USER MOD reduce.3.24.130724 H: found=0, std=0, add=693, rem=0, adj=22 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 53:sc= 1.29 USER MOD Set 1.2: A 63 THR OG1 : rot 180:sc= 1.02 USER MOD Set 2.1: A 18 THR OG1 : rot 116:sc= 1.14! USER MOD Set 2.2: A 21 SER OG : rot 180:sc= -1.14 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot -109:sc= 0.862 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) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= -0.503 USER MOD Single : A 33 THR OG1 : rot -70:sc= -0.83 USER MOD Single : A 37 TYR OH : rot -59:sc= -0.613 USER MOD Single : A 40 THR OG1 : rot 76:sc= 0.615 USER MOD Single : A 57 SER OG : rot 118:sc= 0.781 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot -130:sc= -2.41! USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 TYR OH : rot 180:sc= 0.135 USER MOD Single : A 76 SER OG : rot 180:sc= -0.661 USER MOD Single : A 79 THR OG1 : rot -120:sc= 0.546 USER MOD Single : A 82 ASN : amide:sc= -1.09 K(o=-1.1,f=-3.6!) USER MOD Single : B 208 SER OG : rot 180:sc= 0 USER MOD Single : B 210 THR OG1 : rot -50:sc= 0.776 USER MOD Single : B 213 ASN : amide:sc= -0.899 K(o=-0.9,f=-2.9!) USER MOD Single : B 215 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 -0.310 -0.941 -8.137 1.00 0.00 N ATOM 115 CA ASP A 11 0.470 -0.885 -9.374 1.00 0.00 C ATOM 116 C ASP A 11 0.746 -2.290 -9.887 1.00 0.00 C ATOM 117 O ASP A 11 1.633 -2.983 -9.384 1.00 0.00 O ATOM 118 CB ASP A 11 1.794 -0.167 -9.123 1.00 0.00 C ATOM 119 CG ASP A 11 2.470 0.157 -10.452 1.00 0.00 C ATOM 120 OD1 ASP A 11 1.786 0.144 -11.461 1.00 0.00 O ATOM 121 OD2 ASP A 11 3.663 0.412 -10.440 1.00 0.00 O ATOM 0 HA ASP A 11 -0.104 -0.338 -10.122 1.00 0.00 H new ATOM 0 HB2 ASP A 11 1.619 0.750 -8.561 1.00 0.00 H new ATOM 0 HB3 ASP A 11 2.448 -0.793 -8.516 1.00 0.00 H new ATOM 126 N LEU A 12 -0.016 -2.707 -10.891 1.00 0.00 N ATOM 127 CA LEU A 12 0.158 -4.032 -11.467 1.00 0.00 C ATOM 128 C LEU A 12 1.462 -4.109 -12.244 1.00 0.00 C ATOM 129 O LEU A 12 1.790 -3.211 -13.016 1.00 0.00 O ATOM 130 CB LEU A 12 -1.022 -4.364 -12.389 1.00 0.00 C ATOM 131 CG LEU A 12 -0.804 -5.748 -13.067 1.00 0.00 C ATOM 132 CD1 LEU A 12 -2.123 -6.528 -13.101 1.00 0.00 C ATOM 133 CD2 LEU A 12 -0.300 -5.560 -14.507 1.00 0.00 C ATOM 0 H LEU A 12 -0.755 -2.150 -11.320 1.00 0.00 H new ATOM 0 HA LEU A 12 0.193 -4.760 -10.656 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -1.949 -4.374 -11.816 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -1.127 -3.591 -13.150 1.00 0.00 H new ATOM 0 HG LEU A 12 -0.063 -6.302 -12.490 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.962 -7.495 -13.577 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -2.482 -6.680 -12.083 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -2.865 -5.964 -13.667 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -0.151 -6.535 -14.971 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.036 -4.995 -15.079 1.00 0.00 H new ATOM 0 HD23 LEU A 12 0.645 -5.017 -14.494 1.00 0.00 H new ATOM 145 N SER A 13 2.204 -5.197 -12.038 1.00 0.00 N ATOM 146 CA SER A 13 3.476 -5.394 -12.731 1.00 0.00 C ATOM 147 C SER A 13 3.661 -6.861 -13.094 1.00 0.00 C ATOM 148 O SER A 13 2.989 -7.736 -12.550 1.00 0.00 O ATOM 149 CB SER A 13 4.634 -4.942 -11.849 1.00 0.00 C ATOM 150 OG SER A 13 4.772 -5.840 -10.754 1.00 0.00 O ATOM 0 H SER A 13 1.948 -5.951 -11.401 1.00 0.00 H new ATOM 0 HA SER A 13 3.464 -4.798 -13.643 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.557 -4.913 -12.428 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.455 -3.931 -11.484 1.00 0.00 H new ATOM 0 HG SER A 13 5.517 -5.552 -10.187 1.00 0.00 H new ATOM 156 N PHE A 14 4.573 -7.118 -14.026 1.00 0.00 N ATOM 157 CA PHE A 14 4.851 -8.481 -14.479 1.00 0.00 C ATOM 158 C PHE A 14 6.227 -8.933 -14.010 1.00 0.00 C ATOM 159 O PHE A 14 7.151 -8.127 -13.894 1.00 0.00 O ATOM 160 CB PHE A 14 4.801 -8.514 -16.001 1.00 0.00 C ATOM 161 CG PHE A 14 3.466 -7.991 -16.457 1.00 0.00 C ATOM 162 CD1 PHE A 14 3.262 -6.611 -16.543 1.00 0.00 C ATOM 163 CD2 PHE A 14 2.439 -8.878 -16.810 1.00 0.00 C ATOM 164 CE1 PHE A 14 2.032 -6.113 -16.985 1.00 0.00 C ATOM 165 CE2 PHE A 14 1.209 -8.380 -17.255 1.00 0.00 C ATOM 166 CZ PHE A 14 1.006 -6.995 -17.343 1.00 0.00 C ATOM 0 H PHE A 14 5.134 -6.400 -14.485 1.00 0.00 H new ATOM 0 HA PHE A 14 4.103 -9.154 -14.060 1.00 0.00 H new ATOM 0 HB2 PHE A 14 5.605 -7.908 -16.418 1.00 0.00 H new ATOM 0 HB3 PHE A 14 4.950 -9.532 -16.361 1.00 0.00 H new ATOM 0 HD1 PHE A 14 4.054 -5.930 -16.268 1.00 0.00 H new ATOM 0 HD2 PHE A 14 2.597 -9.944 -16.739 1.00 0.00 H new ATOM 0 HE1 PHE A 14 1.874 -5.047 -17.050 1.00 0.00 H new ATOM 0 HE2 PHE A 14 0.417 -9.061 -17.530 1.00 0.00 H new ATOM 0 HZ PHE A 14 0.058 -6.609 -17.687 1.00 0.00 H new ATOM 176 N VAL A 15 6.362 -10.229 -13.743 1.00 0.00 N ATOM 177 CA VAL A 15 7.633 -10.787 -13.291 1.00 0.00 C ATOM 178 C VAL A 15 7.835 -12.182 -13.867 1.00 0.00 C ATOM 179 O VAL A 15 6.872 -12.885 -14.166 1.00 0.00 O ATOM 180 CB VAL A 15 7.656 -10.846 -11.764 1.00 0.00 C ATOM 181 CG1 VAL A 15 7.702 -9.424 -11.204 1.00 0.00 C ATOM 182 CG2 VAL A 15 6.391 -11.546 -11.266 1.00 0.00 C ATOM 0 H VAL A 15 5.609 -10.911 -13.832 1.00 0.00 H new ATOM 0 HA VAL A 15 8.443 -10.146 -13.640 1.00 0.00 H new ATOM 0 HB VAL A 15 8.535 -11.399 -11.432 1.00 0.00 H new ATOM 0 HG11 VAL A 15 7.718 -9.462 -10.115 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.600 -8.920 -11.563 1.00 0.00 H new ATOM 0 HG13 VAL A 15 6.821 -8.874 -11.534 1.00 0.00 H new ATOM 0 HG21 VAL A 15 6.404 -11.590 -10.177 1.00 0.00 H new ATOM 0 HG22 VAL A 15 5.514 -10.990 -11.596 1.00 0.00 H new ATOM 0 HG23 VAL A 15 6.352 -12.558 -11.669 1.00 0.00 H new ATOM 192 N ASP A 16 9.092 -12.573 -14.020 1.00 0.00 N ATOM 193 CA ASP A 16 9.410 -13.885 -14.565 1.00 0.00 C ATOM 194 C ASP A 16 8.853 -14.027 -15.979 1.00 0.00 C ATOM 195 O ASP A 16 8.446 -15.115 -16.389 1.00 0.00 O ATOM 196 CB ASP A 16 8.821 -14.980 -13.670 1.00 0.00 C ATOM 197 CG ASP A 16 9.462 -16.324 -13.998 1.00 0.00 C ATOM 198 OD1 ASP A 16 10.670 -16.432 -13.864 1.00 0.00 O ATOM 199 OD2 ASP A 16 8.737 -17.229 -14.378 1.00 0.00 O ATOM 0 H ASP A 16 9.903 -12.005 -13.776 1.00 0.00 H new ATOM 0 HA ASP A 16 10.494 -13.990 -14.601 1.00 0.00 H new ATOM 0 HB2 ASP A 16 8.990 -14.734 -12.622 1.00 0.00 H new ATOM 0 HB3 ASP A 16 7.742 -15.038 -13.814 1.00 0.00 H new ATOM 204 N ILE A 17 8.846 -12.924 -16.725 1.00 0.00 N ATOM 205 CA ILE A 17 8.343 -12.941 -18.094 1.00 0.00 C ATOM 206 C ILE A 17 9.106 -13.972 -18.918 1.00 0.00 C ATOM 207 O ILE A 17 10.334 -14.049 -18.852 1.00 0.00 O ATOM 208 CB ILE A 17 8.511 -11.561 -18.719 1.00 0.00 C ATOM 209 CG1 ILE A 17 7.591 -10.578 -18.000 1.00 0.00 C ATOM 210 CG2 ILE A 17 8.154 -11.610 -20.207 1.00 0.00 C ATOM 211 CD1 ILE A 17 7.912 -9.143 -18.442 1.00 0.00 C ATOM 0 H ILE A 17 9.180 -12.015 -16.406 1.00 0.00 H new ATOM 0 HA ILE A 17 7.286 -13.207 -18.081 1.00 0.00 H new ATOM 0 HB ILE A 17 9.548 -11.240 -18.620 1.00 0.00 H new ATOM 0 HG12 ILE A 17 6.550 -10.812 -18.222 1.00 0.00 H new ATOM 0 HG13 ILE A 17 7.716 -10.672 -16.921 1.00 0.00 H new ATOM 0 HG21 ILE A 17 8.277 -10.619 -20.644 1.00 0.00 H new ATOM 0 HG22 ILE A 17 8.811 -12.315 -20.716 1.00 0.00 H new ATOM 0 HG23 ILE A 17 7.119 -11.931 -20.322 1.00 0.00 H new ATOM 0 HD11 ILE A 17 7.252 -8.447 -17.925 1.00 0.00 H new ATOM 0 HD12 ILE A 17 8.948 -8.910 -18.197 1.00 0.00 H new ATOM 0 HD13 ILE A 17 7.764 -9.052 -19.518 1.00 0.00 H new ATOM 223 N THR A 18 8.374 -14.766 -19.692 1.00 0.00 N ATOM 224 CA THR A 18 8.990 -15.802 -20.531 1.00 0.00 C ATOM 225 C THR A 18 8.354 -15.809 -21.922 1.00 0.00 C ATOM 226 O THR A 18 7.599 -14.901 -22.272 1.00 0.00 O ATOM 227 CB THR A 18 8.830 -17.186 -19.863 1.00 0.00 C ATOM 228 OG1 THR A 18 8.604 -17.007 -18.473 1.00 0.00 O ATOM 229 CG2 THR A 18 10.098 -18.027 -20.063 1.00 0.00 C ATOM 0 H THR A 18 7.357 -14.717 -19.760 1.00 0.00 H new ATOM 0 HA THR A 18 10.052 -15.582 -20.638 1.00 0.00 H new ATOM 0 HB THR A 18 7.987 -17.705 -20.319 1.00 0.00 H new ATOM 0 HG1 THR A 18 7.714 -17.344 -18.240 1.00 0.00 H new ATOM 0 HG21 THR A 18 9.969 -18.999 -19.587 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.278 -18.167 -21.129 1.00 0.00 H new ATOM 0 HG23 THR A 18 10.949 -17.514 -19.616 1.00 0.00 H new ATOM 237 N ASP A 19 8.658 -16.843 -22.702 1.00 0.00 N ATOM 238 CA ASP A 19 8.100 -16.960 -24.046 1.00 0.00 C ATOM 239 C ASP A 19 6.649 -17.419 -23.991 1.00 0.00 C ATOM 240 O ASP A 19 5.780 -16.815 -24.619 1.00 0.00 O ATOM 241 CB ASP A 19 8.905 -17.962 -24.874 1.00 0.00 C ATOM 242 CG ASP A 19 9.097 -19.256 -24.084 1.00 0.00 C ATOM 243 OD1 ASP A 19 8.734 -19.271 -22.917 1.00 0.00 O ATOM 244 OD2 ASP A 19 9.600 -20.209 -24.654 1.00 0.00 O ATOM 0 H ASP A 19 9.281 -17.604 -22.431 1.00 0.00 H new ATOM 0 HA ASP A 19 8.149 -15.976 -24.512 1.00 0.00 H new ATOM 0 HB2 ASP A 19 8.388 -18.171 -25.811 1.00 0.00 H new ATOM 0 HB3 ASP A 19 9.875 -17.537 -25.133 1.00 0.00 H new ATOM 249 N SER A 20 6.390 -18.500 -23.252 1.00 0.00 N ATOM 250 CA SER A 20 5.040 -19.049 -23.130 1.00 0.00 C ATOM 251 C SER A 20 4.602 -19.081 -21.671 1.00 0.00 C ATOM 252 O SER A 20 3.645 -19.768 -21.321 1.00 0.00 O ATOM 253 CB SER A 20 5.025 -20.472 -23.691 1.00 0.00 C ATOM 254 OG SER A 20 5.359 -20.436 -25.074 1.00 0.00 O ATOM 0 H SER A 20 7.100 -19.013 -22.729 1.00 0.00 H new ATOM 0 HA SER A 20 4.351 -18.415 -23.688 1.00 0.00 H new ATOM 0 HB2 SER A 20 5.736 -21.096 -23.150 1.00 0.00 H new ATOM 0 HB3 SER A 20 