USER MOD reduce.3.24.130724 H: found=0, std=0, add=693, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 695 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 37 TYR OH : rot 72:sc= 0.949 USER MOD Set 1.2: A 57 SER OG : rot 63:sc= 1.99! USER MOD Set 2.1: A 18 THR OG1 : rot 65:sc= 1.49 USER MOD Set 2.2: A 21 SER OG : rot 62:sc= -0.26 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot -65:sc= -3.21! USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= -0.482 USER MOD Single : A 33 THR OG1 : rot -60:sc= -1.95! USER MOD Single : A 40 THR OG1 : rot 180:sc= -0.933 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot 82:sc= -1.84! USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 TYR OH : rot 180:sc= 0.209 USER MOD Single : A 76 SER OG : rot 180:sc= -0.559 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -0.0182 K(o=-0.018,f=-1) USER MOD Single : B 208 SER OG : rot 180:sc= 0 USER MOD Single : B 210 THR OG1 : rot -57:sc= 0.948 USER MOD Single : B 213 ASN : amide:sc= -0.952 K(o=-0.95,f=-2.9!) USER MOD Single : B 215 LYS NZ :NH3+ 141:sc= -1.96 (180deg=-4.14!) USER MOD Single : B 217 THR OG1 : rot 180:sc= 0 USER MOD Single : B 219 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 114 N ASP A 11 0.322 0.603 -9.081 1.00 0.00 N ATOM 115 CA ASP A 11 0.325 0.078 -10.443 1.00 0.00 C ATOM 116 C ASP A 11 0.742 -1.393 -10.457 1.00 0.00 C ATOM 117 O ASP A 11 1.511 -1.841 -9.606 1.00 0.00 O ATOM 118 CB ASP A 11 1.285 0.895 -11.314 1.00 0.00 C ATOM 119 CG ASP A 11 0.706 2.283 -11.563 1.00 0.00 C ATOM 120 OD1 ASP A 11 -0.472 2.468 -11.306 1.00 0.00 O ATOM 121 OD2 ASP A 11 1.449 3.141 -12.009 1.00 0.00 O ATOM 0 HA ASP A 11 -0.686 0.156 -10.843 1.00 0.00 H new ATOM 0 HB2 ASP A 11 2.254 0.979 -10.822 1.00 0.00 H new ATOM 0 HB3 ASP A 11 1.452 0.385 -12.263 1.00 0.00 H new ATOM 126 N LEU A 12 0.231 -2.131 -11.437 1.00 0.00 N ATOM 127 CA LEU A 12 0.550 -3.552 -11.573 1.00 0.00 C ATOM 128 C LEU A 12 1.951 -3.726 -12.144 1.00 0.00 C ATOM 129 O LEU A 12 2.447 -2.859 -12.863 1.00 0.00 O ATOM 130 CB LEU A 12 -0.474 -4.243 -12.483 1.00 0.00 C ATOM 131 CG LEU A 12 -0.208 -5.780 -12.535 1.00 0.00 C ATOM 132 CD1 LEU A 12 -1.538 -6.544 -12.527 1.00 0.00 C ATOM 133 CD2 LEU A 12 0.552 -6.145 -13.819 1.00 0.00 C ATOM 0 H LEU A 12 -0.405 -1.772 -12.149 1.00 0.00 H new ATOM 0 HA LEU A 12 0.511 -4.011 -10.585 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -1.482 -4.055 -12.115 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -0.418 -3.824 -13.488 1.00 0.00 H new ATOM 0 HG LEU A 12 0.386 -6.053 -11.663 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.342 -7.616 -12.564 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -2.089 -6.307 -11.617 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -2.130 -6.254 -13.395 1.00 0.00 H new ATOM 0 HD21 LEU A 12 0.731 -7.220 -13.843 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -0.041 -5.857 -14.687 1.00 0.00 H new ATOM 0 HD23 LEU A 12 1.506 -5.618 -13.840 1.00 0.00 H new ATOM 145 N SER A 13 2.583 -4.864 -11.842 1.00 0.00 N ATOM 146 CA SER A 13 3.922 -5.148 -12.356 1.00 0.00 C ATOM 147 C SER A 13 4.034 -6.613 -12.751 1.00 0.00 C ATOM 148 O SER A 13 3.349 -7.473 -12.201 1.00 0.00 O ATOM 149 CB SER A 13 4.981 -4.831 -11.308 1.00 0.00 C ATOM 150 OG SER A 13 5.073 -5.915 -10.391 1.00 0.00 O ATOM 0 H SER A 13 2.192 -5.596 -11.250 1.00 0.00 H new ATOM 0 HA SER A 13 4.087 -4.519 -13.231 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.945 -4.662 -11.788 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.723 -3.913 -10.780 1.00 0.00 H new ATOM 0 HG SER A 13 5.755 -5.715 -9.716 1.00 0.00 H new ATOM 156 N PHE A 14 4.897 -6.883 -13.723 1.00 0.00 N ATOM 157 CA PHE A 14 5.101 -8.242 -14.222 1.00 0.00 C ATOM 158 C PHE A 14 6.483 -8.752 -13.846 1.00 0.00 C ATOM 159 O PHE A 14 7.435 -7.978 -13.764 1.00 0.00 O ATOM 160 CB PHE A 14 4.965 -8.221 -15.735 1.00 0.00 C ATOM 161 CG PHE A 14 3.697 -7.495 -16.090 1.00 0.00 C ATOM 162 CD1 PHE A 14 3.672 -6.097 -16.049 1.00 0.00 C ATOM 163 CD2 PHE A 14 2.551 -8.209 -16.464 1.00 0.00 C ATOM 164 CE1 PHE A 14 2.502 -5.408 -16.387 1.00 0.00 C ATOM 165 CE2 PHE A 14 1.382 -7.519 -16.806 1.00 0.00 C ATOM 166 CZ PHE A 14 1.360 -6.119 -16.770 1.00 0.00 C ATOM 0 H PHE A 14 5.470 -6.177 -14.185 1.00 0.00 H new ATOM 0 HA PHE A 14 4.359 -8.905 -13.778 1.00 0.00 H new ATOM 0 HB2 PHE A 14 5.824 -7.725 -16.186 1.00 0.00 H new ATOM 0 HB3 PHE A 14 4.942 -9.238 -16.127 1.00 0.00 H new ATOM 0 HD1 PHE A 14 4.556 -5.549 -15.756 1.00 0.00 H new ATOM 0 HD2 PHE A 14 2.569 -9.289 -16.488 1.00 0.00 H new ATOM 0 HE1 PHE A 14 2.481 -4.329 -16.352 1.00 0.00 H new ATOM 0 HE2 PHE A 14 0.498 -8.066 -17.097 1.00 0.00 H new ATOM 0 HZ PHE A 14 0.459 -5.587 -17.039 1.00 0.00 H new ATOM 176 N VAL A 15 6.595 -10.060 -13.632 1.00 0.00 N ATOM 177 CA VAL A 15 7.880 -10.659 -13.283 1.00 0.00 C ATOM 178 C VAL A 15 7.969 -12.078 -13.833 1.00 0.00 C ATOM 179 O VAL A 15 6.955 -12.728 -14.071 1.00 0.00 O ATOM 180 CB VAL A 15 8.051 -10.684 -11.766 1.00 0.00 C ATOM 181 CG1 VAL A 15 8.159 -9.249 -11.239 1.00 0.00 C ATOM 182 CG2 VAL A 15 6.842 -11.368 -11.129 1.00 0.00 C ATOM 0 H VAL A 15 5.820 -10.720 -13.693 1.00 0.00 H new ATOM 0 HA VAL A 15 8.675 -10.058 -13.724 1.00 0.00 H new ATOM 0 HB VAL A 15 8.957 -11.234 -11.513 1.00 0.00 H new ATOM 0 HG11 VAL A 15 8.281 -9.267 -10.156 1.00 0.00 H new ATOM 0 HG12 VAL A 15 9.020 -8.759 -11.693 1.00 0.00 H new ATOM 0 HG13 VAL A 15 7.253 -8.699 -11.493 1.00 0.00 H new ATOM 0 HG21 VAL A 15 6.963 -11.386 -10.046 1.00 0.00 H new ATOM 0 HG22 VAL A 15 5.936 -10.817 -11.384 1.00 0.00 H new ATOM 0 HG23 VAL A 15 6.763 -12.389 -11.503 1.00 0.00 H new ATOM 192 N ASP A 16 9.194 -12.537 -14.036 1.00 0.00 N ATOM 193 CA ASP A 16 9.426 -13.879 -14.560 1.00 0.00 C ATOM 194 C ASP A 16 8.842 -14.024 -15.965 1.00 0.00 C ATOM 195 O ASP A 16 8.434 -15.114 -16.368 1.00 0.00 O ATOM 196 CB ASP A 16 8.794 -14.919 -13.630 1.00 0.00 C ATOM 197 CG ASP A 16 9.346 -16.305 -13.942 1.00 0.00 C ATOM 198 OD1 ASP A 16 10.073 -16.427 -14.910 1.00 0.00 O ATOM 199 OD2 ASP A 16 9.031 -17.226 -13.204 1.00 0.00 O ATOM 0 H ASP A 16 10.043 -12.004 -13.847 1.00 0.00 H new ATOM 0 HA ASP A 16 10.502 -14.044 -14.613 1.00 0.00 H new ATOM 0 HB2 ASP A 16 9.000 -14.662 -12.591 1.00 0.00 H new ATOM 0 HB3 ASP A 16 7.711 -14.915 -13.750 1.00 0.00 H new ATOM 204 N ILE A 17 8.806 -12.921 -16.705 1.00 0.00 N ATOM 205 CA ILE A 17 8.275 -12.942 -18.065 1.00 0.00 C ATOM 206 C ILE A 17 9.037 -13.972 -18.899 1.00 0.00 C ATOM 207 O ILE A 17 10.267 -14.004 -18.883 1.00 0.00 O ATOM 208 CB ILE A 17 8.410 -11.553 -18.693 1.00 0.00 C ATOM 209 CG1 ILE A 17 7.392 -10.620 -18.039 1.00 0.00 C ATOM 210 CG2 ILE A 17 8.148 -11.624 -20.205 1.00 0.00 C ATOM 211 CD1 ILE A 17 7.642 -9.168 -18.476 1.00 0.00 C ATOM 0 H ILE A 17 9.135 -12.008 -16.390 1.00 0.00 H new ATOM 0 HA ILE A 17 7.221 -13.217 -18.038 1.00 0.00 H new ATOM 0 HB ILE A 17 9.421 -11.178 -18.534 1.00 0.00 H new ATOM 0 HG12 ILE A 17 6.382 -10.922 -18.316 1.00 0.00 H new ATOM 0 HG13 ILE A 17 7.462 -10.698 -16.954 1.00 0.00 H new ATOM 0 HG21 ILE A 17 8.247 -10.629 -20.639 1.00 0.00 H new ATOM 0 HG22 ILE A 17 8.871 -12.296 -20.668 1.00 0.00 H new ATOM 0 HG23 ILE A 17 7.140 -11.998 -20.382 1.00 0.00 H new ATOM 0 HD11 ILE A 17 6.909 -8.514 -18.003 1.00 0.00 H new ATOM 0 HD12 ILE A 17 8.645 -8.866 -18.177 1.00 0.00 H new ATOM 0 HD13 ILE A 17 7.549 -9.093 -19.559 1.00 0.00 H new ATOM 223 N THR A 18 8.298 -14.815 -19.618 1.00 0.00 N ATOM 224 CA THR A 18 8.906 -15.859 -20.455 1.00 0.00 C ATOM 225 C THR A 18 8.278 -15.852 -21.849 1.00 0.00 C ATOM 226 O THR A 18 7.539 -14.930 -22.197 1.00 0.00 O ATOM 227 CB THR A 18 8.717 -17.243 -19.787 1.00 0.00 C ATOM 228 OG1 THR A 18 8.493 -17.060 -18.396 1.00 0.00 O ATOM 229 CG2 THR A 18 9.966 -18.112 -19.982 1.00 0.00 C ATOM 0 H THR A 18 7.278 -14.799 -19.641 1.00 0.00 H new ATOM 0 HA THR A 18 9.972 -15.657 -20.555 1.00 0.00 H new ATOM 0 HB THR A 18 7.865 -17.742 -20.247 1.00 0.00 H new ATOM 0 HG1 THR A 18 7.648 -16.582 -18.261 1.00 0.00 H new ATOM 0 HG21 THR A 18 9.814 -19.080 -19.505 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.146 -18.256 -21.047 1.00 0.00 H new ATOM 0 HG23 THR A 18 10.827 -17.618 -19.532 1.00 0.00 H new ATOM 237 N ASP A 19 8.565 -16.887 -22.637 1.00 0.00 N ATOM 238 CA ASP A 19 8.003 -16.982 -23.981 1.00 0.00 C ATOM 239 C ASP A 19 6.562 -17.468 -23.935 1.00 0.00 C ATOM 240 O ASP A 19 5.691 -16.889 -24.582 1.00 0.00 O ATOM 241 CB ASP A 19 8.812 -17.950 -24.843 1.00 0.00 C ATOM 242 CG ASP A 19 8.992 -19.273 -24.104 1.00 0.00 C ATOM 243 OD1 ASP A 19 8.655 -19.323 -22.932 1.00 0.00 O ATOM 244 OD2 ASP A 19 9.468 -20.212 -24.717 1.00 0.00 O ATOM 0 H ASP A 19 9.175 -17.661 -22.372 1.00 0.00 H new ATOM 0 HA ASP A 19 8.040 -15.983 -24.416 1.00 0.00 H new ATOM 0 HB2 ASP A 19 8.303 -18.119 -25.792 1.00 0.00 H new ATOM 0 HB3 ASP A 19 9.785 -17.518 -25.076 1.00 0.00 H new ATOM 249 N SER A 20 6.309 -18.548 -23.187 1.00 0.00 N ATOM 250 CA SER A 20 4.967 -19.120 -23.086 1.00 0.00 C ATOM 251 C SER A 20 4.489 -19.125 -21.635 1.00 0.00 C ATOM 252 O SER A 20 3.497 -19.775 -21.306 1.00 0.00 O ATOM 253 CB SER A 20 5.006 -20.560 -23.597 1.00 0.00 C ATOM 254 OG SER A 20 3.763 -21.191 -23.322 1.00 0.00 O ATOM 0 H SER A 20 7.018 -19.041 -22.644 1.00 0.00 H new ATOM 0 HA SER A 20 4.281 -18.517 -23.681 1.00 0.00 H new ATOM 0 HB2 SER A 20 5.204 -20.572 -24.669 1.00 0.00 H new ATOM 0 HB3 SER A 20 5.818 -21.106 -23.117 1.00 0.00 H new ATOM 0 HG SER A 20 3.637 -21.257 -22.352 1.00 0.00 H new ATOM 260 N SER A 21 5.198 -18.404 -20.768 1.00 0.00 N ATOM 261 CA SER A 21 4.833 -18.338 -19.353 1.00 0.00 C ATOM 262 C SER A 21 5.174 -16.965 -18.788 1.00 0.00 C ATOM 263 O SER A 21 6.281 -16.460 -18.981 1.00 0.00 O ATOM 264 CB SER A 21 5.577 -19.419 -18.567 1.00 0.00 C ATOM 265 OG SER A 21 6.975 -19.182 -18.635 1.00 0.00 O ATOM 0 H SER A 21 6.024 -17.860 -21.018 1.00 0.00 H new ATOM 0 HA SER A 21 3.760 -18.505 -19.261 1.00 0.00 H new ATOM 0 HB2 SER A 21 5.248 -19.418 -17.528 1.00 0.00 H new ATOM 0 HB3 SER A 21 5.345 -20.403 -18.974 1.00 0.00 H new ATOM 0 HG SER A 21 7.181 -18.320 -18.218 1.00 0.00 H new ATOM 271 N ILE A 22 4.213 -16.361 -18.095 1.00 0.00 N ATOM 272 CA ILE A 22 4.400 -15.036 -17.501 1.00 0.00 C ATOM 273 C ILE A 22 4.038 -15.073 -16.017 1.00 0.00 C ATOM 274 O ILE A 22 3.091 -15.750 -15.615 1.00 0.00 O ATOM 275 CB ILE A 22 3.520 -14.015 -18.244 1.00 0.00 C ATOM 276 CG1 ILE A 22 2.035 -14.409 -18.141 1.00 0.00 C ATOM 277 CG2 ILE A 22 3.930 -13.987 -19.723 1.00 0.00 C ATOM 278 CD1 ILE A 22 1.165 -13.279 -18.700 1.00 0.00 C ATOM 0 H ILE A 22 3.293 -16.768 -17.929 1.00 0.00 H new ATOM 0 HA ILE A 22 5.445 -14.739 -17.593 1.00 0.00 H new ATOM 0 HB ILE A 22 3.657 -13.032 -17.793 1.00 0.00 H new ATOM 0 HG12 ILE A 