USER MOD reduce.3.24.130724 H: found=0, std=0, add=693, rem=0, adj=26 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 61 TYR OH : rot -147:sc= 1.75 USER MOD Set 1.2: A 63 THR OG1 : rot -40:sc= 1.41 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 70:sc= 1.12 USER MOD Single : A 20 SER OG : rot -69:sc= 1.28 USER MOD Single : A 21 SER OG : rot -170:sc= -1.43! USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= -0.0523 X(o=-0.052,f=-0.47) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= -0.462 USER MOD Single : A 33 THR OG1 : rot -80:sc= -0.581 USER MOD Single : A 37 TYR OH : rot 110:sc= -0.599 USER MOD Single : A 40 THR OG1 : rot 180:sc= -0.693 USER MOD Single : A 57 SER OG : rot 150:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot 30:sc= -2.51! USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 TYR OH : rot -146:sc= 0.814 USER MOD Single : A 76 SER OG : rot 3:sc= 0.121 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 ASN :FLIP amide:sc= -0.608 F(o=-2.5!,f=-0.61) USER MOD Single : B 208 SER OG : rot 180:sc= 0 USER MOD Single : B 210 THR OG1 : rot -6:sc= 0.432 USER MOD Single : B 213 ASN :FLIP amide:sc= -1.36 F(o=-1.9,f=-1.4) USER MOD Single : B 215 LYS NZ :NH3+ -165:sc=-0.00945 (180deg=-0.264) USER MOD Single : B 217 THR OG1 : rot 180:sc= 0 USER MOD Single : B 219 LYS NZ :NH3+ 150:sc= 0.705 (180deg=0.126) USER MOD ----------------------------------------------------------------- ATOM 114 N ASP A 11 1.450 0.125 -8.513 1.00 0.00 N ATOM 115 CA ASP A 11 1.015 -0.326 -9.835 1.00 0.00 C ATOM 116 C ASP A 11 1.389 -1.788 -10.047 1.00 0.00 C ATOM 117 O ASP A 11 2.319 -2.298 -9.425 1.00 0.00 O ATOM 118 CB ASP A 11 1.675 0.534 -10.917 1.00 0.00 C ATOM 119 CG ASP A 11 1.091 1.940 -10.888 1.00 0.00 C ATOM 120 OD1 ASP A 11 0.061 2.119 -10.257 1.00 0.00 O ATOM 121 OD2 ASP A 11 1.680 2.819 -11.495 1.00 0.00 O ATOM 0 HA ASP A 11 -0.069 -0.226 -9.900 1.00 0.00 H new ATOM 0 HB2 ASP A 11 2.752 0.575 -10.755 1.00 0.00 H new ATOM 0 HB3 ASP A 11 1.517 0.085 -11.898 1.00 0.00 H new ATOM 126 N LEU A 12 0.655 -2.457 -10.926 1.00 0.00 N ATOM 127 CA LEU A 12 0.916 -3.862 -11.207 1.00 0.00 C ATOM 128 C LEU A 12 2.293 -4.031 -11.830 1.00 0.00 C ATOM 129 O LEU A 12 2.778 -3.148 -12.539 1.00 0.00 O ATOM 130 CB LEU A 12 -0.156 -4.407 -12.168 1.00 0.00 C ATOM 131 CG LEU A 12 0.049 -5.928 -12.406 1.00 0.00 C ATOM 132 CD1 LEU A 12 -1.308 -6.651 -12.424 1.00 0.00 C ATOM 133 CD2 LEU A 12 0.750 -6.172 -13.753 1.00 0.00 C ATOM 0 H LEU A 12 -0.120 -2.054 -11.453 1.00 0.00 H new ATOM 0 HA LEU A 12 0.883 -4.418 -10.270 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -1.148 -4.228 -11.754 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -0.106 -3.874 -13.118 1.00 0.00 H new ATOM 0 HG LEU A 12 0.666 -6.315 -11.595 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.150 -7.716 -12.592 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -1.811 -6.505 -11.468 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -1.926 -6.245 -13.225 1.00 0.00 H new ATOM 0 HD21 LEU A 12 0.886 -7.243 -13.904 1.00 0.00 H new ATOM 0 HD22 LEU A 12 0.139 -5.767 -14.560 1.00 0.00 H new ATOM 0 HD23 LEU A 12 1.722 -5.680 -13.752 1.00 0.00 H new ATOM 145 N SER A 13 2.924 -5.179 -11.568 1.00 0.00 N ATOM 146 CA SER A 13 4.250 -5.460 -12.114 1.00 0.00 C ATOM 147 C SER A 13 4.340 -6.913 -12.573 1.00 0.00 C ATOM 148 O SER A 13 3.588 -7.772 -12.117 1.00 0.00 O ATOM 149 CB SER A 13 5.323 -5.198 -11.063 1.00 0.00 C ATOM 150 OG SER A 13 5.219 -6.178 -10.038 1.00 0.00 O ATOM 0 H SER A 13 2.540 -5.923 -10.985 1.00 0.00 H new ATOM 0 HA SER A 13 4.412 -4.802 -12.968 1.00 0.00 H new ATOM 0 HB2 SER A 13 6.313 -5.234 -11.519 1.00 0.00 H new ATOM 0 HB3 SER A 13 5.202 -4.200 -10.643 1.00 0.00 H new ATOM 0 HG SER A 13 5.907 -6.016 -9.360 1.00 0.00 H new ATOM 156 N PHE A 14 5.267 -7.168 -13.490 1.00 0.00 N ATOM 157 CA PHE A 14 5.467 -8.511 -14.036 1.00 0.00 C ATOM 158 C PHE A 14 6.796 -9.093 -13.569 1.00 0.00 C ATOM 159 O PHE A 14 7.778 -8.367 -13.403 1.00 0.00 O ATOM 160 CB PHE A 14 5.462 -8.418 -15.556 1.00 0.00 C ATOM 161 CG PHE A 14 4.176 -7.771 -16.002 1.00 0.00 C ATOM 162 CD1 PHE A 14 4.004 -6.391 -15.854 1.00 0.00 C ATOM 163 CD2 PHE A 14 3.158 -8.547 -16.561 1.00 0.00 C ATOM 164 CE1 PHE A 14 2.811 -5.783 -16.269 1.00 0.00 C ATOM 165 CE2 PHE A 14 1.966 -7.944 -16.979 1.00 0.00 C ATOM 166 CZ PHE A 14 1.792 -6.562 -16.834 1.00 0.00 C ATOM 0 H PHE A 14 5.895 -6.462 -13.874 1.00 0.00 H new ATOM 0 HA PHE A 14 4.667 -9.164 -13.688 1.00 0.00 H new ATOM 0 HB2 PHE A 14 6.316 -7.835 -15.901 1.00 0.00 H new ATOM 0 HB3 PHE A 14 5.556 -9.411 -15.995 1.00 0.00 H new ATOM 0 HD1 PHE A 14 4.791 -5.793 -15.419 1.00 0.00 H new ATOM 0 HD2 PHE A 14 3.291 -9.613 -16.671 1.00 0.00 H new ATOM 0 HE1 PHE A 14 2.677 -4.718 -16.154 1.00 0.00 H new ATOM 0 HE2 PHE A 14 1.180 -8.545 -17.413 1.00 0.00 H new ATOM 0 HZ PHE A 14 0.873 -6.097 -17.158 1.00 0.00 H new ATOM 176 N VAL A 15 6.830 -10.408 -13.371 1.00 0.00 N ATOM 177 CA VAL A 15 8.050 -11.082 -12.936 1.00 0.00 C ATOM 178 C VAL A 15 8.132 -12.483 -13.532 1.00 0.00 C ATOM 179 O VAL A 15 7.116 -13.072 -13.900 1.00 0.00 O ATOM 180 CB VAL A 15 8.084 -11.169 -11.409 1.00 0.00 C ATOM 181 CG1 VAL A 15 8.304 -9.772 -10.826 1.00 0.00 C ATOM 182 CG2 VAL A 15 6.751 -11.727 -10.907 1.00 0.00 C ATOM 0 H VAL A 15 6.030 -11.026 -13.504 1.00 0.00 H new ATOM 0 HA VAL A 15 8.905 -10.503 -13.284 1.00 0.00 H new ATOM 0 HB VAL A 15 8.896 -11.825 -11.096 1.00 0.00 H new ATOM 0 HG11 VAL A 15 8.329 -9.832 -9.738 1.00 0.00 H new ATOM 0 HG12 VAL A 15 9.250 -9.371 -11.189 1.00 0.00 H new ATOM 0 HG13 VAL A 15 7.490 -9.116 -11.135 1.00 0.00 H new ATOM 0 HG21 VAL A 15 6.770 -11.791 -9.819 1.00 0.00 H new ATOM 0 HG22 VAL A 15 5.940 -11.068 -11.218 1.00 0.00 H new ATOM 0 HG23 VAL A 15 6.591 -12.720 -11.326 1.00 0.00 H new ATOM 192 N ASP A 16 9.349 -13.009 -13.618 1.00 0.00 N ATOM 193 CA ASP A 16 9.559 -14.343 -14.162 1.00 0.00 C ATOM 194 C ASP A 16 8.946 -14.467 -15.552 1.00 0.00 C ATOM 195 O ASP A 16 8.493 -15.542 -15.945 1.00 0.00 O ATOM 196 CB ASP A 16 8.942 -15.388 -13.234 1.00 0.00 C ATOM 197 CG ASP A 16 9.767 -15.508 -11.957 1.00 0.00 C ATOM 198 OD1 ASP A 16 10.888 -15.025 -11.948 1.00 0.00 O ATOM 199 OD2 ASP A 16 9.264 -16.081 -11.004 1.00 0.00 O ATOM 0 H ASP A 16 10.201 -12.534 -13.319 1.00 0.00 H new ATOM 0 HA ASP A 16 10.633 -14.514 -14.240 1.00 0.00 H new ATOM 0 HB2 ASP A 16 7.917 -15.108 -12.989 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.897 -16.353 -13.739 1.00 0.00 H new ATOM 204 N ILE A 17 8.933 -13.363 -16.291 1.00 0.00 N ATOM 205 CA ILE A 17 8.367 -13.362 -17.637 1.00 0.00 C ATOM 206 C ILE A 17 9.058 -14.407 -18.504 1.00 0.00 C ATOM 207 O ILE A 17 10.271 -14.602 -18.414 1.00 0.00 O ATOM 208 CB ILE A 17 8.525 -11.980 -18.274 1.00 0.00 C ATOM 209 CG1 ILE A 17 7.711 -10.964 -17.464 1.00 0.00 C ATOM 210 CG2 ILE A 17 8.023 -12.015 -19.724 1.00 0.00 C ATOM 211 CD1 ILE A 17 7.986 -9.537 -17.964 1.00 0.00 C ATOM 0 H ILE A 17 9.304 -12.464 -15.985 1.00 0.00 H new ATOM 0 HA ILE A 17 7.307 -13.605 -17.566 1.00 0.00 H new ATOM 0 HB ILE A 17 9.576 -11.692 -18.274 1.00 0.00 H new ATOM 0 HG12 ILE A 17 6.648 -11.188 -17.551 1.00 0.00 H new ATOM 0 HG13 ILE A 17 7.968 -11.042 -16.408 1.00 0.00 H new ATOM 0 HG21 ILE A 17 8.138 -11.028 -20.173 1.00 0.00 H new ATOM 0 HG22 ILE A 17 8.603 -12.742 -20.292 1.00 0.00 H new ATOM 0 HG23 ILE A 17 6.971 -12.300 -19.738 1.00 0.00 H new ATOM 0 HD11 ILE A 17 7.401 -8.827 -17.379 1.00 0.00 H new ATOM 0 HD12 ILE A 17 9.047 -9.311 -17.854 1.00 0.00 H new ATOM 0 HD13 ILE A 17 7.706 -9.459 -19.015 1.00 0.00 H new ATOM 223 N THR A 18 8.272 -15.084 -19.339 1.00 0.00 N ATOM 224 CA THR A 18 8.805 -16.120 -20.226 1.00 0.00 C ATOM 225 C THR A 18 8.123 -16.056 -21.597 1.00 0.00 C ATOM 226 O THR A 18 7.407 -15.100 -21.903 1.00 0.00 O ATOM 227 CB THR A 18 8.608 -17.513 -19.586 1.00 0.00 C ATOM 228 OG1 THR A 18 8.382 -17.356 -18.192 1.00 0.00 O ATOM 229 CG2 THR A 18 9.857 -18.385 -19.797 1.00 0.00 C ATOM 0 H THR A 18 7.266 -14.935 -19.421 1.00 0.00 H new ATOM 0 HA THR A 18 9.872 -15.947 -20.369 1.00 0.00 H new ATOM 0 HB THR A 18 7.754 -18.000 -20.056 1.00 0.00 H new ATOM 0 HG1 THR A 18 7.501 -16.952 -18.047 1.00 0.00 H new ATOM 0 HG21 THR A 18 9.700 -19.362 -19.340 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.038 -18.509 -20.865 1.00 0.00 H new ATOM 0 HG23 THR A 18 10.719 -17.903 -19.336 1.00 0.00 H new ATOM 237 N ASP A 19 8.345 -17.083 -22.412 1.00 0.00 N ATOM 238 CA ASP A 19 7.743 -17.148 -23.746 1.00 0.00 C ATOM 239 C ASP A 19 6.396 -17.853 -23.694 1.00 0.00 C ATOM 240 O ASP A 19 5.437 -17.433 -24.341 1.00 0.00 O ATOM 241 CB ASP A 19 8.661 -17.909 -24.708 1.00 0.00 C ATOM 242 CG ASP A 19 9.082 -19.232 -24.079 1.00 0.00 C ATOM 243 OD1 ASP A 19 9.342 -19.243 -22.887 1.00 0.00 O ATOM 244 OD2 ASP A 19 9.139 -20.215 -24.799 1.00 0.00 O ATOM 0 H ASP A 19 8.935 -17.881 -22.176 1.00 0.00 H new ATOM 0 HA ASP A 19 7.604 -16.126 -24.100 1.00 0.00 H new ATOM 0 HB2 ASP A 19 8.145 -18.092 -25.650 1.00 0.00 H new ATOM 0 HB3 ASP A 19 9.541 -17.308 -24.938 1.00 0.00 H new ATOM 249 N SER A 20 6.334 -18.941 -22.923 1.00 0.00 N ATOM 250 CA SER A 20 5.104 -19.724 -22.791 1.00 0.00 C ATOM 251 C SER A 20 4.558 -19.658 -21.363 1.00 0.00 C ATOM 252 O SER A 20 3.583 -20.331 -21.035 1.00 0.00 O ATOM 253 CB SER A 20 5.384 -21.179 -23.174 1.00 0.00 C ATOM 254 OG SER A 20 5.452 -21.285 -24.591 1.00 0.00 O ATOM 0 H SER A 20 7.120 -19.299 -22.381 1.00 0.00 H new ATOM 0 HA SER A 20 4.353 -19.304 -23.459 1.00 0.00 H new ATOM 0 HB2 SER A 20 6.321 -21.511 -22.727 1.00 0.00 H new ATOM 0 HB3 SER A 20 4.598 -21.827 -22.786 1.00 0.00 H new ATOM 0 HG SER A 20 4.562 -21.134 -24.973 1.00 0.00 H new ATOM 260 N SER A 21 5.186 -18.837 -20.525 1.00 0.00 N ATOM 261 CA SER A 21 4.757 -18.678 -19.137 1.00 0.00 C ATOM 262 C SER A 21 5.115 -17.290 -18.628 1.00 0.00 C ATOM 263 O SER A 21 6.114 -16.701 -19.040 1.00 0.00 O ATOM 264 CB SER A 21 5.428 -19.726 -18.256 1.00 0.00 C ATOM 265 OG SER A 21 5.102 -19.473 -16.895 1.00 0.00 O ATOM 0 H SER A 21 5.994 -18.271 -20.783 1.00 0.00 H new ATOM 0 HA SER A 21 3.676 -18.808 -19.095 1.00 0.00 H new ATOM 0 HB2 SER A 21 5.097 -20.724 -18.542 1.00 0.00 H new ATOM 0 HB3 SER A 21 6.509 -19.697 -18.395 1.00 0.00 H new ATOM 0 HG SER A 21 5.652 -20.041 -16.316 1.00 0.00 H new ATOM 271 N ILE A 22 4.296 -16.770 -17.728 1.00 0.00 N ATOM 272 CA ILE A 22 4.526 -15.442 -17.151 1.00 0.00 C ATOM 273 C ILE A 22 4.186 -15.448 -15.662 1.00 0.00 C ATOM 274 O ILE A 22 3.264 -16.143 -15.235 1.00 0.00 O ATOM 275 CB ILE A 22 3.662 -14.406 -17.884 1.00 0.00 C ATOM 276 CG1 ILE A 22 2.178 -14.780 -17.770 1.00 0.00 C ATOM 277 CG2 ILE A 22 4.056 -14.371 -19.362 1.00 0.00 C ATOM 278 CD1 ILE A 22 1.325 -13.667 -18.383 1.00 0.00 C ATOM 0 H ILE A 