4.040 -20.919 -23.554 1.00 0.00 H new ATOM 0 HG SER A 20 4.561 -20.631 -25.608 1.00 0.00 H new ATOM 260 N SER A 21 5.313 -18.346 -20.820 1.00 0.00 N ATOM 261 CA SER A 21 4.991 -18.305 -19.392 1.00 0.00 C ATOM 262 C SER A 21 5.285 -16.928 -18.818 1.00 0.00 C ATOM 263 O SER A 21 6.383 -16.398 -18.973 1.00 0.00 O ATOM 264 CB SER A 21 5.816 -19.353 -18.647 1.00 0.00 C ATOM 265 OG SER A 21 7.138 -18.869 -18.456 1.00 0.00 O ATOM 0 H SER A 21 6.112 -17.773 -21.090 1.00 0.00 H new ATOM 0 HA SER A 21 3.929 -18.518 -19.269 1.00 0.00 H new ATOM 0 HB2 SER A 21 5.356 -19.575 -17.684 1.00 0.00 H new ATOM 0 HB3 SER A 21 5.837 -20.284 -19.213 1.00 0.00 H new ATOM 0 HG SER A 21 7.666 -19.541 -17.977 1.00 0.00 H new ATOM 271 N ILE A 22 4.286 -16.347 -18.157 1.00 0.00 N ATOM 272 CA ILE A 22 4.424 -15.019 -17.554 1.00 0.00 C ATOM 273 C ILE A 22 3.982 -15.072 -16.094 1.00 0.00 C ATOM 274 O ILE A 22 3.023 -15.765 -15.749 1.00 0.00 O ATOM 275 CB ILE A 22 3.572 -14.014 -18.342 1.00 0.00 C ATOM 276 CG1 ILE A 22 2.092 -14.432 -18.307 1.00 0.00 C ATOM 277 CG2 ILE A 22 4.064 -13.987 -19.797 1.00 0.00 C ATOM 278 CD1 ILE A 22 1.240 -13.375 -19.020 1.00 0.00 C ATOM 0 H ILE A 22 3.369 -16.774 -18.024 1.00 0.00 H new ATOM 0 HA ILE A 22 5.466 -14.701 -17.589 1.00 0.00 H new ATOM 0 HB ILE A 22 3.667 -13.025 -17.894 1.00 0.00 H new ATOM 0 HG12 ILE A 22 1.966 -15.401 -18.790 1.00 0.00 H new ATOM 0 HG13 ILE A 22 1.760 -14.545 -17.275 1.00 0.00 H new ATOM 0 HG21 ILE A 22 3.468 -13.277 -20.370 1.00 0.00 H new ATOM 0 HG22 ILE A 22 5.111 -13.684 -19.822 1.00 0.00 H new ATOM 0 HG23 ILE A 22 3.963 -14.981 -20.234 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.192 -13.674 -18.994 1.00 0.00 H new ATOM 0 HD12 ILE A 22 1.356 -12.415 -18.518 1.00 0.00 H new ATOM 0 HD13 ILE A 22 1.565 -13.284 -20.056 1.00 0.00 H new ATOM 290 N GLY A 23 4.694 -14.354 -15.234 1.00 0.00 N ATOM 291 CA GLY A 23 4.377 -14.336 -13.806 1.00 0.00 C ATOM 292 C GLY A 23 3.641 -13.064 -13.406 1.00 0.00 C ATOM 293 O GLY A 23 4.262 -12.075 -13.018 1.00 0.00 O ATOM 0 H GLY A 23 5.493 -13.777 -15.497 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.765 -15.203 -13.559 1.00 0.00 H new ATOM 0 HA3 GLY A 23 5.297 -14.420 -13.228 1.00 0.00 H new ATOM 297 N LEU A 24 2.315 -13.093 -13.500 1.00 0.00 N ATOM 298 CA LEU A 24 1.512 -11.931 -13.142 1.00 0.00 C ATOM 299 C LEU A 24 1.721 -11.574 -11.676 1.00 0.00 C ATOM 300 O LEU A 24 1.964 -12.443 -10.839 1.00 0.00 O ATOM 301 CB LEU A 24 0.017 -12.217 -13.392 1.00 0.00 C ATOM 302 CG LEU A 24 -0.364 -11.830 -14.823 1.00 0.00 C ATOM 303 CD1 LEU A 24 0.442 -12.663 -15.814 1.00 0.00 C ATOM 304 CD2 LEU A 24 -1.855 -12.088 -15.037 1.00 0.00 C ATOM 0 H LEU A 24 1.779 -13.900 -13.818 1.00 0.00 H new ATOM 0 HA LEU A 24 1.827 -11.093 -13.763 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -0.191 -13.274 -13.226 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -0.591 -11.657 -12.682 1.00 0.00 H new ATOM 0 HG LEU A 24 -0.148 -10.773 -14.981 1.00 0.00 H new ATOM 0 HD11 LEU A 24 0.168 -12.384 -16.831 1.00 0.00 H new ATOM 0 HD12 LEU A 24 1.506 -12.480 -15.662 1.00 0.00 H new ATOM 0 HD13 LEU A 24 0.229 -13.721 -15.658 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -2.129 -11.813 -16.056 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.068 -13.145 -14.876 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -2.433 -11.490 -14.332 1.00 0.00 H new ATOM 316 N ARG A 25 1.620 -10.285 -11.378 1.00 0.00 N ATOM 317 CA ARG A 25 1.794 -9.812 -10.014 1.00 0.00 C ATOM 318 C ARG A 25 1.113 -8.467 -9.813 1.00 0.00 C ATOM 319 O ARG A 25 1.208 -7.577 -10.658 1.00 0.00 O ATOM 320 CB ARG A 25 3.283 -9.707 -9.689 1.00 0.00 C ATOM 321 CG ARG A 25 3.475 -9.315 -8.214 1.00 0.00 C ATOM 322 CD ARG A 25 4.841 -9.797 -7.729 1.00 0.00 C ATOM 323 NE ARG A 25 5.105 -9.302 -6.384 1.00 0.00 N ATOM 324 CZ ARG A 25 6.118 -9.774 -5.669 1.00 0.00 C ATOM 325 NH1 ARG A 25 6.892 -10.699 -6.164 1.00 0.00 N ATOM 326 NH2 ARG A 25 6.338 -9.311 -4.468 1.00 0.00 N ATOM 0 H ARG A 25 1.420 -9.553 -12.060 1.00 0.00 H new ATOM 0 HA ARG A 25 1.329 -10.529 -9.337 1.00 0.00 H new ATOM 0 HB2 ARG A 25 3.775 -10.659 -9.887 1.00 0.00 H new ATOM 0 HB3 ARG A 25 3.753 -8.965 -10.335 1.00 0.00 H new ATOM 0 HG2 ARG A 25 3.399 -8.233 -8.102 1.00 0.00 H new ATOM 0 HG3 ARG A 25 2.686 -9.755 -7.605 1.00 0.00 H new ATOM 0 HD2 ARG A 25 4.873 -10.887 -7.735 1.00 0.00 H new ATOM 0 HD3 ARG A 25 5.619 -9.451 -8.410 1.00 0.00 H new ATOM 0 HE ARG A 25 4.502 -8.582 -5.986 1.00 0.00 H new ATOM 0 HH11 ARG A 25 6.719 -11.061 -7.102 1.00 0.00 H new ATOM 0 HH12 ARG A 25 7.671 -11.061 -5.613 1.00 0.00 H new ATOM 0 HH21 ARG A 25 5.732 -8.588 -4.081 1.00 0.00 H new ATOM 0 HH22 ARG A 25 7.116 -9.673 -3.917 1.00 0.00 H new ATOM 340 N TRP A 26 0.422 -8.331 -8.687 1.00 0.00 N ATOM 341 CA TRP A 26 -0.286 -7.093 -8.361 1.00 0.00 C ATOM 342 C TRP A 26 -0.122 -6.777 -6.887 1.00 0.00 C ATOM 343 O TRP A 26 0.215 -7.657 -6.097 1.00 0.00 O ATOM 344 CB TRP A 26 -1.774 -7.217 -8.693 1.00 0.00 C ATOM 345 CG TRP A 26 -2.347 -8.413 -8.003 1.00 0.00 C ATOM 346 CD1 TRP A 26 -3.034 -8.380 -6.838 1.00 0.00 C ATOM 347 CD2 TRP A 26 -2.298 -9.810 -8.410 1.00 0.00 C ATOM 348 NE1 TRP A 26 -3.412 -9.667 -6.505 1.00 0.00 N ATOM 349 CE2 TRP A 26 -2.981 -10.583 -7.443 1.00 0.00 C ATOM 350 CE3 TRP A 26 -1.734 -10.472 -9.514 1.00 0.00 C ATOM 351 CZ2 TRP A 26 -3.099 -11.966 -7.566 1.00 0.00 C ATOM 352 CZ3 TRP A 26 -1.852 -11.866 -9.641 1.00 0.00 C ATOM 353 CH2 TRP A 26 -2.533 -12.611 -8.667 1.00 0.00 C ATOM 0 H TRP A 26 0.335 -9.063 -7.982 1.00 0.00 H new ATOM 0 HA TRP A 26 0.141 -6.287 -8.958 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -2.302 -6.317 -8.380 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -1.910 -7.307 -9.771 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -3.252 -7.493 -6.262 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -3.944 -9.910 -5.669 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -1.207 -9.906 -10.268 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -3.625 -12.535 -6.814 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -1.416 -12.367 -10.493 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -2.619 -13.683 -8.769 1.00 0.00 H new ATOM 364 N THR A 27 -0.330 -5.511 -6.526 1.00 0.00 N ATOM 365 CA THR A 27 -0.189 -5.079 -5.136 1.00 0.00 C ATOM 366 C THR A 27 -1.561 -4.789 -4.508 1.00 0.00 C ATOM 367 O THR A 27 -2.115 -3.706 -4.711 1.00 0.00 O ATOM 368 CB THR A 27 0.649 -3.802 -5.075 1.00 0.00 C ATOM 369 OG1 THR A 27 1.739 -3.908 -5.981 1.00 0.00 O ATOM 370 CG2 THR A 27 1.179 -3.611 -3.650 1.00 0.00 C ATOM 0 H THR A 27 -0.596 -4.769 -7.174 1.00 0.00 H new ATOM 0 HA THR A 27 0.297 -5.882 -4.583 1.00 0.00 H new ATOM 0 HB THR A 27 0.033 -2.946 -5.350 1.00 0.00 H new ATOM 0 HG1 THR A 27 2.276 -3.089 -5.944 1.00 0.00 H new ATOM 0 HG21 THR A 27 1.777 -2.701 -3.603 1.00 0.00 H new ATOM 0 HG22 THR A 27 0.341 -3.530 -2.958 1.00 0.00 H new ATOM 0 HG23 THR A 27 1.797 -4.466 -3.374 1.00 0.00 H new ATOM 378 N PRO A 28 -2.106 -5.701 -3.741 1.00 0.00 N ATOM 379 CA PRO A 28 -3.419 -5.491 -3.074 1.00 0.00 C ATOM 380 C PRO A 28 -3.446 -4.243 -2.189 1.00 0.00 C ATOM 381 O PRO A 28 -2.417 -3.794 -1.686 1.00 0.00 O ATOM 382 CB PRO A 28 -3.641 -6.771 -2.244 1.00 0.00 C ATOM 383 CG PRO A 28 -2.730 -7.797 -2.843 1.00 0.00 C ATOM 384 CD PRO A 28 -1.553 -7.034 -3.440 1.00 0.00 C ATOM 0 HA PRO A 28 -4.208 -5.320 -3.806 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -3.406 -6.603 -1.193 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -4.681 -7.094 -2.291 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -2.390 -8.504 -2.086 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -3.247 -8.375 -3.609 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.721 -6.972 -2.739 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -1.176 -7.522 -4.339 1.00 0.00 H new ATOM 392 N LEU A 29 -4.642 -3.689 -2.017 1.00 0.00 N ATOM 393 CA LEU A 29 -4.843 -2.485 -1.200 1.00 0.00 C ATOM 394 C LEU A 29 -5.598 -2.815 0.071 1.00 0.00 C ATOM 395 O LEU A 29 -6.583 -3.550 0.066 1.00 0.00 O ATOM 396 CB LEU A 29 -5.632 -1.445 -1.995 1.00 0.00 C ATOM 397 CG LEU A 29 -4.987 -1.262 -3.365 1.00 0.00 C ATOM 398 CD1 LEU A 29 -5.792 -0.240 -4.174 1.00 0.00 C ATOM 399 CD2 LEU A 29 -3.546 -0.772 -3.178 1.00 0.00 C ATOM 0 H LEU A 29 -5.498 -4.055 -2.435 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.864 -2.087 -0.935 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -6.668 -1.766 -2.108 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -5.649 -0.496 -1.459 1.00 0.00 H new ATOM 0 HG LEU A 29 -4.978 -2.210 -3.903 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -5.332 -0.108 -5.154 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -6.814 -0.598 -4.298 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -5.803 0.714 -3.647 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -3.078 -0.639 -4.153 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -3.551 0.179 -2.645 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -2.983 -1.507 -2.603 1.00 0.00 H new ATOM 411 N ASN A 30 -5.118 -2.257 1.161 1.00 0.00 N ATOM 412 CA ASN A 30 -5.735 -2.476 2.454 1.00 0.00 C ATOM 413 C ASN A 30 -7.251 -2.334 2.353 1.00 0.00 C ATOM 414 O ASN A 30 -7.997 -2.980 3.089 1.00 0.00 O ATOM 415 CB ASN A 30 -5.184 -1.452 3.429 1.00 0.00 C ATOM 416 CG ASN A 30 -5.879 -1.594 4.782 1.00 0.00 C ATOM 417 OD1 ASN A 30 -6.771 -0.809 5.109 1.00 0.00 O ATOM 418 ND2 