22 1.853 -15.330 -18.695 1.00 0.00 H new ATOM 0 HG13 ILE A 22 1.771 -14.605 -17.102 1.00 0.00 H new ATOM 0 HG21 ILE A 22 3.312 -13.266 -20.258 1.00 0.00 H new ATOM 0 HG22 ILE A 22 4.978 -13.698 -19.805 1.00 0.00 H new ATOM 0 HG23 ILE A 22 3.792 -14.977 -20.158 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.114 -13.559 -18.627 1.00 0.00 H new ATOM 0 HD12 ILE A 22 1.339 -12.368 -18.127 1.00 0.00 H new ATOM 0 HD13 ILE A 22 1.422 -13.105 -19.745 1.00 0.00 H new ATOM 290 N GLY A 23 4.796 -14.346 -15.203 1.00 0.00 N ATOM 291 CA GLY A 23 4.541 -14.305 -13.761 1.00 0.00 C ATOM 292 C GLY A 23 3.795 -13.032 -13.390 1.00 0.00 C ATOM 293 O GLY A 23 4.399 -12.046 -12.971 1.00 0.00 O ATOM 0 H GLY A 23 5.587 -13.780 -15.510 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.957 -15.176 -13.464 1.00 0.00 H new ATOM 0 HA3 GLY A 23 5.484 -14.353 -13.217 1.00 0.00 H new ATOM 297 N LEU A 24 2.476 -13.057 -13.553 1.00 0.00 N ATOM 298 CA LEU A 24 1.662 -11.891 -13.235 1.00 0.00 C ATOM 299 C LEU A 24 1.638 -11.668 -11.731 1.00 0.00 C ATOM 300 O LEU A 24 1.291 -12.568 -10.963 1.00 0.00 O ATOM 301 CB LEU A 24 0.230 -12.104 -13.751 1.00 0.00 C ATOM 302 CG LEU A 24 0.189 -11.962 -15.291 1.00 0.00 C ATOM 303 CD1 LEU A 24 -0.992 -12.760 -15.855 1.00 0.00 C ATOM 304 CD2 LEU A 24 0.012 -10.485 -15.684 1.00 0.00 C ATOM 0 H LEU A 24 1.954 -13.862 -13.899 1.00 0.00 H new ATOM 0 HA LEU A 24 2.093 -11.013 -13.717 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -0.126 -13.093 -13.460 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -0.441 -11.377 -13.294 1.00 0.00 H new ATOM 0 HG LEU A 24 1.127 -12.341 -15.697 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.016 -12.656 -16.940 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -0.878 -13.812 -15.593 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -1.922 -12.380 -15.433 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -0.015 -10.398 -16.770 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.921 -10.107 -15.266 1.00 0.00 H new ATOM 0 HD23 LEU A 24 0.847 -9.902 -15.294 1.00 0.00 H new ATOM 316 N ARG A 25 2.010 -10.461 -11.309 1.00 0.00 N ATOM 317 CA ARG A 25 2.032 -10.115 -9.887 1.00 0.00 C ATOM 318 C ARG A 25 1.523 -8.701 -9.665 1.00 0.00 C ATOM 319 O ARG A 25 1.776 -7.798 -10.463 1.00 0.00 O ATOM 320 CB ARG A 25 3.451 -10.265 -9.329 1.00 0.00 C ATOM 321 CG ARG A 25 3.475 -9.829 -7.861 1.00 0.00 C ATOM 322 CD ARG A 25 4.809 -10.234 -7.229 1.00 0.00 C ATOM 323 NE ARG A 25 4.980 -9.580 -5.938 1.00 0.00 N ATOM 324 CZ ARG A 25 5.996 -9.896 -5.138 1.00 0.00 C ATOM 325 NH1 ARG A 25 6.851 -10.813 -5.499 1.00 0.00 N ATOM 326 NH2 ARG A 25 6.135 -9.291 -3.990 1.00 0.00 N ATOM 0 H ARG A 25 2.300 -9.706 -11.930 1.00 0.00 H new ATOM 0 HA ARG A 25 1.370 -10.800 -9.357 1.00 0.00 H new ATOM 0 HB2 ARG A 25 3.779 -11.301 -9.417 1.00 0.00 H new ATOM 0 HB3 ARG A 25 4.147 -9.660 -9.910 1.00 0.00 H new ATOM 0 HG2 ARG A 25 3.339 -8.750 -7.789 1.00 0.00 H new ATOM 0 HG3 ARG A 25 2.649 -10.291 -7.320 1.00 0.00 H new ATOM 0 HD2 ARG A 25 4.845 -11.316 -7.103 1.00 0.00 H new ATOM 0 HD3 ARG A 25 5.630 -9.963 -7.893 1.00 0.00 H new ATOM 0 HE ARG A 25 4.311 -8.869 -5.643 1.00 0.00 H new ATOM 0 HH11 ARG A 25 6.741 -11.288 -6.395 1.00 0.00 H new ATOM 0 HH12 ARG A 25 7.629 -11.055 -4.885 1.00 0.00 H new ATOM 0 HH21 ARG A 25 5.465 -8.576 -3.706 1.00 0.00 H new ATOM 0 HH22 ARG A 25 6.913 -9.533 -3.377 1.00 0.00 H new ATOM 340 N TRP A 26 0.793 -8.522 -8.571 1.00 0.00 N ATOM 341 CA TRP A 26 0.222 -7.227 -8.216 1.00 0.00 C ATOM 342 C TRP A 26 0.274 -7.038 -6.705 1.00 0.00 C ATOM 343 O TRP A 26 0.378 -8.012 -5.962 1.00 0.00 O ATOM 344 CB TRP A 26 -1.225 -7.143 -8.712 1.00 0.00 C ATOM 345 CG TRP A 26 -2.079 -8.098 -7.938 1.00 0.00 C ATOM 346 CD1 TRP A 26 -2.485 -7.922 -6.658 1.00 0.00 C ATOM 347 CD2 TRP A 26 -2.634 -9.373 -8.372 1.00 0.00 C ATOM 348 NE1 TRP A 26 -3.256 -9.005 -6.280 1.00 0.00 N ATOM 349 CE2 TRP A 26 -3.377 -9.927 -7.301 1.00 0.00 C ATOM 350 CE3 TRP A 26 -2.569 -10.095 -9.576 1.00 0.00 C ATOM 351 CZ2 TRP A 26 -4.031 -11.155 -7.424 1.00 0.00 C ATOM 352 CZ3 TRP A 26 -3.225 -11.329 -9.702 1.00 0.00 C ATOM 353 CH2 TRP A 26 -3.956 -11.857 -8.629 1.00 0.00 C ATOM 0 H TRP A 26 0.580 -9.266 -7.907 1.00 0.00 H new ATOM 0 HA TRP A 26 0.802 -6.435 -8.690 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -1.601 -6.127 -8.595 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -1.270 -7.379 -9.775 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -2.245 -7.074 -6.034 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -3.683 -9.110 -5.360 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -2.010 -9.697 -10.410 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -4.591 -11.559 -6.593 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -3.166 -11.875 -10.632 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -4.461 -12.806 -8.734 1.00 0.00 H new ATOM 364 N THR A 27 0.223 -5.785 -6.257 1.00 0.00 N ATOM 365 CA THR A 27 0.279 -5.472 -4.825 1.00 0.00 C ATOM 366 C THR A 27 -1.114 -5.121 -4.282 1.00 0.00 C ATOM 367 O THR A 27 -1.592 -4.008 -4.507 1.00 0.00 O ATOM 368 CB THR A 27 1.191 -4.263 -4.609 1.00 0.00 C ATOM 369 OG1 THR A 27 2.342 -4.389 -5.431 1.00 0.00 O ATOM 370 CG2 THR A 27 1.613 -4.186 -3.139 1.00 0.00 C ATOM 0 H THR A 27 0.143 -4.968 -6.863 1.00 0.00 H new ATOM 0 HA THR A 27 0.659 -6.349 -4.301 1.00 0.00 H new ATOM 0 HB THR A 27 0.653 -3.353 -4.873 1.00 0.00 H new ATOM 0 HG1 THR A 27 2.927 -3.615 -5.296 1.00 0.00 H new ATOM 0 HG21 THR A 27 2.262 -3.323 -2.992 1.00 0.00 H new ATOM 0 HG22 THR A 27 0.728 -4.085 -2.511 1.00 0.00 H new ATOM 0 HG23 THR A 27 2.150 -5.095 -2.866 1.00 0.00 H new ATOM 378 N PRO A 28 -1.771 -6.000 -3.563 1.00 0.00 N ATOM 379 CA PRO A 28 -3.114 -5.696 -2.993 1.00 0.00 C ATOM 380 C PRO A 28 -3.129 -4.429 -2.133 1.00 0.00 C ATOM 381 O PRO A 28 -2.115 -4.029 -1.557 1.00 0.00 O ATOM 382 CB PRO A 28 -3.483 -6.946 -2.172 1.00 0.00 C ATOM 383 CG PRO A 28 -2.629 -8.041 -2.729 1.00 0.00 C ATOM 384 CD PRO A 28 -1.345 -7.371 -3.224 1.00 0.00 C ATOM 0 HA PRO A 28 -3.836 -5.488 -3.782 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -3.287 -6.793 -1.111 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -4.542 -7.183 -2.269 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -2.409 -8.789 -1.967 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -3.138 -8.556 -3.544 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.572 -7.371 -2.456 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -0.933 -7.888 -4.091 1.00 0.00 H new ATOM 392 N LEU A 29 -4.306 -3.813 -2.058 1.00 0.00 N ATOM 393 CA LEU A 29 -4.500 -2.591 -1.272 1.00 0.00 C ATOM 394 C LEU A 29 -5.162 -2.900 0.057 1.00 0.00 C ATOM 395 O LEU A 29 -6.149 -3.629 0.139 1.00 0.00 O ATOM 396 CB LEU A 29 -5.372 -1.596 -2.042 1.00 0.00 C ATOM 397 CG LEU A 29 -4.751 -1.314 -3.412 1.00 0.00 C ATOM 398 CD1 LEU A 29 -5.654 -0.357 -4.193 1.00 0.00 C ATOM 399 CD2 LEU A 29 -3.359 -0.690 -3.225 1.00 0.00 C ATOM 0 H LEU A 29 -5.147 -4.140 -2.534 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.518 -2.155 -1.089 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -6.378 -1.998 -2.164 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -5.466 -0.668 -1.477 1.00 0.00 H new ATOM 0 HG LEU A 29 -4.652 -2.246 -3.969 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -5.213 -0.155 -5.169 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -6.636 -0.810 -4.326 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -5.757 0.577 -3.641 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.916 -0.489 -4.201 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -3.450 0.243 -2.669 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -2.722 -1.381 -2.673 1.00 0.00 H new ATOM 411 N ASN A 30 -4.599 -2.326 1.098 1.00 0.00 N ATOM 412 CA ASN A 30 -5.113 -2.516 2.435 1.00 0.00 C ATOM 413 C ASN A 30 -6.633 -2.386 2.440 1.00 0.00 C ATOM 414 O ASN A 30 -7.321 -3.026 3.233 1.00 0.00 O ATOM 415 CB ASN A 30 -4.494 -1.461 3.334 1.00 0.00 C ATOM 416 CG ASN A 30 -5.038 -1.592 4.753 1.00 0.00 C ATOM 417 OD1 ASN A 30 -6.065 -0.995 5.083 1.00 0.00 O ATOM 418 ND2 ASN A 30 -4.414 -2.344 5.618 1.00 0.00 N ATOM 0 H ASN A 30 -3.780 -1.720 1.042 1.00 0.00 H new ATOM 0 HA ASN A 30 -4.858 -3.513 2.796 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -3.409 -1.570 3.341 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -4.712 -0.467 2.944 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -4.776 -2.438 6.567 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -3.564 -2.838 5.345 1.00 0.00 H new ATOM 425 N SER A 31 -7.147 -1.561 1.530 1.00 0.00 N ATOM 426 CA SER A 31 -8.587 -1.362 1.412 1.00 0.00 C ATOM 427 C SER A 31 -9.196 -2.379 0.448 1.00 0.00 C ATOM 428 O SER A 31 -10.368 -2.735 0.571 1.00 0.00 O ATOM 429 CB SER A 31 -8.882 0.052 0.910 1.00 0.00 C ATOM 430 OG SER A 31 -8.378 0.997 1.846 1.00 0.00 O ATOM 0 H SER A 31 -6.589 -1.022 0.867 1.00 0.00 H new ATOM 0 HA SER A 31 -9.031 -1.500 2.398 1.00 0.00 H new ATOM 0 HB2 SER A 31 -8.421 0.208 -0.065 1.00 0.00 H new ATOM 0 HB3 SER A 31 -9.956 0.188 0.781 1.00 0.00 H new ATOM 0 HG SER A 31 -8.564 1.905 1.527 1.00 0.00 H new ATOM 436 N SER A 32 -8.395 -2.853 -0.511 1.00 0.00 N ATOM 437 CA SER A 32 -8.895 -3.832 -1.475 1.00 0.00 C ATOM 438 C SER A 32 -9.444 -5.055 -0.749 1.00 0.00 C ATOM 439 O SER A 32 -8.742 -5.723 0.010 1.00 0.00 O ATOM 440 CB SER A 32 -7.783 -4.251 -2.458 1.00 0.00 C ATOM 441 OG SER A 32 -7.733 -3.318 -3.530 1.00 0.00 O ATOM 0 H SER A 32 -7.420 -2.581 -0.638 1.00 0.00 H new ATOM 0 HA SER A 32 -9.700 -3.369 -2.046 1.00 0.00 H new ATOM 0 HB2 SER A 32 -6.822 -4.286 -1.945 1.00 0.00 H new ATOM 0 HB3 SER A 32 -7.977 -5.253 -2.840 1.00 0.00 H new ATOM 0 HG SER A 32 -7.027 -3.578 -4.157 1.00 0.00 H new ATOM 447 N THR A 33 -10.718 -5.316 -0.985 1.00 0.00 N ATOM 448 CA THR A 33 -11.393 -6.439 -0.351 1.00 0.00 C ATOM 449 C THR A 33 -10.599 -7.718 -0.590 1.00 0.00 C ATOM 450 O THR A 33 -9.943 -7.868 -1.621 1.00 0.00 O ATOM 451 CB THR A 33 -12.800 -6.588 -0.919 1.00 0.00 C ATOM 452 OG1 THR A 33 -13.403 -5.311 -1.000 1.00 0.00 O ATOM 453 CG2 THR A 33 -13.634 -7.496 -0.013 1.00 0.00 C ATOM 0 H THR A 33 -11.307 -4.767 -1.611 1.00 0.00 H new ATOM 0 HA THR A 33 -11.462 -6.255 0.721 1.00 0.00 H new ATOM 0 HB THR A 33 -12.747 -7.034 -1.912 1.00 0.00 H new ATOM 0 HG1 THR A 33 -13.451 -4.914 -0.105 1.00 0.00 H new ATOM 0 HG21 THR A 33 -14.638 -7.598 -0.425 1.00 0.00 H new ATOM 0 HG22 THR A 33 -13.165 -8.478 0.048 1.00 0.00 H new ATOM 0 HG23 THR A 33 -13.694 -7.060 0.984 1.00 0.00 H new ATOM 461 N ILE A 34 -10.639 -8.629 0.379 1.00 0.00 N ATOM 462 CA ILE A 34 -9.892 -9.880 0.271 1.00 0.00 C ATOM 463 C ILE A 34 -10.760 -10.981 -0.322 1.00 0.00 C ATOM 464 O ILE A 34 -11.477 -11.676 