22 3.463 -17.243 -17.377 1.00 0.00 H new ATOM 0 HA ILE A 22 5.578 -15.180 -17.267 1.00 0.00 H new ATOM 0 HB ILE A 22 3.822 -13.427 -17.431 1.00 0.00 H new ATOM 0 HG12 ILE A 22 1.989 -15.723 -18.283 1.00 0.00 H new ATOM 0 HG13 ILE A 22 1.908 -14.926 -16.724 1.00 0.00 H new ATOM 0 HG21 ILE A 22 3.444 -13.636 -19.884 1.00 0.00 H new ATOM 0 HG22 ILE A 22 5.107 -14.097 -19.452 1.00 0.00 H new ATOM 0 HG23 ILE A 22 3.898 -15.355 -19.804 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.270 -13.931 -18.303 1.00 0.00 H new ATOM 0 HD12 ILE A 22 1.507 -12.734 -17.850 1.00 0.00 H new ATOM 0 HD13 ILE A 22 1.589 -13.543 -19.433 1.00 0.00 H new ATOM 290 N GLY A 23 4.933 -14.674 -14.876 1.00 0.00 N ATOM 291 CA GLY A 23 4.698 -14.601 -13.434 1.00 0.00 C ATOM 292 C GLY A 23 3.954 -13.323 -13.066 1.00 0.00 C ATOM 293 O GLY A 23 4.560 -12.341 -12.641 1.00 0.00 O ATOM 0 H GLY A 23 5.701 -14.092 -15.210 1.00 0.00 H new ATOM 0 HA2 GLY A 23 4.121 -15.468 -13.112 1.00 0.00 H new ATOM 0 HA3 GLY A 23 5.650 -14.637 -12.904 1.00 0.00 H new ATOM 297 N LEU A 24 2.635 -13.339 -13.234 1.00 0.00 N ATOM 298 CA LEU A 24 1.829 -12.170 -12.913 1.00 0.00 C ATOM 299 C LEU A 24 1.819 -11.941 -11.406 1.00 0.00 C ATOM 300 O LEU A 24 1.409 -12.812 -10.638 1.00 0.00 O ATOM 301 CB LEU A 24 0.395 -12.377 -13.418 1.00 0.00 C ATOM 302 CG LEU A 24 0.394 -12.521 -14.946 1.00 0.00 C ATOM 303 CD1 LEU A 24 -1.025 -12.854 -15.420 1.00 0.00 C ATOM 304 CD2 LEU A 24 0.868 -11.212 -15.606 1.00 0.00 C ATOM 0 H LEU A 24 2.109 -14.139 -13.586 1.00 0.00 H new ATOM 0 HA LEU A 24 2.259 -11.295 -13.401 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -0.036 -13.267 -12.960 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -0.229 -11.533 -13.123 1.00 0.00 H new ATOM 0 HG LEU A 24 1.076 -13.323 -15.231 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.031 -12.957 -16.505 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -1.351 -13.789 -14.965 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -1.704 -12.053 -15.128 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.862 -11.328 -16.690 1.00 0.00 H new ATOM 0 HD22 LEU A 24 0.198 -10.399 -15.325 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.879 -10.981 -15.271 1.00 0.00 H new ATOM 316 N ARG A 25 2.271 -10.761 -10.981 1.00 0.00 N ATOM 317 CA ARG A 25 2.313 -10.430 -9.559 1.00 0.00 C ATOM 318 C ARG A 25 1.960 -8.962 -9.345 1.00 0.00 C ATOM 319 O ARG A 25 2.410 -8.088 -10.086 1.00 0.00 O ATOM 320 CB ARG A 25 3.713 -10.702 -9.002 1.00 0.00 C ATOM 321 CG ARG A 25 3.708 -10.478 -7.488 1.00 0.00 C ATOM 322 CD ARG A 25 5.033 -10.961 -6.896 1.00 0.00 C ATOM 323 NE ARG A 25 5.086 -10.669 -5.466 1.00 0.00 N ATOM 324 CZ ARG A 25 4.566 -11.502 -4.568 1.00 0.00 C ATOM 325 NH1 ARG A 25 3.985 -12.602 -4.960 1.00 0.00 N ATOM 326 NH2 ARG A 25 4.637 -11.216 -3.296 1.00 0.00 N ATOM 0 H ARG A 25 2.611 -10.023 -11.598 1.00 0.00 H new ATOM 0 HA ARG A 25 1.585 -11.051 -9.037 1.00 0.00 H new ATOM 0 HB2 ARG A 25 4.015 -11.725 -9.229 1.00 0.00 H new ATOM 0 HB3 ARG A 25 4.440 -10.043 -9.476 1.00 0.00 H new ATOM 0 HG2 ARG A 25 3.563 -9.421 -7.267 1.00 0.00 H new ATOM 0 HG3 ARG A 25 2.877 -11.016 -7.033 1.00 0.00 H new ATOM 0 HD2 ARG A 25 5.143 -12.033 -7.059 1.00 0.00 H new ATOM 0 HD3 ARG A 25 5.865 -10.474 -7.405 1.00 0.00 H new ATOM 0 HE ARG A 25 5.531 -9.808 -5.149 1.00 0.00 H new ATOM 0 HH11 ARG A 25 3.930 -12.823 -5.954 1.00 0.00 H new ATOM 0 HH12 ARG A 25 3.586 -13.241 -4.272 1.00 0.00 H new ATOM 0 HH21 ARG A 25 5.091 -10.355 -2.991 1.00 0.00 H new ATOM 0 HH22 ARG A 25 4.239 -11.854 -2.607 1.00 0.00 H new ATOM 340 N TRP A 26 1.150 -8.704 -8.322 1.00 0.00 N ATOM 341 CA TRP A 26 0.736 -7.336 -7.996 1.00 0.00 C ATOM 342 C TRP A 26 0.659 -7.186 -6.480 1.00 0.00 C ATOM 343 O TRP A 26 0.583 -8.176 -5.763 1.00 0.00 O ATOM 344 CB TRP A 26 -0.633 -7.000 -8.626 1.00 0.00 C ATOM 345 CG TRP A 26 -1.771 -7.472 -7.760 1.00 0.00 C ATOM 346 CD1 TRP A 26 -1.789 -8.604 -7.021 1.00 0.00 C ATOM 347 CD2 TRP A 26 -3.050 -6.815 -7.517 1.00 0.00 C ATOM 348 NE1 TRP A 26 -3.000 -8.691 -6.360 1.00 0.00 N ATOM 349 CE2 TRP A 26 -3.807 -7.612 -6.627 1.00 0.00 C ATOM 350 CE3 TRP A 26 -3.623 -5.620 -7.982 1.00 0.00 C ATOM 351 CZ2 TRP A 26 -5.083 -7.236 -6.212 1.00 0.00 C ATOM 352 CZ3 TRP A 26 -4.909 -5.238 -7.564 1.00 0.00 C ATOM 353 CH2 TRP A 26 -5.636 -6.047 -6.678 1.00 0.00 C ATOM 0 H TRP A 26 0.766 -9.419 -7.704 1.00 0.00 H new ATOM 0 HA TRP A 26 1.471 -6.643 -8.404 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -0.711 -5.923 -8.776 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -0.706 -7.465 -9.609 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -0.987 -9.324 -6.957 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -3.263 -9.463 -5.748 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -3.072 -4.991 -8.665 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -5.640 -7.864 -5.532 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -5.340 -4.317 -7.927 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -6.623 -5.748 -6.358 1.00 0.00 H new ATOM 364 N THR A 27 0.672 -5.949 -5.999 1.00 0.00 N ATOM 365 CA THR A 27 0.575 -5.694 -4.565 1.00 0.00 C ATOM 366 C THR A 27 -0.863 -5.283 -4.238 1.00 0.00 C ATOM 367 O THR A 27 -1.254 -4.151 -4.521 1.00 0.00 O ATOM 368 CB THR A 27 1.506 -4.547 -4.173 1.00 0.00 C ATOM 369 OG1 THR A 27 2.759 -4.698 -4.828 1.00 0.00 O ATOM 370 CG2 THR A 27 1.714 -4.553 -2.661 1.00 0.00 C ATOM 0 H THR A 27 0.748 -5.111 -6.575 1.00 0.00 H new ATOM 0 HA THR A 27 0.856 -6.594 -4.019 1.00 0.00 H new ATOM 0 HB THR A 27 1.057 -3.600 -4.474 1.00 0.00 H new ATOM 0 HG1 THR A 27 3.352 -3.960 -4.575 1.00 0.00 H new ATOM 0 HG21 THR A 27 2.378 -3.735 -2.382 1.00 0.00 H new ATOM 0 HG22 THR A 27 0.754 -4.428 -2.161 1.00 0.00 H new ATOM 0 HG23 THR A 27 2.159 -5.501 -2.359 1.00 0.00 H new ATOM 378 N PRO A 28 -1.671 -6.146 -3.679 1.00 0.00 N ATOM 379 CA PRO A 28 -3.084 -5.782 -3.368 1.00 0.00 C ATOM 380 C PRO A 28 -3.195 -4.519 -2.506 1.00 0.00 C ATOM 381 O PRO A 28 -2.308 -4.224 -1.704 1.00 0.00 O ATOM 382 CB PRO A 28 -3.640 -7.001 -2.619 1.00 0.00 C ATOM 383 CG PRO A 28 -2.753 -8.143 -3.005 1.00 0.00 C ATOM 384 CD PRO A 28 -1.371 -7.544 -3.296 1.00 0.00 C ATOM 0 HA PRO A 28 -3.638 -5.550 -4.278 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -3.626 -6.840 -1.541 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -4.675 -7.196 -2.899 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -2.696 -8.878 -2.202 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -3.144 -8.659 -3.882 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.722 -7.590 -2.421 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -0.863 -8.079 -4.098 1.00 0.00 H new ATOM 392 N LEU A 29 -4.292 -3.775 -2.685 1.00 0.00 N ATOM 393 CA LEU A 29 -4.514 -2.543 -1.931 1.00 0.00 C ATOM 394 C LEU A 29 -5.204 -2.827 -0.618 1.00 0.00 C ATOM 395 O LEU A 29 -6.192 -3.555 -0.554 1.00 0.00 O ATOM 396 CB LEU A 29 -5.382 -1.567 -2.734 1.00 0.00 C ATOM 397 CG LEU A 29 -4.755 -1.320 -4.104 1.00 0.00 C ATOM 398 CD1 LEU A 29 -5.671 -0.400 -4.919 1.00 0.00 C ATOM 399 CD2 LEU A 29 -3.375 -0.672 -3.927 1.00 0.00 C ATOM 0 H LEU A 29 -5.036 -4.006 -3.344 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.536 -2.100 -1.740 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -6.387 -1.973 -2.852 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -5.480 -0.625 -2.194 1.00 0.00 H new ATOM 0 HG LEU A 29 -4.635 -2.266 -4.633 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -5.228 -0.220 -5.899 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -6.645 -0.873 -5.043 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -5.792 0.549 -4.396 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.928 -0.496 -4.905 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -3.483 0.277 -3.401 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -2.733 -1.336 -3.349 1.00 0.00 H new ATOM 411 N ASN A 30 -4.674 -2.235 0.429 1.00 0.00 N ATOM 412 CA ASN A 30 -5.230 -2.402 1.756 1.00 0.00 C ATOM 413 C ASN A 30 -6.743 -2.221 1.720 1.00 0.00 C ATOM 414 O ASN A 30 -7.478 -2.878 2.458 1.00 0.00 O ATOM 415 CB ASN A 30 -4.604 -1.358 2.670 1.00 0.00 C ATOM 416 CG ASN A 30 -5.189 -1.469 4.069 1.00 0.00 C ATOM 417 OD1 ASN A 30 -6.243 -0.898 4.343 1.00 0.00 O ATOM 418 ND2 ASN A 30 -4.575 -2.175 4.981 1.00 0.00 N ATOM 0 H ASN A 30 -3.854 -1.630 0.388 1.00 0.00 H new ATOM 0 HA ASN A 30 -5.015 -3.404 2.126 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -3.524 -1.497 2.707 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -4.783 -0.360 2.271 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -4.970 -2.252 5.918 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -3.701 -2.649 4.756 1.00 0.00 H new ATOM 425 N SER A 31 -7.199 -1.335 0.837 1.00 0.00 N ATOM 426 CA SER A 31 -8.626 -1.086 0.684 1.00 0.00 C ATOM 427 C SER A 31 -9.267 -2.163 -0.188 1.00 0.00 C ATOM 428 O SER A 31 -10.418 -2.538 0.030 1.00 0.00 O ATOM 429 CB SER A 31 -8.855 0.287 0.052 1.00 0.00 C ATOM 430 OG SER A 31 -8.317 1.290 0.901 1.00 0.00 O ATOM 0 H SER A 31 -6.603 -0.782 0.221 1.00 0.00 H new ATOM 0 HA SER A 31 -9.086 -1.110 1.672 1.00 0.00 H new ATOM 0 HB2 SER A 31 -8.382 0.332 -0.929 1.00 0.00 H new ATOM 0 HB3 SER A 31 -9.921 0.457 -0.100 1.00 0.00 H new ATOM 0 HG SER A 31 -8.461 2.172 0.498 1.00 0.00 H new ATOM 436 N SER A 32 -8.518 -2.657 -1.176 1.00 0.00 N ATOM 437 CA SER A 32 -9.044 -3.686 -2.068 1.00 0.00 C ATOM 438 C SER A 32 -9.505 -4.892 -1.258 1.00 0.00 C ATOM 439 O SER A 32 -8.751 -5.437 -0.451 1.00 0.00 O ATOM 440 CB SER A 32 -7.974 -4.115 -3.088 1.00 0.00 C ATOM 441 OG SER A 32 -7.927 -3.161 -4.141 1.00 0.00 O ATOM 0 H SER A 32 -7.561 -2.366 -1.375 1.00 0.00 H new ATOM 0 HA SER A 32 -9.895 -3.273 -2.610 1.00 0.00 H new ATOM 0 HB2 SER A 32 -7.000 -4.189 -2.603 1.00 0.00 H new ATOM 0 HB3 SER A 32 -8.208 -5.103 -3.485 1.00 0.00 H new ATOM 0 HG SER A 32 -7.246 -3.427 -4.794 1.00 0.00 H new ATOM 447 N THR A 33 -10.746 -5.301 -1.486 1.00 0.00 N ATOM 448 CA THR A 33 -11.314 -6.445 -0.782 1.00 0.00 C ATOM 449 C THR A 33 -10.511 -7.707 -1.099 1.00 0.00 C ATOM 450 O THR A 33 -9.881 -7.798 -2.152 1.00 0.00 O ATOM 451 CB THR A 33 -12.775 -6.619 -1.201 1.00 0.00 C ATOM 452 OG1 THR A 33 -13.463 -5.392 -1.009 1.00 0.00 O ATOM 453 CG2 THR A 33 -13.436 -7.708 -0.350 1.00 0.00 C ATOM 0 H THR A 33 -11.379 -4.859 -2.152 1.00 0.00 H new ATOM 0 HA THR A 33 -11.269 -6.272 0.293 1.00 0.00 H new ATOM 0 HB THR A 33 -12.817 -6.910 -2.251 1.00 0.00 H new ATOM 0 HG1 THR A 33 -13.701 -5.295 -0.063 1.00 0.00 H new ATOM 0 HG21 THR A 33 -14.476 -7.826 -0.654 1.00 0.00 H new ATOM 0 HG22 THR A 33 -12.907 -8.651 -0.491 1.00 0.00 H new ATOM 0 HG23 THR A 33 -13.396 -7.423 0.701 1.00 0.00 H new ATOM 461 N ILE A 34 -10.510 -8.664 -0.168 1.00 0.00 