ASN A 30 -5.529 -2.557 5.591 1.00 0.00 N ATOM 0 H ASN A 30 -4.301 -1.647 1.179 1.00 0.00 H new ATOM 0 HA ASN A 30 -5.510 -3.485 2.801 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -4.109 -1.591 3.546 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -5.335 -0.446 3.037 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -5.994 -2.659 6.493 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -4.791 -3.207 5.321 1.00 0.00 H new ATOM 425 N SER A 31 -7.697 -1.492 1.424 1.00 0.00 N ATOM 426 CA SER A 31 -9.127 -1.276 1.213 1.00 0.00 C ATOM 427 C SER A 31 -9.674 -2.263 0.184 1.00 0.00 C ATOM 428 O SER A 31 -10.869 -2.558 0.170 1.00 0.00 O ATOM 429 CB SER A 31 -9.371 0.154 0.731 1.00 0.00 C ATOM 430 OG SER A 31 -8.981 1.066 1.749 1.00 0.00 O ATOM 0 H SER A 31 -7.092 -0.950 0.807 1.00 0.00 H new ATOM 0 HA SER A 31 -9.643 -1.434 2.160 1.00 0.00 H new ATOM 0 HB2 SER A 31 -8.804 0.344 -0.180 1.00 0.00 H new ATOM 0 HB3 SER A 31 -10.424 0.293 0.486 1.00 0.00 H new ATOM 0 HG SER A 31 -9.135 1.984 1.442 1.00 0.00 H new ATOM 436 N SER A 32 -8.794 -2.773 -0.679 1.00 0.00 N ATOM 437 CA SER A 32 -9.213 -3.728 -1.706 1.00 0.00 C ATOM 438 C SER A 32 -9.699 -5.022 -1.055 1.00 0.00 C ATOM 439 O SER A 32 -8.953 -5.700 -0.350 1.00 0.00 O ATOM 440 CB SER A 32 -8.045 -4.037 -2.655 1.00 0.00 C ATOM 441 OG SER A 32 -7.938 -2.998 -3.618 1.00 0.00 O ATOM 0 H SER A 32 -7.800 -2.545 -0.688 1.00 0.00 H new ATOM 0 HA SER A 32 -10.029 -3.285 -2.277 1.00 0.00 H new ATOM 0 HB2 SER A 32 -7.116 -4.124 -2.091 1.00 0.00 H new ATOM 0 HB3 SER A 32 -8.207 -4.994 -3.151 1.00 0.00 H new ATOM 0 HG SER A 32 -7.193 -3.190 -4.225 1.00 0.00 H new ATOM 447 N THR A 33 -10.954 -5.356 -1.313 1.00 0.00 N ATOM 448 CA THR A 33 -11.538 -6.570 -0.762 1.00 0.00 C ATOM 449 C THR A 33 -10.686 -7.770 -1.158 1.00 0.00 C ATOM 450 O THR A 33 -10.168 -7.834 -2.273 1.00 0.00 O ATOM 451 CB THR A 33 -12.964 -6.742 -1.277 1.00 0.00 C ATOM 452 OG1 THR A 33 -13.674 -5.536 -1.068 1.00 0.00 O ATOM 453 CG2 THR A 33 -13.666 -7.885 -0.532 1.00 0.00 C ATOM 0 H THR A 33 -11.585 -4.807 -1.897 1.00 0.00 H new ATOM 0 HA THR A 33 -11.567 -6.496 0.325 1.00 0.00 H new ATOM 0 HB THR A 33 -12.937 -6.983 -2.340 1.00 0.00 H new ATOM 0 HG1 THR A 33 -13.830 -5.410 -0.109 1.00 0.00 H new ATOM 0 HG21 THR A 33 -14.682 -7.996 -0.910 1.00 0.00 H new ATOM 0 HG22 THR A 33 -13.117 -8.813 -0.690 1.00 0.00 H new ATOM 0 HG23 THR A 33 -13.698 -7.659 0.534 1.00 0.00 H new ATOM 461 N ILE A 34 -10.515 -8.714 -0.230 1.00 0.00 N ATOM 462 CA ILE A 34 -9.690 -9.897 -0.492 1.00 0.00 C ATOM 463 C ILE A 34 -10.536 -11.068 -0.971 1.00 0.00 C ATOM 464 O ILE A 34 -11.147 -11.773 -0.171 1.00 0.00 O ATOM 465 CB ILE A 34 -8.965 -10.305 0.788 1.00 0.00 C ATOM 466 CG1 ILE A 34 -8.265 -9.079 1.401 1.00 0.00 C ATOM 467 CG2 ILE A 34 -7.933 -11.392 0.474 1.00 0.00 C ATOM 468 CD1 ILE A 34 -7.350 -8.417 0.367 1.00 0.00 C ATOM 0 H ILE A 34 -10.932 -8.684 0.701 1.00 0.00 H new ATOM 0 HA ILE A 34 -8.974 -9.642 -1.273 1.00 0.00 H new ATOM 0 HB ILE A 34 -9.689 -10.697 1.502 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.009 -8.363 1.749 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.683 -9.382 2.271 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.418 -11.680 1.390 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -8.437 -12.261 0.052 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -7.208 -11.009 -0.244 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -6.862 -7.551 0.815 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.594 -9.131 0.040 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.942 -8.097 -0.490 1.00 0.00 H new ATOM 480 N ILE A 35 -10.559 -11.273 -2.288 1.00 0.00 N ATOM 481 CA ILE A 35 -11.323 -12.371 -2.881 1.00 0.00 C ATOM 482 C ILE A 35 -10.534 -13.004 -4.021 1.00 0.00 C ATOM 483 O ILE A 35 -9.675 -12.361 -4.621 1.00 0.00 O ATOM 484 CB ILE A 35 -12.667 -11.859 -3.413 1.00 0.00 C ATOM 485 CG1 ILE A 35 -12.446 -10.558 -4.224 1.00 0.00 C ATOM 486 CG2 ILE A 35 -13.621 -11.617 -2.234 1.00 0.00 C ATOM 487 CD1 ILE A 35 -12.501 -9.321 -3.313 1.00 0.00 C ATOM 0 H ILE A 35 -10.059 -10.695 -2.963 1.00 0.00 H new ATOM 0 HA ILE A 35 -11.506 -13.119 -2.110 1.00 0.00 H new ATOM 0 HB ILE A 35 -13.112 -12.602 -4.075 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -11.480 -10.600 -4.728 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -13.207 -10.476 -5.000 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -14.578 -11.253 -2.609 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -13.775 -12.551 -1.693 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -13.189 -10.875 -1.562 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -12.343 -8.423 -3.909 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -13.476 -9.268 -2.829 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -11.723 -9.394 -2.553 1.00 0.00 H new ATOM 499 N GLY A 36 -10.834 -14.261 -4.317 1.00 0.00 N ATOM 500 CA GLY A 36 -10.142 -14.960 -5.391 1.00 0.00 C ATOM 501 C GLY A 36 -10.624 -14.473 -6.752 1.00 0.00 C ATOM 502 O GLY A 36 -11.655 -14.922 -7.254 1.00 0.00 O ATOM 0 H GLY A 36 -11.544 -14.813 -3.835 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -9.067 -14.800 -5.302 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -10.313 -16.033 -5.302 1.00 0.00 H new ATOM 506 N TYR A 37 -9.866 -13.556 -7.345 1.00 0.00 N ATOM 507 CA TYR A 37 -10.218 -13.014 -8.652 1.00 0.00 C ATOM 508 C TYR A 37 -9.826 -14.001 -9.750 1.00 0.00 C ATOM 509 O TYR A 37 -8.681 -14.453 -9.808 1.00 0.00 O ATOM 510 CB TYR A 37 -9.508 -11.663 -8.870 1.00 0.00 C ATOM 511 CG TYR A 37 -8.083 -11.891 -9.349 1.00 0.00 C ATOM 512 CD1 TYR A 37 -7.175 -12.584 -8.542 1.00 0.00 C ATOM 513 CD2 TYR A 37 -7.682 -11.418 -10.606 1.00 0.00 C ATOM 514 CE1 TYR A 37 -5.870 -12.809 -8.992 1.00 0.00 C ATOM 515 CE2 TYR A 37 -6.375 -11.641 -11.052 1.00 0.00 C ATOM 516 CZ TYR A 37 -5.471 -12.338 -10.245 1.00 0.00 C ATOM 517 OH TYR A 37 -4.185 -12.570 -10.688 1.00 0.00 O ATOM 0 H TYR A 37 -9.009 -13.175 -6.944 1.00 0.00 H new ATOM 0 HA TYR A 37 -11.296 -12.855 -8.693 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -10.055 -11.070 -9.603 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -9.500 -11.094 -7.941 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -7.481 -12.945 -7.571 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -8.382 -10.882 -11.230 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -5.170 -13.347 -8.370 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -6.064 -11.275 -12.019 1.00 0.00 H new ATOM 0 HH TYR A 37 -3.546 -12.170 -10.062 1.00 0.00 H new ATOM 527 N ARG A 38 -10.778 -14.339 -10.607 1.00 0.00 N ATOM 528 CA ARG A 38 -10.521 -15.276 -11.689 1.00 0.00 C ATOM 529 C ARG A 38 -9.774 -14.600 -12.835 1.00 0.00 C ATOM 530 O ARG A 38 -10.155 -13.519 -13.291 1.00 0.00 O ATOM 531 CB ARG A 38 -11.852 -15.848 -12.198 1.00 0.00 C ATOM 532 CG ARG A 38 -11.634 -16.693 -13.488 1.00 0.00 C ATOM 533 CD ARG A 38 -12.211 -15.953 -14.701 1.00 0.00 C ATOM 534 NE ARG A 38 -13.665 -15.937 -14.621 1.00 0.00 N ATOM 535 CZ ARG A 38 -14.399 -15.429 -15.601 1.00 0.00 C ATOM 536 NH1 ARG A 38 -13.818 -14.928 -16.656 1.00 0.00 N ATOM 537 NH2 ARG A 38 -15.700 -15.431 -15.509 1.00 0.00 N ATOM 0 H ARG A 38 -11.732 -13.980 -10.574 1.00 0.00 H new ATOM 0 HA ARG A 38 -9.896 -16.083 -11.307 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -12.306 -16.467 -11.425 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -12.547 -15.034 -12.404 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -10.570 -16.878 -13.636 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -12.115 -17.665 -13.382 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -11.828 -14.933 -14.733 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -11.893 -16.442 -15.622 1.00 0.00 H new ATOM 0 HE ARG A 38 -14.126 -16.323 -13.797 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -12.800 -14.928 -16.726 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -14.381 -14.537 -17.411 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -16.152 -15.823 -14.683 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -16.265 -15.040 -16.263 1.00 0.00 H new ATOM 551 N ILE A 39 -8.715 -15.257 -13.311 1.00 0.00 N ATOM 552 CA ILE A 39 -7.917 -14.735 -14.421 1.00 0.00 C ATOM 553 C ILE A 39 -8.358 -15.410 -15.715 1.00 0.00 C ATOM 554 O ILE A 39 -8.310 -16.631 -15.838 1.00 0.00 O ATOM 555 CB ILE A 39 -6.425 -15.003 -14.155 1.00 0.00 C ATOM 556 CG1 ILE A 39 -6.093 -16.477 -14.451 1.00 0.00 C ATOM 557 CG2 ILE A 39 -6.106 -14.691 -12.686 1.00 0.00 C ATOM 558 CD1 ILE A 39 -4.762 -16.859 -13.809 1.00 0.00 C ATOM 0 H ILE A 39 -8.390 -16.152 -12.945 1.00 0.00 H new ATOM 0 HA ILE A 39 -8.066 -13.659 -14.512 1.00 0.00 H new ATOM 0 HB ILE A 39 -5.825 -14.366 -14.805 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -6.886 -17.119 -14.069 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -6.044 -16.637 -15.528 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -5.050 -14.880 -12.495 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -6.331 -13.645 -12.479 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -6.711 -15.327 -12.039 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -4.540 -17.904 -14.026 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -3.970 -16.228 -14.212 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -4.825 -16.718 -12.730 1.00 0.00 H new ATOM 570 N THR A 40 -8.798 -14.616 -16.681 1.00 