0.398 1.00 0.00 O ATOM 465 CB ILE A 34 -9.417 -10.310 1.660 1.00 0.00 C ATOM 466 CG1 ILE A 34 -8.743 -9.125 2.367 1.00 0.00 C ATOM 467 CG2 ILE A 34 -8.424 -11.466 1.529 1.00 0.00 C ATOM 468 CD1 ILE A 34 -7.651 -8.520 1.476 1.00 0.00 C ATOM 0 H ILE A 34 -11.175 -8.527 1.241 1.00 0.00 H new ATOM 0 HA ILE A 34 -9.038 -9.716 -0.386 1.00 0.00 H new ATOM 0 HB ILE A 34 -10.274 -10.637 2.248 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.487 -8.366 2.607 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.309 -9.456 3.311 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -8.087 -11.770 2.520 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -8.909 -12.308 1.036 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -7.567 -11.144 0.937 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.183 -7.681 1.992 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.898 -9.277 1.258 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -8.094 -8.171 0.544 1.00 0.00 H new ATOM 480 N ILE A 35 -10.680 -11.138 -1.641 1.00 0.00 N ATOM 481 CA ILE A 35 -11.450 -12.164 -2.337 1.00 0.00 C ATOM 482 C ILE A 35 -10.715 -12.611 -3.591 1.00 0.00 C ATOM 483 O ILE A 35 -10.258 -11.787 -4.382 1.00 0.00 O ATOM 484 CB ILE A 35 -12.836 -11.625 -2.691 1.00 0.00 C ATOM 485 CG1 ILE A 35 -12.702 -10.334 -3.513 1.00 0.00 C ATOM 486 CG2 ILE A 35 -13.609 -11.329 -1.406 1.00 0.00 C ATOM 487 CD1 ILE A 35 -14.081 -9.670 -3.694 1.00 0.00 C ATOM 0 H ILE A 35 -10.090 -10.568 -2.248 1.00 0.00 H new ATOM 0 HA ILE A 35 -11.568 -13.026 -1.681 1.00 0.00 H new ATOM 0 HB ILE A 35 -13.370 -12.371 -3.279 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -12.022 -9.645 -3.012 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -12.268 -10.559 -4.487 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -14.598 -10.944 -1.657 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -13.713 -12.245 -0.824 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -13.069 -10.586 -0.819 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -13.971 -8.756 -4.278 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -14.749 -10.356 -4.215 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -14.499 -9.428 -2.717 1.00 0.00 H new ATOM 499 N GLY A 36 -10.591 -13.921 -3.763 1.00 0.00 N ATOM 500 CA GLY A 36 -9.891 -14.463 -4.921 1.00 0.00 C ATOM 501 C GLY A 36 -10.475 -13.919 -6.219 1.00 0.00 C ATOM 502 O GLY A 36 -11.692 -13.847 -6.385 1.00 0.00 O ATOM 0 H GLY A 36 -10.962 -14.622 -3.122 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.832 -14.210 -4.861 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -9.960 -15.551 -4.915 1.00 0.00 H new ATOM 506 N TYR A 37 -9.589 -13.544 -7.140 1.00 0.00 N ATOM 507 CA TYR A 37 -10.010 -13.011 -8.433 1.00 0.00 C ATOM 508 C TYR A 37 -9.975 -14.115 -9.478 1.00 0.00 C ATOM 509 O TYR A 37 -9.620 -15.255 -9.177 1.00 0.00 O ATOM 510 CB TYR A 37 -9.079 -11.869 -8.865 1.00 0.00 C ATOM 511 CG TYR A 37 -8.721 -11.026 -7.662 1.00 0.00 C ATOM 512 CD1 TYR A 37 -9.731 -10.508 -6.844 1.00 0.00 C ATOM 513 CD2 TYR A 37 -7.375 -10.760 -7.364 1.00 0.00 C ATOM 514 CE1 TYR A 37 -9.401 -9.730 -5.732 1.00 0.00 C ATOM 515 CE2 TYR A 37 -7.047 -9.981 -6.249 1.00 0.00 C ATOM 516 CZ TYR A 37 -8.058 -9.466 -5.433 1.00 0.00 C ATOM 517 OH TYR A 37 -7.734 -8.697 -4.334 1.00 0.00 O ATOM 0 H TYR A 37 -8.578 -13.599 -7.015 1.00 0.00 H new ATOM 0 HA TYR A 37 -11.026 -12.627 -8.341 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -8.175 -12.275 -9.320 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -9.567 -11.254 -9.621 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -10.767 -10.710 -7.073 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -6.593 -11.156 -7.995 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -10.182 -9.331 -5.102 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -6.012 -9.777 -6.019 1.00 0.00 H new ATOM 0 HH TYR A 37 -7.898 -9.211 -3.516 1.00 0.00 H new ATOM 527 N ARG A 38 -10.338 -13.769 -10.709 1.00 0.00 N ATOM 528 CA ARG A 38 -10.341 -14.737 -11.802 1.00 0.00 C ATOM 529 C ARG A 38 -9.581 -14.189 -13.001 1.00 0.00 C ATOM 530 O ARG A 38 -9.888 -13.108 -13.505 1.00 0.00 O ATOM 531 CB ARG A 38 -11.782 -15.053 -12.213 1.00 0.00 C ATOM 532 CG ARG A 38 -11.791 -15.964 -13.472 1.00 0.00 C ATOM 533 CD ARG A 38 -12.127 -15.139 -14.726 1.00 0.00 C ATOM 534 NE ARG A 38 -13.449 -14.536 -14.594 1.00 0.00 N ATOM 535 CZ ARG A 38 -14.554 -15.229 -14.850 1.00 0.00 C ATOM 536 NH1 ARG A 38 -14.470 -16.474 -15.223 1.00 0.00 N ATOM 537 NH2 ARG A 38 -15.722 -14.662 -14.728 1.00 0.00 N ATOM 0 H ARG A 38 -10.633 -12.829 -10.975 1.00 0.00 H new ATOM 0 HA ARG A 38 -9.851 -15.648 -11.459 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -12.302 -15.548 -11.393 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -12.320 -14.128 -12.420 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -10.818 -16.440 -13.592 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -12.523 -16.762 -13.347 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -11.377 -14.361 -14.870 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -12.097 -15.778 -15.609 1.00 0.00 H new ATOM 0 HE ARG A 38 -13.527 -13.563 -14.299 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -13.556 -16.917 -15.319 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -15.318 -17.006 -15.419 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -15.788 -13.687 -14.436 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -16.570 -15.194 -14.924 1.00 0.00 H new ATOM 551 N ILE A 39 -8.589 -14.948 -13.458 1.00 0.00 N ATOM 552 CA ILE A 39 -7.782 -14.545 -14.608 1.00 0.00 C ATOM 553 C ILE A 39 -8.242 -15.301 -15.857 1.00 0.00 C ATOM 554 O ILE A 39 -8.206 -16.530 -15.906 1.00 0.00 O ATOM 555 CB ILE A 39 -6.299 -14.836 -14.318 1.00 0.00 C ATOM 556 CG1 ILE A 39 -6.031 -16.348 -14.461 1.00 0.00 C ATOM 557 CG2 ILE A 39 -5.954 -14.379 -12.888 1.00 0.00 C ATOM 558 CD1 ILE A 39 -4.742 -16.737 -13.746 1.00 0.00 C ATOM 0 H ILE A 39 -8.324 -15.845 -13.051 1.00 0.00 H new ATOM 0 HA ILE A 39 -7.906 -13.477 -14.786 1.00 0.00 H new ATOM 0 HB ILE A 39 -5.677 -14.292 -15.029 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -6.867 -16.911 -14.046 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -5.961 -16.612 -15.516 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -4.903 -14.586 -12.684 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -6.139 -13.309 -12.794 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -6.576 -14.919 -12.174 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -4.572 -17.808 -13.859 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -3.906 -16.189 -14.180 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -4.826 -16.493 -12.687 1.00 0.00 H new ATOM 570 N THR A 40 -8.705 -14.562 -16.856 1.00 0.00 N ATOM 571 CA THR A 40 -9.195 -15.171 -18.097 1.00 0.00 C ATOM 572 C THR A 40 -8.156 -15.037 -19.207 1.00 0.00 C ATOM 573 O THR A 40 -7.574 -13.969 -19.398 1.00 0.00 O ATOM 574 CB THR A 40 -10.501 -14.503 -18.527 1.00 0.00 C ATOM 575 OG1 THR A 40 -11.429 -14.541 -17.455 1.00 0.00 O ATOM 576 CG2 THR A 40 -11.083 -15.246 -19.731 1.00 0.00 C ATOM 0 H THR A 40 -8.754 -13.543 -16.837 1.00 0.00 H new ATOM 0 HA THR A 40 -9.376 -16.230 -17.914 1.00 0.00 H new ATOM 0 HB THR A 40 -10.304 -13.466 -18.800 1.00 0.00 H new ATOM 0 HG1 THR A 40 -12.265 -14.111 -17.731 1.00 0.00 H new ATOM 0 HG21 THR A 40 -12.014 -14.769 -20.037 1.00 0.00 H new ATOM 0 HG22 THR A 40 -10.371 -15.216 -20.556 1.00 0.00 H new ATOM 0 HG23 THR A 40 -11.279 -16.283 -19.459 1.00 0.00 H new ATOM 584 N VAL A 41 -7.921 -16.132 -19.934 1.00 0.00 N ATOM 585 CA VAL A 41 -6.940 -16.139 -21.028 1.00 0.00 C ATOM 586 C VAL A 41 -7.551 -16.746 -22.287 1.00 0.00 C ATOM 587 O VAL A 41 -8.336 -17.692 -22.209 1.00 0.00 O ATOM 588 CB VAL A 41 -5.696 -16.929 -20.604 1.00 0.00 C ATOM 589 CG1 VAL A 41 -6.122 -18.285 -20.022 1.00 0.00 C ATOM 590 CG2 VAL A 41 -4.759 -17.139 -21.815 1.00 0.00 C ATOM 0 H VAL A 41 -8.394 -17.024 -19.788 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.650 -15.112 -21.249 1.00 0.00 H new ATOM 0 HB VAL A 41 -5.157 -16.366 -19.842 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.237 -18.846 -19.721 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -6.762 -18.124 -19.155 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -6.670 -18.849 -20.777 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.879 -17.701 -21.501 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -5.286 -17.694 -22.591 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.450 -16.170 -22.208 1.00 0.00 H new ATOM 600 N VAL A 42 -7.184 -16.202 -23.456 1.00 0.00 N ATOM 601 CA VAL A 42 -7.706 -16.708 -24.727 1.00 0.00 C ATOM 602 C VAL A 42 -6.578 -16.862 -25.740 1.00 0.00 C ATOM 603 O VAL A 42 -5.743 -15.971 -25.896 1.00 0.00 O ATOM 604 CB VAL A 42 -8.775 -15.749 -25.269 1.00 0.00 C ATOM 605 CG1 VAL A 42 -9.101 -16.094 -26.728 1.00 0.00 C ATOM 606 CG2 VAL A 42 -10.045 -15.875 -24.423 1.00 0.00 C ATOM 0 H VAL A 42 -6.535 -15.420 -23.545 1.00 0.00 H new ATOM 0 HA VAL A 42 -8.156 -17.686 -24.558 1.00 0.00 H new ATOM 0 HB VAL A 42 -8.396 -14.728 -25.219 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -9.860 -15.408 -27.103 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -8.199 -16.003 -27.334 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -9.475 -17.116 -26.785 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -10.806 -15.195 -24.806 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -10.415 -16.899 -24.473 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -9.819 -15.621 -23.387 1.00 0.00 H new ATOM 616 N ALA A 43 -6.572 -17.993 -26.440 1.00 0.00 N ATOM 617 CA ALA A 43 -5.557 -18.258 -27.455 1.00 0.00 C ATOM 618 C ALA A 43 -6.110 -17.906 -28.833 1.00 0.00 C ATOM 619 O ALA A 43 -7.228 -18.294 -29.171 1.00 0.00 O ATOM 620 CB ALA A 43 -5.185 -19.741 -27.443 1.00 0.00 C ATOM 0 H ALA A 43 -7.257 -18.739 -26.323 1.00 0.00 H new ATOM 0 HA ALA A 43 -4.676 -17.654 -27.239 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -4.427 -19.932 -28.203 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -4.792 -20.010 -26.463 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -6.071 -20.340 -27.655 1.00 0.00 H new ATOM 626 N ALA A 44 -5.333 -17.184 -29.636 1.00 0.00 N ATOM 627 CA ALA A 44 -5.787 -16.816 -30.978 1.00 0.00 C ATOM 628 C ALA A 44 -5.382 -17.884 -31.996 1.00 0.00 C ATOM 629 O ALA A 44 -6.156 -18.226 -32.892 1.00 0.00 O ATOM 630 CB ALA A 44 -5.205 -15.462 -31.389 1.00 0.00 C ATOM 0 H ALA A 44 -4.403 -16.846 -29.389 1.00 0.00 H new ATOM 0 HA ALA A 44 -6.874 -16.743 -30.958 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -5.553 -15.205 -32.389 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -5.530 -14.697 -30.684 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -4.116 -15.518 -31.387 1.00 0.00 H new ATOM 636 N GLY A 45 -4.163 -18.405 -31.856 1.00 0.00 N ATOM 637 CA GLY A 45 -3.666 -19.429 -32.771 1.00 0.00 C ATOM 638 C GLY A 45 -4.196 -20.809 -32.402 1.00 0.00 C ATOM 639 O GLY A 45 -3.538 -21.821 -32.642 1.00 0.00 O ATOM 0 H GLY A 45 -3.507 -18.136 -31.123 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -3.964 -19.184 -33.790 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -2.576 -19.439 -32.751 1.00 0.00 H new ATOM 643 N GLU A 46 -5.393 -20.844 -31.824 1.00 0.00 N ATOM 644 CA GLU A 46 -6.016 -22.107 -31.426 1.00 0.00 C ATOM 645 C GLU A 46 -7.506 -22.079 -31.721 1.00 0.00 C ATOM 646 O GLU A 46 -8.153 -21.033 -31.632 1.00 0.00 O ATOM 647 CB GLU A 46 -5.812 -22.355 -29.931 1.00 0.00 C ATOM 648 CG GLU A 46 -4.325 -22.549 -29.626 1.00 0.00 C ATOM 649 CD GLU A 46 -3.808 -23.814 -30.304 1.00 0.00 C ATOM 650 OE1 GLU A 46 -4.623 -24.660 -30.635 1.00 0.00 O ATOM 651 OE2 GLU A 46 -2.606 -23.920 -30.483 1.00 0.00 O ATOM 0 H GLU A 46 -5.952 -20.015 -31.620 1.00 0.00 H new ATOM 0 HA GLU A 46 -5.546 -22.908 -31.996 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -6.201 -21.513 -29.359 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.372 -23.237 -29.621 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -3.759 -21.684 -29.973 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -4.173 -22.617 -28.549 1.00 0.00 H new ATOM 658 N GLY A 47 -8.045 -23.238 -32.067 1.00 0.00 N ATOM 659 CA GLY A 47 -9.463 -23.352 -32.370 1.00 0.00 C ATOM 660 C GLY A 47 -10.310 -23.185 -31.111 1.00 0.00 C ATOM 661 O GLY A 47 -11.499 -22.888 -31.194 1.00 0.00 O ATOM 0 H GLY A 47 -7.523 -24.111 -32.145 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -9.743 -22.596 -33.103 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -9.665 -24.324 -32.821 1.00 0.00 H new ATOM 665 N ILE A 48 -9.694 -23.388 -29.939 1.00 0.00 N ATOM 666 CA ILE A 48 -10.417 -23.265 -28.664 1.00 0.00 C ATOM 667 C ILE A 48 -9.572 -22.473 -27.641 1.00 0.00 C ATOM 668 O ILE A 48 -8.357 -22.646 -27.572 1.00 0.00 O ATOM 669 CB ILE A 48 -10.753 -24.697 -28.136 1.00 0.00 C ATOM 670 CG1 ILE A 48 -12.249 -24.986 -28.318 1.00 0.00 C ATOM 671 CG2 ILE A 48 -10.410 -24.864 -26.645 1.00 0.00 C ATOM 672 CD1 ILE A 48 -12.501 -26.488 -28.151 1.00 0.00 C ATOM 0 H ILE A 48 -8.709 -23.635 -29.846 1.00 0.00 H new ATOM 0 HA ILE A 48 -11.346 -22.715 -28.814 1.00 0.00 H new ATOM 0 HB ILE A 48 -10.147 -25.395 -28.714 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -12.831 -24.425 -27.587 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -12.577 -24.659 -29.305 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -10.661 -25.875 -26.325 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -9.344 -24.690 -26.495 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -10.981 -24.145 -26.058 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -13.563 -26.695 -28.280 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -11.931 -27.038 -28.899 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -12.189 -26.801 -27.155 1.00 0.00 H new ATOM 684 N PRO A 49 -10.196 -21.643 -26.828 1.00 0.00 N ATOM 685 CA PRO A 49 -9.478 -20.855 -25.780 1.00 0.00 C ATOM 686 C PRO A 49 -9.017 -21.744 -24.626 1.00 0.00 C ATOM 687 O PRO A 49 -9.461 -22.884 -24.485 1.00 0.00 O ATOM 688 CB PRO A 49 -10.519 -19.825 -25.319 1.00 0.00 C ATOM 689 CG PRO A 49 -11.839 -20.480 -25.570 1.00 0.00 C ATOM 690 CD PRO A 49 -11.646 -21.358 -26.808 1.00 0.00 C ATOM 0 HA PRO A 49 -8.567 -20.389 -26.157 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -10.393 -19.580 -24.264 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -10.427 -18.893 -25.876 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -12.147 -21.078 -24.712 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -12.618 -19.736 -25.737 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -12.231 -22.275 -26.741 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -11.963 -20.843 -27.715 1.00 0.00 H new ATOM 698 N ILE A 50 -8.114 -21.216 -23.809 1.00 0.00 N ATOM 699 CA ILE A 50 -7.582 -21.964 -22.670 1.00 0.00 C ATOM 700 C ILE A 50 -8.480 -21.792 -21.447 1.00 0.00 C ATOM 701 O ILE A 50 -9.260 -20.842 -21.368 1.00 0.00 O ATOM 702 CB ILE A 50 -6.157 -21.492 -22.327 1.00 0.00 C ATOM 703 CG1 ILE A 50 -5.398 -21.163 -23.623 1.00 0.00 C ATOM 704 CG2 ILE A 50 -5.413 -22.597 -21.574 1.00 0.00 C ATOM 705 CD1 ILE A 50 -5.862 -19.816 -24.216 1.00 0.00 C ATOM 0 H ILE A 50 -7.734 -20.275 -23.911 1.00 0.00 H new ATOM 0 HA ILE A 50 -7.552 -23.018 -22.947 1.00 0.00 H new ATOM 0 HB ILE A 50 -6.216 -20.602 -21.700 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.328 -21.125 -23.421 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -5.556 -21.958 -24.352 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -4.405 -22.258 -21.333 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -5.946 -22.832 -20.653 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.357 -23.489 -22.199 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -5.307 -19.611 -25.132 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -6.927 -19.865 -24.441 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -5.680 -19.019 -23.495 1.00 0.00 H new ATOM 717 N PHE A 51 -8.363 -22.714 -20.499 1.00 0.00 N ATOM 718 CA PHE A 51 -9.167 -22.650 -19.288 1.00 0.00 C ATOM 719 C PHE A 51 -8.645 -21.563 -18.348 1.00 0.00 C ATOM 720 O PHE A 51 -7.437 -21.376 -18.206 1.00 0.00 O ATOM 721 CB PHE A 51 -9.135 -23.997 -18.569 1.00 0.00 C ATOM 722 CG PHE A 51 -9.612 -25.078 -19.510 1.00 0.00 C ATOM 723 CD1 PHE A 51 -10.984 -25.296 -19.692 1.00 0.00 C ATOM 724 CD2 PHE A 51 -8.683 -25.864 -20.200 1.00 0.00 C ATOM 725 CE1 PHE A 51 -11.425 -26.299 -20.567 1.00 0.00 C ATOM 726 CE2 PHE A 51 -9.122 -26.867 -21.074 1.00 0.00 C ATOM 727 CZ PHE A 51 -10.493 -27.083 -21.256 1.00 0.00 C ATOM 0 H PHE A 51 -7.724 -23.508 -20.545 1.00 0.00 H new ATOM 0 HA PHE A 51 -10.192 -22.409 -19.572 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -8.123 -24.216 -18.228 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -9.769 -23.964 -17.683 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -11.702 -24.691 -19.158 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -7.625 -25.697 -20.059 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -12.482 -26.466 -20.709 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -8.404 -27.473 -21.607 1.00 0.00 H new ATOM 0 HZ PHE A 51 -10.832 -27.856 -21.929 1.00 0.00 H new ATOM 737 N GLU A 52 -9.570 -20.864 -17.708 1.00 0.00 N ATOM 738 CA GLU A 52 -9.219 -19.801 -16.771 1.00 0.00 C ATOM 739 C GLU A 52 -8.605 -20.383 -15.514 1.00 0.00 C ATOM 740 O GLU A 52 -8.394 -21.591 -15.414 1.00 0.00 O ATOM 741 CB GLU A 52 -10.460 -18.960 -16.432 1.00 0.00 C ATOM 742 CG GLU A 52 -11.322 -19.675 -15.370 1.00 0.00 C ATOM 743 CD GLU A 52 -12.788 -19.286 -15.524 1.00 0.00 C ATOM 744 OE1 GLU A 52 -13.414 -19.768 -16.454 1.00 0.00 O ATOM 745 OE2 GLU A 52 -13.263 -18.511 -14.711 1.00 0.00 O ATOM 0 H GLU A 52 -10.573 -21.012 -17.819 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.480 -19.151 -17.240 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.154 -17.981 -16.062 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -11.049 -18.790 -17.333 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -11.213 -20.755 -15.471 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -10.972 -19.412 -14.372 1.00 0.00 H new ATOM 752 N ASP A 53 -8.321 -19.515 -14.547 1.00 0.00 N ATOM 753 CA ASP A 53 -7.733 -19.957 -13.293 1.00 0.00 C ATOM 754 C ASP A 53 -8.227 -19.077 -12.138 1.00 0.00 C ATOM 755 O ASP A 53 -8.377 -17.864 -12.290 1.00 0.00 O ATOM 756 CB ASP A 53 -6.191 -19.911 -13.409 1.00 0.00 C ATOM 757 CG ASP A 53 -5.603 -21.322 -13.464 1.00 0.00 C ATOM 758 OD1 ASP A 53 -5.928 -22.114 -12.595 1.00 0.00 O ATOM 759 OD2 ASP A 53 -4.838 -21.586 -14.375 1.00 0.00 O ATOM 0 H ASP A 53 -8.488 -18.511 -14.609 1.00 0.00 H new ATOM 0 HA ASP A 53 -8.038 -20.982 -13.085 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.906 -19.359 -14.305 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -5.775 -19.373 -12.558 1.00 0.00 H new ATOM 764 N PHE A 54 -8.479 -19.703 -10.987 1.00 0.00 N ATOM 765 CA PHE A 54 -8.960 -18.981 -9.802 1.00 0.00 C ATOM 766 C PHE A 54 -7.906 -19.008 -8.696 1.00 0.00 C ATOM 767 O PHE A 54 -7.524 -20.080 -8.227 1.00 0.00 O ATOM 768 CB PHE A 54 -10.235 -19.648 -9.282 1.00 0.00 C ATOM 769 CG PHE A 54 -11.206 -19.844 -10.419 1.00 0.00 C ATOM 770 CD1 PHE A 54 -11.164 -21.023 -11.171 1.00 0.00 C ATOM 771 CD2 PHE A 54 -12.148 -18.853 -10.721 1.00 0.00 C ATOM 772 CE1 PHE A 54 -12.060 -21.214 -12.227 1.00 0.00 C ATOM 773 CE2 PHE A 54 -13.049 -19.045 -11.776 1.00 0.00 C ATOM 774 CZ PHE A 54 -13.004 -20.226 -12.529 1.00 0.00 C ATOM 0 H PHE A 54 -8.359 -20.706 -10.848 1.00 0.00 H new ATOM 0 HA PHE A 54 -9.161 -17.947 -10.083 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -9.995 -20.609 -8.827 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -10.689 -19.032 -8.506 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -10.438 -21.787 -10.935 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -12.180 -17.942 -10.141 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -12.024 -22.123 -12.809 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -13.778 -18.283 -12.009 1.00 0.00 H new ATOM 0 HZ PHE A 54 -13.698 -20.374 -13.343 1.00 0.00 H new ATOM 784 N VAL A 55 -7.433 -17.831 -8.276 1.00 0.00 N ATOM 785 CA VAL A 55 -6.418 -17.740 -7.219 1.00 0.00 C ATOM 786 C VAL A 55 -6.869 -16.775 -6.124 1.00 0.00 C ATOM 787 O VAL A 55 -7.455 -15.731 -6.403 1.00 0.00 O ATOM 788 CB VAL A 55 -5.084 -17.262 -7.817 1.00 0.00 C ATOM 789 CG1 VAL A 55 -5.189 -15.786 -8.210 1.00 0.00 C ATOM 790 CG2 VAL A 55 -3.960 -17.437 -6.783 1.00 0.00 C ATOM 0 H VAL A 55 -7.734 -16.931 -8.649 1.00 0.00 H new ATOM 0 HA VAL A 55 -6.284 -18.728 -6.779 1.00 0.00 H new ATOM 0 HB VAL A 55 -4.859 -17.856 -8.703 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -4.241 -15.454 -8.633 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -5.980 -15.662 -8.950 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -5.421 -15.190 -7.327 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -3.016 -17.097 -7.210 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.188 -16.849 -5.894 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -3.877 -18.489 -6.510 1.00 0.00 H new ATOM 800 N ASP A 56 -6.589 -17.138 -4.875 1.00 0.00 N ATOM 801 CA ASP A 56 -6.964 -16.306 -3.736 1.00 0.00 C ATOM 802 C ASP A 56 -6.209 -14.981 -3.769 1.00 0.00 C ATOM 803 O ASP A 56 -5.115 -14.895 -4.326 1.00 0.00 O ATOM 804 CB ASP A 56 -6.659 -17.039 -2.428 1.00 0.00 C ATOM 805 CG ASP A 56 -7.670 -18.159 -2.202 1.00 0.00 C ATOM 806 OD1 ASP A 56 -8.691 -18.154 -2.870 1.00 0.00 O ATOM 807 OD2 ASP A 56 -7.410 -19.003 -1.361 1.00 0.00 O ATOM 0 H ASP A 56 -6.105 -18.001 -4.627 1.00 0.00 H new ATOM 0 HA ASP A 56 -8.033 -16.103 -3.795 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -5.650 -17.451 -2.461 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -6.690 -16.338 -1.594 1.00 0.00 H new ATOM 812 N SER A 57 -6.797 -13.950 -3.166 1.00 0.00 N ATOM 813 CA SER A 57 -6.172 -12.634 -3.130 1.00 0.00 C ATOM 814 C SER A 57 -4.867 -12.678 -2.334 1.00 0.00 C ATOM 815 O SER A 57 -3.918 -11.955 -2.640 1.00 0.00 O ATOM 816 CB SER A 57 -7.131 -11.620 -2.493 1.00 0.00 C ATOM 817 OG SER A 57 -6.757 -10.308 -2.895 1.00 0.00 O ATOM 0 H SER A 57 -7.702 -14.002 -2.698 1.00 0.00 H new ATOM 0 HA SER A 57 -5.947 -12.330 -4.152 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.156 -11.829 -2.799 1.00 0.00 H new ATOM 0 HB3 SER A 57 -7.099 -11.704 -1.407 1.00 0.00 H new ATOM 0 HG SER A 57 -6.844 -10.227 -3.868 1.00 0.00 H new ATOM 823 N SER A 58 -4.833 -13.522 -1.310 1.00 0.00 N ATOM 824 CA SER A 58 -3.647 -13.644 -0.468 1.00 0.00 C ATOM 825 C SER A 58 -2.411 -13.909 -1.317 1.00 0.00 C ATOM 826 O SER A 58 -1.338 -13.365 -1.051 1.00 0.00 O ATOM 827 CB SER A 58 -3.829 -14.787 0.531 1.00 0.00 C ATOM 828 OG SER A 58 -4.961 -14.521 1.348 1.00 0.00 O ATOM 0 H SER A 58 -5.608 -14.129 -1.043 1.00 0.00 H new ATOM 0 HA SER A 58 -3.513 -12.706 0.070 1.00 0.00 H new ATOM 0 HB2 SER A 58 -3.962 -15.730 0.001 1.00 0.00 H new ATOM 0 HB3 SER A 58 -2.937 -14.891 1.149 1.00 0.00 H new ATOM 0 HG SER A 58 -5.081 -15.253 1.988 1.00 0.00 H new ATOM 834 N VAL A 59 -2.560 -14.751 -2.331 1.00 0.00 N ATOM 835 CA VAL A 59 -1.439 -15.080 -3.199 1.00 0.00 C ATOM 836 C VAL A 59 -0.930 -13.819 -3.897 1.00 0.00 C ATOM 837 O VAL A 59 0.275 -13.591 -3.982 1.00 0.00 O ATOM 838 CB VAL A 59 -1.871 -16.123 -4.234 1.00 0.00 C ATOM 839 CG1 VAL A 59 -0.648 -16.624 -5.007 1.00 0.00 C ATOM 840 CG2 VAL A 59 -2.539 -17.302 -3.524 1.00 0.00 C ATOM 0 H VAL A 59 -3.437 -15.214 -2.571 1.00 0.00 H new ATOM 0 HA VAL A 59 -0.631 -15.496 -2.597 1.00 0.00 H new ATOM 0 HB VAL A 59 -2.576 -15.667 -4.929 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -0.961 -17.366 -5.742 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -0.172 -15.787 -5.517 1.00 0.00 H new ATOM 0 HG13 VAL A 59 0.060 -17.077 -4.313 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -2.846 -18.044 -4.261 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -1.834 -17.754 -2.827 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -3.414 -16.949 -2.978 1.00 0.00 H new ATOM 850 N GLY A 60 -1.860 -12.995 -4.385 1.00 0.00 N ATOM 851 CA GLY A 60 -1.489 -11.752 -5.061 1.00 0.00 C ATOM 852 C GLY A 60 -0.895 -12.025 -6.439 1.00 0.00 C ATOM 853 O GLY A 60 -1.130 -11.278 -7.388 1.00 0.00 O ATOM 0 H GLY A 60 -2.864 -13.164 -4.326 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -2.367 -11.114 -5.161 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -0.767 -11.207 -4.453 1.00 0.00 H new ATOM 857 N TYR A 61 -0.106 -13.094 -6.533 1.00 0.00 N ATOM 858 CA TYR A 61 0.554 -13.471 -7.791 1.00 0.00 C ATOM 859 C TYR A 61 0.027 -14.798 -8.305 1.00 0.00 C ATOM 860 O TYR A 61 -0.517 -15.596 -7.551 1.00 0.00 O ATOM 861 CB TYR A 61 2.064 -13.576 -7.582 1.00 0.00 C ATOM 862 CG TYR A 61 2.352 -14.512 -6.430 1.00 0.00 C ATOM 863 CD1 TYR A 61 2.354 -15.896 -6.637 1.00 0.00 C ATOM 864 CD2 TYR A 61 2.615 -13.992 -5.158 1.00 0.00 C ATOM 865 CE1 TYR A 61 2.618 -16.762 -5.568 1.00 0.00 C ATOM 866 CE2 TYR A 61 2.877 -14.858 -4.088 1.00 0.00 C ATOM 867 CZ TYR A 61 2.880 -16.243 -4.293 1.00 0.00 C ATOM 868 OH TYR A 61 3.138 -17.096 -3.241 1.00 0.00 O ATOM 0 H TYR A 61 0.095 -13.719 -5.752 1.00 0.00 H new ATOM 0 HA TYR A 61 0.338 -12.697 -8.528 1.00 0.00 H new ATOM 0 HB2 TYR A 61 2.542 -13.943 -8.490 1.00 0.00 H new ATOM 0 HB3 TYR A 61 2.482 -12.591 -7.377 1.00 0.00 H new ATOM 0 HD1 TYR A 61 2.152 -16.296 -7.620 1.00 0.00 H new ATOM 0 HD2 TYR A 61 2.616 -12.923 -5.001 1.00 0.00 H new ATOM 0 HE1 TYR A 61 2.620 -17.830 -5.727 1.00 0.00 H new ATOM 0 HE2 TYR A 61 3.077 -14.457 -3.105 1.00 0.00 H new ATOM 0 HH TYR A 61 3.300 -16.573 -2.428 1.00 0.00 H new ATOM 878 N TYR A 62 0.200 -15.038 -9.601 1.00 0.00 N ATOM 879 CA TYR A 62 -0.253 -16.286 -10.202 1.00 0.00 C ATOM 880 C TYR A 62 0.626 -16.618 -11.403 1.00 0.00 C ATOM 881 O TYR A 62 1.266 -15.736 -11.974 1.00 0.00 O ATOM 882 CB TYR A 62 -1.714 -16.165 -10.648 1.00 0.00 C ATOM 883 CG TYR A 62 -2.277 -17.548 -10.887 1.00 0.00 C ATOM 884 CD1 TYR A 62 -2.537 -18.391 -9.802 1.00 0.00 C ATOM 885 CD2 TYR A 62 -2.537 -17.982 -12.187 1.00 0.00 C ATOM 886 CE1 TYR A 62 -3.059 -19.668 -10.018 1.00 0.00 C ATOM 887 CE2 TYR A 62 -3.059 -19.261 -12.405 1.00 0.00 C ATOM 888 CZ TYR A 62 -3.322 -20.106 -11.319 1.00 0.00 C ATOM 889 OH TYR A 62 -3.835 -21.369 -11.531 1.00 0.00 O ATOM 0 H TYR A 62 0.647 -14.390 -10.250 1.00 0.00 H new ATOM 0 HA TYR A 62 -0.180 -17.083 -9.462 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -2.298 -15.648 -9.886 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -1.781 -15.570 -11.559 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.334 -18.054 -8.796 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -2.335 -17.331 -13.025 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -3.260 -20.318 -9.179 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -3.260 -19.598 -13.411 1.00 0.00 H new ATOM 0 HH TYR A 62 -4.806 -21.355 -11.397 1.00 0.00 H new ATOM 899 N THR A 63 0.652 -17.893 -11.788 1.00 0.00 N ATOM 900 CA THR A 63 1.453 -18.338 -12.931 1.00 0.00 C ATOM 901 C THR A 63 0.556 -18.973 -13.982 1.00 0.00 C ATOM 902 O THR A 63 -0.291 -19.808 -13.667 1.00 0.00 O ATOM 903 CB THR A 63 2.506 -19.352 -12.474 1.00 0.00 C ATOM 904 OG1 THR A 63 3.431 -18.714 -11.603 1.00 0.00 O ATOM 905 CG2 THR A 63 3.245 -19.909 -13.691 1.00 0.00 C ATOM 0 H THR A 63 0.128 -18.637 -11.327 1.00 0.00 H new ATOM 0 HA THR A 63 1.954 -17.472 -13.363 1.00 0.00 H new ATOM 0 HB THR A 63 2.017 -20.170 -11.946 1.00 0.00 H new ATOM 0 HG1 THR A 63 4.104 -19.363 -11.309 1.00 0.00 H new ATOM 0 HG21 THR A 63 3.994 -20.630 -13.363 1.00 0.00 H new ATOM 0 HG22 THR A 63 2.534 -20.400 -14.355 1.00 0.00 H new ATOM 0 HG23 THR A 63 3.735 -19.094 -14.224 1.00 0.00 H new ATOM 913 N VAL A 64 0.763 -18.587 -15.237 1.00 0.00 N ATOM 914 CA VAL A 64 -0.011 -19.136 -16.349 1.00 0.00 C ATOM 915 C VAL A 64 0.939 -19.556 -17.469 1.00 0.00 C ATOM 916 O VAL A 64 1.443 -18.713 -18.208 1.00 0.00 O ATOM 917 CB VAL A 64 -1.020 -18.082 -16.869 1.00 0.00 C ATOM 918 CG1 VAL A 64 -2.346 -18.202 -16.103 1.00 0.00 C ATOM 919 CG2 VAL A 64 -0.439 -16.679 -16.657 1.00 0.00 C ATOM 0 H VAL A 64 1.461 -17.895 -15.511 1.00 0.00 H new ATOM 0 HA VAL A 64 -0.569 -20.007 -16.005 1.00 0.00 H new ATOM 0 HB VAL A 64 -1.202 -18.253 -17.930 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -3.050 -17.457 -16.475 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.762 -19.199 -16.249 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -2.169 -18.035 -15.041 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -1.146 -15.934 -17.022 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -0.257 -16.517 -15.595 1.00 0.00 H new ATOM 0 HG23 VAL A 64 0.499 -16.587 -17.204 1.00 0.00 H new ATOM 929 N THR A 65 1.173 -20.863 -17.590 1.00 0.00 N ATOM 930 CA THR A 65 2.064 -21.392 -18.631 1.00 0.00 C ATOM 931 C THR A 65 1.293 -22.270 -19.590 1.00 0.00 C ATOM 932 O THR A 65 0.188 -22.721 -19.290 1.00 0.00 O ATOM 933 CB THR A 65 3.199 -22.221 -18.007 1.00 0.00 C ATOM 934 OG1 THR A 65 2.719 -23.533 -17.744 1.00 0.00 O ATOM 935 CG2 THR A 65 3.688 -21.589 -16.692 1.00 0.00 C ATOM 0 H THR A 65 0.762 -21.574 -16.985 1.00 0.00 H new ATOM 0 HA THR A 65 2.487 -20.543 -19.168 1.00 0.00 H new ATOM 0 HB THR A 65 4.035 -22.251 -18.706 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.436 -24.070 -17.347 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.490 -22.196 -16.273 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.058 -20.583 -16.888 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.862 -21.540 -15.983 1.00 0.00 H new ATOM 943 N GLY A 66 1.888 -22.508 -20.756 1.00 0.00 N ATOM 944 CA GLY A 66 1.256 -23.337 -21.773 1.00 0.00 C ATOM 945 C GLY A 66 0.737 -22.492 -22.926 1.00 0.00 C ATOM 946 O GLY A 66 -0.167 -22.915 -23.644 1.00 0.00 O ATOM 0 H GLY A 66 2.803 -22.140 -21.017 1.00 0.00 H new ATOM 0 HA2 GLY A 66 1.973 -24.067 -22.148 1.00 0.00 H new ATOM 0 HA3 GLY A 66 0.433 -23.897 -21.330 1.00 0.00 H new ATOM 950 N LEU A 67 1.310 -21.299 -23.113 1.00 0.00 N ATOM 951 CA LEU A 67 0.890 -20.420 -24.198 1.00 0.00 C ATOM 952 C LEU A 67 1.842 -20.594 -25.377 1.00 0.00 C ATOM 953 O LEU A 67 3.005 -20.210 -25.306 1.00 0.00 O ATOM 954 CB LEU A 67 0.927 -18.964 -23.734 1.00 0.00 C ATOM 955 CG LEU A 67 0.404 -18.857 -22.298 1.00 0.00 C ATOM 956 CD1 LEU A 67 0.417 -17.393 -21.864 1.00 0.00 C ATOM 957 CD2 LEU A 67 -1.023 -19.391 -22.224 1.00 0.00 C ATOM 0 H LEU A 67 2.059 -20.926 -22.530 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.127 -20.676 -24.496 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.947 -18.583 -23.788 1.00 0.00 H new ATOM 0 HB3 LEU A 67 0.321 -18.347 -24.397 1.00 0.00 H new ATOM 0 HG LEU A 67 1.043 -19.445 -21.639 1.00 0.00 H new ATOM 0 HD11 LEU A 67 0.045 -17.313 -20.842 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.436 -17.009 -21.911 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.221 -16.811 -22.529 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.388 -19.312 -21.200 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.665 -18.808 -22.884 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -1.037 -20.436 -22.535 1.00 0.00 H new ATOM 969 N GLU A 68 1.359 -21.195 -26.447 1.00 0.00 N ATOM 970 CA GLU A 68 2.211 -21.444 -27.610 1.00 0.00 C ATOM 971 C GLU A 68 2.946 -20.167 -28.067 1.00 0.00 C ATOM 972 O GLU A 68 2.333 -19.106 -28.170 1.00 0.00 O ATOM 973 CB GLU A 68 1.380 -21.990 -28.781 1.00 0.00 C ATOM 974 CG GLU A 68 0.575 -23.207 -28.321 1.00 0.00 C ATOM 975 CD GLU A 68 1.504 -24.294 -27.783 1.00 0.00 C ATOM 976 OE1 GLU A 68 2.605 -24.415 -28.297 1.00 0.00 O ATOM 977 OE2 GLU A 68 1.101 -24.989 -26.865 1.00 0.00 O ATOM 0 H GLU A 68 0.396 -21.519 -26.543 1.00 0.00 H new ATOM 0 HA GLU A 68 2.954 -22.182 -27.307 1.00 0.00 H new ATOM 0 HB2 GLU A 68 0.708 -21.217 -29.153 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.036 -22.267 -29.607 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.133 -22.910 -27.547 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -0.009 -23.599 -29.154 1.00 0.00 H new ATOM 984 N PRO A 69 4.234 -20.249 -28.366 