N ATOM 462 CA ILE A 34 -9.746 -9.903 -0.341 1.00 0.00 C ATOM 463 C ILE A 34 -10.631 -11.040 -0.860 1.00 0.00 C ATOM 464 O ILE A 34 -11.267 -11.744 -0.076 1.00 0.00 O ATOM 465 CB ILE A 34 -9.151 -10.307 1.011 1.00 0.00 C ATOM 466 CG1 ILE A 34 -8.447 -9.101 1.649 1.00 0.00 C ATOM 467 CG2 ILE A 34 -8.144 -11.441 0.821 1.00 0.00 C ATOM 468 CD1 ILE A 34 -7.453 -8.477 0.663 1.00 0.00 C ATOM 0 H ILE A 34 -11.027 -8.606 0.709 1.00 0.00 H new ATOM 0 HA ILE A 34 -8.959 -9.725 -1.074 1.00 0.00 H new ATOM 0 HB ILE A 34 -9.955 -10.646 1.664 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.186 -8.358 1.949 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.924 -9.414 2.553 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.726 -11.722 1.788 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -8.645 -12.302 0.378 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -7.342 -11.109 0.161 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -6.963 -7.624 1.132 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.704 -9.218 0.384 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.985 -8.145 -0.229 1.00 0.00 H new ATOM 480 N ILE A 35 -10.654 -11.221 -2.186 1.00 0.00 N ATOM 481 CA ILE A 35 -11.450 -12.285 -2.804 1.00 0.00 C ATOM 482 C ILE A 35 -10.658 -12.969 -3.914 1.00 0.00 C ATOM 483 O ILE A 35 -9.758 -12.375 -4.502 1.00 0.00 O ATOM 484 CB ILE A 35 -12.738 -11.707 -3.397 1.00 0.00 C ATOM 485 CG1 ILE A 35 -12.411 -10.474 -4.264 1.00 0.00 C ATOM 486 CG2 ILE A 35 -13.690 -11.333 -2.260 1.00 0.00 C ATOM 487 CD1 ILE A 35 -12.407 -9.194 -3.424 1.00 0.00 C ATOM 0 H ILE A 35 -10.133 -10.646 -2.848 1.00 0.00 H new ATOM 0 HA ILE A 35 -11.696 -13.014 -2.032 1.00 0.00 H new ATOM 0 HB ILE A 35 -13.219 -12.451 -4.032 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -11.437 -10.606 -4.736 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -13.144 -10.384 -5.065 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -14.609 -10.921 -2.676 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -13.924 -12.222 -1.674 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -13.217 -10.590 -1.619 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -12.174 -8.341 -4.061 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -13.389 -9.052 -2.973 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -11.656 -9.276 -2.639 1.00 0.00 H new ATOM 499 N GLY A 36 -11.000 -14.216 -4.208 1.00 0.00 N ATOM 500 CA GLY A 36 -10.303 -14.944 -5.255 1.00 0.00 C ATOM 501 C GLY A 36 -10.500 -14.281 -6.610 1.00 0.00 C ATOM 502 O GLY A 36 -11.606 -14.252 -7.152 1.00 0.00 O ATOM 0 H GLY A 36 -11.744 -14.737 -3.744 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -9.239 -14.992 -5.022 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -10.668 -15.970 -5.293 1.00 0.00 H new ATOM 506 N TYR A 37 -9.410 -13.756 -7.157 1.00 0.00 N ATOM 507 CA TYR A 37 -9.457 -13.100 -8.458 1.00 0.00 C ATOM 508 C TYR A 37 -9.423 -14.140 -9.569 1.00 0.00 C ATOM 509 O TYR A 37 -8.715 -15.142 -9.472 1.00 0.00 O ATOM 510 CB TYR A 37 -8.269 -12.149 -8.620 1.00 0.00 C ATOM 511 CG TYR A 37 -8.423 -10.979 -7.677 1.00 0.00 C ATOM 512 CD1 TYR A 37 -9.422 -10.027 -7.908 1.00 0.00 C ATOM 513 CD2 TYR A 37 -7.565 -10.843 -6.579 1.00 0.00 C ATOM 514 CE1 TYR A 37 -9.565 -8.938 -7.040 1.00 0.00 C ATOM 515 CE2 TYR A 37 -7.709 -9.756 -5.709 1.00 0.00 C ATOM 516 CZ TYR A 37 -8.709 -8.802 -5.940 1.00 0.00 C ATOM 517 OH TYR A 37 -8.850 -7.729 -5.086 1.00 0.00 O ATOM 0 H TYR A 37 -8.487 -13.771 -6.723 1.00 0.00 H new ATOM 0 HA TYR A 37 -10.383 -12.529 -8.521 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -7.338 -12.676 -8.412 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -8.212 -11.794 -9.649 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -10.083 -10.132 -8.756 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -6.792 -11.577 -6.403 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -10.336 -8.203 -7.219 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -7.050 -9.653 -4.860 1.00 0.00 H new ATOM 0 HH TYR A 37 -9.196 -8.040 -4.224 1.00 0.00 H new ATOM 527 N ARG A 38 -10.191 -13.895 -10.627 1.00 0.00 N ATOM 528 CA ARG A 38 -10.243 -14.818 -11.757 1.00 0.00 C ATOM 529 C ARG A 38 -9.476 -14.255 -12.941 1.00 0.00 C ATOM 530 O ARG A 38 -9.799 -13.184 -13.451 1.00 0.00 O ATOM 531 CB ARG A 38 -11.698 -15.058 -12.168 1.00 0.00 C ATOM 532 CG ARG A 38 -11.759 -15.972 -13.416 1.00 0.00 C ATOM 533 CD ARG A 38 -12.067 -15.143 -14.671 1.00 0.00 C ATOM 534 NE ARG A 38 -13.341 -14.446 -14.515 1.00 0.00 N ATOM 535 CZ ARG A 38 -14.497 -15.071 -14.719 1.00 0.00 C ATOM 536 NH1 ARG A 38 -14.508 -16.336 -15.042 1.00 0.00 N ATOM 537 NH2 ARG A 38 -15.620 -14.423 -14.586 1.00 0.00 N ATOM 0 H ARG A 38 -10.783 -13.070 -10.726 1.00 0.00 H new ATOM 0 HA ARG A 38 -9.787 -15.760 -11.452 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -12.245 -15.518 -11.345 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -12.185 -14.106 -12.381 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -10.810 -16.493 -13.540 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -12.525 -16.735 -13.279 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -11.268 -14.422 -14.844 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -12.104 -15.793 -15.545 1.00 0.00 H new ATOM 0 HE ARG A 38 -13.344 -13.462 -14.245 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -13.630 -16.846 -15.138 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -15.395 -16.815 -15.198 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -15.612 -13.437 -14.326 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -16.507 -14.902 -14.742 1.00 0.00 H new ATOM 551 N ILE A 39 -8.456 -14.988 -13.371 1.00 0.00 N ATOM 552 CA ILE A 39 -7.635 -14.570 -14.503 1.00 0.00 C ATOM 553 C ILE A 39 -8.146 -15.232 -15.782 1.00 0.00 C ATOM 554 O ILE A 39 -8.232 -16.454 -15.861 1.00 0.00 O ATOM 555 CB ILE A 39 -6.176 -14.977 -14.237 1.00 0.00 C ATOM 556 CG1 ILE A 39 -6.021 -16.492 -14.464 1.00 0.00 C ATOM 557 CG2 ILE A 39 -5.802 -14.625 -12.787 1.00 0.00 C ATOM 558 CD1 ILE A 39 -4.756 -17.003 -13.784 1.00 0.00 C ATOM 0 H ILE A 39 -8.177 -15.876 -12.953 1.00 0.00 H new ATOM 0 HA ILE A 39 -7.692 -13.488 -14.626 1.00 0.00 H new ATOM 0 HB ILE A 39 -5.515 -14.441 -14.917 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -6.891 -17.016 -14.069 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -5.979 -16.704 -15.532 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -4.768 -14.913 -12.598 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -5.914 -13.552 -12.633 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -6.459 -15.160 -12.102 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -4.660 -18.075 -13.953 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -3.888 -16.491 -14.199 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -4.815 -16.808 -12.713 1.00 0.00 H new ATOM 570 N THR A 40 -8.493 -14.423 -16.776 1.00 0.00 N ATOM 571 CA THR A 40 -9.010 -14.948 -18.040 1.00 0.00 C ATOM 572 C THR A 40 -7.990 -14.754 -19.156 1.00 0.00 C ATOM 573 O THR A 40 -7.433 -13.668 -19.320 1.00 0.00 O ATOM 574 CB THR A 40 -10.319 -14.240 -18.395 1.00 0.00 C ATOM 575 OG1 THR A 40 -11.273 -14.469 -17.363 1.00 0.00 O ATOM 576 CG2 THR A 40 -10.851 -14.793 -19.715 1.00 0.00 C ATOM 0 H THR A 40 -8.427 -13.406 -16.735 1.00 0.00 H new ATOM 0 HA THR A 40 -9.198 -16.016 -17.927 1.00 0.00 H new ATOM 0 HB THR A 40 -10.142 -13.169 -18.495 1.00 0.00 H new ATOM 0 HG1 THR A 40 -12.112 -14.015 -17.587 1.00 0.00 H new ATOM 0 HG21 THR A 40 -11.784 -14.290 -19.971 1.00 0.00 H new ATOM 0 HG22 THR A 40 -10.118 -14.621 -20.503 1.00 0.00 H new ATOM 0 HG23 THR A 40 -11.031 -15.863 -19.615 1.00 0.00 H new ATOM 584 N VAL A 41 -7.743 -15.825 -19.914 1.00 0.00 N ATOM 585 CA VAL A 41 -6.779 -15.794 -21.018 1.00 0.00 C ATOM 586 C VAL A 41 -7.412 -16.335 -22.296 1.00 0.00 C ATOM 587 O VAL A 41 -8.217 -17.266 -22.255 1.00 0.00 O ATOM 588 CB VAL A 41 -5.538 -16.622 -20.638 1.00 0.00 C ATOM 589 CG1 VAL A 41 -5.975 -17.950 -19.999 1.00 0.00 C ATOM 590 CG2 VAL A 41 -4.690 -16.895 -21.895 1.00 0.00 C ATOM 0 H VAL A 41 -8.199 -16.728 -19.783 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.478 -14.762 -21.201 1.00 0.00 H new ATOM 0 HB VAL A 41 -4.938 -16.063 -19.920 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.093 -18.533 -19.732 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -6.561 -17.747 -19.103 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -6.581 -18.513 -20.709 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.813 -17.481 -21.622 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -5.284 -17.449 -22.622 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.372 -15.948 -22.332 1.00 0.00 H new ATOM 600 N VAL A 42 -7.040 -15.748 -23.438 1.00 0.00 N ATOM 601 CA VAL A 42 -7.569 -16.184 -24.726 1.00 0.00 C ATOM 602 C VAL A 42 -6.435 -16.353 -25.724 1.00 0.00 C ATOM 603 O VAL A 42 -5.585 -15.473 -25.871 1.00 0.00 O ATOM 604 CB VAL A 42 -8.580 -15.153 -25.248 1.00 0.00 C ATOM 605 CG1 VAL A 42 -8.892 -15.414 -26.729 1.00 0.00 C ATOM 606 CG2 VAL A 42 -9.873 -15.258 -24.432 1.00 0.00 C ATOM 0 H VAL A 42 -6.378 -14.974 -23.493 1.00 0.00 H new ATOM 0 HA VAL A 42 -8.071 -17.143 -24.599 1.00 0.00 H new ATOM 0 HB VAL A 42 -8.154 -14.155 -25.147 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -9.610 -14.675 -27.085 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -7.975 -15.339 -27.313 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -9.313 -16.413 -26.842 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -10.595 -14.528 -24.798 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -10.287 -16.261 -24.534 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -9.658 -15.060 -23.382 1.00 0.00 H new ATOM 616 N ALA A 43 -6.431 -17.484 -26.414 1.00 0.00 N ATOM 617 CA ALA A 43 -5.413 -17.768 -27.414 1.00 0.00 C ATOM 618 C ALA A 43 -5.964 -17.446 -28.800 1.00 0.00 C ATOM 619 O ALA A 43 -7.126 -17.729 -29.084 1.00 0.00 O ATOM 620 CB ALA A 43 -5.033 -19.248 -27.335 1.00 0.00 C ATOM 0 H ALA A 43 -7.125 -18.223 -26.299 1.00 0.00 H new ATOM 0 HA ALA A 43 -4.529 -17.158 -27.230 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -4.270 -19.468 -28.082 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -4.643 -19.471 -26.342 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -5.914 -19.861 -27.525 1.00 0.00 H new ATOM 626 N ALA A 44 -5.138 -16.859 -29.666 1.00 0.00 N ATOM 627 CA ALA A 44 -5.589 -16.520 -31.013 1.00 0.00 C ATOM 628 C ALA A 44 -5.151 -17.587 -32.016 1.00 0.00 C ATOM 629 O ALA A 44 -5.696 -17.680 -33.116 1.00 0.00 O ATOM 630 CB ALA A 44 -5.032 -15.158 -31.431 1.00 0.00 C ATOM 0 H ALA A 44 -4.169 -16.612 -29.463 1.00 0.00 H new ATOM 0 HA ALA A 44 -6.678 -16.475 -31.005 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -5.376 -14.917 -32.437 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -5.380 -14.394 -30.736 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -3.943 -15.191 -31.418 1.00 0.00 H new ATOM 636 N GLY A 45 -4.160 -18.393 -31.625 1.00 0.00 N ATOM 637 CA GLY A 45 -3.647 -19.461 -32.489 1.00 0.00 C ATOM 638 C GLY A 45 -4.264 -20.808 -32.110 1.00 0.00 C ATOM 639 O GLY A 45 -3.642 -21.860 -32.264 1.00 0.00 O ATOM 0 H GLY A 45 -3.698 -18.327 -30.718 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -3.873 -19.233 -33.531 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -2.562 -19.516 -32.403 1.00 0.00 H new ATOM 643 N GLU A 46 -5.500 -20.763 -31.614 1.00 0.00 N ATOM 644 CA GLU A 46 -6.201 -21.982 -31.214 1.00 0.00 C ATOM 645 C GLU A 46 -7.695 -21.850 -31.466 1.00 0.00 C ATOM 646 O GLU A 46 -8.259 -20.758 -31.392 1.00 0.00 O ATOM 647 CB GLU A 46 -5.967 -22.265 -29.729 1.00 0.00 C ATOM 648 CG GLU A 46 -4.479 -22.108 -29.402 1.00 0.00 C ATOM 649 CD GLU A 46 -4.225 -22.497 -27.948 1.00 0.00 C ATOM 650 OE1 GLU A 46 -5.169 -22.908 -27.291 1.00 0.00 O ATOM 651 OE2 GLU A 46 -3.093 -22.377 -27.510 1.00 0.00 O ATOM 0 H GLU A 46 -6.033 -19.903 -31.480 1.00 0.00 H new ATOM 0 HA GLU A 46 -5.809 -22.806 -31.810 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -6.557 -21.580 -29.121 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.298 -23.274 -29.485 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -3.883 -22.735 -30.065 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -4.167 -21.078 -29.572 1.00 0.00 H new ATOM 658 N GLY A 47 -8.332 -22.975 -31.764 1.00 0.00 N ATOM 659 CA GLY A 47 -9.763 -22.982 -32.021 1.00 0.00 C ATOM 660 C GLY A 47 -10.550 -22.691 -30.745 1.00 0.00 C ATOM 661 O GLY A 47 -11.710 -22.278 -30.804 1.00 0.00 O ATOM 0 H GLY A 47 -7.882 -23.888 -31.833 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -10.004 -22.236 -32.779 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -10.059 -23.951 -32.422 1.00 0.00 H new ATOM 665 N ILE A 48 -9.915 -22.908 -29.588 1.00 0.00 N ATOM 666 CA ILE A 48 -10.578 -22.661 -28.299 1.00 0.00 C ATOM 667 C ILE A 48 -9.621 -21.942 -27.330 1.00 0.00 C ATOM 668 O ILE A 48 -8.426 -22.239 -27.295 1.00 0.00 O ATOM 669 CB ILE A 48 -11.063 -24.019 -27.696 1.00 0.00 C ATOM 670 CG1 ILE A 48 -12.585 -24.149 -27.854 1.00 0.00 C ATOM 671 CG2 ILE A 48 -10.719 -24.156 -26.202 1.00 0.00 C ATOM 672 CD1 ILE A 48 -12.996 -25.611 -27.642 1.00 0.00 C ATOM 0 H ILE A 48 -8.957 -23.249 -29.515 1.00 0.00 H new ATOM 0 HA ILE A 48 -11.442 -22.015 -28.456 1.00 0.00 H new ATOM 0 HB ILE A 48 -10.545 -24.807 -28.242 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -13.093 -23.509 -27.133 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -12.889 -23.815 -28.846 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -11.078 -25.117 -25.833 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -9.639 -24.097 -26.071 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -11.197 -23.351 -25.643 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -14.076 -25.705 -27.754 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -12.499 -26.240 -28.381 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -12.706 -25.929 -26.641 1.00 0.00 H new ATOM 684 N PRO A 49 -10.119 -21.002 -26.551 1.00 0.00 N ATOM 685 CA PRO A 49 -9.290 -20.251 -25.557 1.00 0.00 C ATOM 686 C PRO A 49 -8.935 -21.112 -24.349 1.00 0.00 C ATOM 687 O PRO A 49 -9.567 -22.139 -24.100 1.00 0.00 O ATOM 688 CB PRO A 49 -10.185 -19.071 -25.152 1.00 0.00 C ATOM 689 CG PRO A 49 -11.575 -19.575 -25.339 1.00 0.00 C ATOM 690 CD PRO A 49 -11.518 -20.529 -26.536 1.00 0.00 C ATOM 0 HA PRO A 49 -8.333 -19.936 -25.972 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -10.006 -18.774 -24.119 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -9.993 -18.196 -25.773 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -11.927 -20.090 -24.445 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -12.266 -18.754 -25.527 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -12.218 -21.357 -26.420 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -11.777 -20.020 -27.464 1.00 0.00 H new ATOM 698 N ILE A 50 -7.924 -20.685 -23.600 1.00 0.00 N ATOM 699 CA ILE A 50 -7.496 -21.422 -22.417 1.00 0.00 C ATOM 700 C ILE A 50 -8.463 -21.186 -21.261 1.00 0.00 C ATOM 701 O ILE A 50 -9.107 -20.140 -21.182 1.00 0.00 O ATOM 702 CB ILE A 50 -6.084 -21.001 -22.012 1.00 0.00 C ATOM 703 CG1 ILE A 50 -5.091 -21.426 -23.096 1.00 0.00 C ATOM 704 CG2 ILE A 50 -5.709 -21.675 -20.687 1.00 0.00 C ATOM 705 CD1 ILE A 50 -3.734 -20.777 -22.823 1.00 0.00 C ATOM 0 H ILE A 50 -7.389 -19.838 -23.789 1.00 0.00 H new ATOM 0 HA ILE A 50 -7.492 -22.485 -22.657 1.00 0.00 H new ATOM 0 HB ILE A 50 -6.051 -19.918 -21.893 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.992 -22.511 -23.108 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -5.458 -21.128 -24.078 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -4.702 -21.375 -20.398 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.414 -21.372 -19.913 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.744 -22.758 -20.807 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -3.025 -21.078 -23.594 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -3.841 -19.692 -22.832 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -3.367 -21.097 -21.848 1.00 0.00 H new ATOM 717 N PHE A 51 -8.564 -22.168 -20.367 1.00 0.00 N ATOM 718 CA PHE A 51 -9.464 -22.064 -19.221 1.00 0.00 C ATOM 719 C PHE A 51 -8.944 -21.042 -18.219 1.00 0.00 C ATOM 720 O PHE A 51 -7.737 -20.886 -18.047 1.00 0.00 O ATOM 721 CB PHE A 51 -9.586 -23.422 -18.527 1.00 0.00 C ATOM 722 CG PHE A 51 -10.048 -24.460 -19.519 1.00 0.00 C ATOM 723 CD1 PHE A 51 -11.408 -24.578 -19.827 1.00 0.00 C ATOM 724 CD2 PHE A 51 -9.114 -25.304 -20.128 1.00 0.00 C ATOM 725 CE1 PHE A 51 -11.834 -25.543 -20.749 1.00 0.00 C ATOM 726 CE2 PHE A 51 -9.539 -26.269 -21.048 1.00 0.00 C ATOM 727 CZ PHE A 51 -10.900 -26.388 -21.359 1.00 0.00 C ATOM 0 H PHE A 51 -8.037 -23.040 -20.414 1.00 0.00 H new ATOM 0 HA PHE A 51 -10.440 -21.744 -19.585 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -8.625 -23.712 -18.103 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -10.292 -23.356 -17.699 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -12.128 -23.926 -19.355 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -8.065 -25.211 -19.888 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -12.883 -25.635 -20.989 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -8.818 -26.922 -21.518 1.00 0.00 H new ATOM 0 HZ PHE A 51 -11.228 -27.132 -22.070 1.00 0.00 H new ATOM 737 N GLU A 52 -9.872 -20.353 -17.559 1.00 0.00 N ATOM 738 CA GLU A 52 -9.519 -19.348 -16.562 1.00 0.00 C ATOM 739 C GLU A 52 -9.240 -20.001 -15.216 1.00 0.00 C ATOM 740 O GLU A 52 -9.866 -20.996 -14.847 1.00 0.00 O ATOM 741 CB GLU A 52 -10.659 -18.324 -16.440 1.00 0.00 C ATOM 742 CG GLU A 52 -11.801 -18.890 -15.589 1.00 0.00 C ATOM 743 CD GLU A 52 -12.232 -20.244 -16.141 1.00 0.00 C ATOM 744 OE1 GLU A 52 -12.500 -20.319 -17.327 1.00 0.00 O ATOM 745 OE2 GLU A 52 -12.288 -21.185 -15.366 1.00 0.00 O ATOM 0 H GLU A 52 -10.875 -20.473 -17.698 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.611 -18.835 -16.880 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.283 -17.405 -15.990 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -11.030 -18.065 -17.431 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -11.478 -18.995 -14.553 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -12.645 -18.200 -15.591 1.00 0.00 H new ATOM 752 N ASP A 53 -8.287 -19.430 -14.491 1.00 0.00 N ATOM 753 CA ASP A 53 -7.904 -19.947 -13.182 1.00 0.00 C ATOM 754 C ASP A 53 -8.296 -18.957 -12.082 1.00 0.00 C ATOM 755 O ASP A 53 -8.396 -17.753 -12.319 1.00 0.00 O ATOM 756 CB ASP A 53 -6.381 -20.203 -13.174 1.00 0.00 C ATOM 757 CG ASP A 53 -6.077 -21.703 -13.249 1.00 0.00 C ATOM 758 OD1 ASP A 53 -6.715 -22.451 -12.526 1.00 0.00 O ATOM 759 OD2 ASP A 53 -5.212 -22.079 -14.025 1.00 0.00 O ATOM 0 H ASP A 53 -7.763 -18.606 -14.788 1.00 0.00 H new ATOM 0 HA ASP A 53 -8.428 -20.883 -12.987 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.918 -19.692 -14.018 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -5.943 -19.784 -12.268 1.00 0.00 H new ATOM 764 N PHE A 54 -8.526 -19.486 -10.879 1.00 0.00 N ATOM 765 CA PHE A 54 -8.915 -18.664 -9.729 1.00 0.00 C ATOM 766 C PHE A 54 -7.874 -18.783 -8.619 1.00 0.00 C ATOM 767 O PHE A 54 -7.503 -19.892 -8.227 1.00 0.00 O ATOM 768 CB PHE A 54 -10.274 -19.132 -9.204 1.00 0.00 C ATOM 769 CG PHE A 54 -11.200 -19.395 -10.367 1.00 0.00 C ATOM 770 CD1 PHE A 54 -11.012 -20.532 -11.162 1.00 0.00 C ATOM 771 CD2 PHE A 54 -12.244 -18.507 -10.654 1.00 0.00 C ATOM 772 CE1 PHE A 54 -11.866 -20.782 -12.243 1.00 0.00 C ATOM 773 CE2 PHE A 54 -13.098 -18.755 -11.736 1.00 0.00 C ATOM 774 CZ PHE A 54 -12.910 -19.893 -12.530 1.00 0.00 C ATOM 0 H PHE A 54 -8.450 -20.482 -10.674 1.00 0.00 H new ATOM 0 HA PHE A 54 -8.980 -17.623 -10.044 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -10.154 -20.037 -8.609 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -10.703 -18.374 -8.548 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -10.207 -21.217 -10.941 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -12.391 -17.630 -10.041 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -11.720 -21.660 -12.855 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -13.902 -18.068 -11.958 1.00 0.00 H new ATOM 0 HZ PHE A 54 -13.570 -20.085 -13.363 1.00 0.00 H new ATOM 784 N VAL A 55 -7.400 -17.642 -8.120 1.00 0.00 N ATOM 785 CA VAL A 55 -6.392 -17.629 -7.057 1.00 0.00 C ATOM 786 C VAL A 55 -6.802 -16.683 -5.932 1.00 0.00 C ATOM 787 O VAL A 55 -7.308 -15.589 -6.184 1.00 0.00 O ATOM 788 CB VAL A 55 -5.042 -17.187 -7.635 1.00 0.00 C ATOM 789 CG1 VAL A 55 -5.070 -15.685 -7.945 1.00 0.00 C ATOM 790 CG2 VAL A 55 -3.935 -17.472 -6.617 1.00 0.00 C ATOM 0 H VAL A 55 -7.696 -16.717 -8.432 1.00 0.00 H new ATOM 0 HA VAL A 55 -6.306 -18.636 -6.648 1.00 0.00 H new ATOM 0 HB VAL A 55 -4.850 -17.740 -8.555 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -4.107 -15.380 -8.355 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -5.856 -15.478 -8.672 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -5.267 -15.128 -7.029 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -2.975 -17.158 -7.026 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.135 -16.921 -5.698 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -3.906 -18.540 -6.401 1.00 0.00 H new ATOM 800 N ASP A 56 -6.576 -17.108 -4.696 1.00 0.00 N ATOM 801 CA ASP A 56 -6.917 -16.288 -3.540 1.00 0.00 C ATOM 802 C