0.00 N ATOM 571 CA THR A 40 -9.265 -15.160 -17.955 1.00 0.00 C ATOM 572 C THR A 40 -8.184 -15.049 -19.024 1.00 0.00 C ATOM 573 O THR A 40 -7.532 -14.014 -19.157 1.00 0.00 O ATOM 574 CB THR A 40 -10.511 -14.402 -18.411 1.00 0.00 C ATOM 575 OG1 THR A 40 -11.426 -14.301 -17.331 1.00 0.00 O ATOM 576 CG2 THR A 40 -11.169 -15.160 -19.566 1.00 0.00 C ATOM 0 H THR A 40 -8.843 -13.599 -16.611 1.00 0.00 H new ATOM 0 HA THR A 40 -9.504 -16.214 -17.811 1.00 0.00 H new ATOM 0 HB THR A 40 -10.229 -13.402 -18.742 1.00 0.00 H new ATOM 0 HG1 THR A 40 -11.115 -13.618 -16.701 1.00 0.00 H new ATOM 0 HG21 THR A 40 -12.059 -14.622 -19.894 1.00 0.00 H new ATOM 0 HG22 THR A 40 -10.467 -15.240 -20.396 1.00 0.00 H new ATOM 0 HG23 THR A 40 -11.451 -16.158 -19.232 1.00 0.00 H new ATOM 584 N VAL A 41 -8.007 -16.127 -19.790 1.00 0.00 N ATOM 585 CA VAL A 41 -7.008 -16.153 -20.863 1.00 0.00 C ATOM 586 C VAL A 41 -7.625 -16.721 -22.138 1.00 0.00 C ATOM 587 O VAL A 41 -8.396 -17.681 -22.089 1.00 0.00 O ATOM 588 CB VAL A 41 -5.799 -16.999 -20.443 1.00 0.00 C ATOM 589 CG1 VAL A 41 -6.281 -18.323 -19.846 1.00 0.00 C ATOM 590 CG2 VAL A 41 -4.909 -17.273 -21.663 1.00 0.00 C ATOM 0 H VAL A 41 -8.540 -16.991 -19.689 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.673 -15.134 -21.054 1.00 0.00 H new ATOM 0 HB VAL A 41 -5.222 -16.456 -19.695 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.421 -18.922 -19.548 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -6.904 -18.124 -18.974 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -6.863 -18.867 -20.590 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -4.052 -17.874 -21.360 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -5.482 -17.812 -22.418 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.561 -16.328 -22.079 1.00 0.00 H new ATOM 600 N VAL A 42 -7.280 -16.127 -23.285 1.00 0.00 N ATOM 601 CA VAL A 42 -7.803 -16.592 -24.566 1.00 0.00 C ATOM 602 C VAL A 42 -6.669 -16.746 -25.564 1.00 0.00 C ATOM 603 O VAL A 42 -5.849 -15.844 -25.729 1.00 0.00 O ATOM 604 CB VAL A 42 -8.835 -15.589 -25.099 1.00 0.00 C ATOM 605 CG1 VAL A 42 -9.137 -15.867 -26.579 1.00 0.00 C ATOM 606 CG2 VAL A 42 -10.127 -15.711 -24.285 1.00 0.00 C ATOM 0 H VAL A 42 -6.646 -15.330 -23.349 1.00 0.00 H new ATOM 0 HA VAL A 42 -8.284 -17.560 -24.425 1.00 0.00 H new ATOM 0 HB VAL A 42 -8.430 -14.581 -25.005 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -9.871 -15.147 -26.942 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -8.220 -15.775 -27.161 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -9.535 -16.876 -26.686 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -10.862 -15.000 -24.661 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -10.521 -16.723 -24.377 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -9.918 -15.497 -23.237 1.00 0.00 H new ATOM 616 N ALA A 43 -6.636 -17.888 -26.238 1.00 0.00 N ATOM 617 CA ALA A 43 -5.611 -18.149 -27.235 1.00 0.00 C ATOM 618 C ALA A 43 -6.165 -17.849 -28.623 1.00 0.00 C ATOM 619 O ALA A 43 -7.277 -18.260 -28.955 1.00 0.00 O ATOM 620 CB ALA A 43 -5.197 -19.615 -27.157 1.00 0.00 C ATOM 0 H ALA A 43 -7.307 -18.646 -26.112 1.00 0.00 H new ATOM 0 HA ALA A 43 -4.745 -17.514 -27.047 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -4.428 -19.816 -27.903 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -4.804 -19.830 -26.163 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -6.063 -20.248 -27.349 1.00 0.00 H new ATOM 626 N ALA A 44 -5.395 -17.130 -29.433 1.00 0.00 N ATOM 627 CA ALA A 44 -5.840 -16.782 -30.779 1.00 0.00 C ATOM 628 C ALA A 44 -5.334 -17.799 -31.804 1.00 0.00 C ATOM 629 O ALA A 44 -5.798 -17.826 -32.944 1.00 0.00 O ATOM 630 CB ALA A 44 -5.337 -15.383 -31.144 1.00 0.00 C ATOM 0 H ALA A 44 -4.470 -16.780 -29.185 1.00 0.00 H new ATOM 0 HA ALA A 44 -6.930 -16.794 -30.795 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -5.671 -15.127 -32.149 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -5.733 -14.657 -30.434 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -4.248 -15.367 -31.109 1.00 0.00 H new ATOM 636 N GLY A 45 -4.373 -18.623 -31.393 1.00 0.00 N ATOM 637 CA GLY A 45 -3.798 -19.634 -32.284 1.00 0.00 C ATOM 638 C GLY A 45 -4.409 -21.006 -32.031 1.00 0.00 C ATOM 639 O GLY A 45 -3.816 -22.031 -32.360 1.00 0.00 O ATOM 0 H GLY A 45 -3.976 -18.613 -30.454 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -3.965 -19.345 -33.322 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -2.719 -19.681 -32.136 1.00 0.00 H new ATOM 643 N GLU A 46 -5.601 -21.020 -31.438 1.00 0.00 N ATOM 644 CA GLU A 46 -6.287 -22.276 -31.144 1.00 0.00 C ATOM 645 C GLU A 46 -7.789 -22.115 -31.334 1.00 0.00 C ATOM 646 O GLU A 46 -8.342 -21.030 -31.150 1.00 0.00 O ATOM 647 CB GLU A 46 -6.001 -22.714 -29.705 1.00 0.00 C ATOM 648 CG GLU A 46 -4.512 -23.040 -29.548 1.00 0.00 C ATOM 649 CD GLU A 46 -4.216 -23.457 -28.111 1.00 0.00 C ATOM 650 OE1 GLU A 46 -5.137 -23.461 -27.313 1.00 0.00 O ATOM 651 OE2 GLU A 46 -3.067 -23.763 -27.831 1.00 0.00 O ATOM 0 H GLU A 46 -6.109 -20.182 -31.153 1.00 0.00 H new ATOM 0 HA GLU A 46 -5.917 -23.037 -31.831 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -6.285 -21.923 -29.011 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.602 -23.588 -29.455 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.233 -23.841 -30.232 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -3.911 -22.170 -29.814 1.00 0.00 H new ATOM 658 N GLY A 47 -8.444 -23.208 -31.703 1.00 0.00 N ATOM 659 CA GLY A 47 -9.883 -23.190 -31.918 1.00 0.00 C ATOM 660 C GLY A 47 -10.625 -22.987 -30.602 1.00 0.00 C ATOM 661 O GLY A 47 -11.794 -22.596 -30.595 1.00 0.00 O ATOM 0 H GLY A 47 -8.003 -24.114 -31.859 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -10.141 -22.391 -32.613 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -10.198 -24.127 -32.378 1.00 0.00 H new ATOM 665 N ILE A 48 -9.943 -23.258 -29.481 1.00 0.00 N ATOM 666 CA ILE A 48 -10.557 -23.097 -28.163 1.00 0.00 C ATOM 667 C ILE A 48 -9.601 -22.360 -27.204 1.00 0.00 C ATOM 668 O ILE A 48 -8.404 -22.645 -27.177 1.00 0.00 O ATOM 669 CB ILE A 48 -10.943 -24.498 -27.590 1.00 0.00 C ATOM 670 CG1 ILE A 48 -12.459 -24.707 -27.708 1.00 0.00 C ATOM 671 CG2 ILE A 48 -10.557 -24.643 -26.104 1.00 0.00 C ATOM 672 CD1 ILE A 48 -12.788 -26.190 -27.531 1.00 0.00 C ATOM 0 H ILE A 48 -8.977 -23.586 -29.463 1.00 0.00 H new ATOM 0 HA ILE A 48 -11.460 -22.495 -28.263 1.00 0.00 H new ATOM 0 HB ILE A 48 -10.396 -25.242 -28.170 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -12.978 -24.116 -26.953 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -12.810 -24.360 -28.680 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -10.844 -25.632 -25.748 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -9.480 -24.516 -25.994 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -11.074 -23.883 -25.518 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -13.865 -26.336 -27.615 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -12.282 -26.770 -28.303 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -12.452 -26.522 -26.549 1.00 0.00 H new ATOM 684 N PRO A 49 -10.116 -21.461 -26.389 1.00 0.00 N ATOM 685 CA PRO A 49 -9.295 -20.717 -25.391 1.00 0.00 C ATOM 686 C PRO A 49 -8.897 -21.600 -24.208 1.00 0.00 C ATOM 687 O PRO A 49 -9.469 -22.672 -23.998 1.00 0.00 O ATOM 688 CB PRO A 49 -10.220 -19.580 -24.938 1.00 0.00 C ATOM 689 CG PRO A 49 -11.604 -20.107 -25.132 1.00 0.00 C ATOM 690 CD PRO A 49 -11.535 -21.048 -26.329 1.00 0.00 C ATOM 0 HA PRO A 49 -8.354 -20.364 -25.812 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -10.040 -19.317 -23.896 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -10.055 -18.678 -25.528 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -11.949 -20.633 -24.242 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -12.308 -19.295 -25.315 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -12.194 -21.906 -26.198 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -11.842 -20.547 -27.247 1.00 0.00 H new ATOM 698 N ILE A 50 -7.916 -21.138 -23.438 1.00 0.00 N ATOM 699 CA ILE A 50 -7.455 -21.885 -22.277 1.00 0.00 C ATOM 700 C ILE A 50 -8.407 -21.689 -21.099 1.00 0.00 C ATOM 701 O ILE A 50 -9.114 -20.683 -21.020 1.00 0.00 O ATOM 702 CB ILE A 50 -6.047 -21.435 -21.878 1.00 0.00 C ATOM 703 CG1 ILE A 50 -5.059 -21.815 -22.983 1.00 0.00 C ATOM 704 CG2 ILE A 50 -5.636 -22.114 -20.568 1.00 0.00 C ATOM 705 CD1 ILE A 50 -3.709 -21.150 -22.710 1.00 0.00 C ATOM 0 H ILE A 50 -7.429 -20.256 -23.597 1.00 0.00 H new ATOM 0 HA ILE A 50 -7.432 -22.942 -22.542 1.00 0.00 H new ATOM 0 HB ILE A 50 -6.041 -20.354 -21.738 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.941 -22.898 -23.024 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -5.443 -21.499 -23.953 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -4.633 -21.790 -20.289 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.338 -21.840 -19.780 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.644 -23.196 -20.701 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -3.005 -21.420 -23.497 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -3.834 -20.067 -22.691 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -3.325 -21.488 -21.747 1.00 0.00 H new ATOM 717 N PHE A 51 -8.421 -22.659 -20.189 1.00 0.00 N ATOM 718 CA PHE A 51 -9.289 -22.582 -19.021 1.00 0.00 C ATOM 719 C PHE A 51 -8.780 -21.524 -18.049 1.00 0.00 C ATOM 720 