977 -7.879 -3.108 1.00 0.00 H new ATOM 0 HG2 LYS A 236 -4.295 -7.542 -0.865 1.00 0.00 H new ATOM 0 HG3 LYS A 236 -5.187 -6.326 -1.759 1.00 0.00 H new ATOM 0 HD2 LYS A 236 -6.019 -7.899 -3.323 1.00 0.00 H new ATOM 0 HD3 LYS A 236 -4.782 -9.080 -2.942 1.00 0.00 H new ATOM 0 HE2 LYS A 236 -5.939 -8.900 -0.501 1.00 0.00 H new ATOM 0 HE3 LYS A 236 -7.317 -8.438 -1.479 1.00 0.00 H new ATOM 0 HZ1 LYS A 236 -7.261 -10.818 -1.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 236 -7.055 -10.480 -2.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 236 -5.719 -10.928 -1.817 1.00 0.00 H new ATOM 941 N LYS A 237 -0.406 -6.884 -0.445 1.00 0.00 N ATOM 942 CA LYS A 237 0.268 -7.656 0.608 1.00 0.00 C ATOM 943 C LYS A 237 0.368 -9.126 0.210 1.00 0.00 C ATOM 944 O LYS A 237 -0.562 -9.901 0.443 1.00 0.00 O ATOM 945 CB LYS A 237 -0.458 -7.531 1.953 1.00 0.00 C ATOM 946 CG LYS A 237 -0.489 -6.119 2.518 1.00 0.00 C ATOM 947 CD LYS A 237 -1.093 -6.102 3.917 1.00 0.00 C ATOM 948 CE LYS A 237 -1.113 -4.701 4.513 1.00 0.00 C ATOM 949 NZ LYS A 237 -1.970 -3.782 3.722 1.00 0.00 N ATOM 0 H LYS A 237 0.175 -6.156 -0.861 1.00 0.00 H new ATOM 0 HA LYS A 237 1.270 -7.244 0.724 1.00 0.00 H new ATOM 0 HB2 LYS A 237 -1.482 -7.885 1.834 1.00 0.00 H new ATOM 0 HB3 LYS A 237 0.025 -8.189 2.676 1.00 0.00 H new ATOM 0 HG2 LYS A 237 0.523 -5.714 2.550 1.00 0.00 H new ATOM 0 HG3 LYS A 237 -1.070 -5.473 1.860 1.00 0.00 H new ATOM 0 HD2 LYS A 237 -2.109 -6.494 3.878 1.00 0.00 H new ATOM 0 HD3 LYS A 237 -0.521 -6.764 4.567 1.00 0.00 H new ATOM 0 HE2 LYS A 237 -1.478 -4.747 5.539 1.00 0.00 H new ATOM 0 HE3 LYS A 237 -0.097 -4.308 4.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 237 -1.400 -2.981 3.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 237 -2.367 -4.293 2.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 237 -2.744 -3.428 4.320 1.00 0.00 H new ATOM 963 N SER A 238 1.498 -9.493 -0.388 1.00 0.00 N ATOM 964 CA SER A 238 1.744 -10.862 -0.830 1.00 0.00 C ATOM 965 C SER A 238 1.483 -11.853 0.302 1.00 0.00 C ATOM 966 O SER A 238 2.152 -11.826 1.338 1.00 0.00 O ATOM 967 CB SER A 238 3.184 -10.987 -1.334 1.00 0.00 C ATOM 968 OG SER A 238 3.490 -9.935 -2.246 1.00 0.00 O ATOM 0 H SER A 238 2.267 -8.851 -0.579 1.00 0.00 H new ATOM 0 HA SER A 238 1.059 -11.098 -1.644 1.00 0.00 H new ATOM 0 HB2 SER A 238 3.874 -10.957 -0.491 1.00 0.00 H new ATOM 0 HB3 SER A 238 3.321 -11.951 -1.823 1.00 0.00 H new ATOM 0 HG SER A 238 4.415 -10.030 -2.556 1.00 0.00 H new ATOM 974 N ASN A 239 0.493 -12.710 0.100 1.00 0.00 N ATOM 975 CA ASN A 239 0.120 -13.698 1.100 1.00 0.00 C ATOM 976 C ASN A 239 0.819 -15.023 0.809 1.00 0.00 C ATOM 977 O ASN A 239 1.564 -15.128 -0.168 1.00 0.00 O ATOM 978 CB ASN A 239 -1.403 -13.885 1.104 1.00 0.00 C ATOM 979 CG ASN A 239 -1.954 -14.208 2.476 1.00 0.00 C ATOM 980 OD1 ASN A 239 -1.621 -15.229 3.073 1.00 0.00 O ATOM 981 ND2 ASN A 239 -2.804 -13.330 2.980 1.00 0.00 N ATOM 0 H ASN A 239 -0.068 -12.740 -0.751 1.00 0.00 H new ATOM 0 HA ASN A 239 0.432 -13.349 2.084 1.00 0.00 H new ATOM 0 HB2 ASN A 239 -1.876 -12.976 0.733 1.00 0.00 H new ATOM 0 HB3 ASN A 239 -1.667 -14.686 0.414 1.00 0.00 H new ATOM 0 HD21 ASN A 239 -3.213 -13.487 3.901 1.00 0.00 H new ATOM 0 HD22 ASN A 239 -3.051 -12.496 2.448 1.00 0.00 H new ATOM 988 N ASN A 240 0.567 -16.021 1.654 1.00 0.00 N ATOM 989 CA ASN A 240 1.153 -17.358 1.506 1.00 0.00 C ATOM 990 C ASN A 240 2.674 -17.323 1.574 1.00 0.00 C ATOM 991 O ASN A 240 3.356 -18.009 0.809 1.00 0.00 O ATOM 992 CB ASN A 240 0.701 -18.024 0.207 1.00 0.00 C ATOM 993 CG ASN A 240 -0.762 -18.412 0.233 1.00 0.00 C ATOM 994 OD1 ASN A 240 -1.650 -17.556 0.271 1.00 0.00 O ATOM 995 ND2 ASN A 240 -1.025 -19.710 0.225 1.00 0.00 N ATOM 0 H ASN A 240 -0.049 -15.929 2.462 1.00 0.00 H new ATOM 0 HA ASN A 240 0.791 -17.952 2.345 1.00 0.00 H new ATOM 0 HB2 ASN A 240 0.879 -17.345 -0.627 1.00 0.00 H new ATOM 0 HB3 ASN A 240 1.306 -18.913 0.028 1.00 0.00 H new ATOM 0 HD21 ASN A 240 -1.992 -20.035 0.251 1.00 0.00 H new ATOM 0 HD22 ASN A 240 -0.261 -20.385 0.193 1.00 0.00 H new ATOM 1002 N LEU A 241 3.201 -16.538 2.506 1.00 0.00 N ATOM 1003 CA LEU A 241 4.643 -16.439 2.687 1.00 0.00 C ATOM 1004 C LEU A 241 5.110 -17.537 3.629 1.00 0.00 C ATOM 1005 O LEU A 241 5.994 -18.324 3.286 1.00 0.00 O ATOM 1006 CB LEU A 241 5.033 -15.073 3.252 1.00 0.00 C ATOM 1007 CG LEU A 241 4.622 -13.869 2.400 1.00 0.00 C ATOM 1008 CD1 LEU A 241 5.079 -12.580 3.062 1.00 0.00 C ATOM 1009 CD2 LEU A 241 5.187 -13.974 0.992 1.00 0.00 C ATOM 0 H LEU A 241 2.653 -15.963 3.146 1.00 0.00 H new ATOM 0 HA LEU A 241 5.123 -16.555 1.715 1.00 0.00 H new ATOM 0 HB2 LEU A 241 4.586 -14.967 4.241 1.00 0.00 H new ATOM 0 HB3 LEU A 241 6.114 -15.049 3.386 1.00 0.00 H new ATOM 0 HG LEU A 241 3.535 -13.861 2.323 1.00 0.00 H new ATOM 0 HD11 LEU A 241 4.782 -11.730 2.448 1.00 0.00 H new ATOM 0 HD12 LEU A 241 4.620 -12.494 4.047 1.00 0.00 H new ATOM 0 HD13 LEU A 241 6.164 -12.590 3.167 1.00 0.00 H new ATOM 0 HD21 LEU A 241 4.879 -13.105 0.410 1.00 0.00 H new ATOM 0 HD22 LEU A 241 6.275 -14.012 1.039 1.00 0.00 H new ATOM 0 HD23 LEU A 241 4.813 -14.880 0.516 1.00 0.00 H new ATOM 1021 N ASP A 242 4.482 -17.580 4.807 1.00 0.00 N ATOM 1022 CA ASP A 242 4.769 -18.577 5.843 1.00 0.00 C ATOM 1023 C ASP A 242 6.222 -18.521 6.310 1.00 0.00 C ATOM 1024 O ASP A 242 6.543 -17.838 7.284 1.00 0.00 O ATOM 1025 CB ASP A 242 4.430 -19.988 5.347 1.00 0.00 C ATOM 1026 CG ASP A 242 4.514 -21.026 6.440 1.00 0.00 C ATOM 1027 OD1 ASP A 242 4.569 -20.645 7.624 1.00 0.00 O ATOM 1028 OD2 ASP A 242 4.507 -22.229 6.114 1.00 0.00 O ATOM 0 H ASP A 242 3.753 -16.917 5.071 1.00 0.00 H new ATOM 0 HA ASP A 242 4.138 -18.337 6.698 1.00 0.00 H new ATOM 0 HB2 ASP A 242 3.424 -19.989 4.927 1.00 0.00 H new ATOM 0 HB3 ASP A 242 5.112 -20.259 4.541 1.00 0.00 H new