ASP A 56 -6.184 -14.950 -3.606 1.00 0.00 C ATOM 803 O ASP A 56 -5.029 -14.884 -4.026 1.00 0.00 O ATOM 804 CB ASP A 56 -6.547 -17.026 -2.254 1.00 0.00 C ATOM 805 CG ASP A 56 -7.478 -18.219 -2.056 1.00 0.00 C ATOM 806 OD1 ASP A 56 -8.664 -18.065 -2.300 1.00 0.00 O ATOM 807 OD2 ASP A 56 -6.991 -19.267 -1.669 1.00 0.00 O ATOM 0 H ASP A 56 -6.160 -18.011 -4.468 1.00 0.00 H new ATOM 0 HA ASP A 56 -7.990 -16.098 -3.546 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -5.512 -17.365 -2.303 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -6.621 -16.350 -1.402 1.00 0.00 H new ATOM 812 N SER A 57 -6.864 -13.887 -3.184 1.00 0.00 N ATOM 813 CA SER A 57 -6.277 -12.550 -3.192 1.00 0.00 C ATOM 814 C SER A 57 -5.040 -12.498 -2.301 1.00 0.00 C ATOM 815 O SER A 57 -4.076 -11.790 -2.597 1.00 0.00 O ATOM 816 CB SER A 57 -7.302 -11.526 -2.697 1.00 0.00 C ATOM 817 OG SER A 57 -6.627 -10.332 -2.325 1.00 0.00 O ATOM 0 H SER A 57 -7.821 -13.925 -2.833 1.00 0.00 H new ATOM 0 HA SER A 57 -5.985 -12.312 -4.215 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.032 -11.317 -3.479 1.00 0.00 H new ATOM 0 HB3 SER A 57 -7.853 -11.927 -1.846 1.00 0.00 H new ATOM 0 HG SER A 57 -7.218 -9.564 -2.470 1.00 0.00 H new ATOM 823 N SER A 58 -5.080 -13.245 -1.201 1.00 0.00 N ATOM 824 CA SER A 58 -3.962 -13.275 -0.262 1.00 0.00 C ATOM 825 C SER A 58 -2.671 -13.682 -0.965 1.00 0.00 C ATOM 826 O SER A 58 -1.589 -13.211 -0.614 1.00 0.00 O ATOM 827 CB SER A 58 -4.259 -14.266 0.864 1.00 0.00 C ATOM 828 OG SER A 58 -5.306 -13.753 1.676 1.00 0.00 O ATOM 0 H SER A 58 -5.870 -13.835 -0.939 1.00 0.00 H new ATOM 0 HA SER A 58 -3.835 -12.274 0.149 1.00 0.00 H new ATOM 0 HB2 SER A 58 -4.546 -15.232 0.448 1.00 0.00 H new ATOM 0 HB3 SER A 58 -3.364 -14.431 1.465 1.00 0.00 H new ATOM 0 HG SER A 58 -5.500 -14.386 2.398 1.00 0.00 H new ATOM 834 N VAL A 59 -2.790 -14.558 -1.954 1.00 0.00 N ATOM 835 CA VAL A 59 -1.621 -15.020 -2.693 1.00 0.00 C ATOM 836 C VAL A 59 -0.951 -13.852 -3.413 1.00 0.00 C ATOM 837 O VAL A 59 0.270 -13.707 -3.370 1.00 0.00 O ATOM 838 CB VAL A 59 -2.027 -16.093 -3.710 1.00 0.00 C ATOM 839 CG1 VAL A 59 -0.806 -16.521 -4.533 1.00 0.00 C ATOM 840 CG2 VAL A 59 -2.585 -17.309 -2.965 1.00 0.00 C ATOM 0 H VAL A 59 -3.675 -14.960 -2.262 1.00 0.00 H new ATOM 0 HA VAL A 59 -0.913 -15.451 -1.985 1.00 0.00 H new ATOM 0 HB VAL A 59 -2.786 -15.686 -4.378 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -1.102 -17.284 -5.253 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -0.404 -15.658 -5.063 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -0.043 -16.926 -3.868 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -2.875 -18.075 -3.684 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -1.821 -17.709 -2.298 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -3.456 -17.010 -2.382 1.00 0.00 H new ATOM 850 N GLY A 60 -1.755 -13.024 -4.074 1.00 0.00 N ATOM 851 CA GLY A 60 -1.217 -11.875 -4.795 1.00 0.00 C ATOM 852 C GLY A 60 -0.271 -12.327 -5.903 1.00 0.00 C ATOM 853 O GLY A 60 0.602 -11.571 -6.332 1.00 0.00 O ATOM 0 H GLY A 60 -2.769 -13.125 -4.125 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -2.034 -11.293 -5.222 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -0.687 -11.221 -4.103 1.00 0.00 H new ATOM 857 N TYR A 61 -0.437 -13.568 -6.357 1.00 0.00 N ATOM 858 CA TYR A 61 0.423 -14.104 -7.407 1.00 0.00 C ATOM 859 C TYR A 61 -0.171 -15.369 -8.023 1.00 0.00 C ATOM 860 O TYR A 61 -0.868 -16.133 -7.357 1.00 0.00 O ATOM 861 CB TYR A 61 1.808 -14.417 -6.819 1.00 0.00 C ATOM 862 CG TYR A 61 2.592 -15.319 -7.753 1.00 0.00 C ATOM 863 CD1 TYR A 61 3.128 -14.806 -8.938 1.00 0.00 C ATOM 864 CD2 TYR A 61 2.782 -16.669 -7.430 1.00 0.00 C ATOM 865 CE1 TYR A 61 3.853 -15.636 -9.800 1.00 0.00 C ATOM 866 CE2 TYR A 61 3.507 -17.501 -8.290 1.00 0.00 C ATOM 867 CZ TYR A 61 4.044 -16.984 -9.474 1.00 0.00 C ATOM 868 OH TYR A 61 4.760 -17.803 -10.324 1.00 0.00 O ATOM 0 H TYR A 61 -1.150 -14.214 -6.018 1.00 0.00 H new ATOM 0 HA TYR A 61 0.510 -13.355 -8.194 1.00 0.00 H new ATOM 0 HB2 TYR A 61 2.357 -13.490 -6.654 1.00 0.00 H new ATOM 0 HB3 TYR A 61 1.696 -14.899 -5.848 1.00 0.00 H new ATOM 0 HD1 TYR A 61 2.982 -13.766 -9.189 1.00 0.00 H new ATOM 0 HD2 TYR A 61 2.368 -17.068 -6.516 1.00 0.00 H new ATOM 0 HE1 TYR A 61 4.265 -15.237 -10.715 1.00 0.00 H new ATOM 0 HE2 TYR A 61 3.652 -18.542 -8.040 1.00 0.00 H new ATOM 0 HH TYR A 61 4.395 -18.712 -10.287 1.00 0.00 H new ATOM 878 N TYR A 62 0.134 -15.588 -9.298 1.00 0.00 N ATOM 879 CA TYR A 62 -0.346 -16.773 -9.995 1.00 0.00 C ATOM 880 C TYR A 62 0.557 -17.092 -11.181 1.00 0.00 C ATOM 881 O TYR A 62 1.210 -16.207 -11.733 1.00 0.00 O ATOM 882 CB TYR A 62 -1.784 -16.570 -10.485 1.00 0.00 C ATOM 883 CG TYR A 62 -2.416 -17.920 -10.752 1.00 0.00 C ATOM 884 CD1 TYR A 62 -2.740 -18.761 -9.682 1.00 0.00 C ATOM 885 CD2 TYR A 62 -2.669 -18.328 -12.063 1.00 0.00 C ATOM 886 CE1 TYR A 62 -3.321 -20.012 -9.925 1.00 0.00 C ATOM 887 CE2 TYR A 62 -3.251 -19.578 -12.309 1.00 0.00 C ATOM 888 CZ TYR A 62 -3.574 -20.421 -11.238 1.00 0.00 C ATOM 889 OH TYR A 62 -4.146 -21.652 -11.479 1.00 0.00 O ATOM 0 H TYR A 62 0.708 -14.964 -9.865 1.00 0.00 H new ATOM 0 HA TYR A 62 -0.328 -17.607 -9.294 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -2.362 -16.026 -9.738 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -1.789 -15.967 -11.393 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.542 -18.445 -8.668 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -2.416 -17.679 -12.888 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -3.573 -20.660 -9.099 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -3.450 -19.891 -13.323 1.00 0.00 H new ATOM 0 HH TYR A 62 -4.726 -21.896 -10.727 1.00 0.00 H new ATOM 899 N THR A 63 0.584 -18.362 -11.572 1.00 0.00 N ATOM 900 CA THR A 63 1.397 -18.805 -12.702 1.00 0.00 C ATOM 901 C THR A 63 0.500 -19.361 -13.799 1.00 0.00 C ATOM 902 O THR A 63 -0.382 -20.179 -13.538 1.00 0.00 O ATOM 903 CB THR A 63 2.378 -19.892 -12.258 1.00 0.00 C ATOM 904 OG1 THR A 63 3.279 -19.353 -11.300 1.00 0.00 O ATOM 905 CG2 THR A 63 3.161 -20.401 -13.476 1.00 0.00 C ATOM 0 H THR A 63 0.051 -19.106 -11.122 1.00 0.00 H new ATOM 0 HA THR A 63 1.956 -17.950 -13.082 1.00 0.00 H new ATOM 0 HB THR A 63 1.829 -20.720 -11.810 1.00 0.00 H new ATOM 0 HG1 THR A 63 3.538 -18.447 -11.568 1.00 0.00 H new ATOM 0 HG21 THR A 63 3.860 -21.176 -13.161 1.00 0.00 H new ATOM 0 HG22 THR A 63 2.467 -20.814 -14.208 1.00 0.00 H new ATOM 0 HG23 THR A 63 3.712 -19.575 -13.925 1.00 0.00 H new ATOM 913 N VAL A 64 0.748 -18.925 -15.029 1.00 0.00 N ATOM 914 CA VAL A 64 -0.020 -19.393 -16.181 1.00 0.00 C ATOM 915 C VAL A 64 0.941 -19.822 -17.289 1.00 0.00 C ATOM 916 O VAL A 64 1.654 -18.994 -17.858 1.00 0.00 O ATOM 917 CB VAL A 64 -0.953 -18.271 -16.683 1.00 0.00 C ATOM 918 CG1 VAL A 64 -2.318 -18.361 -15.975 1.00 0.00 C ATOM 919 CG2 VAL A 64 -0.309 -16.906 -16.387 1.00 0.00 C ATOM 0 H VAL A 64 1.476 -18.247 -15.256 1.00 0.00 H new ATOM 0 HA VAL A 64 -0.632 -20.246 -15.889 1.00 0.00 H new ATOM 0 HB VAL A 64 -1.104 -18.383 -17.757 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -2.969 -17.565 -16.337 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.775 -19.328 -16.187 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -2.178 -18.255 -14.899 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -0.965 -16.110 -16.740 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -0.157 -16.801 -15.313 1.00 0.00 H new ATOM 0 HG23 VAL A 64 0.651 -16.838 -16.898 1.00 0.00 H new ATOM 929 N THR A 65 0.955 -21.120 -17.593 1.00 0.00 N ATOM 930 CA THR A 65 1.836 -21.651 -18.634 1.00 0.00 C ATOM 931 C THR A 65 1.031 -22.410 -19.671 1.00 0.00 C ATOM 932 O THR A 65 -0.089 -22.850 -19.407 1.00 0.00 O ATOM 933 CB THR A 65 2.878 -22.600 -18.031 1.00 0.00 C ATOM 934 OG1 THR A 65 2.316 -23.899 -17.919 1.00 0.00 O ATOM 935 CG2 THR A 65 3.295 -22.113 -16.642 1.00 0.00 C ATOM 0 H THR A 65 0.370 -21.820 -17.136 1.00 0.00 H new ATOM 0 HA THR A 65 2.341 -20.807 -19.103 1.00 0.00 H new ATOM 0 HB THR A 65 3.754 -22.625 -18.679 1.00 0.00 H new ATOM 0 HG1 THR A 65 2.979 -24.510 -17.535 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.035 -22.795 -16.224 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.725 -21.115 -16.720 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.422 -22.082 -15.990 1.00 0.00 H new ATOM 943 N GLY A 66 1.612 -22.558 -20.853 1.00 0.00 N ATOM 944 CA GLY A 66 0.953 -23.265 -21.944 1.00 0.00 C ATOM 945 C GLY A 66 0.504 -22.291 -23.028 1.00 0.00 C ATOM 946 O GLY A 66 -0.572 -22.442 -23.606 1.00 0.00 O ATOM 0 H GLY A 66 2.539 -22.198 -21.082 1.00 0.00 H new ATOM 0 HA2 GLY A 66 1.634 -24.001 -22.370 1.00 0.00 H new ATOM 0 HA3 GLY A 66 0.092 -23.812 -21.561 1.00 0.00 H new ATOM 950 N LEU A 67 1.342 -21.297 -23.310 1.00 0.00 N ATOM 951 CA LEU A 67 1.034 -20.306 -24.347 1.00 0.00 C ATOM 952 C LEU A 67 2.011 -20.485 -25.500 1.00 0.00 C ATOM 953 O LEU A 67 3.193 -20.162 -25.373 1.00 0.00 O ATOM 954 CB LEU A 67 1.160 -18.890 -23.789 1.00 0.00 C ATOM 955 CG LEU A 67 0.539 -18.820 -22.396 1.00 0.00 C ATOM 956 CD1 LEU A 67 0.702 -17.404 -21.846 1.00 0.00 C ATOM 957 CD2 LEU A 67 -0.949 -19.163 -22.481 1.00 0.00 C ATOM 0 H LEU A 67 2.236 -21.153 -22.840 1.00 0.00 H new ATOM 0 HA LEU A 67 0.010 -20.453 -24.692 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.210 -18.601 -23.743 1.00 0.00 H new ATOM 0 HB3 LEU A 67 0.663 -18.183 -24.453 1.00 0.00 H new ATOM 0 HG LEU A 67 1.037 -19.532 -21.737 1.00 0.00 H new ATOM 0 HD11 LEU A 67 0.260 -17.347 -20.851 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.762 -17.156 -21.787 1.00 0.00 H new ATOM 0 HD13 LEU A 67 0.200 -16.697 -22.507 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.391 -19.113 -21.486 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.450 -18.451 -23.137 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -1.068 -20.170 -22.881 1.00 0.00 H new ATOM 969 N GLU A 68 1.530 -21.027 -26.607 1.00 0.00 N ATOM 970 CA GLU A 68 2.393 -21.278 -27.751 1.00 0.00 C ATOM 971 C GLU A 68 3.137 -20.009 -28.191 1.00 0.00 C ATOM 972 O GLU A 68 2.539 -18.933 -28.272 1.00 0.00 O ATOM 973 CB GLU A 68 1.571 -21.808 -28.926 1.00 0.00 C ATOM 974 CG GLU A 68 0.645 -22.929 -28.460 1.00 0.00 C ATOM 975 CD GLU A 68 1.449 -24.018 -27.763 1.00 0.00 C ATOM 976 OE1 GLU A 68 1.735 -23.857 -26.588 1.00 0.00 O ATOM 977 OE2 GLU A 68 1.766 -24.999 -28.414 1.00 0.00 O ATOM 0 H GLU A 68 0.556 -21.300 -26.738 1.00 0.00 H new ATOM 0 HA GLU A 68 3.129 -22.021 -27.445 1.00 0.00 H new ATOM 0 HB2 GLU A 68 0.984 -21.000 -29.362 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.236 -22.177 -29.707 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.107 -22.530 -27.780 1.00 0.00 H new ATOM 0 HG3 GLU A 68 0.112 -23.349 -29.313 1.00 0.00 H new ATOM 984 N PRO A 69 4.418 -20.111 -28.499 1.00 0.00 N ATOM 985 CA PRO A 69 5.233 -18.949 -28.962 1.00 0.00 C ATOM 986 C PRO A 69 4.898 -18.568 -30.394 1.00 0.00 C ATOM 987 O PRO A 69 4.450 -19.397 -31.188 1.00 0.00 O ATOM 988 CB PRO A 69 6.677 -19.447 -28.834 1.00 0.00 C ATOM 989 CG PRO A 69 6.578 -20.911 -29.082 1.00 0.00 C ATOM 990 CD PRO A 69 5.239 -21.340 -28.457 1.00 0.00 C ATOM 0 HA PRO A 69 5.047 -18.046 -28.381 1.00 0.00 H new ATOM 0 HB2 PRO A 69 7.332 -18.963 -29.559 1.00 0.00 H new ATOM 0 HB3 PRO A 69 7.085 -19.237 -27.846 1.00 0.00 H new ATOM 0 HG2 PRO A 69 6.602 -21.131 -30.149 1.00 0.00 H new ATOM 0 HG3 PRO A 69 7.413 -21.444 -28.627 1.00 0.00 H new ATOM 0 HD2 PRO A 69 4.776 -22.150 -29.021 1.00 0.00 H new ATOM 0 HD3 PRO A 69 5.371 -21.698 -27.436 1.00 0.00 H new ATOM 998 N GLY A 70 5.136 -17.310 -30.719 1.00 0.00 N ATOM 999 CA GLY A 70 4.868 -16.822 -32.059 1.00 0.00 C ATOM 1000 C GLY A 70 3.366 -16.721 -32.329 1.00 0.00 C ATOM 1001 O GLY A 70 2.945 -16.474 -33.461 1.00 0.00 O ATOM 0 H GLY A 70 5.512 -16.612 -30.078 1.00 0.00 H new ATOM 0 HA2 GLY A 70 5.329 -15.843 -32.190 1.00 0.00 H new ATOM 0 HA3 GLY A 70 5.326 -17.490 -32.789 1.00 0.00 H new ATOM 1005 N ILE A 71 2.561 -16.914 -31.282 1.00 0.00 N ATOM 1006 CA ILE A 71 1.098 -16.845 -31.406 1.00 0.00 C ATOM 1007 C ILE A 71 0.588 -15.680 -30.567 1.00 0.00 C ATOM 1008 O ILE A 71 1.114 -15.388 -29.491 1.00 0.00 O ATOM 1009 CB ILE A 71 0.456 -18.181 -30.933 1.00 0.00 C ATOM 1010 CG1 ILE A 71 0.471 -19.234 -32.062 1.00 0.00 C ATOM 1011 CG2 ILE A 71 -1.011 -17.962 -30.510 1.00 0.00 C ATOM 1012 CD1 ILE A 71 1.868 -19.852 -32.203 1.00 0.00 C ATOM 0 H ILE A 71 2.894 -17.119 -30.340 1.00 0.00 H new ATOM 0 HA ILE A 71 0.823 -16.688 -32.449 1.00 0.00 H new ATOM 0 HB ILE A 71 1.044 -18.535 -30.087 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -0.259 -20.015 -31.848 1.00 0.00 H new ATOM 0 HG13 ILE A 71 0.175 -18.771 -33.003 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -1.441 -18.909 -30.183 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -1.050 -17.244 -29.691 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -1.580 -17.579 -31.357 1.00 0.00 H new ATOM 0 HD11 ILE A 71 1.859 -20.592 -33.003 1.00 0.00 H new ATOM 0 HD12 ILE A 71 2.590 -19.070 -32.439 1.00 0.00 H new ATOM 0 HD13 ILE A 71 2.149 -20.334 -31.267 1.00 0.00 H new ATOM 1024 N ASP A 72 -0.436 -15.025 -31.076 1.00 0.00 N ATOM 1025 CA ASP A 72 -1.034 -13.890 -30.400 1.00 0.00 C ATOM 1026 C ASP A 72 -2.011 -14.370 -29.331 1.00 0.00 C ATOM 1027 O ASP A 72 -3.047 -14.950 -29.636 1.00 0.00 O ATOM 1028 CB ASP A 72 -1.751 -13.028 -31.442 1.00 0.00 C ATOM 1029 CG ASP A 72 -2.606 -11.965 -30.764 1.00 0.00 C ATOM 1030 OD1 ASP A 72 -3.487 -12.336 -30.007 1.00 0.00 O ATOM 1031 OD2 ASP A 72 -2.376 -10.794 -31.020 1.00 0.00 O ATOM 0 H ASP A 72 -0.876 -15.262 -31.965 1.00 0.00 H new ATOM 0 HA ASP A 72 -0.263 -13.299 -29.906 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -1.019 -12.552 -32.094 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -2.378 -13.658 -32.074 1.00 0.00 H new ATOM 1036 N TYR A 73 -1.665 -14.131 -28.070 1.00 0.00 N ATOM 1037 CA TYR A 73 -2.509 -14.542 -26.951 1.00 0.00 C ATOM 1038 C TYR A 73 -3.180 -13.330 -26.321 1.00 0.00 C ATOM 1039 O TYR A 73 -2.516 -12.415 -25.855 1.00 0.00 O ATOM 1040 CB TYR A 73 -1.652 -15.247 -25.881 1.00 0.00 C ATOM 1041 CG TYR A 73 -1.580 -16.732 -26.147 1.00 0.00 C ATOM 1042 CD1 TYR A 73 -0.640 -17.241 -27.047 1.00 0.00 C ATOM 1043 CD2 TYR A 73 -2.455 -17.600 -25.480 1.00 0.00 C ATOM 1044 CE1 TYR A 73 -0.573 -18.618 -27.283 1.00 0.00 C ATOM 1045 CE2 TYR A 73 -2.388 -18.974 -25.716 1.00 0.00 C ATOM 1046 CZ TYR A 73 -1.448 -19.482 -26.619 1.00 0.00 C ATOM 1047 OH TYR A 73 -1.388 -20.839 -26.851 1.00 0.00 O ATOM 0 H TYR A 73 -0.806 -13.655 -27.796 1.00 0.00 H new ATOM 0 HA TYR A 73 -3.271 -15.224 -27.327 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -0.647 -14.824 -25.876 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -2.077 -15.070 -24.893 1.00 0.00 H new ATOM 0 HD1 TYR A 73 0.034 -16.571 -27.560 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -3.181 -17.206 -24.784 1.00 0.00 H new ATOM 0 HE1 TYR A 73 0.154 -19.013 -27.977 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -3.061 -19.644 -25.202 1.00 0.00 H new ATOM 0 HH TYR A 73 -2.289 -21.221 -26.792 1.00 0.00 H new ATOM 1057 N ASP A 74 -4.497 -13.344 -26.335 1.00 0.00 N ATOM 1058 CA ASP A 74 -5.294 -12.266 -25.766 1.00 0.00 C ATOM 1059 C ASP A 74 -5.557 -12.555 -24.292 1.00 0.00 C ATOM 1060 O ASP A 74 -6.235 -13.523 -23.957 1.00 0.00 O ATOM 1061 CB ASP A 74 -6.613 -12.173 -26.542 1.00 0.00 C ATOM 1062 CG ASP A 74 -6.446 -11.278 -27.774 1.00 0.00 C ATOM 1063 OD1 ASP A 74 -5.925 -10.184 -27.621 1.00 0.00 O ATOM 1064 OD2 ASP A 74 -6.847 -11.697 -28.848 1.00 0.00 O ATOM 0 H ASP A 74 -5.049 -14.100 -26.740 1.00 0.00 H new ATOM 0 HA ASP A 74 -4.764 -11.317 -25.842 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -6.933 -13.169 -26.849 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -7.394 -11.772 -25.897 1.00 0.00 H new ATOM 1069 N ILE A 75 -5.015 -11.712 -23.410 1.00 0.00 N ATOM 1070 CA ILE A 75 -5.192 -11.900 -21.970 1.00 0.00 C ATOM 1071 C ILE A 75 -6.052 -10.781 -21.389 1.00 0.00 C ATOM 1072 O ILE A 75 -6.296 -9.761 -22.035 1.00 0.00 O ATOM 1073 CB ILE A 75 -3.822 -11.970 -21.252 1.00 0.00 C ATOM 1074 CG1 ILE A 75 -2.775 -11.178 -22.060 1.00 0.00 C ATOM 1075 CG2 ILE A 75 -3.368 -13.436 -21.103 1.00 0.00 C ATOM 1076 CD1 ILE A 75 -2.207 -12.028 -23.204 1.00 0.00 C ATOM 0 H ILE A 75 -4.454 -10.899 -23.666 1.00 0.00 H new ATOM 0 HA ILE A 75 -5.705 -12.848 -21.808 1.00 0.00 H new ATOM 0 HB ILE A 75 -3.921 -11.533 -20.258 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -3.230 -10.274 -22.465 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.966 -10.860 -21.402 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.403 -13.468 -20.596 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -4.104 -13.987 -20.518 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -3.275 -13.890 -22.089 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.471 -11.446 -23.759 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -1.731 -12.919 -22.794 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -3.015 -12.324 -23.873 1.00 0.00 H new ATOM 1088 N SER A 76 -6.491 -10.991 -20.158 1.00 0.00 N ATOM 1089 CA SER A 76 -7.312 -10.011 -19.462 1.00 0.00 C ATOM 1090 C SER A 76 -7.156 -10.166 -17.957 1.00 0.00 C ATOM 1091 O SER A 76 -6.887 -11.262 -17.465 1.00 0.00 O ATOM 1092 CB SER A 76 -8.777 -10.192 -19.861 1.00 0.00 C ATOM 1093 OG SER A 76 -9.112 -11.568 -19.789 1.00 0.00 O ATOM 0 H SER A 76 -6.292 -11.833 -19.618 1.00 0.00 H new ATOM 0 HA SER A 76 -6.985 -9.010 -19.743 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.421 -9.613 -19.199 1.00 0.00 H new ATOM 0 HB3 SER A 76 -8.940 -9.818 -20.872 1.00 0.00 H new ATOM 0 HG SER A 76 -8.343 -12.075 -19.455 1.00 0.00 H new ATOM 1099 N VAL A 77 -7.334 -9.069 -17.226 1.00 0.00 N ATOM 1100 CA VAL A 77 -7.220 -9.100 -15.767 1.00 0.00 C ATOM 1101 C VAL A 77 -8.442 -8.397 -15.162 1.00 0.00 C ATOM 1102 O VAL A 77 -8.511 -7.169 -15.141 1.00 0.00 O ATOM 1103 CB VAL A 77 -5.929 -8.377 -15.326 1.00 0.00 C ATOM 1104 CG1 VAL A 77 -5.370 -9.021 -14.048 1.00 0.00 C ATOM 1105 CG2 VAL A 77 -4.883 -8.455 -16.442 1.00 0.00 C ATOM 0 H VAL A 77 -7.556 -8.152 -17.615 1.00 0.00 H new ATOM 0 HA VAL A 77 -7.178 -10.133 -15.422 1.00 0.00 H new ATOM 0 HB VAL A 77 -6.164 -7.332 -15.123 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.460 -8.502 -13.747 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -6.109 -8.948 -13.250 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.144 -10.070 -14.238 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -3.974 -7.943 -16.125 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.656 -9.499 -16.655 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.274 -7.978 -17.341 1.00 0.00 H new ATOM 1115 N ILE A 78 -9.404 -9.178 -14.681 1.00 0.00 N ATOM 1116 CA ILE A 78 -10.613 -8.604 -14.090 1.00 0.00 C ATOM 1117 C ILE A 78 -10.391 -8.308 -12.614 1.00 0.00 C ATOM 1118 O ILE A 78 -10.034 -9.198 -11.841 1.00 0.00 O ATOM 1119 CB ILE A 78 -11.788 -9.574 -14.249 1.00 0.00 C ATOM 1120 CG1 ILE A 78 -12.103 -9.745 -15.735 1.00 0.00 C ATOM 1121 CG2 ILE A 78 -13.017 -9.015 -13.530 1.00 0.00 C ATOM 1122 CD1 ILE A 78 -13.070 -10.915 -15.922 1.00 0.00 C ATOM 0 H ILE A 78 -9.374 -10.198 -14.687 1.00 0.00 H new ATOM 0 HA ILE A 78 -10.843 -7.673 -14.608 1.00 0.00 H new ATOM 0 HB ILE A 78 -11.524 -10.539 -13.816 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -12.542 -8.830 -16.132 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -11.185 -9.926 -16.294 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -13.852 -9.707 -13.645 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -12.793 -8.889 -12.471 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -13.284 -8.050 -13.962 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -13.294 -11.036 -16.982 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -12.614 -11.829 -15.541 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -13.992 -10.715 -15.377 1.00 0.00 H new ATOM 1134 N THR A 79 -10.608 -7.052 -12.223 1.00 0.00 N ATOM 1135 CA THR A 79 -10.434 -6.650 -10.825 1.00 0.00 C ATOM 1136 C THR A 79 -11.793 -6.462 -10.165 1.00 0.00 C ATOM 1137 O THR A 79 -12.513 -5.509 -10.463 1.00 0.00 O ATOM 1138 CB THR A 79 -9.661 -5.335 -10.750 1.00 0.00 C ATOM 1139 OG1 THR A 79 -8.389 -5.494 -11.364 1.00 0.00 O ATOM 1140 CG2 THR A 79 -9.474 -4.931 -9.286 1.00 0.00 C ATOM 0 H THR A 79 -10.902 -6.301 -12.847 1.00 0.00 H new ATOM 0 HA THR A 79 -9.878 -7.431 -10.306 1.00 0.00 H new ATOM 0 HB THR A 79 -10.221 -4.558 -11.271 1.00 0.00 H new ATOM 0 HG1 THR A 79 -7.895 -4.649 -11.317 1.00 0.00 H new ATOM 0 HG21 THR A 79 -8.922 -3.992 -9.235 1.00 0.00 H new ATOM 0 HG22 THR A 79 -10.449 -4.804 -8.816 1.00 0.00 H new ATOM 0 HG23 THR A 79 -8.917 -5.708 -8.762 1.00 0.00 H new ATOM 1148 N LEU A 80 -12.136 -7.380 -9.266 1.00 0.00 N ATOM 1149 CA LEU A 80 -13.413 -7.323 -8.554 1.00 0.00 C ATOM 1150 C LEU A 80 -13.182 -7.251 -7.056 1.00 0.00 C ATOM 1151 O LEU A 80 -12.604 -8.161 -6.464 1.00 0.00 O ATOM 1152 CB LEU A 80 -14.252 -8.563 -8.897 1.00 0.00 C ATOM 1153 CG LEU A 80 -15.660 -8.464 -8.249 1.00 0.00 C ATOM 1154 CD1 LEU A 80 -16.733 -8.969 -9.228 1.00 0.00 C ATOM 1155 CD2 LEU A 80 -15.719 -9.316 -6.970 1.00 0.00 C ATOM 0 H LEU A 80 -11.548 -8.174 -9.012 1.00 0.00 H new ATOM 0 HA LEU A 80 -13.950 -6.427 -8.865 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -14.349 -8.656 -9.979 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -13.745 -9.461 -8.544 1.00 