O PHE A 51 -7.575 -21.375 -17.851 1.00 0.00 O ATOM 721 CB PHE A 51 -9.330 -23.935 -18.312 1.00 0.00 C ATOM 722 CG PHE A 51 -9.941 -24.967 -19.231 1.00 0.00 C ATOM 723 CD1 PHE A 51 -11.327 -25.156 -19.254 1.00 0.00 C ATOM 724 CD2 PHE A 51 -9.115 -25.732 -20.062 1.00 0.00 C ATOM 725 CE1 PHE A 51 -11.889 -26.113 -20.111 1.00 0.00 C ATOM 726 CE2 PHE A 51 -9.673 -26.687 -20.917 1.00 0.00 C ATOM 727 CZ PHE A 51 -11.059 -26.879 -20.942 1.00 0.00 C ATOM 0 H PHE A 51 -7.846 -23.500 -20.238 1.00 0.00 H new ATOM 0 HA PHE A 51 -10.291 -22.311 -19.354 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -8.323 -24.238 -18.026 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -9.913 -23.859 -17.394 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -11.964 -24.565 -18.612 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -8.045 -25.585 -20.043 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -12.959 -26.260 -20.131 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -9.034 -27.277 -21.558 1.00 0.00 H new ATOM 0 HZ PHE A 51 -11.490 -27.618 -21.602 1.00 0.00 H new ATOM 737 N GLU A 52 -9.708 -20.798 -17.441 1.00 0.00 N ATOM 738 CA GLU A 52 -9.348 -19.762 -16.484 1.00 0.00 C ATOM 739 C GLU A 52 -8.965 -20.374 -15.148 1.00 0.00 C ATOM 740 O GLU A 52 -9.544 -21.371 -14.719 1.00 0.00 O ATOM 741 CB GLU A 52 -10.527 -18.798 -16.303 1.00 0.00 C ATOM 742 CG GLU A 52 -11.605 -19.432 -15.419 1.00 0.00 C ATOM 743 CD GLU A 52 -12.004 -20.791 -15.989 1.00 0.00 C ATOM 744 OE1 GLU A 52 -12.362 -20.841 -17.155 1.00 0.00 O ATOM 745 OE2 GLU A 52 -11.943 -21.762 -15.254 1.00 0.00 O ATOM 0 H GLU A 52 -10.711 -20.907 -17.593 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.487 -19.214 -16.867 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.179 -17.868 -15.853 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -10.949 -18.543 -17.275 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -11.232 -19.549 -14.401 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -12.476 -18.779 -15.366 1.00 0.00 H new ATOM 752 N ASP A 53 -7.992 -19.762 -14.496 1.00 0.00 N ATOM 753 CA ASP A 53 -7.527 -20.237 -13.199 1.00 0.00 C ATOM 754 C ASP A 53 -8.057 -19.343 -12.080 1.00 0.00 C ATOM 755 O ASP A 53 -8.248 -18.142 -12.263 1.00 0.00 O ATOM 756 CB ASP A 53 -5.990 -20.245 -13.199 1.00 0.00 C ATOM 757 CG ASP A 53 -5.449 -21.637 -13.530 1.00 0.00 C ATOM 758 OD1 ASP A 53 -5.783 -22.566 -12.813 1.00 0.00 O ATOM 759 OD2 ASP A 53 -4.709 -21.751 -14.493 1.00 0.00 O ATOM 0 H ASP A 53 -7.506 -18.934 -14.841 1.00 0.00 H new ATOM 0 HA ASP A 53 -7.899 -21.246 -13.024 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.619 -19.524 -13.928 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -5.621 -19.930 -12.223 1.00 0.00 H new ATOM 764 N PHE A 54 -8.284 -19.948 -10.913 1.00 0.00 N ATOM 765 CA PHE A 54 -8.785 -19.216 -9.751 1.00 0.00 C ATOM 766 C PHE A 54 -7.741 -19.224 -8.638 1.00 0.00 C ATOM 767 O PHE A 54 -7.342 -20.285 -8.159 1.00 0.00 O ATOM 768 CB PHE A 54 -10.063 -19.882 -9.245 1.00 0.00 C ATOM 769 CG PHE A 54 -10.988 -20.133 -10.410 1.00 0.00 C ATOM 770 CD1 PHE A 54 -10.780 -21.247 -11.232 1.00 0.00 C ATOM 771 CD2 PHE A 54 -12.053 -19.261 -10.669 1.00 0.00 C ATOM 772 CE1 PHE A 54 -11.635 -21.491 -12.311 1.00 0.00 C ATOM 773 CE2 PHE A 54 -12.907 -19.505 -11.751 1.00 0.00 C ATOM 774 CZ PHE A 54 -12.697 -20.620 -12.571 1.00 0.00 C ATOM 0 H PHE A 54 -8.129 -20.943 -10.748 1.00 0.00 H new ATOM 0 HA PHE A 54 -8.993 -18.186 -10.042 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -9.824 -20.821 -8.746 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -10.552 -19.245 -8.508 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -9.958 -21.919 -11.032 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -12.215 -18.402 -10.035 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -11.475 -22.352 -12.943 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -13.728 -18.833 -11.953 1.00 0.00 H new ATOM 0 HZ PHE A 54 -13.356 -20.808 -13.406 1.00 0.00 H new ATOM 784 N VAL A 55 -7.296 -18.037 -8.227 1.00 0.00 N ATOM 785 CA VAL A 55 -6.293 -17.915 -7.166 1.00 0.00 C ATOM 786 C VAL A 55 -6.751 -16.908 -6.115 1.00 0.00 C ATOM 787 O VAL A 55 -7.374 -15.902 -6.442 1.00 0.00 O ATOM 788 CB VAL A 55 -4.954 -17.454 -7.761 1.00 0.00 C ATOM 789 CG1 VAL A 55 -5.039 -15.969 -8.139 1.00 0.00 C ATOM 790 CG2 VAL A 55 -3.835 -17.653 -6.726 1.00 0.00 C ATOM 0 H VAL A 55 -7.613 -17.147 -8.611 1.00 0.00 H new ATOM 0 HA VAL A 55 -6.167 -18.890 -6.696 1.00 0.00 H new ATOM 0 HB VAL A 55 -4.736 -18.043 -8.652 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -4.087 -15.646 -8.561 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -5.830 -15.826 -8.876 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -5.261 -15.379 -7.250 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -2.885 -17.326 -7.149 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.056 -17.067 -5.834 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -3.769 -18.708 -6.460 1.00 0.00 H new ATOM 800 N ASP A 56 -6.429 -17.186 -4.858 1.00 0.00 N ATOM 801 CA ASP A 56 -6.803 -16.293 -3.770 1.00 0.00 C ATOM 802 C ASP A 56 -6.066 -14.961 -3.891 1.00 0.00 C ATOM 803 O ASP A 56 -4.924 -14.914 -4.350 1.00 0.00 O ATOM 804 CB ASP A 56 -6.474 -16.942 -2.428 1.00 0.00 C ATOM 805 CG ASP A 56 -7.440 -18.089 -2.151 1.00 0.00 C ATOM 806 OD1 ASP A 56 -8.445 -18.172 -2.841 1.00 0.00 O ATOM 807 OD2 ASP A 56 -7.164 -18.869 -1.255 1.00 0.00 O ATOM 0 H ASP A 56 -5.913 -18.017 -4.568 1.00 0.00 H new ATOM 0 HA ASP A 56 -7.875 -16.107 -3.829 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -5.449 -17.313 -2.436 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -6.539 -16.201 -1.631 1.00 0.00 H new ATOM 812 N SER A 57 -6.726 -13.883 -3.475 1.00 0.00 N ATOM 813 CA SER A 57 -6.125 -12.554 -3.537 1.00 0.00 C ATOM 814 C SER A 57 -4.929 -12.459 -2.587 1.00 0.00 C ATOM 815 O SER A 57 -3.970 -11.734 -2.852 1.00 0.00 O ATOM 816 CB SER A 57 -7.180 -11.490 -3.181 1.00 0.00 C ATOM 817 OG SER A 57 -7.764 -11.002 -4.380 1.00 0.00 O ATOM 0 H SER A 57 -7.672 -13.903 -3.093 1.00 0.00 H new ATOM 0 HA SER A 57 -5.768 -12.376 -4.551 1.00 0.00 H new ATOM 0 HB2 SER A 57 -7.946 -11.920 -2.536 1.00 0.00 H new ATOM 0 HB3 SER A 57 -6.719 -10.673 -2.626 1.00 0.00 H new ATOM 0 HG SER A 57 -8.722 -11.208 -4.385 1.00 0.00 H new ATOM 823 N SER A 58 -4.999 -13.189 -1.478 1.00 0.00 N ATOM 824 CA SER A 58 -3.922 -13.172 -0.493 1.00 0.00 C ATOM 825 C SER A 58 -2.587 -13.496 -1.152 1.00 0.00 C ATOM 826 O SER A 58 -1.551 -12.946 -0.777 1.00 0.00 O ATOM 827 CB SER A 58 -4.209 -14.193 0.607 1.00 0.00 C ATOM 828 OG SER A 58 -5.466 -13.901 1.202 1.00 0.00 O ATOM 0 H SER A 58 -5.784 -13.795 -1.240 1.00 0.00 H new ATOM 0 HA SER A 58 -3.867 -12.173 -0.059 1.00 0.00 H new ATOM 0 HB2 SER A 58 -4.216 -15.201 0.191 1.00 0.00 H new ATOM 0 HB3 SER A 58 -3.422 -14.164 1.360 1.00 0.00 H new ATOM 0 HG SER A 58 -5.654 -14.555 1.907 1.00 0.00 H new ATOM 834 N VAL A 59 -2.613 -14.393 -2.130 1.00 0.00 N ATOM 835 CA VAL A 59 -1.392 -14.783 -2.821 1.00 0.00 C ATOM 836 C VAL A 59 -0.739 -13.569 -3.473 1.00 0.00 C ATOM 837 O VAL A 59 0.475 -13.392 -3.392 1.00 0.00 O ATOM 838 CB VAL A 59 -1.713 -15.827 -3.897 1.00 0.00 C ATOM 839 CG1 VAL A 59 -0.435 -16.185 -4.667 1.00 0.00 C ATOM 840 CG2 VAL A 59 -2.280 -17.085 -3.233 1.00 0.00 C ATOM 0 H VAL A 59 -3.458 -14.860 -2.460 1.00 0.00 H new ATOM 0 HA VAL A 59 -0.702 -15.209 -2.092 1.00 0.00 H new ATOM 0 HB VAL A 59 -2.448 -15.418 -4.590 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -0.666 -16.927 -5.431 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -0.033 -15.290 -5.141 1.00 0.00 H new ATOM 0 HG13 VAL A 59 0.303 -16.593 -3.977 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -2.509 -17.828 -3.997 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -1.545 -17.493 -2.539 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -3.190 -16.831 -2.690 1.00 0.00 H new ATOM 850 N GLY A 60 -1.548 -12.732 -4.113 1.00 0.00 N ATOM 851 CA GLY A 60 -1.021 -11.539 -4.762 1.00 0.00 C ATOM 852 C GLY A 60 -0.098 -11.924 -5.914 1.00 0.00 C ATOM 853 O GLY A 60 0.778 -11.153 -6.305 1.00 0.00 O ATOM 0 H GLY A 60 -2.557 -12.855 -4.196 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -1.842 -10.927 -5.135 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -0.476 -10.934 -4.038 1.00 0.00 H new ATOM 857 N TYR A 61 -0.297 -13.125 -6.447 1.00 0.00 N ATOM 858 CA TYR A 61 0.533 -13.603 -7.548 1.00 0.00 C ATOM 859 C TYR A 61 -0.022 -14.894 -8.148 1.00 0.00 C ATOM 860 O TYR A 61 -0.693 -15.671 -7.470 1.00 0.00 O ATOM 861 CB TYR A 61 1.966 -13.838 -7.041 1.00 0.00 C ATOM 862 CG TYR A 61 2.777 -14.572 -8.089 1.00 0.00 C ATOM 863 CD1 TYR A 61 2.787 -15.971 -8.106 1.00 0.00 C ATOM 864 CD2 TYR A 61 3.504 -13.855 -9.042 1.00 0.00 C ATOM 865 CE1 TYR A 61 3.529 -16.652 -9.078 1.00 0.00 C ATOM 866 CE2 TYR A 61 4.244 -14.535 -10.016 1.00 0.00 C ATOM 867 CZ TYR A 61 4.257 -15.936 -10.032 1.00 0.00 C ATOM 868 OH TYR A 61 4.987 -16.607 -10.991 1.00 0.00 O ATOM 0 H TYR A 61 -1.017 -13.779 -6.139 1.00 0.00 H new ATOM 0 HA TYR A 61 0.533 -12.844 -8.331 1.00 0.00 H new ATOM 0 HB2 TYR A 61 2.438 -12.884 -6.808 1.00 0.00 H new ATOM 0 HB3 TYR A 61 1.943 -14.416 -6.117 1.00 0.00 H new ATOM 0 HD1 TYR A 61 2.223 -16.525 -7.370 1.00 0.00 H new ATOM 0 HD2 TYR A 61 3.495 -12.775 -9.027 1.00 0.00 H new ATOM 0 HE1 TYR A 61 3.539 -17.732 -9.091 1.00 0.00 H new ATOM 0 HE2 TYR A 61 