1.00 0.00 N ATOM 985 CA PRO A 69 5.035 -19.075 -28.844 1.00 0.00 C ATOM 986 C PRO A 69 4.694 -18.729 -30.279 1.00 0.00 C ATOM 987 O PRO A 69 4.209 -19.572 -31.033 1.00 0.00 O ATOM 988 CB PRO A 69 6.482 -19.554 -28.707 1.00 0.00 C ATOM 989 CG PRO A 69 6.402 -21.023 -28.927 1.00 0.00 C ATOM 990 CD PRO A 69 5.079 -21.464 -28.296 1.00 0.00 C ATOM 0 HA PRO A 69 4.839 -18.164 -28.278 1.00 0.00 H new ATOM 0 HB2 PRO A 69 7.131 -19.076 -29.441 1.00 0.00 H new ATOM 0 HB3 PRO A 69 6.888 -19.320 -27.723 1.00 0.00 H new ATOM 0 HG2 PRO A 69 6.428 -21.262 -29.990 1.00 0.00 H new ATOM 0 HG3 PRO A 69 7.246 -21.535 -28.465 1.00 0.00 H new ATOM 0 HD2 PRO A 69 4.632 -22.295 -28.842 1.00 0.00 H new ATOM 0 HD3 PRO A 69 5.217 -21.797 -27.267 1.00 0.00 H new ATOM 998 N GLY A 70 4.959 -17.494 -30.658 1.00 0.00 N ATOM 999 CA GLY A 70 4.688 -17.058 -32.011 1.00 0.00 C ATOM 1000 C GLY A 70 3.192 -16.901 -32.261 1.00 0.00 C ATOM 1001 O GLY A 70 2.775 -16.387 -33.300 1.00 0.00 O ATOM 0 H GLY A 70 5.360 -16.779 -30.051 1.00 0.00 H new ATOM 0 HA2 GLY A 70 5.190 -16.108 -32.195 1.00 0.00 H new ATOM 0 HA3 GLY A 70 5.102 -17.779 -32.716 1.00 0.00 H new ATOM 1005 N ILE A 71 2.388 -17.348 -31.301 1.00 0.00 N ATOM 1006 CA ILE A 71 0.928 -17.267 -31.412 1.00 0.00 C ATOM 1007 C ILE A 71 0.411 -16.134 -30.539 1.00 0.00 C ATOM 1008 O ILE A 71 0.899 -15.900 -29.433 1.00 0.00 O ATOM 1009 CB ILE A 71 0.293 -18.618 -30.995 1.00 0.00 C ATOM 1010 CG1 ILE A 71 0.345 -19.618 -32.167 1.00 0.00 C ATOM 1011 CG2 ILE A 71 -1.175 -18.431 -30.578 1.00 0.00 C ATOM 1012 CD1 ILE A 71 1.766 -20.160 -32.327 1.00 0.00 C ATOM 0 H ILE A 71 2.720 -17.771 -30.434 1.00 0.00 H new ATOM 0 HA ILE A 71 0.651 -17.062 -32.446 1.00 0.00 H new ATOM 0 HB ILE A 71 0.863 -19.002 -30.149 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -0.348 -20.439 -31.987 1.00 0.00 H new ATOM 0 HG13 ILE A 71 0.027 -19.129 -33.088 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -1.597 -19.394 -30.290 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -1.229 -17.744 -29.733 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -1.742 -18.022 -31.415 1.00 0.00 H new ATOM 0 HD11 ILE A 71 1.795 -20.866 -33.157 1.00 0.00 H new ATOM 0 HD12 ILE A 71 2.450 -19.335 -32.528 1.00 0.00 H new ATOM 0 HD13 ILE A 71 2.068 -20.666 -31.410 1.00 0.00 H new ATOM 1024 N ASP A 72 -0.574 -15.432 -31.069 1.00 0.00 N ATOM 1025 CA ASP A 72 -1.173 -14.311 -30.371 1.00 0.00 C ATOM 1026 C ASP A 72 -2.169 -14.805 -29.323 1.00 0.00 C ATOM 1027 O ASP A 72 -3.171 -15.438 -29.647 1.00 0.00 O ATOM 1028 CB ASP A 72 -1.867 -13.423 -31.398 1.00 0.00 C ATOM 1029 CG ASP A 72 -2.711 -12.350 -30.716 1.00 0.00 C ATOM 1030 OD1 ASP A 72 -3.595 -12.708 -29.953 1.00 0.00 O ATOM 1031 OD2 ASP A 72 -2.461 -11.182 -30.969 1.00 0.00 O ATOM 0 H ASP A 72 -0.978 -15.621 -31.987 1.00 0.00 H new ATOM 0 HA ASP A 72 -0.403 -13.741 -29.851 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -1.122 -12.951 -32.038 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -2.500 -14.033 -32.042 1.00 0.00 H new ATOM 1036 N TYR A 73 -1.876 -14.515 -28.062 1.00 0.00 N ATOM 1037 CA TYR A 73 -2.740 -14.931 -26.954 1.00 0.00 C ATOM 1038 C TYR A 73 -3.469 -13.734 -26.370 1.00 0.00 C ATOM 1039 O TYR A 73 -2.855 -12.778 -25.921 1.00 0.00 O ATOM 1040 CB TYR A 73 -1.880 -15.582 -25.851 1.00 0.00 C ATOM 1041 CG TYR A 73 -1.739 -17.069 -26.081 1.00 0.00 C ATOM 1042 CD1 TYR A 73 -0.895 -17.549 -27.084 1.00 0.00 C ATOM 1043 CD2 TYR A 73 -2.453 -17.968 -25.281 1.00 0.00 C ATOM 1044 CE1 TYR A 73 -0.769 -18.927 -27.290 1.00 0.00 C ATOM 1045 CE2 TYR A 73 -2.325 -19.343 -25.490 1.00 0.00 C ATOM 1046 CZ TYR A 73 -1.484 -19.821 -26.494 1.00 0.00 C ATOM 1047 OH TYR A 73 -1.363 -21.178 -26.696 1.00 0.00 O ATOM 0 H TYR A 73 -1.047 -13.993 -27.776 1.00 0.00 H new ATOM 0 HA TYR A 73 -3.472 -15.645 -27.331 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -0.894 -15.118 -25.833 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -2.335 -15.403 -24.877 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -0.340 -16.857 -27.700 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -3.103 -17.599 -24.502 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -0.117 -19.299 -28.067 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -2.878 -20.036 -24.874 1.00 0.00 H new ATOM 0 HH TYR A 73 -1.929 -21.656 -26.054 1.00 0.00 H new ATOM 1057 N ASP A 74 -4.786 -13.804 -26.406 1.00 0.00 N ATOM 1058 CA ASP A 74 -5.625 -12.737 -25.888 1.00 0.00 C ATOM 1059 C ASP A 74 -5.895 -12.965 -24.406 1.00 0.00 C ATOM 1060 O ASP A 74 -6.546 -13.938 -24.035 1.00 0.00 O ATOM 1061 CB ASP A 74 -6.945 -12.724 -26.669 1.00 0.00 C ATOM 1062 CG ASP A 74 -6.800 -11.903 -27.950 1.00 0.00 C ATOM 1063 OD1 ASP A 74 -5.680 -11.554 -28.283 1.00 0.00 O ATOM 1064 OD2 ASP A 74 -7.813 -11.634 -28.577 1.00 0.00 O ATOM 0 H ASP A 74 -5.302 -14.595 -26.792 1.00 0.00 H new ATOM 0 HA ASP A 74 -5.121 -11.778 -26.005 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -7.239 -13.744 -26.915 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -7.737 -12.305 -26.049 1.00 0.00 H new ATOM 1069 N ILE A 75 -5.390 -12.065 -23.555 1.00 0.00 N ATOM 1070 CA ILE A 75 -5.584 -12.189 -22.107 1.00 0.00 C ATOM 1071 C ILE A 75 -6.462 -11.059 -21.592 1.00 0.00 C ATOM 1072 O ILE A 75 -6.661 -10.047 -22.266 1.00 0.00 O ATOM 1073 CB ILE A 75 -4.221 -12.203 -21.369 1.00 0.00 C ATOM 1074 CG1 ILE A 75 -3.170 -11.434 -22.200 1.00 0.00 C ATOM 1075 CG2 ILE A 75 -3.753 -13.654 -21.144 1.00 0.00 C ATOM 1076 CD1 ILE A 75 -2.529 -12.349 -23.254 1.00 0.00 C ATOM 0 H ILE A 75 -4.848 -11.249 -23.841 1.00 0.00 H new ATOM 0 HA ILE A 75 -6.086 -13.136 -21.907 1.00 0.00 H new ATOM 0 HB ILE A 75 -4.338 -11.718 -20.400 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -3.641 -10.582 -22.690 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -2.399 -11.036 -21.540 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.795 -13.651 -20.625 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -4.490 -14.185 -20.542 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -3.643 -14.154 -22.106 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.793 -11.785 -23.826 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.039 -13.187 -22.759 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -3.300 -12.725 -23.926 1.00 0.00 H new ATOM 1088 N SER A 76 -6.972 -11.247 -20.381 1.00 0.00 N ATOM 1089 CA SER A 76 -7.824 -10.253 -19.746 1.00 0.00 C ATOM 1090 C SER A 76 -7.707 -10.361 -18.230 1.00 0.00 C ATOM 1091 O SER A 76 -7.930 -11.423 -17.652 1.00 0.00 O ATOM 1092 CB SER A 76 -9.279 -10.453 -20.182 1.00 0.00 C ATOM 1093 OG SER A 76 -9.549 -11.843 -20.279 1.00 0.00 O ATOM 0 H SER A 76 -6.809 -12.082 -19.819 1.00 0.00 H new ATOM 0 HA SER A 76 -7.501 -9.258 -20.054 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.954 -9.988 -19.463 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.453 -9.968 -21.143 1.00 0.00 H new ATOM 0 HG SER A 76 -10.479 -11.977 -20.556 1.00 0.00 H new ATOM 1099 N VAL A 77 -7.362 -9.249 -17.595 1.00 0.00 N ATOM 1100 CA VAL A 77 -7.218 -9.213 -16.139 1.00 0.00 C ATOM 1101 C VAL A 77 -8.406 -8.469 -15.538 1.00 0.00 C ATOM 1102 O VAL A 77 -8.763 -7.382 -15.988 1.00 0.00 O ATOM 1103 CB VAL A 77 -5.919 -8.503 -15.758 1.00 0.00 C ATOM 1104 CG1 VAL A 77 -5.854 -8.331 -14.239 1.00 0.00 C ATOM 1105 CG2 VAL A 77 -4.722 -9.334 -16.229 1.00 0.00 C ATOM 0 H VAL A 77 -7.176 -8.360 -18.060 1.00 0.00 H new ATOM 0 HA VAL A 77 -7.188 -10.232 -15.753 1.00 0.00 H new ATOM 0 HB VAL A 77 -5.891 -7.523 -16.235 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.927 -7.825 -13.969 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -6.703 -7.736 -13.904 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.885 -9.310 -13.760 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -3.797 -8.826 -15.957 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.751 -10.315 -15.755 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -4.765 -9.453 -17.312 1.00 0.00 H new ATOM 1115 N ILE A 78 -9.015 -9.070 -14.519 1.00 0.00 N ATOM 1116 CA ILE A 78 -10.171 -8.465 -13.852 1.00 0.00 C ATOM 1117 C ILE A 78 -9.961 -8.410 -12.344 1.00 0.00 C ATOM 1118 O ILE A 78 -9.595 -9.403 -11.718 1.00 0.00 O ATOM 1119 CB ILE A 78 -11.441 -9.264 -14.168 1.00 0.00 C ATOM 1120 CG1 ILE A 78 -11.733 -9.171 -15.669 1.00 0.00 C ATOM 1121 CG2 ILE A 78 -12.620 -8.682 -13.384 1.00 0.00 C ATOM 1122 CD1 ILE A 78 -12.865 -10.137 -16.031 1.00 0.00 C ATOM 0 H ILE A 78 -8.731 -9.972 -14.136 1.00 0.00 H new ATOM 0 HA ILE A 78 -10.283 -7.447 -14.225 1.00 0.00 H new ATOM 0 HB ILE A 78 -11.297 -10.307 -13.885 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -12.013 -8.151 -15.933 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -10.837 -9.414 -16.240 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -13.523 -9.250 -13.609 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -12.411 -8.741 -12.316 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -12.767 -7.640 -13.668 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -13.072 -10.071 -17.099 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -12.568 -11.156 -15.782 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -13.762 -9.873 -15.470 1.00 0.00 H new ATOM 1134 N THR A 79 -10.212 -7.236 -11.767 1.00 0.00 N ATOM 1135 CA THR A 79 -10.072 -7.041 -10.324 1.00 0.00 C ATOM 1136 C THR A 79 -11.451 -6.941 -9.688 1.00 0.00 C ATOM 1137 O THR A 79 -12.256 -6.088 -10.061 1.00 0.00 O ATOM 1138 CB THR A 79 -9.278 -5.761 -10.038 1.00 0.00 C ATOM 1139 OG1 THR A 79 -9.087 -5.632 -8.637 1.00 0.00 O ATOM 1140 CG2 THR A 79 -10.045 -4.545 -10.563 1.00 0.00 C ATOM 0 H THR A 79 -10.513 -6.405 -12.276 1.00 0.00 H new ATOM 0 HA THR A 79 -9.536 -7.891 -9.901 1.00 0.00 H new ATOM 0 HB THR A 79 -8.311 -5.816 -10.538 1.00 0.00 H new ATOM 0 HG1 THR A 79 -8.578 -4.816 -8.450 1.00 0.00 H new ATOM 0 HG21 THR A 79 -9.476 -3.639 -10.357 1.00 0.00 H new ATOM 0 HG22 THR A 79 -10.192 -4.644 -11.638 1.00 0.00 H new ATOM 0 HG23 THR A 79 -11.014 -4.485 -10.068 1.00 0.00 H new ATOM 1148 N LEU A 80 -11.721 -7.826 -8.732 1.00 0.00 N ATOM 1149 CA LEU A 80 -13.016 -7.848 -8.050 1.00 0.00 C ATOM 1150 C LEU A 80 -12.835 -7.618 -6.555 1.00 0.00 C ATOM 1151 O LEU A 80 -12.278 -8.463 -5.857 1.00 0.00 O ATOM 1152 CB LEU A 80 -13.688 -9.210 -8.264 1.00 0.00 C ATOM 1153 CG LEU A 80 -13.682 -9.571 -9.754 1.00 0.00 C ATOM 1154 CD1 LEU A 80 -14.283 -10.963 -9.941 1.00 0.00 C ATOM 1155 CD2 LEU A 80 -14.512 -8.553 -10.545 1.00 0.00 C ATOM 0 H LEU A 80 -11.063 -8.537 -8.411 1.00 0.00 H new ATOM 0 HA LEU A 80 -13.638 -7.054 -8.463 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -13.164 -9.977 -7.694 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -14.712 -9.181 -7.893 1.00 0.00 H