0.00 H new ATOM 0 HG LEU A 80 -15.848 -7.419 -8.004 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -17.715 -8.894 -8.761 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -16.714 -8.362 -10.133 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -16.531 -10.009 -9.484 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -16.711 -9.238 -6.526 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -15.513 -10.358 -7.217 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -14.974 -8.958 -6.259 1.00 0.00 H new ATOM 1167 N ILE A 81 -13.650 -6.165 -6.448 1.00 0.00 N ATOM 1168 CA ILE A 81 -13.510 -5.977 -5.005 1.00 0.00 C ATOM 1169 C ILE A 81 -14.778 -5.362 -4.427 1.00 0.00 C ATOM 1170 O ILE A 81 -15.421 -4.529 -5.065 1.00 0.00 O ATOM 1171 CB ILE A 81 -12.293 -5.093 -4.701 1.00 0.00 C ATOM 1172 CG1 ILE A 81 -12.536 -3.635 -5.171 1.00 0.00 C ATOM 1173 CG2 ILE A 81 -11.066 -5.670 -5.427 1.00 0.00 C ATOM 1174 CD1 ILE A 81 -12.967 -2.747 -3.992 1.00 0.00 C ATOM 0 H ILE A 81 -14.128 -5.403 -6.929 1.00 0.00 H new ATOM 0 HA ILE A 81 -13.356 -6.949 -4.537 1.00 0.00 H new ATOM 0 HB ILE A 81 -12.125 -5.081 -3.624 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -11.626 -3.236 -5.619 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -13.305 -3.620 -5.944 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -10.195 -5.049 -5.218 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -10.881 -6.686 -5.077 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -11.252 -5.684 -6.501 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -13.132 -1.729 -4.345 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -13.890 -3.136 -3.562 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -12.185 -2.746 -3.233 1.00 0.00 H new ATOM 1186 N ASN A 82 -15.138 -5.786 -3.222 1.00 0.00 N ATOM 1187 CA ASN A 82 -16.339 -5.277 -2.574 1.00 0.00 C ATOM 1188 C ASN A 82 -16.199 -3.790 -2.265 1.00 0.00 C ATOM 1189 O ASN A 82 -17.035 -2.980 -2.667 1.00 0.00 O ATOM 1190 CB ASN A 82 -16.575 -6.045 -1.279 1.00 0.00 C ATOM 1191 CG ASN A 82 -17.871 -5.580 -0.627 1.00 0.00 C ATOM 1192 OD1 ASN A 82 -18.606 -4.683 -1.227 1.00 0.00 O flip ATOM 1193 ND2 ASN A 82 -18.221 -6.043 0.456 1.00 0.00 N flip ATOM 0 H ASN A 82 -14.620 -6.476 -2.678 1.00 0.00 H new ATOM 0 HA ASN A 82 -17.185 -5.412 -3.248 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -16.625 -7.114 -1.484 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -15.739 -5.890 -0.597 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -17.644 -6.744 0.922 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -19.088 -5.727 0.889 1.00 0.00 H new ATOM 1457 N GLY B 207 1.633 -0.580 -20.517 1.00 0.00 N ATOM 1458 CA GLY B 207 0.188 -0.351 -20.562 1.00 0.00 C ATOM 1459 C GLY B 207 -0.237 0.639 -19.487 1.00 0.00 C ATOM 1460 O GLY B 207 0.578 1.403 -18.972 1.00 0.00 O ATOM 0 HA2 GLY B 207 -0.094 0.029 -21.544 1.00 0.00 H new ATOM 0 HA3 GLY B 207 -0.339 -1.295 -20.422 1.00 0.00 H new ATOM 1464 N SER B 208 -1.519 0.618 -19.152 1.00 0.00 N ATOM 1465 CA SER B 208 -2.044 1.515 -18.139 1.00 0.00 C ATOM 1466 C SER B 208 -3.410 1.041 -17.655 1.00 0.00 C ATOM 1467 O SER B 208 -4.006 0.136 -18.241 1.00 0.00 O ATOM 1468 CB SER B 208 -2.146 2.927 -18.703 1.00 0.00 C ATOM 1469 OG SER B 208 -2.904 2.902 -19.906 1.00 0.00 O ATOM 0 H SER B 208 -2.210 -0.008 -19.566 1.00 0.00 H new ATOM 0 HA SER B 208 -1.363 1.518 -17.288 1.00 0.00 H new ATOM 0 HB2 SER B 208 -2.619 3.587 -17.976 1.00 0.00 H new ATOM 0 HB3 SER B 208 -1.150 3.326 -18.896 1.00 0.00 H new ATOM 0 HG SER B 208 -2.972 3.810 -20.269 1.00 0.00 H new ATOM 1475 N TRP B 209 -3.910 1.660 -16.590 1.00 0.00 N ATOM 1476 CA TRP B 209 -5.216 1.292 -16.056 1.00 0.00 C ATOM 1477 C TRP B 209 -6.320 2.004 -16.830 1.00 0.00 C ATOM 1478 O TRP B 209 -6.299 3.228 -16.972 1.00 0.00 O ATOM 1479 CB TRP B 209 -5.305 1.663 -14.576 1.00 0.00 C ATOM 1480 CG TRP B 209 -4.469 0.718 -13.779 1.00 0.00 C ATOM 1481 CD1 TRP B 209 -3.162 0.895 -13.502 1.00 0.00 C ATOM 1482 CD2 TRP B 209 -4.854 -0.543 -13.162 1.00 0.00 C ATOM 1483 NE1 TRP B 209 -2.716 -0.173 -12.744 1.00 0.00 N ATOM 1484 CE2 TRP B 209 -3.724 -1.088 -12.508 1.00 0.00 C ATOM 1485 CE3 TRP B 209 -6.063 -1.259 -13.103 1.00 0.00 C ATOM 1486 CZ2 TRP B 209 -3.792 -2.300 -11.819 1.00 0.00 C ATOM 1487 CZ3 TRP B 209 -6.136 -2.481 -12.413 1.00 0.00 C ATOM 1488 CH2 TRP B 209 -5.001 -2.999 -11.772 1.00 0.00 C ATOM 0 H TRP B 209 -3.437 2.410 -16.085 1.00 0.00 H new ATOM 0 HA TRP B 209 -5.343 0.215 -16.162 1.00 0.00 H new ATOM 0 HB2 TRP B 209 -4.962 2.686 -14.425 1.00 0.00 H new ATOM 0 HB3 TRP B 209 -6.341 1.621 -14.241 1.00 0.00 H new ATOM 0 HD1 TRP B 209 -2.561 1.734 -13.820 1.00 0.00 H new ATOM 0 HE1 TRP B 209 -1.760 -0.273 -12.401 1.00 0.00 H new ATOM 0 HE3 TRP B 209 -6.942 -0.867 -13.592 1.00 0.00 H new ATOM 0 HZ2 TRP B 209 -2.916 -2.695 -11.326 1.00 0.00 H new ATOM 0 HZ3 TRP B 209 -7.069 -3.023 -12.376 1.00 0.00 H new ATOM 0 HH2 TRP B 209 -5.062 -3.938 -11.242 1.00 0.00 H new ATOM 1499 N THR B 210 -7.284 1.234 -17.336 1.00 0.00 N ATOM 1500 CA THR B 210 -8.396 1.802 -18.104 1.00 0.00 C ATOM 1501 C THR B 210 -9.694 1.731 -17.307 1.00 0.00 C ATOM 1502 O THR B 210 -9.973 0.730 -16.648 1.00 0.00 O ATOM 1503 CB THR B 210 -8.565 1.033 -19.418 1.00 0.00 C ATOM 1504 OG1 THR B 210 -8.804 -0.337 -19.134 1.00 0.00 O ATOM 1505 CG2 THR B 210 -7.294 1.169 -20.258 1.00 0.00 C ATOM 0 H THR B 210 -7.319 0.220 -17.230 1.00 0.00 H new ATOM 0 HA THR B 210 -8.169 2.847 -18.315 1.00 0.00 H new ATOM 0 HB THR B 210 -9.409 1.442 -19.974 1.00 0.00 H new ATOM 0 HG1 THR B 210 -8.702 -0.494 -18.172 1.00 0.00 H new ATOM 0 HG21 THR B 210 -7.415 0.621 -21.193 1.00 0.00 H new ATOM 0 HG22 THR B 210 -7.112 2.222 -20.475 1.00 0.00 H new ATOM 0 HG23 THR B 210 -6.447 0.761 -19.706 1.00 0.00 H new ATOM 1513 N TRP B 211 -10.483 2.802 -17.378 1.00 0.00 N ATOM 1514 CA TRP B 211 -11.759 2.862 -16.668 1.00 0.00 C ATOM 1515 C TRP B 211 -12.903 2.454 -17.596 1.00 0.00 C ATOM 1516 O TRP B 211 -13.185 3.128 -18.586 1.00 0.00 O ATOM 1517 CB TRP B 211 -11.998 4.286 -16.147 1.00 0.00 C ATOM 1518 CG TRP B 211 -13.401 4.410 -15.640 1.00 0.00 C ATOM 1519 CD1 TRP B 211 -14.363 5.176 -16.203 1.00 0.00 C ATOM 1520 CD2 TRP B 211 -14.016 3.761 -14.492 1.00 0.00 C ATOM 1521 NE1 TRP B 211 -15.531 5.037 -15.476 1.00 0.00 N ATOM 1522 CE2 TRP B 211 -15.368 4.174 -14.410 1.00 0.00 C ATOM 1523 CE3 TRP B 211 -13.540 2.861 -13.522 1.00 0.00 C ATOM 1524 CZ2 TRP B 211 -16.216 3.713 -13.403 1.00 0.00 C ATOM 1525 CZ3 TRP B 211 -14.391 2.392 -12.507 1.00 0.00 C ATOM 1526 CH2 TRP B 211 -15.727 2.818 -12.447 1.00 0.00 C ATOM 0 H TRP B 211 -10.262 3.638 -17.919 1.00 0.00 H new ATOM 0 HA TRP B 211 -11.724 2.170 -15.827 1.00 0.00 H new ATOM 0 HB2 TRP B 211 -11.291 4.515 -15.349 1.00 0.00 H new ATOM 0 HB3 TRP B 211 -11.824 5.009 -16.944 1.00 0.00 H new ATOM 0 HD1 TRP B 211 -14.239 5.796 -17.079 1.00 0.00 H new ATOM 0 HE1 TRP B 211 -16.405 5.513 -15.699 1.00 0.00 H new ATOM 0 HE3 TRP B 211 -12.513 2.528 -13.557 1.00 0.00 H new ATOM 0 HZ2 TRP B 211 -17.243 4.045 -13.362 1.00 0.00 H new ATOM 0 HZ3 TRP B 211 -14.015 1.700 -11.769 1.00 0.00 H new ATOM 0 HH2 TRP B 211 -16.376 2.455 -11.664 1.00 0.00 H new ATOM 1537 N GLU B 212 -13.563 1.351 -17.258 1.00 0.00 N ATOM 1538 CA GLU B 212 -14.684 0.871 -18.059 1.00 0.00 C ATOM 1539 C GLU B 212 -15.510 -0.136 -17.271 1.00 0.00 C ATOM 1540 O GLU B 212 -15.058 -0.661 -16.256 1.00 0.00 O ATOM 1541 CB GLU B 212 -14.154 0.234 -19.371 1.00 0.00 C ATOM 1542 CG GLU B 212 -14.200 -1.308 -19.324 1.00 0.00 C ATOM 1543 CD GLU B 212 -13.366 -1.890 -20.468 1.00 0.00 C ATOM 1544 OE1 GLU B 212 -13.316 -1.267 -21.518 1.00 0.00 O ATOM 1545 OE2 GLU B 212 -12.785 -2.946 -20.276 1.00 0.00 O ATOM 0 H GLU B 212 -13.344 0.777 -16.443 1.00 0.00 H new ATOM 0 HA GLU B 212 -15.328 1.714 -18.310 1.00 0.00 H new ATOM 0 HB2 GLU B 212 -14.749 0.589 -20.213 1.00 0.00 H new ATOM 0 HB3 GLU B 212 -13.129 0.561 -19.545 1.00 0.00 H new ATOM 0 HG2 GLU B 212 -13.818 -1.663 -18.367 1.00 0.00 H new ATOM 0 HG3 GLU B 212 -15.231 -1.652 -19.403 1.00 0.00 H new ATOM 1552 N ASN B 213 -16.694 -0.446 -17.776 1.00 0.00 N ATOM 1553 CA ASN B 213 -17.531 -1.446 -17.135 1.00 0.00 C ATOM 1554 C ASN B 213 -17.667 -1.191 -15.632 1.00 0.00 C ATOM 1555 O ASN B 213 -17.761 -2.133 -14.847 1.00 0.00 O ATOM 1556 CB ASN B 213 -16.904 -2.826 -17.373 1.00 0.00 C ATOM 1557 CG ASN B 213 -17.145 -3.272 -18.812 1.00 0.00 C ATOM 1558 OD1 ASN B 213 -18.299 -3.039 -19.369 1.00 0.00 O flip ATOM 1559 ND2 ASN B 213 -16.258 -3.850 -19.444 1.00 0.00 N flip ATOM 0 H ASN B 213 -17.092 -0.026 -18.616 1.00 0.00 H new ATOM 0 HA ASN B 213 -18.531 -1.396 -17.566 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -15.834 -2.787 -17.171 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -17.333 -3.552 -16.683 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -15.355 -4.031 -19.006 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -16.427 -4.147 -20.405 1.00 0.00 H new ATOM 1566 N GLY B 214 -17.685 0.080 -15.239 1.00 0.00 N ATOM 1567 CA GLY B 214 -17.823 0.427 -13.827 1.00 0.00 C ATOM 1568 C GLY B 214 -16.756 -0.256 -12.973 1.00 0.00 C ATOM 1569 O GLY B 214 -16.850 -0.274 -11.746 1.00 0.00 O ATOM 0 H GLY B 214 -17.607 0.878 -15.869 1.00 0.00 H new ATOM 0 HA2 GLY B 214 -17.748 1.508 -13.708 1.00 0.00 H new ATOM 0 HA3 GLY B 214 -18.813 0.136 -13.475 1.00 0.00 H new ATOM 1573 N LYS B 215 -15.747 -0.825 -13.631 1.00 0.00 N ATOM 1574 CA LYS B 215 -14.665 -1.514 -12.931 1.00 0.00 C ATOM 1575 C LYS B 215 -13.326 -1.251 -13.613 1.00 0.00 C ATOM 1576 O LYS B 215 -13.266 -1.031 -14.821 1.00 0.00 O ATOM 1577 CB LYS B 215 -14.941 -3.016 -12.917 1.00 0.00 C ATOM 1578 CG LYS B 215 -16.232 -3.271 -12.159 1.00 0.00 C ATOM 1579 CD LYS B 215 -16.442 -4.776 -12.011 1.00 0.00 C ATOM 1580 CE LYS B 215 -17.811 -5.030 -11.391 1.00 0.00 C ATOM 1581 NZ LYS B 215 -17.830 -4.511 -9.994 1.00 0.00 N ATOM 0 H LYS B 215 -15.657 -0.822 -14.647 1.00 0.00 H new ATOM 0 HA LYS B 215 -14.617 -1.136 -11.910 1.00 0.00 H new ATOM 0 HB2 LYS B 215 -15.021 -3.394 -13.936 1.00 0.00 H new ATOM 0 HB3 LYS B 215 -14.115 -3.547 -12.444 1.00 0.00 H new ATOM 0 HG2 LYS B 215 -16.190 -2.800 -11.177 1.00 0.00 H new ATOM 0 HG3 LYS B 215 -17.073 -2.825 -12.690 1.00 0.00 H new ATOM 0 HD2 LYS B 215 -16.374 -5.263 -12.984 1.00 0.00 H new ATOM 0 HD3 LYS B 215 -15.660 -5.205 -11.384 1.00 0.00 H new ATOM 0 HE2 LYS B 215 -18.586 -4.541 -11.982 1.00 0.00 H new ATOM 0 HE3 LYS B 215 -18.032 -6.097 -11.396 1.00 0.00 H new ATOM 0 HZ1 LYS B 215 -18.652 -4.900 -9.490 1.00 0.00 H new ATOM 0 HZ2 LYS B 215 -16.958 -4.797 -9.505 1.00 0.00 H new ATOM 0 HZ3 LYS B 215 -17.893 -3.473 -10.010 1.00 0.00 H new ATOM 1595 N TRP B 216 -12.251 -1.278 -12.833 1.00 0.00 N ATOM 1596 CA TRP B 216 -10.918 -1.043 -13.378 1.00 0.00 C ATOM 