4.804 -13.981 -10.754 1.00 0.00 H new ATOM 0 HH TYR A 61 4.410 -17.254 -11.448 1.00 0.00 H new ATOM 878 N TYR A 62 0.289 -15.121 -9.420 1.00 0.00 N ATOM 879 CA TYR A 62 -0.154 -16.333 -10.099 1.00 0.00 C ATOM 880 C TYR A 62 0.726 -16.613 -11.310 1.00 0.00 C ATOM 881 O TYR A 62 1.413 -15.725 -11.811 1.00 0.00 O ATOM 882 CB TYR A 62 -1.614 -16.202 -10.548 1.00 0.00 C ATOM 883 CG TYR A 62 -2.178 -17.579 -10.814 1.00 0.00 C ATOM 884 CD1 TYR A 62 -2.363 -18.472 -9.754 1.00 0.00 C ATOM 885 CD2 TYR A 62 -2.514 -17.959 -12.112 1.00 0.00 C ATOM 886 CE1 TYR A 62 -2.886 -19.748 -9.994 1.00 0.00 C ATOM 887 CE2 TYR A 62 -3.038 -19.233 -12.355 1.00 0.00 C ATOM 888 CZ TYR A 62 -3.224 -20.127 -11.295 1.00 0.00 C ATOM 889 OH TYR A 62 -3.746 -21.381 -11.534 1.00 0.00 O ATOM 0 H TYR A 62 0.842 -14.487 -9.997 1.00 0.00 H new ATOM 0 HA TYR A 62 -0.074 -17.162 -9.395 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -2.200 -15.698 -9.779 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -1.677 -15.590 -11.448 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.102 -18.177 -8.748 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -2.370 -17.270 -12.931 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -3.028 -20.438 -9.175 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -3.299 -19.527 -13.361 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.253 -21.806 -12.267 1.00 0.00 H new ATOM 899 N THR A 63 0.695 -17.857 -11.780 1.00 0.00 N ATOM 900 CA THR A 63 1.488 -18.267 -12.940 1.00 0.00 C ATOM 901 C THR A 63 0.594 -18.913 -13.988 1.00 0.00 C ATOM 902 O THR A 63 -0.237 -19.763 -13.672 1.00 0.00 O ATOM 903 CB THR A 63 2.569 -19.257 -12.509 1.00 0.00 C ATOM 904 OG1 THR A 63 3.401 -18.649 -11.529 1.00 0.00 O ATOM 905 CG2 THR A 63 3.413 -19.652 -13.724 1.00 0.00 C ATOM 0 H THR A 63 0.128 -18.602 -11.375 1.00 0.00 H new ATOM 0 HA THR A 63 1.959 -17.383 -13.370 1.00 0.00 H new ATOM 0 HB THR A 63 2.102 -20.147 -12.088 1.00 0.00 H new ATOM 0 HG1 THR A 63 4.095 -19.283 -11.250 1.00 0.00 H new ATOM 0 HG21 THR A 63 4.184 -20.358 -13.417 1.00 0.00 H new ATOM 0 HG22 THR A 63 2.774 -20.116 -14.475 1.00 0.00 H new ATOM 0 HG23 THR A 63 3.882 -18.763 -14.146 1.00 0.00 H new ATOM 913 N VAL A 64 0.784 -18.515 -15.243 1.00 0.00 N ATOM 914 CA VAL A 64 0.009 -19.070 -16.354 1.00 0.00 C ATOM 915 C VAL A 64 0.946 -19.440 -17.500 1.00 0.00 C ATOM 916 O VAL A 64 1.366 -18.573 -18.270 1.00 0.00 O ATOM 917 CB VAL A 64 -1.043 -18.046 -16.827 1.00 0.00 C ATOM 918 CG1 VAL A 64 -2.353 -18.259 -16.061 1.00 0.00 C ATOM 919 CG2 VAL A 64 -0.527 -16.629 -16.551 1.00 0.00 C ATOM 0 H VAL A 64 1.468 -17.810 -15.518 1.00 0.00 H new ATOM 0 HA VAL A 64 -0.509 -19.969 -16.019 1.00 0.00 H new ATOM 0 HB VAL A 64 -1.220 -18.177 -17.894 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -3.094 -17.534 -16.398 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.723 -19.268 -16.246 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -2.176 -18.127 -14.994 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -1.267 -15.901 -16.884 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -0.353 -16.507 -15.482 1.00 0.00 H new ATOM 0 HG23 VAL A 64 0.406 -16.470 -17.091 1.00 0.00 H new ATOM 929 N THR A 65 1.266 -20.727 -17.618 1.00 0.00 N ATOM 930 CA THR A 65 2.161 -21.202 -18.680 1.00 0.00 C ATOM 931 C THR A 65 1.416 -22.108 -19.635 1.00 0.00 C ATOM 932 O THR A 65 0.325 -22.590 -19.330 1.00 0.00 O ATOM 933 CB THR A 65 3.340 -21.973 -18.078 1.00 0.00 C ATOM 934 OG1 THR A 65 2.975 -23.336 -17.922 1.00 0.00 O ATOM 935 CG2 THR A 65 3.704 -21.395 -16.702 1.00 0.00 C ATOM 0 H THR A 65 0.923 -21.459 -16.996 1.00 0.00 H new ATOM 0 HA THR A 65 2.533 -20.332 -19.222 1.00 0.00 H new ATOM 0 HB THR A 65 4.198 -21.885 -18.744 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.727 -23.834 -17.539 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.543 -21.951 -16.284 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.981 -20.346 -16.810 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.846 -21.477 -16.034 1.00 0.00 H new ATOM 943 N GLY A 66 2.015 -22.335 -20.799 1.00 0.00 N ATOM 944 CA GLY A 66 1.407 -23.189 -21.807 1.00 0.00 C ATOM 945 C GLY A 66 0.881 -22.371 -22.974 1.00 0.00 C ATOM 946 O GLY A 66 -0.018 -22.813 -23.689 1.00 0.00 O ATOM 0 H GLY A 66 2.917 -21.940 -21.065 1.00 0.00 H new ATOM 0 HA2 GLY A 66 2.140 -23.911 -22.166 1.00 0.00 H new ATOM 0 HA3 GLY A 66 0.591 -23.758 -21.361 1.00 0.00 H new ATOM 950 N LEU A 67 1.437 -21.174 -23.174 1.00 0.00 N ATOM 951 CA LEU A 67 1.001 -20.314 -24.275 1.00 0.00 C ATOM 952 C LEU A 67 1.946 -20.485 -25.461 1.00 0.00 C ATOM 953 O LEU A 67 3.081 -20.022 -25.438 1.00 0.00 O ATOM 954 CB LEU A 67 1.014 -18.854 -23.824 1.00 0.00 C ATOM 955 CG LEU A 67 0.497 -18.754 -22.386 1.00 0.00 C ATOM 956 CD1 LEU A 67 0.452 -17.289 -21.967 1.00 0.00 C ATOM 957 CD2 LEU A 67 -0.909 -19.353 -22.300 1.00 0.00 C ATOM 0 H LEU A 67 2.181 -20.782 -22.596 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.010 -20.593 -24.570 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.026 -18.453 -23.886 1.00 0.00 H new ATOM 0 HB3 LEU A 67 0.392 -18.253 -24.487 1.00 0.00 H new ATOM 0 HG LEU A 67 1.163 -19.305 -21.722 1.00 0.00 H new ATOM 0 HD11 LEU A 67 0.084 -17.214 -20.944 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.454 -16.863 -22.025 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.214 -16.740 -22.633 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.274 -19.280 -21.275 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.579 -18.806 -22.963 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.877 -20.400 -22.600 1.00 0.00 H new ATOM 969 N GLU A 68 1.475 -21.168 -26.483 1.00 0.00 N ATOM 970 CA GLU A 68 2.304 -21.423 -27.658 1.00 0.00 C ATOM 971 C GLU A 68 3.029 -20.151 -28.134 1.00 0.00 C ATOM 972 O GLU A 68 2.425 -19.080 -28.199 1.00 0.00 O ATOM 973 CB GLU A 68 1.450 -21.984 -28.802 1.00 0.00 C ATOM 974 CG GLU A 68 0.632 -23.174 -28.298 1.00 0.00 C ATOM 975 CD GLU A 68 1.553 -24.254 -27.733 1.00 0.00 C ATOM 976 OE1 GLU A 68 1.953 -24.125 -26.587 1.00 0.00 O ATOM 977 OE2 GLU A 68 1.844 -25.192 -28.455 1.00 0.00 O ATOM 0 H GLU A 68 0.533 -21.556 -26.531 1.00 0.00 H new ATOM 0 HA GLU A 68 3.058 -22.156 -27.369 1.00 0.00 H new ATOM 0 HB2 GLU A 68 0.786 -21.210 -29.186 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.090 -22.294 -29.628 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.066 -22.844 -27.529 1.00 0.00 H new ATOM 0 HG3 GLU A 68 0.037 -23.585 -29.113 1.00 0.00 H new ATOM 984 N PRO A 69 4.297 -20.247 -28.496 1.00 0.00 N ATOM 985 CA PRO A 69 5.084 -19.078 -29.001 1.00 0.00 C ATOM 986 C PRO A 69 4.675 -18.709 -30.416 1.00 0.00 C ATOM 987 O PRO A 69 4.157 -19.540 -31.160 1.00 0.00 O ATOM 988 CB PRO A 69 6.535 -19.571 -28.943 1.00 0.00 C ATOM 989 CG PRO A 69 6.438 -21.047 -29.126 1.00 0.00 C ATOM 990 CD PRO A 69 5.123 -21.473 -28.469 1.00 0.00 C ATOM 0 HA PRO A 69 4.925 -18.173 -28.415 1.00 0.00 H new ATOM 0 HB2 PRO A 69 7.141 -19.113 -29.725 1.00 0.00 H new ATOM 0 HB3 PRO A 69 7.001 -19.319 -27.991 1.00 0.00 H new ATOM 0 HG2 PRO A 69 6.448 -21.310 -30.184 1.00 0.00 H new ATOM 0 HG3 PRO A 69 7.286 -21.553 -28.664 1.00 0.00 H new ATOM 0 HD2 PRO A 69 4.648 -22.287 -29.017 1.00 0.00 H new ATOM 0 HD3 PRO A 69 5.282 -21.825 -27.450 1.00 0.00 H new ATOM 998 N GLY A 70 4.923 -17.465 -30.783 1.00 0.00 N ATOM 999 CA GLY A 70 4.591 -17.001 -32.114 1.00 0.00 C ATOM 1000 C GLY A 70 3.083 -16.853 -32.300 1.00 0.00 C ATOM 1001 O GLY A 70 2.619 -16.376 -33.334 1.00 0.00 O ATOM 0 H GLY A 70 5.351 -16.762 -30.180 1.00 0.00 H new ATOM 0 HA2 GLY A 70 5.076 -16.042 -32.297 1.00 0.00 H new ATOM 0 HA3 GLY A 70 4.982 -17.702 -32.852 1.00 0.00 H new ATOM 1005 N ILE A 71 2.324 -17.272 -31.291 1.00 0.00 N ATOM 1006 CA ILE A 71 0.859 -17.194 -31.335 1.00 0.00 C ATOM 1007 C ILE A 71 0.384 -16.033 -30.477 1.00 0.00 C ATOM 1008 O ILE A 71 0.954 -15.740 -29.428 1.00 0.00 O ATOM 1009 CB ILE A 71 0.252 -18.527 -30.825 1.00 0.00 C ATOM 1010 CG1 ILE A 71 0.212 -19.571 -31.953 1.00 0.00 C ATOM 1011 CG2 ILE A 71 -1.186 -18.317 -30.317 1.00 0.00 C ATOM 1012 CD1 ILE A 71 1.618 -20.110 -32.213 1.00 0.00 C ATOM 0 H ILE A 71 2.696 -17.671 -30.429 1.00 0.00 H new ATOM 0 HA ILE A 71 0.532 -17.029 -32.362 1.00 0.00 H new ATOM 0 HB ILE A 71 0.885 -18.879 -30.010 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -0.456 -20.388 -31.680 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -0.189 -19.122 -32.862 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -1.590 -19.266 -29.965 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -1.181 -17.598 -29.497 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -1.807 -17.938 -31.129 1.00 0.00 H new ATOM 0 HD11 ILE A 71 1.582 -20.849 -33.013 1.00 0.00 H new ATOM 0 HD12 ILE A 71 2.274 -19.290 -32.506 1.00 0.00 H new ATOM 0 HD13 ILE A 71 2.003 -20.576 -31.306 1.00 0.00 H new ATOM 1024 N ASP A 72 -0.676 -15.388 -30.940 1.00 0.00 N ATOM 1025 CA ASP A 72 -1.259 -14.266 -30.227 1.00 0.00 C ATOM 1026 C ASP A 72 -2.228 -14.759 -29.158 1.00 0.00 C ATOM 1027 O ASP A 72 -3.218 -15.422 -29.462 1.00 0.00 O ATOM 1028 CB ASP A 72 -1.980 -13.371 -31.229 1.00 0.00 C ATOM 1029 CG ASP A 72 -2.813 -12.316 -30.505 1.00 0.00 C ATOM 1030 OD1 ASP A 72 -3.723 -12.700 -29.787 1.00 0.00 O ATOM 1031 OD2 ASP A 72 -2.523 -11.144 -30.669 1.00 0.00 O ATOM 0 H ASP A 72 -1.151 -15.625 -31.811 1.00 0.00 H new ATOM 0 HA ASP A 72 -0.472 -13.699 -29.729 