new ATOM 0 HG LEU A 80 -12.655 -9.558 -10.119 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -14.280 -11.222 -11.000 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -13.691 -11.692 -9.388 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -15.308 -10.970 -9.569 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -14.502 -8.818 -11.602 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -15.539 -8.558 -10.180 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -14.086 -7.558 -10.416 1.00 0.00 H new ATOM 1167 N ILE A 81 -13.325 -6.479 -6.063 1.00 0.00 N ATOM 1168 CA ILE A 81 -13.232 -6.170 -4.635 1.00 0.00 C ATOM 1169 C ILE A 81 -14.452 -5.368 -4.185 1.00 0.00 C ATOM 1170 O ILE A 81 -14.975 -4.543 -4.936 1.00 0.00 O ATOM 1171 CB ILE A 81 -11.941 -5.397 -4.317 1.00 0.00 C ATOM 1172 CG1 ILE A 81 -11.956 -3.989 -4.978 1.00 0.00 C ATOM 1173 CG2 ILE A 81 -10.740 -6.196 -4.835 1.00 0.00 C ATOM 1174 CD1 ILE A 81 -12.371 -2.924 -3.961 1.00 0.00 C ATOM 0 H ILE A 81 -13.785 -5.763 -6.624 1.00 0.00 H new ATOM 0 HA ILE A 81 -13.206 -7.112 -4.088 1.00 0.00 H new ATOM 0 HB ILE A 81 -11.868 -5.265 -3.238 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -10.968 -3.756 -5.374 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -12.647 -3.984 -5.821 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -9.820 -5.655 -4.614 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -10.714 -7.171 -4.348 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -10.831 -6.332 -5.913 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -12.376 -1.945 -4.441 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -13.369 -3.149 -3.585 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -11.664 -2.918 -3.132 1.00 0.00 H new ATOM 1186 N ASN A 82 -14.906 -5.620 -2.961 1.00 0.00 N ATOM 1187 CA ASN A 82 -16.072 -4.920 -2.422 1.00 0.00 C ATOM 1188 C ASN A 82 -15.786 -3.434 -2.213 1.00 0.00 C ATOM 1189 O ASN A 82 -16.571 -2.578 -2.618 1.00 0.00 O ATOM 1190 CB ASN A 82 -16.476 -5.543 -1.090 1.00 0.00 C ATOM 1191 CG ASN A 82 -17.689 -4.812 -0.522 1.00 0.00 C ATOM 1192 OD1 ASN A 82 -18.510 -4.292 -1.280 1.00 0.00 O ATOM 1193 ND2 ASN A 82 -17.854 -4.740 0.769 1.00 0.00 N ATOM 0 H ASN A 82 -14.488 -6.299 -2.325 1.00 0.00 H new ATOM 0 HA ASN A 82 -16.882 -5.017 -3.145 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -16.708 -6.599 -1.228 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -15.645 -5.489 -0.386 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -18.664 -4.253 1.153 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -17.174 -5.171 1.395 1.00 0.00 H new ATOM 1457 N GLY B 207 2.034 -1.346 -19.611 1.00 0.00 N ATOM 1458 CA GLY B 207 0.845 -0.743 -20.220 1.00 0.00 C ATOM 1459 C GLY B 207 0.248 0.321 -19.312 1.00 0.00 C ATOM 1460 O GLY B 207 0.958 1.194 -18.812 1.00 0.00 O ATOM 0 HA2 GLY B 207 1.109 -0.300 -21.180 1.00 0.00 H new ATOM 0 HA3 GLY B 207 0.102 -1.516 -20.418 1.00 0.00 H new ATOM 1464 N SER B 208 -1.059 0.237 -19.092 1.00 0.00 N ATOM 1465 CA SER B 208 -1.743 1.191 -18.229 1.00 0.00 C ATOM 1466 C SER B 208 -3.137 0.692 -17.869 1.00 0.00 C ATOM 1467 O SER B 208 -3.625 -0.286 -18.434 1.00 0.00 O ATOM 1468 CB SER B 208 -1.828 2.550 -18.905 1.00 0.00 C ATOM 1469 OG SER B 208 -2.429 2.407 -20.184 1.00 0.00 O ATOM 0 H SER B 208 -1.663 -0.478 -19.497 1.00 0.00 H new ATOM 0 HA SER B 208 -1.167 1.292 -17.309 1.00 0.00 H new ATOM 0 HB2 SER B 208 -2.412 3.237 -18.292 1.00 0.00 H new ATOM 0 HB3 SER B 208 -0.832 2.981 -19.006 1.00 0.00 H new ATOM 0 HG SER B 208 -2.485 3.283 -20.619 1.00 0.00 H new ATOM 1475 N TRP B 209 -3.781 1.381 -16.928 1.00 0.00 N ATOM 1476 CA TRP B 209 -5.129 1.015 -16.497 1.00 0.00 C ATOM 1477 C TRP B 209 -6.172 1.751 -17.332 1.00 0.00 C ATOM 1478 O TRP B 209 -5.906 2.826 -17.867 1.00 0.00 O ATOM 1479 CB TRP B 209 -5.327 1.358 -15.019 1.00 0.00 C ATOM 1480 CG TRP B 209 -4.624 0.353 -14.169 1.00 0.00 C ATOM 1481 CD1 TRP B 209 -3.333 0.430 -13.791 1.00 0.00 C ATOM 1482 CD2 TRP B 209 -5.150 -0.877 -13.597 1.00 0.00 C ATOM 1483 NE1 TRP B 209 -3.032 -0.672 -13.005 1.00 0.00 N ATOM 1484 CE2 TRP B 209 -4.123 -1.505 -12.857 1.00 0.00 C ATOM 1485 CE3 TRP B 209 -6.410 -1.497 -13.643 1.00 0.00 C ATOM 1486 CZ2 TRP B 209 -4.341 -2.710 -12.184 1.00 0.00 C ATOM 1487 CZ3 TRP B 209 -6.631 -2.710 -12.970 1.00 0.00 C ATOM 1488 CH2 TRP B 209 -5.599 -3.314 -12.241 1.00 0.00 C ATOM 0 H TRP B 209 -3.392 2.194 -16.450 1.00 0.00 H new ATOM 0 HA TRP B 209 -5.251 -0.059 -16.636 1.00 0.00 H new ATOM 0 HB2 TRP B 209 -4.941 2.356 -14.813 1.00 0.00 H new ATOM 0 HB3 TRP B 209 -6.390 1.372 -14.778 1.00 0.00 H new ATOM 0 HD1 TRP B 209 -2.646 1.220 -14.056 1.00 0.00 H new ATOM 0 HE1 TRP B 209 -2.118 -0.846 -12.588 1.00 0.00 H new ATOM 0 HE3 TRP B 209 -7.214 -1.038 -14.199 1.00 0.00 H new ATOM 0 HZ2 TRP B 209 -3.542 -3.171 -11.623 1.00 0.00 H new ATOM 0 HZ3 TRP B 209 -7.603 -3.180 -13.015 1.00 0.00 H new ATOM 0 HH2 TRP B 209 -5.776 -4.245 -11.724 1.00 0.00 H new ATOM 1499 N THR B 210 -7.370 1.167 -17.427 1.00 0.00 N ATOM 1500 CA THR B 210 -8.462 1.777 -18.190 1.00 0.00 C ATOM 1501 C THR B 210 -9.735 1.830 -17.349 1.00 0.00 C ATOM 1502 O THR B 210 -10.145 0.825 -16.768 1.00 0.00 O ATOM 1503 CB THR B 210 -8.721 0.964 -19.459 1.00 0.00 C ATOM 1504 OG1 THR B 210 -9.003 -0.383 -19.106 1.00 0.00 O ATOM 1505 CG2 THR B 210 -7.482 1.009 -20.357 1.00 0.00 C ATOM 0 H THR B 210 -7.607 0.278 -16.988 1.00 0.00 H new ATOM 0 HA THR B 210 -8.175 2.793 -18.459 1.00 0.00 H new ATOM 0 HB THR B 210 -9.571 1.386 -19.995 1.00 0.00 H new ATOM 0 HG1 THR B 210 -8.256 -0.748 -18.587 1.00 0.00 H new ATOM 0 HG21 THR B 210 -7.667 0.429 -21.261 1.00 0.00 H new ATOM 0 HG22 THR B 210 -7.265 2.043 -20.626 1.00 0.00 H new ATOM 0 HG23 THR B 210 -6.630 0.587 -19.823 1.00 0.00 H new ATOM 1513 N TRP B 211 -10.357 3.007 -17.291 1.00 0.00 N ATOM 1514 CA TRP B 211 -11.591 3.179 -16.521 1.00 0.00 C ATOM 1515 C TRP B 211 -12.809 2.915 -17.405 1.00 0.00 C ATOM 1516 O TRP B 211 -13.126 3.708 -18.293 1.00 0.00 O ATOM 1517 CB TRP B 211 -11.653 4.605 -15.950 1.00 0.00 C ATOM 1518 CG TRP B 211 -13.016 4.874 -15.386 1.00 0.00 C ATOM 1519 CD1 TRP B 211 -13.872 5.815 -15.847 1.00 0.00 C ATOM 1520 CD2 TRP B 211 -13.699 4.205 -14.285 1.00 0.00 C ATOM 1521 NE1 TRP B 211 -15.035 5.769 -15.098 1.00 0.00 N ATOM 1522 CE2 TRP B 211 -14.975 4.792 -14.124 1.00 0.00 C ATOM 1523 CE3 TRP B 211 -13.337 3.157 -13.417 1.00 0.00 C ATOM 1524 CZ2 TRP B 211 -15.864 4.356 -13.141 1.00 0.00 C ATOM 1525 CZ3 TRP B 211 -14.229 2.716 -12.426 1.00 0.00 C ATOM 1526 CH2 TRP B 211 -15.489 3.314 -12.288 1.00 0.00 C ATOM 0 H TRP B 211 -10.031 3.850 -17.763 1.00 0.00 H new ATOM 0 HA TRP B 211 -11.597 2.464 -15.699 1.00 0.00 H new ATOM 0 HB2 TRP B 211 -10.898 4.727 -15.173 1.00 0.00 H new ATOM 0 HB3 TRP B 211 -11.425 5.329 -16.732 1.00 0.00 H new ATOM 0 HD1 TRP B 211 -13.679 6.492 -16.666 1.00 0.00 H new ATOM 0 HE1 TRP B 211 -15.837 6.381 -15.247 1.00 0.00 H new ATOM 0 HE3 TRP B 211 -12.368 2.690 -13.514 1.00 0.00 H new ATOM 0 HZ2 TRP B 211 -16.834 4.820 -13.040 1.00 0.00 H new ATOM 0 HZ3 TRP B 211 -13.942 1.911 -11.766 1.00 0.00 H new ATOM 0 HH2 TRP B 211 -16.170 2.970 -11.523 1.00 0.00 H new ATOM 1537 N GLU B 212 -13.493 1.804 -17.150 1.00 0.00 N ATOM 1538 CA GLU B 212 -14.679 1.462 -17.928 1.00 0.00 C ATOM 1539 C GLU B 212 -15.519 0.421 -17.195 1.00 0.00 C ATOM 1540 O GLU B 212 -15.075 -0.173 -16.221 1.00 0.00 O ATOM 1541 CB GLU B 212 -14.250 0.941 -19.325 1.00 0.00 C ATOM 1542 CG GLU B 212 -14.307 -0.601 -19.407 1.00 0.00 C ATOM 1543 CD GLU B 212 -13.524 -1.085 -20.618 1.00 0.00 C ATOM 1544 OE1 GLU B 212 -13.522 -0.383 -21.615 1.00 0.00 O ATOM 1545 OE2 GLU B 212 -12.931 -2.147 -20.528 1.00 0.00 O ATOM 0 H GLU B 212 -13.251 1.133 -16.421 1.00 0.00 H new ATOM 0 HA GLU B 212 -15.292 2.354 -18.057 1.00 0.00 H new ATOM 0 HB2 GLU B 212 -14.900 1.369 -20.088 1.00 0.00 H new ATOM 0 HB3 GLU B 212 -13.237 1.279 -19.543 1.00 0.00 H new ATOM 0 HG2 GLU B 212 -13.894 -1.038 -18.498 1.00 0.00 H new ATOM 0 HG3 GLU B 212 -15.343 -0.932 -19.477 1.00 0.00 H new ATOM 1552 N ASN B 213 -16.710 0.172 -17.701 1.00 0.00 N ATOM 1553 CA ASN B 213 -17.560 -0.844 -17.111 1.00 0.00 C ATOM 1554 C ASN B 213 -17.675 -0.667 -15.596 1.00 0.00 C ATOM 1555 O ASN B 213 -17.863 -1.642 -14.868 1.00 0.00 O ATOM 1556 CB ASN B 213 -16.958 -2.215 -17.429 1.00 0.00 C ATOM 1557 CG ASN B 213 -17.212 -2.580 -18.885 1.00 0.00 C ATOM 1558 OD1 ASN B 213 -18.064 -1.977 -19.539 1.00 0.00 O ATOM 1559 ND2 ASN B 213 -16.522 -3.540 -19.432 1.00 0.00 N ATOM 0 H ASN B 213 -17.108 0.651 -18.509 1.00 0.00 H new ATOM 0 HA ASN B 213 -18.563 -0.756 -17.528 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -15.886 -2.203 -17.232 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -17.394 -2.971 -16.776 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -16.686 -3.795 -20.406 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -15.818 -4.036 -18.886 1.00 0.00 H new ATOM 1566 N GLY B 214 -17.578 0.572 -15.125 1.00 0.00 N ATOM 1567 CA GLY B 214 -17.688 0.843 -13.693 1.00 0.00 C ATOM 1568 C GLY B 214 -16.549 0.195 -12.905 1.00 0.00 C ATOM 1569 O GLY B 214 -16.384 0.462 -11.714 1.00 0.00 O ATOM 0 H GLY B 214 -17.425 1.397 -15.705 1.00 0.00 H new ATOM 0 HA2 GLY B 214 -17.680 1.920 -13.525 1.00 0.00 H new ATOM 0 HA3 GLY B 214 -18.644 0.470 -13.324 1.00 0.00 H new ATOM 1573 N LYS B 215 -15.775 -0.667 -13.567 1.00 0.00 N ATOM 1574 CA LYS B 215 -14.659 -1.361 -12.914 1.00 0.00 C ATOM 1575 C LYS B 215 -13.350 -1.108 -13.654 1.00 0.00 C ATOM 1576 O LYS B 215 -13.341 -0.844 -14.855 1.00 0.00 O ATOM 1577 CB LYS B 215 -14.928 -2.869 -12.887 1.00 0.00 C ATOM 1578 CG LYS B 215 -16.293 -3.148 -12.236 1.00 0.00 C ATOM 1579 CD LYS B 215 -16.353 -4.605 -11.731 1.00 0.00 C ATOM 1580 CE LYS B 215 -15.730 -4.708 -10.330 1.00 0.00 C ATOM 1581 NZ LYS B 215 -16.024 -6.046 -9.755 1.00 0.00 N ATOM 0 H LYS B 215 -15.898 -0.902 -14.552 1.00 0.00 H new ATOM 0 HA LYS B 215 -14.573 -0.976 -11.898 1.00 0.00 H new ATOM 0 HB2 LYS B 215 -14.911 -3.268 -13.901 1.00 0.00 H new ATOM 0 HB3 LYS B 215 -14.140 -3.377 -12.331 1.00 0.00 H new ATOM 0 HG2 LYS B 215 -16.456 -2.460 -11.406 1.00 0.00 H new ATOM 0 HG3 LYS B 215 -17.091 -2.972 -12.957 1.00 0.00 H new ATOM 0 HD2 LYS B 215 -17.388 -4.945 -11.702 1.00 0.00 H new ATOM 0 HD3 LYS B 215 -15.822 -5.259 -12.422 1.00 0.00 H new ATOM 0 HE2 LYS B 215 -14.653 -4.554 -10.387 1.00 0.00 H new ATOM 0 HE3 LYS B 215 -16.130 -3.927 -9.684 1.00 0.00 H new ATOM 0 HZ1 LYS B 215 -15.192 -6.391 -9.236 1.00 0.00 H new ATOM 0 HZ2 LYS B 215 -16.833 -5.974 -9.105 1.00 0.00 H new ATOM 0 HZ3 LYS B 215 -16.254 -6.710 -10.521 1.00 0.00 H new ATOM 1595 N TRP B 216 -12.240 -1.195 -12.933 1.00 0.00 N ATOM 1596 CA TRP B 216 -10.932 -0.981 -13.539 1.00 0.00 C ATOM 1597 C TRP B 