ATOM 1033 N GLN A 243 7.089 -19.262 5.626 1.00 0.00 N ATOM 1034 CA GLN A 243 8.500 -19.319 5.979 1.00 0.00 C ATOM 1035 C GLN A 243 9.218 -18.011 5.647 1.00 0.00 C ATOM 1036 O GLN A 243 9.788 -17.852 4.566 1.00 0.00 O ATOM 1037 CB GLN A 243 9.186 -20.485 5.268 1.00 0.00 C ATOM 1038 CG GLN A 243 10.584 -20.770 5.788 1.00 0.00 C ATOM 1039 CD GLN A 243 11.297 -21.827 4.974 1.00 0.00 C ATOM 1040 OE1 GLN A 243 10.829 -22.960 4.858 1.00 0.00 O ATOM 1041 NE2 GLN A 243 12.432 -21.464 4.400 1.00 0.00 N ATOM 0 H GLN A 243 6.835 -19.833 4.820 1.00 0.00 H new ATOM 0 HA GLN A 243 8.559 -19.473 7.056 1.00 0.00 H new ATOM 0 HB2 GLN A 243 8.575 -21.380 5.381 1.00 0.00 H new ATOM 0 HB3 GLN A 243 9.240 -20.269 4.201 1.00 0.00 H new ATOM 0 HG2 GLN A 243 11.168 -19.850 5.775 1.00 0.00 H new ATOM 0 HG3 GLN A 243 10.523 -21.095 6.827 1.00 0.00 H new ATOM 0 HE21 GLN A 243 12.784 -20.515 4.522 1.00 0.00 H new ATOM 0 HE22 GLN A 243 12.955 -22.133 3.835 1.00 0.00 H new ATOM 1050 N TYR A 244 9.200 -17.100 6.603 1.00 0.00 N ATOM 1051 CA TYR A 244 9.858 -15.809 6.472 1.00 0.00 C ATOM 1052 C TYR A 244 10.558 -15.492 7.782 1.00 0.00 C ATOM 1053 O TYR A 244 9.955 -14.909 8.686 1.00 0.00 O ATOM 1054 CB TYR A 244 8.847 -14.706 6.135 1.00 0.00 C ATOM 1055 CG TYR A 244 8.902 -14.226 4.700 1.00 0.00 C ATOM 1056 CD1 TYR A 244 8.637 -15.085 3.643 1.00 0.00 C ATOM 1057 CD2 TYR A 244 9.218 -12.905 4.410 1.00 0.00 C ATOM 1058 CE1 TYR A 244 8.684 -14.642 2.336 1.00 0.00 C ATOM 1059 CE2 TYR A 244 9.268 -12.456 3.105 1.00 0.00 C ATOM 1060 CZ TYR A 244 9.001 -13.328 2.073 1.00 0.00 C ATOM 1061 OH TYR A 244 9.049 -12.884 0.772 1.00 0.00 O ATOM 0 H TYR A 244 8.727 -17.234 7.497 1.00 0.00 H new ATOM 0 HA TYR A 244 10.581 -15.854 5.658 1.00 0.00 H new ATOM 0 HB2 TYR A 244 7.843 -15.074 6.344 1.00 0.00 H new ATOM 0 HB3 TYR A 244 9.020 -13.857 6.796 1.00 0.00 H new ATOM 0 HD1 TYR A 244 8.390 -16.117 3.846 1.00 0.00 H new ATOM 0 HD2 TYR A 244 9.428 -12.219 5.217 1.00 0.00 H new ATOM 0 HE1 TYR A 244 8.473 -15.323 1.524 1.00 0.00 H new ATOM 0 HE2 TYR A 244 9.515 -11.426 2.895 1.00 0.00 H new ATOM 0 HH TYR A 244 9.286 -11.933 0.759 1.00 0.00 H new ATOM 1071 N ASP A 245 11.814 -15.909 7.901 1.00 0.00 N ATOM 1072 CA ASP A 245 12.584 -15.696 9.123 1.00 0.00 C ATOM 1073 C ASP A 245 12.991 -14.235 9.269 1.00 0.00 C ATOM 1074 O ASP A 245 13.564 -13.683 8.314 1.00 0.00 O ATOM 1075 CB ASP A 245 13.828 -16.591 9.144 1.00 0.00 C ATOM 1076 CG ASP A 245 13.491 -18.069 9.183 1.00 0.00 C ATOM 1077 OD1 ASP A 245 12.891 -18.574 8.211 1.00 0.00 O ATOM 1078 OD2 ASP A 245 13.827 -18.727 10.185 1.00 0.00 O ATOM 1079 OXT ASP A 245 12.735 -13.653 10.340 1.00 0.00 O ATOM 0 H ASP A 245 12.322 -16.398 7.164 1.00 0.00 H new ATOM 0 HA ASP A 245 11.945 -15.961 9.966 1.00 0.00 H new ATOM 0 HB2 ASP A 245 14.433 -16.385 8.261 1.00 0.00 H new ATOM 0 HB3 ASP A 245 14.436 -16.339 10.013 1.00 0.00 H new TER 1084 ASP A 245