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -1.253 -12.885 -31.879 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -2.624 -13.976 -31.867 1.00 0.00 H new ATOM 1036 N TYR A 73 -1.930 -14.431 -27.909 1.00 0.00 N ATOM 1037 CA TYR A 73 -2.773 -14.838 -26.783 1.00 0.00 C ATOM 1038 C TYR A 73 -3.489 -13.638 -26.185 1.00 0.00 C ATOM 1039 O TYR A 73 -2.858 -12.690 -25.736 1.00 0.00 O ATOM 1040 CB TYR A 73 -1.895 -15.493 -25.698 1.00 0.00 C ATOM 1041 CG TYR A 73 -1.731 -16.969 -25.972 1.00 0.00 C ATOM 1042 CD1 TYR A 73 -0.765 -17.416 -26.878 1.00 0.00 C ATOM 1043 CD2 TYR A 73 -2.556 -17.890 -25.317 1.00 0.00 C ATOM 1044 CE1 TYR A 73 -0.629 -18.787 -27.128 1.00 0.00 C ATOM 1045 CE2 TYR A 73 -2.417 -19.257 -25.573 1.00 0.00 C ATOM 1046 CZ TYR A 73 -1.455 -19.704 -26.479 1.00 0.00 C ATOM 1047 OH TYR A 73 -1.326 -21.051 -26.730 1.00 0.00 O ATOM 0 H TYR A 73 -1.111 -13.884 -27.645 1.00 0.00 H new ATOM 0 HA TYR A 73 -3.517 -15.547 -27.145 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -0.918 -15.011 -25.672 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -2.348 -15.347 -24.718 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -0.126 -16.707 -27.383 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -3.300 -17.545 -24.614 1.00 0.00 H new ATOM 0 HE1 TYR A 73 0.118 -19.135 -27.826 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -3.055 -19.968 -25.069 1.00 0.00 H new ATOM 0 HH TYR A 73 -1.978 -21.548 -26.193 1.00 0.00 H new ATOM 1057 N ASP A 74 -4.809 -13.694 -26.201 1.00 0.00 N ATOM 1058 CA ASP A 74 -5.629 -12.621 -25.656 1.00 0.00 C ATOM 1059 C ASP A 74 -5.911 -12.885 -24.183 1.00 0.00 C ATOM 1060 O ASP A 74 -6.538 -13.882 -23.835 1.00 0.00 O ATOM 1061 CB ASP A 74 -6.947 -12.543 -26.434 1.00 0.00 C ATOM 1062 CG ASP A 74 -6.776 -11.699 -27.697 1.00 0.00 C ATOM 1063 OD1 ASP A 74 -6.086 -10.697 -27.628 1.00 0.00 O ATOM 1064 OD2 ASP A 74 -7.331 -12.075 -28.717 1.00 0.00 O ATOM 0 H ASP A 74 -5.340 -14.474 -26.587 1.00 0.00 H new ATOM 0 HA ASP A 74 -5.098 -11.674 -25.750 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -7.277 -13.546 -26.702 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -7.723 -12.110 -25.803 1.00 0.00 H new ATOM 1069 N ILE A 75 -5.433 -11.994 -23.324 1.00 0.00 N ATOM 1070 CA ILE A 75 -5.622 -12.140 -21.879 1.00 0.00 C ATOM 1071 C ILE A 75 -6.511 -11.024 -21.354 1.00 0.00 C ATOM 1072 O ILE A 75 -6.740 -10.021 -22.030 1.00 0.00 O ATOM 1073 CB ILE A 75 -4.252 -12.137 -21.156 1.00 0.00 C ATOM 1074 CG1 ILE A 75 -3.221 -11.357 -22.004 1.00 0.00 C ATOM 1075 CG2 ILE A 75 -3.765 -13.583 -20.941 1.00 0.00 C ATOM 1076 CD1 ILE A 75 -2.581 -12.280 -23.051 1.00 0.00 C ATOM 0 H ILE A 75 -4.911 -11.162 -23.599 1.00 0.00 H new ATOM 0 HA ILE A 75 -6.111 -13.094 -21.680 1.00 0.00 H new ATOM 0 HB ILE A 75 -4.361 -11.654 -20.185 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -3.709 -10.518 -22.500 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -2.449 -10.940 -21.357 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.801 -13.570 -20.432 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -4.490 -14.124 -20.333 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -3.659 -14.079 -21.906 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.858 -11.716 -23.640 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.076 -13.105 -22.549 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -3.355 -12.675 -23.709 1.00 0.00 H new ATOM 1088 N SER A 76 -7.007 -11.207 -20.135 1.00 0.00 N ATOM 1089 CA SER A 76 -7.867 -10.214 -19.510 1.00 0.00 C ATOM 1090 C SER A 76 -7.790 -10.320 -17.993 1.00 0.00 C ATOM 1091 O SER A 76 -8.103 -11.365 -17.422 1.00 0.00 O ATOM 1092 CB SER A 76 -9.309 -10.414 -19.987 1.00 0.00 C ATOM 1093 OG SER A 76 -9.529 -11.795 -20.227 1.00 0.00 O ATOM 0 H SER A 76 -6.828 -12.032 -19.563 1.00 0.00 H new ATOM 0 HA SER A 76 -7.529 -9.218 -19.798 1.00 0.00 H new ATOM 0 HB2 SER A 76 -10.008 -10.046 -19.236 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.488 -9.841 -20.897 1.00 0.00 H new ATOM 0 HG SER A 76 -10.451 -11.931 -20.531 1.00 0.00 H new ATOM 1099 N VAL A 77 -7.393 -9.234 -17.340 1.00 0.00 N ATOM 1100 CA VAL A 77 -7.305 -9.225 -15.881 1.00 0.00 C ATOM 1101 C VAL A 77 -8.572 -8.622 -15.288 1.00 0.00 C ATOM 1102 O VAL A 77 -8.723 -7.403 -15.229 1.00 0.00 O ATOM 1103 CB VAL A 77 -6.095 -8.405 -15.435 1.00 0.00 C ATOM 1104 CG1 VAL A 77 -5.851 -8.619 -13.937 1.00 0.00 C ATOM 1105 CG2 VAL A 77 -4.860 -8.848 -16.220 1.00 0.00 C ATOM 0 H VAL A 77 -7.129 -8.357 -17.789 1.00 0.00 H new ATOM 0 HA VAL A 77 -7.194 -10.251 -15.530 1.00 0.00 H new ATOM 0 HB VAL A 77 -6.287 -7.349 -15.623 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.988 -8.033 -13.622 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -6.730 -8.301 -13.376 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.662 -9.675 -13.746 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -3.997 -8.263 -15.902 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.670 -9.905 -16.034 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.031 -8.692 -17.285 1.00 0.00 H new ATOM 1115 N ILE A 78 -9.476 -9.487 -14.840 1.00 0.00 N ATOM 1116 CA ILE A 78 -10.729 -9.032 -14.242 1.00 0.00 C ATOM 1117 C ILE A 78 -10.546 -8.812 -12.747 1.00 0.00 C ATOM 1118 O ILE A 78 -10.286 -9.753 -12.000 1.00 0.00 O ATOM 1119 CB ILE A 78 -11.838 -10.064 -14.479 1.00 0.00 C ATOM 1120 CG1 ILE A 78 -12.176 -10.116 -15.970 1.00 0.00 C ATOM 1121 CG2 ILE A 78 -13.091 -9.677 -13.685 1.00 0.00 C ATOM 1122 CD1 ILE A 78 -13.096 -11.308 -16.243 1.00 0.00 C ATOM 0 H ILE A 78 -9.367 -10.500 -14.878 1.00 0.00 H new ATOM 0 HA ILE A 78 -11.014 -8.090 -14.711 1.00 0.00 H new ATOM 0 HB ILE A 78 -11.492 -11.043 -14.147 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -12.662 -9.190 -16.276 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -11.263 -10.206 -16.558 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -13.874 -10.415 -13.859 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -12.852 -9.644 -12.622 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -13.439 -8.696 -14.009 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -13.337 -11.346 -17.305 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -12.593 -12.230 -15.952 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -14.014 -11.198 -15.666 1.00 0.00 H new ATOM 1134 N THR A 79 -10.687 -7.561 -12.317 1.00 0.00 N ATOM 1135 CA THR A 79 -10.537 -7.220 -10.905 1.00 0.00 C ATOM 1136 C THR A 79 -11.900 -7.102 -10.245 1.00 0.00 C ATOM 1137 O THR A 79 -12.707 -6.250 -10.611 1.00 0.00 O ATOM 1138 CB THR A 79 -9.797 -5.892 -10.763 1.00 0.00 C ATOM 1139 OG1 THR A 79 -10.473 -4.900 -11.516 1.00 0.00 O ATOM 1140 CG2 THR A 79 -8.367 -6.047 -11.277 1.00 0.00 C ATOM 0 H THR A 79 -10.904 -6.770 -12.923 1.00 0.00 H new ATOM 0 HA THR A 79 -9.966 -8.011 -10.418 1.00 0.00 H new ATOM 0 HB THR A 79 -9.769 -5.596 -9.714 1.00 0.00 H new ATOM 0 HG1 THR A 79 -9.868 -4.537 -12.197 1.00 0.00 H new ATOM 0 HG21 THR A 79 -7.839 -5.099 -11.175 1.00 0.00 H new ATOM 0 HG22 THR A 79 -7.853 -6.813 -10.696 1.00 0.00 H new ATOM 0 HG23 THR A 79 -8.387 -6.340 -12.327 1.00 0.00 H new ATOM 1148 N LEU A 80 -12.147 -7.968 -9.269 1.00 0.00 N ATOM 1149 CA LEU A 80 -13.420 -7.966 -8.545 1.00 0.00 C ATOM 1150 C LEU A 80 -13.196 -7.754 -7.057 1.00 0.00 C ATOM 1151 O LEU A 80 -12.685 -8.634 -6.365 1.00 0.00 O ATOM 1152 CB LEU A 80 -14.140 -9.298 -8.781 1.00 0.00 C ATOM 1153 CG LEU A 80 -14.725 -9.329 -10.210 1.00 0.00 C ATOM 1154 CD1 LEU A 80 -14.910 -10.780 -10.656 1.00 0.00 C ATOM 1155 CD2 LEU A 80 -16.091 -8.628 -10.241 1.00 0.00 C ATOM 0 H LEU A 80 -11.486 -8.680 -8.959 1.00 0.00 H new ATOM 0 HA LEU A 80 -14.034 -7.145 -8.916 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -13.445 -10.127 -8.644 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -14.937 -9.426 -8.049 1.00 0.00 H new ATOM 0 HG LEU A 80 -14.036 -8.814 -10.879 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -15.323 -10.801 -11.665 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -13.946 -11.289 -10.648 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -15.593 -11.286 -9.974 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -16.492 -8.657 -11.254 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -16.777 -9.138 -9.564 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -15.975 -7.591 -9.926 1.00 0.00 H new ATOM 1167 N ILE A 81 -13.602 -6.582 -6.566 1.00 0.00 N ATOM 1168 CA ILE A 81 -13.459 -6.262 -5.148 1.00 0.00 C ATOM 1169 C ILE A 81 -14.668 -5.474 -4.657 1.00 0.00 C ATOM 1170 O ILE A 81 -15.171 -4.590 -5.349 1.00 0.00 O ATOM 1171 CB ILE A 81 -12.161 -5.478 -4.898 1.00 0.00 C ATOM 1172 CG1 ILE A 81 -12.330 -3.998 -5.316 1.00 0.00 C ATOM 1173 CG2 ILE A 81 -11.028 -6.112 -5.707 1.00 0.00 C ATOM 1174 CD1 ILE A 81 -12.955 -3.159 -4.188 1.00 0.00 C ATOM 0 H ILE A 81 -14.029 -5.844 -7.126 1.00 0.00 H new ATOM 0 HA ILE A 81 -13.405 -7.195 -4.587 1.00 0.00 H new ATOM 0 HB ILE A 81 -11.925 -5.513 -3.834 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -11.359 -3.582 -5.584 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -12.958 -3.940 -6.205 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -10.104 -5.560 -5.534 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -10.895 -7.148 -5.397 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -11.276 -6.080 -6.768 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -13.058 -2.125 -4.518 