1597 C TRP B 216 -10.343 -2.339 -13.938 1.00 0.00 C ATOM 1598 O TRP B 216 -10.149 -3.305 -13.207 1.00 0.00 O ATOM 1599 CB TRP B 216 -9.997 -0.507 -12.283 1.00 0.00 C ATOM 1600 CG TRP B 216 -10.577 0.749 -11.726 1.00 0.00 C ATOM 1601 CD1 TRP B 216 -11.694 0.811 -10.970 1.00 0.00 C ATOM 1602 CD2 TRP B 216 -10.094 2.116 -11.860 1.00 0.00 C ATOM 1603 NE1 TRP B 216 -11.930 2.130 -10.629 1.00 0.00 N ATOM 1604 CE2 TRP B 216 -10.971 2.973 -11.155 1.00 0.00 C ATOM 1605 CE3 TRP B 216 -8.992 2.691 -12.518 1.00 0.00 C ATOM 1606 CZ2 TRP B 216 -10.761 4.352 -11.104 1.00 0.00 C ATOM 1607 CZ3 TRP B 216 -8.777 4.079 -12.469 1.00 0.00 C ATOM 1608 CH2 TRP B 216 -9.662 4.907 -11.763 1.00 0.00 C ATOM 0 H TRP B 216 -12.275 -1.459 -11.829 1.00 0.00 H new ATOM 0 HA TRP B 216 -10.992 -0.309 -14.181 1.00 0.00 H new ATOM 0 HB2 TRP B 216 -9.881 -1.249 -11.493 1.00 0.00 H new ATOM 0 HB3 TRP B 216 -9.004 -0.315 -12.689 1.00 0.00 H new ATOM 0 HD1 TRP B 216 -12.303 -0.032 -10.679 1.00 0.00 H new ATOM 0 HE1 TRP B 216 -12.716 2.442 -10.059 1.00 0.00 H new ATOM 0 HE3 TRP B 216 -8.306 2.061 -13.065 1.00 0.00 H new ATOM 0 HZ2 TRP B 216 -11.444 4.986 -10.558 1.00 0.00 H new ATOM 0 HZ3 TRP B 216 -7.927 4.510 -12.977 1.00 0.00 H new ATOM 0 HH2 TRP B 216 -9.494 5.973 -11.729 1.00 0.00 H new ATOM 1619 N THR B 217 -10.084 -2.355 -15.245 1.00 0.00 N ATOM 1620 CA THR B 217 -9.538 -3.546 -15.903 1.00 0.00 C ATOM 1621 C THR B 217 -8.266 -3.199 -16.666 1.00 0.00 C ATOM 1622 O THR B 217 -8.195 -2.168 -17.341 1.00 0.00 O ATOM 1623 CB THR B 217 -10.579 -4.129 -16.868 1.00 0.00 C ATOM 1624 OG1 THR B 217 -11.809 -4.308 -16.181 1.00 0.00 O ATOM 1625 CG2 THR B 217 -10.100 -5.484 -17.395 1.00 0.00 C ATOM 0 H THR B 217 -10.242 -1.563 -15.868 1.00 0.00 H new ATOM 0 HA THR B 217 -9.296 -4.286 -15.140 1.00 0.00 H new ATOM 0 HB THR B 217 -10.715 -3.442 -17.704 1.00 0.00 H new ATOM 0 HG1 THR B 217 -12.476 -4.679 -16.796 1.00 0.00 H new ATOM 0 HG21 THR B 217 -10.844 -5.892 -18.079 1.00 0.00 H new ATOM 0 HG22 THR B 217 -9.154 -5.356 -17.921 1.00 0.00 H new ATOM 0 HG23 THR B 217 -9.960 -6.170 -16.560 1.00 0.00 H new ATOM 1633 N TRP B 218 -7.264 -4.070 -16.556 1.00 0.00 N ATOM 1634 CA TRP B 218 -5.989 -3.870 -17.243 1.00 0.00 C ATOM 1635 C TRP B 218 -5.949 -4.689 -18.531 1.00 0.00 C ATOM 1636 O TRP B 218 -6.061 -5.914 -18.502 1.00 0.00 O ATOM 1637 CB TRP B 218 -4.834 -4.293 -16.333 1.00 0.00 C ATOM 1638 CG TRP B 218 -3.543 -4.087 -17.058 1.00 0.00 C ATOM 1639 CD1 TRP B 218 -3.034 -4.922 -17.992 1.00 0.00 C ATOM 1640 CD2 TRP B 218 -2.597 -2.989 -16.931 1.00 0.00 C ATOM 1641 NE1 TRP B 218 -1.836 -4.407 -18.448 1.00 0.00 N ATOM 1642 CE2 TRP B 218 -1.523 -3.214 -17.824 1.00 0.00 C ATOM 1643 CE3 TRP B 218 -2.564 -1.830 -16.137 1.00 0.00 C ATOM 1644 CZ2 TRP B 218 -0.457 -2.322 -17.927 1.00 0.00 C ATOM 1645 CZ3 TRP B 218 -1.496 -0.928 -16.238 1.00 0.00 C ATOM 1646 CH2 TRP B 218 -0.441 -1.173 -17.132 1.00 0.00 C ATOM 0 H TRP B 218 -7.311 -4.922 -15.997 1.00 0.00 H new ATOM 0 HA TRP B 218 -5.888 -2.813 -17.489 1.00 0.00 H new ATOM 0 HB2 TRP B 218 -4.846 -3.709 -15.413 1.00 0.00 H new ATOM 0 HB3 TRP B 218 -4.943 -5.339 -16.048 1.00 0.00 H new ATOM 0 HD1 TRP B 218 -3.490 -5.842 -18.327 1.00 0.00 H new ATOM 0 HE1 TRP B 218 -1.254 -4.852 -19.158 1.00 0.00 H new ATOM 0 HE3 TRP B 218 -3.368 -1.633 -15.443 1.00 0.00 H new ATOM 0 HZ2 TRP B 218 0.351 -2.518 -18.616 1.00 0.00 H new ATOM 0 HZ3 TRP B 218 -1.484 -0.039 -15.625 1.00 0.00 H new ATOM 0 HH2 TRP B 218 0.380 -0.475 -17.205 1.00 0.00 H new ATOM 1657 N LYS B 219 -5.789 -3.999 -19.656 1.00 0.00 N ATOM 1658 CA LYS B 219 -5.737 -4.655 -20.963 1.00 0.00 C ATOM 1659 C LYS B 219 -4.711 -3.985 -21.860 1.00 0.00 C ATOM 1660 O LYS B 219 -4.237 -2.886 -21.575 1.00 0.00 O ATOM 1661 CB LYS B 219 -7.113 -4.607 -21.637 1.00 0.00 C ATOM 1662 CG LYS B 219 -8.065 -5.571 -20.925 1.00 0.00 C ATOM 1663 CD LYS B 219 -9.430 -5.583 -21.627 1.00 0.00 C ATOM 1664 CE LYS B 219 -10.235 -4.333 -21.251 1.00 0.00 C ATOM 1665 NZ LYS B 219 -11.630 -4.471 -21.766 1.00 0.00 N ATOM 0 H LYS B 219 -5.693 -2.984 -19.691 1.00 0.00 H new ATOM 0 HA LYS B 219 -5.446 -5.694 -20.808 1.00 0.00 H new ATOM 0 HB2 LYS B 219 -7.512 -3.593 -21.602 1.00 0.00 H new ATOM 0 HB3 LYS B 219 -7.024 -4.878 -22.689 1.00 0.00 H new ATOM 0 HG2 LYS B 219 -7.641 -6.575 -20.921 1.00 0.00 H new ATOM 0 HG3 LYS B 219 -8.186 -5.272 -19.884 1.00 0.00 H new ATOM 0 HD2 LYS B 219 -9.290 -5.622 -22.707 1.00 0.00 H new ATOM 0 HD3 LYS B 219 -9.984 -6.479 -21.345 1.00 0.00 H new ATOM 0 HE2 LYS B 219 -10.246 -4.205 -20.169 1.00 0.00 H new ATOM 0 HE3 LYS B 219 -9.766 -3.444 -21.672 1.00 0.00 H new ATOM 0 HZ1 LYS B 219 -12.283 -3.955 -21.142 1.00 0.00 H new ATOM 0 HZ2 LYS B 219 -11.686 -4.077 -22.727 1.00 0.00 H new ATOM 0 HZ3 LYS B 219 -11.894 -5.477 -21.788 1.00 0.00 H new ATOM 1679 N GLY B 220 -4.371 -4.664 -22.944 1.00 0.00 N ATOM 1680 CA GLY B 220 -3.398 -4.133 -23.881 1.00 0.00 C ATOM 1681 C GLY B 220 -3.238 -5.049 -25.086 1.00 0.00 C ATOM 1682 O GLY B 220 -4.114 -5.866 -25.377 1.00 0.00 O ATOM 0 H GLY B 220 -4.752 -5.577 -23.194 1.00 0.00 H new ATOM 0 HA2 GLY B 220 -3.711 -3.143 -24.212 1.00 0.00 H new ATOM 0 HA3 GLY B 220 -2.436 -4.013 -23.382 1.00 0.00 H new ATOM 1686 N ILE B 221 -2.131 -4.894 -25.804 1.00 0.00 N ATOM 1687 CA ILE B 221 -1.899 -5.700 -26.998 1.00 0.00 C ATOM 1688 C ILE B 221 -2.031 -7.197 -26.685 1.00 0.00 C ATOM 1689 O ILE B 221 -3.043 -7.814 -27.011 1.00 0.00 O ATOM 1690 CB ILE B 221 -0.484 -5.398 -27.557 1.00 0.00 C ATOM 1691 CG1 ILE B 221 0.432 -4.929 -26.413 1.00 0.00 C ATOM 1692 CG2 ILE B 221 -0.557 -4.292 -28.622 1.00 0.00 C ATOM 1693 CD1 ILE B 221 1.897 -5.049 -26.838 1.00 0.00 C ATOM 0 H ILE B 221 -1.390 -4.228 -25.585 1.00 0.00 H new ATOM 0 HA ILE B 221 -2.651 -5.443 -27.744 1.00 0.00 H new ATOM 0 HB ILE B 221 -0.085 -6.307 -28.007 1.00 0.00 H new ATOM 0 HG12 ILE B 221 0.203 -3.896 -26.152 1.00 0.00 H new ATOM 0 HG13 ILE B 221 0.252 -5.530 -25.522 1.00 0.00 H new ATOM 0 HG21 ILE B 221 0.443 -4.090 -29.006 1.00 0.00 H new ATOM 0 HG22 ILE B 221 -1.201 -4.616 -29.440 1.00 0.00 H new ATOM 0 HG23 ILE B 221 -0.965 -3.385 -28.177 1.00 0.00 H new ATOM 0 HD11 ILE B 221 2.541 -4.715 -26.024 1.00 0.00 H new ATOM 0 HD12 ILE B 221 2.123 -6.088 -27.076 1.00 0.00 H new ATOM 0 HD13 ILE B 221 2.073 -4.429 -27.717 1.00 0.00 H new ATOM 1705 N ILE B 222 -1.010 -7.763 -26.053 1.00 0.00 N ATOM 1706 CA ILE B 222 -1.013 -9.177 -25.708 1.00 0.00 C ATOM 1707 C ILE B 222 0.010 -9.448 -24.609 1.00 0.00 C ATOM 1708 O ILE B 222 0.531 -8.519 -23.991 1.00 0.00 O ATOM 1709 CB ILE B 222 -0.671 -10.029 -26.929 1.00 0.00 C ATOM 1710 CG1 ILE B 222 0.607 -9.496 -27.570 1.00 0.00 C ATOM 1711 CG2 ILE B 222 -1.808 -9.982 -27.956 1.00 0.00 C ATOM 1712 CD1 ILE B 222 1.118 -10.531 -28.558 1.00 0.00 C ATOM 0 H ILE B 222 -0.168 -7.262 -25.769 1.00 0.00 H new ATOM 0 HA ILE B 222 -2.011 -9.440 -25.356 1.00 0.00 H new ATOM 0 HB ILE B 222 -0.530 -11.061 -26.609 1.00 0.00 H new ATOM 0 HG12 ILE B 222 0.411 -8.552 -28.078 1.00 0.00 H new ATOM 0 HG13 ILE B 222 1.359 -9.297 -26.807 1.00 0.00 H new ATOM 0 HG21 ILE B 222 -1.545 -10.595 -28.818 1.00 0.00 H new ATOM 0 HG22 ILE B 222 -2.723 -10.365 -27.504 1.00 0.00 H new ATOM 0 HG23 ILE B 222 -1.966 -8.952 -28.277 1.00 0.00 H new ATOM 0 HD11 ILE B 222 2.032 -10.167 -29.026 1.00 0.00 H new ATOM 0 HD12 ILE B 222 1.326 -11.463 -28.033 1.00 0.00 H new ATOM 0 HD13 ILE B 222 0.363 -10.707 -29.324 1.00 0.00 H new ATOM 1724 N ARG B 223 0.311 -10.724 -24.401 1.00 0.00 N ATOM 1725 CA ARG B 223 1.296 -11.125 -23.409 1.00 0.00 C ATOM 1726 C ARG B 223 2.540 -10.260 -23.504 1.00 0.00 C ATOM 1727 O ARG B 223 2.667 -9.418 -24.393 1.00 0.00 O ATOM 1728 CB ARG B 223 1.678 -12.586 -23.594 1.00 0.00 C ATOM 1729 CG ARG B 223 1.859 -12.883 -25.075 1.00 0.00 C ATOM 1730 CD ARG B 223 2.287 -14.334 -25.225 1.00 0.00 C ATOM 1731 NE ARG B 223 2.499 -14.652 -26.632 1.00 0.00 N ATOM 1732 CZ ARG B 223 3.653 -14.369 -27.234 1.00 0.00 C ATOM 1733 NH1 ARG B 223 4.617 -13.805 -26.558 1.00 0.00 N ATOM 1734 NH2 ARG B 223 3.820 -14.652 -28.498 1.00 0.00 N ATOM 0 H ARG B 223 -0.115 -11.499 -24.909 1.00 0.00 H new ATOM 0 HA ARG B 223 0.849 -10.994 -22.424 1.00 0.00 H new ATOM 0 HB2 ARG B 223 2.600 -12.802 -23.054 1.00 0.00 H new ATOM 0 HB3 ARG B 223 0.905 -13.230 -23.175 1.00 0.00 H new ATOM 0 HG2 ARG B 223 0.929 -12.704 -25.614 1.00 0.00 H new ATOM 0 HG3 ARG B 223 2.609 -12.220 -25.506 1.00 0.00 H new ATOM 0 HD2 ARG B 223 3.204 -14.511 -24.662 1.00 0.00 H new ATOM 0 HD3 ARG B 223 1.525 -14.991 -24.807 1.00 0.00 H new ATOM 0 HE ARG B 223 1.752 -15.098 -27.164 1.00 0.00 H new ATOM 0 HH11 ARG B 223 4.485 -13.582 -25.571 1.00 0.00 H new ATOM 0 HH12 ARG B 223 5.502 -13.587 -27.016 1.00 0.00 H new ATOM 0 HH21 ARG B 223 3.066 -15.091 -29.026 1.00 0.00 H new ATOM 0 HH22 ARG B 223 4.705 -14.434 -28.957 1.00 0.00 H new ATOM 1748 N LEU B 224 3.447 -10.473 -22.572 1.00 0.00 N ATOM 1749 CA LEU B 224 4.673 -9.706 -22.536 1.00 0.00 C ATOM 1750 C LEU B 224 5.452 -9.895 -23.836 1.00 0.00 C ATOM 1751 O LEU B 224 5.785 -11.013 -24.229 1.00 0.00 O ATOM 1752 CB LEU B 224 5.526 -10.158 -21.348 1.00 0.00 C ATOM 1753 CG LEU B 224 4.884 -9.733 -20.014 1.00 0.00 C ATOM 1754 CD1 LEU B 224 4.794 -8.207 -19.923 1.00 0.00 C ATOM 1755 CD2 LEU B 224 3.484 -10.350 -19.876 1.00 0.00 C ATOM 0 H LEU B 224 3.358 -11.169 -21.832 1.00 0.00 H new ATOM 0 HA LEU B 224 4.428 -8.650 -22.425 1.00 0.00 H new ATOM 0 HB2 LEU B 224 5.642 -11.242 -21.371 1.00 0.00 H new ATOM 0 HB3 LEU B 224 6.525 -9.728 -21.428 1.00 0.00 H new ATOM 0 HG LEU B 224 5.512 -10.095 -19.200 1.00 0.00 H new ATOM 0 HD11 LEU B 224 4.338 -7.925 -18.974 1.00 0.00 H new ATOM 0 HD12 LEU B 224 5.795 -7.779 -19.986 1.00 0.00 H new ATOM 0 HD13 LEU B 224 4.185 -7.829 -20.744 1.00 0.00 H new ATOM 0 HD21 LEU B 224 3.042 -10.041 -18.929 1.00 0.00 H new ATOM 0 HD22 LEU B 224 2.854 -10.010 -20.698 1.00 0.00 H new ATOM 0 HD23 LEU B 224 3.561 -11.437 -19.903 1.00 0.00 H new ATOM 1767 N GLU B 225 5.738 -8.777 -24.497 1.00 0.00 N ATOM 1768 CA GLU B 225 6.471 -8.789 -25.761 1.00 0.00 C ATOM 1769 C GLU B 225 7.804 -8.074 -25.601 1.00 0.00 C ATOM 1770 O GLU B 225 7.936 -7.157 -24.790 1.00 0.00 O ATOM 1771 CB GLU B 225 5.642 -8.098 -26.845 1.00 0.00 C ATOM 1772 CG GLU B 225 6.370 -8.201 -28.188 1.00 0.00 C ATOM 1773 CD GLU B 225 5.512 -7.597 -29.293 1.00 0.00 C ATOM 1774 OE1 GLU B 225 4.330 -7.401 -29.060 1.00 0.00 O ATOM 1775 OE2 GLU B 225 6.046 -7.344 -30.360 1.00 0.00 O ATOM 0 H GLU B 225 5.472 -7.846 -24.177 1.00 0.00 H new ATOM 0 HA GLU B 225 6.657 -9.823 -26.052 1.00 0.00 H new ATOM 0 HB2 GLU B 225 4.658 -8.562 -26.916 1.00 0.00 H new ATOM 0 HB3 GLU B 225 5.483 -7.052 -26.585 1.00 0.00 H new ATOM 0 HG2 GLU B 225 7.326 -7.681 -28.133 1.00 0.00 H new ATOM 0 HG3 GLU B 225 6.587 -9.245 -28.414 1.00 0.00 H new