216 -10.419 -2.290 -14.132 1.00 0.00 C ATOM 1598 O TRP B 216 -10.265 -3.284 -13.421 1.00 0.00 O ATOM 1599 CB TRP B 216 -9.951 -0.465 -12.486 1.00 0.00 C ATOM 1600 CG TRP B 216 -10.492 0.796 -11.900 1.00 0.00 C ATOM 1601 CD1 TRP B 216 -11.562 0.863 -11.080 1.00 0.00 C ATOM 1602 CD2 TRP B 216 -10.020 2.162 -12.072 1.00 0.00 C ATOM 1603 NE1 TRP B 216 -11.780 2.183 -10.733 1.00 0.00 N ATOM 1604 CE2 TRP B 216 -10.852 3.025 -11.318 1.00 0.00 C ATOM 1605 CE3 TRP B 216 -8.959 2.733 -12.798 1.00 0.00 C ATOM 1606 CZ2 TRP B 216 -10.642 4.401 -11.288 1.00 0.00 C ATOM 1607 CZ3 TRP B 216 -8.745 4.121 -12.771 1.00 0.00 C ATOM 1608 CH2 TRP B 216 -9.583 4.954 -12.016 1.00 0.00 C ATOM 0 H TRP B 216 -12.218 -1.410 -11.936 1.00 0.00 H new ATOM 0 HA TRP B 216 -11.021 -0.240 -14.334 1.00 0.00 H new ATOM 0 HB2 TRP B 216 -9.808 -1.212 -11.706 1.00 0.00 H new ATOM 0 HB3 TRP B 216 -8.975 -0.283 -12.936 1.00 0.00 H new ATOM 0 HD1 TRP B 216 -12.152 0.021 -10.749 1.00 0.00 H new ATOM 0 HE1 TRP B 216 -12.533 2.497 -10.121 1.00 0.00 H new ATOM 0 HE3 TRP B 216 -8.305 2.100 -13.380 1.00 0.00 H new ATOM 0 HZ2 TRP B 216 -11.292 5.037 -10.706 1.00 0.00 H new ATOM 0 HZ3 TRP B 216 -7.930 4.549 -13.335 1.00 0.00 H new ATOM 0 HH2 TRP B 216 -9.411 6.020 -11.997 1.00 0.00 H new ATOM 1619 N THR B 217 -10.161 -2.286 -15.439 1.00 0.00 N ATOM 1620 CA THR B 217 -9.673 -3.482 -16.135 1.00 0.00 C ATOM 1621 C THR B 217 -8.362 -3.179 -16.849 1.00 0.00 C ATOM 1622 O THR B 217 -8.214 -2.132 -17.485 1.00 0.00 O ATOM 1623 CB THR B 217 -10.717 -3.956 -17.156 1.00 0.00 C ATOM 1624 OG1 THR B 217 -11.985 -4.052 -16.523 1.00 0.00 O ATOM 1625 CG2 THR B 217 -10.325 -5.334 -17.699 1.00 0.00 C ATOM 0 H THR B 217 -10.281 -1.470 -16.039 1.00 0.00 H new ATOM 0 HA THR B 217 -9.504 -4.269 -15.400 1.00 0.00 H new ATOM 0 HB THR B 217 -10.764 -3.241 -17.977 1.00 0.00 H new ATOM 0 HG1 THR B 217 -12.653 -4.353 -17.173 1.00 0.00 H new ATOM 0 HG21 THR B 217 -11.070 -5.665 -18.423 1.00 0.00 H new ATOM 0 HG22 THR B 217 -9.351 -5.270 -18.184 1.00 0.00 H new ATOM 0 HG23 THR B 217 -10.275 -6.048 -16.877 1.00 0.00 H new ATOM 1633 N TRP B 218 -7.411 -4.105 -16.743 1.00 0.00 N ATOM 1634 CA TRP B 218 -6.107 -3.945 -17.386 1.00 0.00 C ATOM 1635 C TRP B 218 -6.025 -4.827 -18.628 1.00 0.00 C ATOM 1636 O TRP B 218 -5.947 -6.051 -18.532 1.00 0.00 O ATOM 1637 CB TRP B 218 -4.996 -4.326 -16.408 1.00 0.00 C ATOM 1638 CG TRP B 218 -3.664 -4.172 -17.071 1.00 0.00 C ATOM 1639 CD1 TRP B 218 -3.139 -5.036 -17.970 1.00 0.00 C ATOM 1640 CD2 TRP B 218 -2.681 -3.111 -16.899 1.00 0.00 C ATOM 1641 NE1 TRP B 218 -1.899 -4.570 -18.366 1.00 0.00 N ATOM 1642 CE2 TRP B 218 -1.572 -3.387 -17.733 1.00 0.00 C ATOM 1643 CE3 TRP B 218 -2.644 -1.947 -16.111 1.00 0.00 C ATOM 1644 CZ2 TRP B 218 -0.466 -2.539 -17.781 1.00 0.00 C ATOM 1645 CZ3 TRP B 218 -1.531 -1.092 -16.158 1.00 0.00 C ATOM 1646 CH2 TRP B 218 -0.444 -1.387 -16.991 1.00 0.00 C ATOM 0 H TRP B 218 -7.518 -4.973 -16.219 1.00 0.00 H new ATOM 0 HA TRP B 218 -5.984 -2.903 -17.681 1.00 0.00 H new ATOM 0 HB2 TRP B 218 -5.047 -3.694 -15.521 1.00 0.00 H new ATOM 0 HB3 TRP B 218 -5.130 -5.355 -16.074 1.00 0.00 H new ATOM 0 HD1 TRP B 218 -3.611 -5.942 -18.321 1.00 0.00 H new ATOM 0 HE1 TRP B 218 -1.299 -5.042 -19.043 1.00 0.00 H new ATOM 0 HE3 TRP B 218 -3.477 -1.709 -15.466 1.00 0.00 H new ATOM 0 HZ2 TRP B 218 0.369 -2.772 -18.425 1.00 0.00 H new ATOM 0 HZ3 TRP B 218 -1.513 -0.201 -15.548 1.00 0.00 H new ATOM 0 HH2 TRP B 218 0.409 -0.725 -17.022 1.00 0.00 H new ATOM 1657 N LYS B 219 -6.050 -4.188 -19.796 1.00 0.00 N ATOM 1658 CA LYS B 219 -5.984 -4.896 -21.076 1.00 0.00 C ATOM 1659 C LYS B 219 -4.975 -4.236 -21.994 1.00 0.00 C ATOM 1660 O LYS B 219 -4.486 -3.143 -21.720 1.00 0.00 O ATOM 1661 CB LYS B 219 -7.363 -4.910 -21.750 1.00 0.00 C ATOM 1662 CG LYS B 219 -8.262 -5.946 -21.080 1.00 0.00 C ATOM 1663 CD LYS B 219 -9.659 -5.886 -21.710 1.00 0.00 C ATOM 1664 CE LYS B 219 -10.523 -7.029 -21.169 1.00 0.00 C ATOM 1665 NZ LYS B 219 -11.963 -6.679 -21.312 1.00 0.00 N ATOM 0 H LYS B 219 -6.116 -3.174 -19.884 1.00 0.00 H new ATOM 0 HA LYS B 219 -5.671 -5.922 -20.883 1.00 0.00 H new ATOM 0 HB2 LYS B 219 -7.820 -3.923 -21.683 1.00 0.00 H new ATOM 0 HB3 LYS B 219 -7.256 -5.140 -22.810 1.00 0.00 H new ATOM 0 HG2 LYS B 219 -7.839 -6.943 -21.199 1.00 0.00 H new ATOM 0 HG3 LYS B 219 -8.325 -5.752 -20.009 1.00 0.00 H new ATOM 0 HD2 LYS B 219 -10.127 -4.927 -21.487 1.00 0.00 H new ATOM 0 HD3 LYS B 219 -9.582 -5.959 -22.795 1.00 0.00 H new ATOM 0 HE2 LYS B 219 -10.307 -7.950 -21.711 1.00 0.00 H new ATOM 0 HE3 LYS B 219 -10.286 -7.213 -20.121 1.00 0.00 H new ATOM 0 HZ1 LYS B 219 -12.547 -7.457 -20.944 1.00 0.00 H new ATOM 0 HZ2 LYS B 219 -12.164 -5.811 -20.776 1.00 0.00 H new ATOM 0 HZ3 LYS B 219 -12.185 -6.525 -22.316 1.00 0.00 H new ATOM 1679 N GLY B 220 -4.677 -4.914 -23.091 1.00 0.00 N ATOM 1680 CA GLY B 220 -3.734 -4.391 -24.055 1.00 0.00 C ATOM 1681 C GLY B 220 -3.601 -5.334 -25.244 1.00 0.00 C ATOM 1682 O GLY B 220 -4.475 -6.168 -25.483 1.00 0.00 O ATOM 0 H GLY B 220 -5.074 -5.822 -23.331 1.00 0.00 H new ATOM 0 HA2 GLY B 220 -4.063 -3.410 -24.398 1.00 0.00 H new ATOM 0 HA3 GLY B 220 -2.761 -4.254 -23.582 1.00 0.00 H new ATOM 1686 N ILE B 221 -2.525 -5.178 -26.003 1.00 0.00 N ATOM 1687 CA ILE B 221 -2.321 -6.007 -27.184 1.00 0.00 C ATOM 1688 C ILE B 221 -2.406 -7.486 -26.815 1.00 0.00 C ATOM 1689 O ILE B 221 -3.387 -8.155 -27.136 1.00 0.00 O ATOM 1690 CB ILE B 221 -0.945 -5.708 -27.794 1.00 0.00 C ATOM 1691 CG1 ILE B 221 -0.753 -4.193 -27.932 1.00 0.00 C ATOM 1692 CG2 ILE B 221 -0.841 -6.350 -29.183 1.00 0.00 C ATOM 1693 CD1 ILE B 221 0.624 -3.910 -28.532 1.00 0.00 C ATOM 0 H ILE B 221 -1.789 -4.495 -25.826 1.00 0.00 H new ATOM 0 HA ILE B 221 -3.100 -5.779 -27.911 1.00 0.00 H new ATOM 0 HB ILE B 221 -0.175 -6.118 -27.140 1.00 0.00 H new ATOM 0 HG12 ILE B 221 -1.532 -3.773 -28.567 1.00 0.00 H new ATOM 0 HG13 ILE B 221 -0.843 -3.713 -26.957 1.00 0.00 H new ATOM 0 HG21 ILE B 221 0.138 -6.134 -29.611 1.00 0.00 H new ATOM 0 HG22 ILE B 221 -0.969 -7.429 -29.096 1.00 0.00 H new ATOM 0 HG23 ILE B 221 -1.618 -5.944 -29.831 1.00 0.00 H new ATOM 0 HD11 ILE B 221 0.763 -2.834 -28.631 1.00 0.00 H new ATOM 0 HD12 ILE B 221 1.396 -4.317 -27.879 1.00 0.00 H new ATOM 0 HD13 ILE B 221 0.696 -4.377 -29.514 1.00 0.00 H new ATOM 1705 N ILE B 222 -1.378 -7.980 -26.135 1.00 0.00 N ATOM 1706 CA ILE B 222 -1.330 -9.381 -25.716 1.00 0.00 C ATOM 1707 C ILE B 222 -0.331 -9.547 -24.582 1.00 0.00 C ATOM 1708 O ILE B 222 0.111 -8.563 -23.987 1.00 0.00 O ATOM 1709 CB ILE B 222 -0.923 -10.278 -26.881 1.00 0.00 C ATOM 1710 CG1 ILE B 222 0.350 -9.717 -27.511 1.00 0.00 C ATOM 1711 CG2 ILE B 222 -2.035 -10.337 -27.931 1.00 0.00 C ATOM 1712 CD1 ILE B 222 0.899 -10.732 -28.499 1.00 0.00 C ATOM 0 H ILE B 222 -0.563 -7.432 -25.860 1.00 0.00 H new ATOM 0 HA ILE B 222 -2.324 -9.672 -25.377 1.00 0.00 H new ATOM 0 HB ILE B 222 -0.747 -11.288 -26.512 1.00 0.00 H new ATOM 0 HG12 ILE B 222 0.137 -8.776 -28.017 1.00 0.00 H new ATOM 0 HG13 ILE B 222 1.090 -9.504 -26.740 1.00 0.00 H new ATOM 0 HG21 ILE B 222 -1.725 -10.982 -28.753 1.00 0.00 H new ATOM 0 HG22 ILE B 222 -2.942 -10.737 -27.478 1.00 0.00 H new ATOM 0 HG23 ILE B 222 -2.231 -9.334 -28.310 1.00 0.00 H new ATOM 0 HD11 ILE B 222 1.809 -10.341 -28.955 1.00 0.00 H new ATOM 0 HD12 ILE B 222 1.125 -11.662 -27.977 1.00 0.00 H new ATOM 0 HD13 ILE B 222 0.157 -10.922 -29.275 1.00 0.00 H new ATOM 1724 N ARG B 223 0.019 -10.799 -24.297 1.00 0.00 N ATOM 1725 CA ARG B 223 0.983 -11.114 -23.254 1.00 0.00 C ATOM 1726 C ARG B 223 2.150 -10.131 -23.273 1.00 0.00 C ATOM 1727 O ARG B 223 2.267 -9.288 -24.160 1.00 0.00 O ATOM 1728 CB ARG B 223 1.498 -12.536 -23.417 1.00 0.00 C ATOM 1729 CG ARG B 223 1.821 -12.803 -24.882 1.00 0.00 C ATOM 1730 CD ARG B 223 2.309 -14.235 -25.013 1.00 0.00 C ATOM 1731 NE ARG B 223 2.688 -14.511 -26.395 1.00 0.00 N ATOM 1732 CZ ARG B 223 2.865 -15.754 -26.829 1.00 0.00 C ATOM 1733 NH1 ARG B 223 2.708 -16.762 -26.015 1.00 0.00 N ATOM 1734 NH2 ARG B 223 3.198 -15.964 -28.072 1.00 0.00 N ATOM 0 H ARG B 223 -0.356 -11.615 -24.780 1.00 0.00 H new ATOM 0 HA ARG B 223 0.477 -11.029 -22.293 1.00 0.00 H new ATOM 0 HB2 ARG B 223 2.389 -12.682 -22.806 1.00 0.00 H new ATOM 0 HB3 ARG B 223 0.750 -13.246 -23.065 1.00 0.00 H new ATOM 0 HG2 ARG B 223 0.937 -12.646 -25.500 1.00 0.00 H new ATOM 0 HG3 ARG B 223 2.584 -12.109 -25.235 1.00 0.00 H new ATOM 0 HD2 ARG B 223 3.162 -14.398 -24.354 1.00 0.00 H new ATOM 0 HD3 ARG B 223 1.526 -14.925 -24.698 1.00 0.00 H new ATOM 0 HE ARG B 223 2.820 -13.733 -27.041 1.00 0.00 H new ATOM 0 HH11 ARG B 223 2.449 -16.597 -25.042 1.00 0.00 H new ATOM 0 HH12 ARG B 223 2.845 -17.715 -26.351 1.00 0.00 H new ATOM 0 HH21 ARG B 223 3.322 -15.175 -28.707 1.00 0.00 H new ATOM 0 HH22 ARG B 223 3.335 -16.917 -28.409 1.00 0.00 H new ATOM 1748 N LEU B 224 3.014 -10.262 -22.290 1.00 0.00 N ATOM 1749 CA LEU B 224 4.166 -9.385 -22.194 1.00 0.00 C ATOM 1750 C LEU B 224 5.065 -9.549 -23.412 1.00 0.00 C ATOM 1751 O LEU B 224 5.722 -10.578 -23.589 1.00 0.00 O ATOM 1752 CB LEU B 224 4.951 -9.686 -20.908 1.00 0.00 C ATOM 1753 CG LEU B 224 4.109 -9.337 -19.658 1.00 0.00 C ATOM 1754 CD1 LEU B 224 3.681 -7.857 -19.696 1.00 0.00 C ATOM 1755 CD2 LEU B 224 2.864 -10.238 -19.582 1.00 0.00 C ATOM 0 H LEU B 224 2.944 -10.961 -21.550 1.00 0.00 H new ATOM 0 HA LEU B 224 3.817 -8.353 -22.161 1.00 0.00 H new ATOM 0 HB2 LEU B 224 5.228 -10.740 -20.883 1.00 0.00 H new ATOM 0 HB3 LEU B 224 5.878 -9.113 -20.900 1.00 0.00 H new ATOM 0 HG LEU B 224 4.722 -9.506 -18.773 1.00 0.00 H new ATOM 0 HD11 LEU B 224 3.089 -7.626 -18.810 1.00 0.00 H new ATOM 0 HD12 LEU B 224 4.567 -7.222 -19.716 1.00 0.00 H new ATOM 0 HD13 LEU B 224 3.083 -7.674 -20.589 1.00 0.00 H new ATOM 0 HD21 LEU B 224 2.282 -9.980 -18.697 1.00 0.00 H new ATOM 0 HD22 LEU B 224 2.254 -10.091 -20.473 1.00 0.00 H new ATOM 0 HD23 LEU B 224 3.173 -11.281 -19.522 1.00 0.00 H new ATOM 1767 N GLU B 225 5.079 -8.516 -24.249 1.00 0.00 N ATOM 1768 CA GLU B 225 5.889 -8.522 -25.461 1.00 0.00 C ATOM 1769 C GLU B 225 7.322 -8.114 -25.142 1.00 0.00 C ATOM 1770 O GLU B 225 7.559 -7.264 -24.285 1.00 0.00 O ATOM 1771 CB GLU B 225 5.297 -7.555 -26.490 1.00 0.00 C ATOM 1772 CG GLU B 225 6.069 -7.668 -27.808 1.00 0.00 C ATOM 1773 CD GLU B 225 5.466 -6.729 -28.848 1.00 0.00 C ATOM 1774 OE1 GLU B 225 5.241 -5.577 -28.517 1.00 0.00 O ATOM 1775 OE2 GLU B 225 5.238 -7.176 -29.960 1.00 0.00 O ATOM 0 H GLU B 225 4.537 -7.663 -24.109 1.00 0.00 H new ATOM 0 HA GLU B 225 5.891 -9.531 -25.873 1.00 0.00 H new ATOM 0 HB2 GLU B 225 4.244 -7.783 -26.654 1.00 0.00 H new ATOM 0 HB3 GLU B 225 5.347 -6.533 -26.114 1.00 0.00 H new ATOM 0 HG2 GLU B 225 7.118 -7.420 -27.647 1.00 0.00 H new ATOM 0 HG3 GLU B 225 6.036 -8.695 -28.171 1.00 0.00 H new