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -13.937 -3.560 -3.938 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -12.313 -3.197 -3.308 1.00 0.00 H new ATOM 1186 N ASN A 82 -15.141 -5.818 -3.463 1.00 0.00 N ATOM 1187 CA ASN A 82 -16.302 -5.150 -2.893 1.00 0.00 C ATOM 1188 C ASN A 82 -16.004 -3.684 -2.592 1.00 0.00 C ATOM 1189 O ASN A 82 -16.748 -2.792 -2.997 1.00 0.00 O ATOM 1190 CB ASN A 82 -16.716 -5.860 -1.609 1.00 0.00 C ATOM 1191 CG ASN A 82 -18.047 -5.298 -1.118 1.00 0.00 C ATOM 1192 OD1 ASN A 82 -18.445 -4.205 -1.526 1.00 0.00 O ATOM 1193 ND2 ASN A 82 -18.764 -5.976 -0.266 1.00 0.00 N ATOM 0 H ASN A 82 -14.741 -6.550 -2.876 1.00 0.00 H new ATOM 0 HA ASN A 82 -17.112 -5.191 -3.621 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -16.806 -6.932 -1.787 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -15.950 -5.727 -0.845 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -19.654 -5.602 0.063 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -18.435 -6.880 0.072 1.00 0.00 H new ATOM 1457 N GLY B 207 2.130 -1.573 -19.625 1.00 0.00 N ATOM 1458 CA GLY B 207 0.875 -1.009 -20.128 1.00 0.00 C ATOM 1459 C GLY B 207 0.371 0.104 -19.221 1.00 0.00 C ATOM 1460 O GLY B 207 1.144 0.954 -18.774 1.00 0.00 O ATOM 0 HA2 GLY B 207 1.025 -0.621 -21.135 1.00 0.00 H new ATOM 0 HA3 GLY B 207 0.122 -1.794 -20.198 1.00 0.00 H new ATOM 1464 N SER B 208 -0.927 0.088 -18.946 1.00 0.00 N ATOM 1465 CA SER B 208 -1.527 1.097 -18.082 1.00 0.00 C ATOM 1466 C SER B 208 -2.929 0.681 -17.656 1.00 0.00 C ATOM 1467 O SER B 208 -3.489 -0.282 -18.182 1.00 0.00 O ATOM 1468 CB SER B 208 -1.574 2.438 -18.805 1.00 0.00 C ATOM 1469 OG SER B 208 -2.196 2.267 -20.070 1.00 0.00 O ATOM 0 H SER B 208 -1.581 -0.607 -19.306 1.00 0.00 H new ATOM 0 HA SER B 208 -0.913 1.194 -17.186 1.00 0.00 H new ATOM 0 HB2 SER B 208 -2.127 3.166 -18.211 1.00 0.00 H new ATOM 0 HB3 SER B 208 -0.565 2.831 -18.933 1.00 0.00 H new ATOM 0 HG SER B 208 -2.230 3.128 -20.537 1.00 0.00 H new ATOM 1475 N TRP B 209 -3.499 1.418 -16.705 1.00 0.00 N ATOM 1476 CA TRP B 209 -4.844 1.121 -16.220 1.00 0.00 C ATOM 1477 C TRP B 209 -5.887 1.802 -17.098 1.00 0.00 C ATOM 1478 O TRP B 209 -5.640 2.875 -17.646 1.00 0.00 O ATOM 1479 CB TRP B 209 -5.006 1.608 -14.784 1.00 0.00 C ATOM 1480 CG TRP B 209 -4.167 0.770 -13.884 1.00 0.00 C ATOM 1481 CD1 TRP B 209 -2.865 0.989 -13.627 1.00 0.00 C ATOM 1482 CD2 TRP B 209 -4.546 -0.414 -13.124 1.00 0.00 C ATOM 1483 NE1 TRP B 209 -2.411 0.026 -12.745 1.00 0.00 N ATOM 1484 CE2 TRP B 209 -3.411 -0.864 -12.405 1.00 0.00 C ATOM 1485 CE3 TRP B 209 -5.747 -1.133 -12.983 1.00 0.00 C ATOM 1486 CZ2 TRP B 209 -3.467 -1.981 -11.577 1.00 0.00 C ATOM 1487 CZ3 TRP B 209 -5.806 -2.263 -12.151 1.00 0.00 C ATOM 1488 CH2 TRP B 209 -4.668 -2.685 -11.449 1.00 0.00 C ATOM 0 H TRP B 209 -3.054 2.220 -16.258 1.00 0.00 H new ATOM 0 HA TRP B 209 -4.989 0.041 -16.257 1.00 0.00 H new ATOM 0 HB2 TRP B 209 -4.710 2.654 -14.707 1.00 0.00 H new ATOM 0 HB3 TRP B 209 -6.052 1.550 -14.484 1.00 0.00 H new ATOM 0 HD1 TRP B 209 -2.270 1.789 -14.043 1.00 0.00 H new ATOM 0 HE1 TRP B 209 -1.456 -0.021 -12.390 1.00 0.00 H new ATOM 0 HE3 TRP B 209 -6.629 -0.814 -13.518 1.00 0.00 H new ATOM 0 HZ2 TRP B 209 -2.589 -2.302 -11.037 1.00 0.00 H new ATOM 0 HZ3 TRP B 209 -6.732 -2.809 -12.051 1.00 0.00 H new ATOM 0 HH2 TRP B 209 -4.719 -3.554 -10.809 1.00 0.00 H new ATOM 1499 N THR B 210 -7.061 1.181 -17.214 1.00 0.00 N ATOM 1500 CA THR B 210 -8.146 1.750 -18.019 1.00 0.00 C ATOM 1501 C THR B 210 -9.438 1.797 -17.210 1.00 0.00 C ATOM 1502 O THR B 210 -9.852 0.795 -16.629 1.00 0.00 O ATOM 1503 CB THR B 210 -8.358 0.899 -19.274 1.00 0.00 C ATOM 1504 OG1 THR B 210 -8.617 -0.445 -18.893 1.00 0.00 O ATOM 1505 CG2 THR B 210 -7.101 0.953 -20.143 1.00 0.00 C ATOM 0 H THR B 210 -7.286 0.292 -16.766 1.00 0.00 H new ATOM 0 HA THR B 210 -7.873 2.765 -18.308 1.00 0.00 H new ATOM 0 HB THR B 210 -9.206 1.285 -19.840 1.00 0.00 H new ATOM 0 HG1 THR B 210 -7.934 -0.742 -18.255 1.00 0.00 H new ATOM 0 HG21 THR B 210 -7.250 0.348 -21.037 1.00 0.00 H new ATOM 0 HG22 THR B 210 -6.903 1.985 -20.433 1.00 0.00 H new ATOM 0 HG23 THR B 210 -6.252 0.565 -19.580 1.00 0.00 H new ATOM 1513 N TRP B 211 -10.073 2.969 -17.178 1.00 0.00 N ATOM 1514 CA TRP B 211 -11.323 3.138 -16.434 1.00 0.00 C ATOM 1515 C TRP B 211 -12.520 2.866 -17.344 1.00 0.00 C ATOM 1516 O TRP B 211 -12.804 3.634 -18.262 1.00 0.00 O ATOM 1517 CB TRP B 211 -11.406 4.564 -15.873 1.00 0.00 C ATOM 1518 CG TRP B 211 -12.784 4.819 -15.345 1.00 0.00 C ATOM 1519 CD1 TRP B 211 -13.655 5.718 -15.857 1.00 0.00 C ATOM 1520 CD2 TRP B 211 -13.468 4.169 -14.236 1.00 0.00 C ATOM 1521 NE1 TRP B 211 -14.829 5.666 -15.128 1.00 0.00 N ATOM 1522 CE2 TRP B 211 -14.762 4.727 -14.119 1.00 0.00 C ATOM 1523 CE3 TRP B 211 -13.095 3.163 -13.327 1.00 0.00 C ATOM 1524 CZ2 TRP B 211 -15.656 4.301 -13.135 1.00 0.00 C ATOM 1525 CZ3 TRP B 211 -13.992 2.732 -12.335 1.00 0.00 C ATOM 1526 CH2 TRP B 211 -15.269 3.300 -12.239 1.00 0.00 C ATOM 0 H TRP B 211 -9.746 3.810 -17.654 1.00 0.00 H new ATOM 0 HA TRP B 211 -11.341 2.427 -15.608 1.00 0.00 H new ATOM 0 HB2 TRP B 211 -10.671 4.696 -15.079 1.00 0.00 H new ATOM 0 HB3 TRP B 211 -11.165 5.287 -16.653 1.00 0.00 H new ATOM 0 HD1 TRP B 211 -13.465 6.369 -16.697 1.00 0.00 H new ATOM 0 HE1 TRP B 211 -15.644 6.250 -15.313 1.00 0.00 H new ATOM 0 HE3 TRP B 211 -12.113 2.719 -13.392 1.00 0.00 H new ATOM 0 HZ2 TRP B 211 -16.640 4.742 -13.066 1.00 0.00 H new ATOM 0 HZ3 TRP B 211 -13.695 1.958 -11.642 1.00 0.00 H new ATOM 0 HH2 TRP B 211 -15.954 2.965 -11.474 1.00 0.00 H new ATOM 1537 N GLU B 212 -13.225 1.772 -17.072 1.00 0.00 N ATOM 1538 CA GLU B 212 -14.397 1.418 -17.863 1.00 0.00 C ATOM 1539 C GLU B 212 -15.269 0.420 -17.110 1.00 0.00 C ATOM 1540 O GLU B 212 -14.825 -0.207 -16.149 1.00 0.00 O ATOM 1541 CB GLU B 212 -13.943 0.829 -19.225 1.00 0.00 C ATOM 1542 CG GLU B 212 -14.064 -0.711 -19.247 1.00 0.00 C ATOM 1543 CD GLU B 212 -13.277 -1.280 -20.418 1.00 0.00 C ATOM 1544 OE1 GLU B 212 -13.158 -0.592 -21.418 1.00 0.00 O ATOM 1545 OE2 GLU B 212 -12.801 -2.397 -20.298 1.00 0.00 O ATOM 0 H GLU B 212 -13.008 1.121 -16.317 1.00 0.00 H new ATOM 0 HA GLU B 212 -14.991 2.314 -18.043 1.00 0.00 H new ATOM 0 HB2 GLU B 212 -14.549 1.254 -20.026 1.00 0.00 H new ATOM 0 HB3 GLU B 212 -12.910 1.116 -19.420 1.00 0.00 H new ATOM 0 HG2 GLU B 212 -13.690 -1.126 -18.311 1.00 0.00 H new ATOM 0 HG3 GLU B 212 -15.112 -1.000 -19.328 1.00 0.00 H new ATOM 1552 N ASN B 213 -16.482 0.227 -17.600 1.00 0.00 N ATOM 1553 CA ASN B 213 -17.371 -0.751 -17.007 1.00 0.00 C ATOM 1554 C ASN B 213 -17.455 -0.573 -15.494 1.00 0.00 C ATOM 1555 O ASN B 213 -17.580 -1.548 -14.757 1.00 0.00 O ATOM 1556 CB ASN B 213 -16.857 -2.152 -17.345 1.00 0.00 C ATOM 1557 CG ASN B 213 -17.148 -2.482 -18.803 1.00 0.00 C ATOM 1558 OD1 ASN B 213 -17.946 -1.802 -19.449 1.00 0.00 O ATOM 1559 ND2 ASN B 213 -16.550 -3.497 -19.363 1.00 0.00 N ATOM 0 H ASN B 213 -16.869 0.730 -18.399 1.00 0.00 H new ATOM 0 HA ASN B 213 -18.373 -0.612 -17.412 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -15.784 -2.208 -17.159 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -17.332 -2.888 -16.696 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -16.743 -3.729 -20.337 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -15.889 -4.059 -18.826 1.00 0.00 H new ATOM 1566 N GLY B 214 -17.393 0.673 -15.039 1.00 0.00 N ATOM 1567 CA GLY B 214 -17.465 0.961 -13.610 1.00 0.00 C ATOM 1568 C GLY B 214 -16.460 0.123 -12.822 1.00 0.00 C ATOM 1569 O GLY B 214 -16.579 -0.026 -11.608 1.00 0.00 O ATOM 0 H GLY B 214 -17.294 1.496 -15.634 1.00 0.00 H new ATOM 0 HA2 GLY B 214 -17.270 2.020 -13.440 1.00 0.00 H new ATOM 0 HA3 GLY B 214 -18.473 0.760 -13.247 1.00 0.00 H new ATOM 1573 N LYS B 215 -15.468 -0.420 -13.525 1.00 0.00 N ATOM 1574 CA LYS B 215 -14.433 -1.239 -12.896 1.00 0.00 C ATOM 1575 C LYS B 215 -13.074 -0.986 -13.536 1.00 0.00 C ATOM 1576 O LYS B 215 -12.983 -0.684 -14.726 1.00 0.00 O ATOM 1577 CB LYS B 215 -14.786 -2.716 -13.047 1.00 0.00 C ATOM 1578 CG LYS B 215 -16.061 -3.010 -12.262 1.00 0.00 C ATOM 1579 CD LYS B 215 -16.302 -4.526 -12.194 1.00 0.00 C ATOM 1580 CE LYS B 215 -16.745 -5.050 -13.561 1.00 0.00 C ATOM 1581 NZ LYS B 215 -17.270 -6.434 -13.408 1.00 0.00 N ATOM 0 H LYS B 215 -15.359 -0.307 -14.533 1.00 0.00 H new ATOM 0 HA LYS B 215 -14.381 -0.970 -11.841 1.00 0.00 H new ATOM 0 HB2 LYS B 215 -14.928 -2.963 -14.099 1.00 0.00 H new ATOM 0 HB3 LYS B 215 -13.968 -3.337 -12.681 1.00 0.00 H new ATOM 0 HG2 LYS B 215 -15.979 -2.601 -11.255 1.00 0.00 H new ATOM 0 HG3 LYS B 215 -16.911 -2.520 -12.737 1.00 0.00 H new ATOM 0 HD2 LYS B 215 -15.390 -5.033 -11.880 1.00 0.00 H new ATOM 0 HD3 LYS B 215 -17.064 -4.748 -11.447 1.00 0.00 H new ATOM 0 HE2 LYS B 215 -17.514 -4.401 -13.981 1.00 0.00 H new ATOM 0 HE3 LYS B 215 -15.906 -5.041 -14.256 1.00 0.00 H new ATOM 0 HZ1 LYS B 215 -17.573 -6.795 -14.335 1.00 0.00 H new ATOM 0 HZ2 LYS B 215 -16.523 -7.048 -13.024 1.00 0.00 H new ATOM 0 HZ3 LYS B 215 -18.081 -6.428 -12.757 1.00 0.00 H new ATOM 1595 N TRP B 216 -12.018 -1.129 -12.739 1.00 0.00 N ATOM 1596 CA TRP B 216 -10.660 -0.930 -13.238 1.00 0.00 C ATOM 1597 C TRP B 216 -10.124 -2.245 -13.787 1.00 0.00 C ATOM 1598 O TRP B 216 -9.971 -3.213 -13.049 1.00 0.00 O ATOM 1599 CB TRP B 216 -9.758 -0.437 -12.107 1.00 0.00 C ATOM 1600 CG TRP B 216 -10.244 0.897 -11.650 1.00 0.00 C ATOM 1601 CD1 TRP B 216 -11.349 1.101 -10.906 1.00 0.00 C ATOM 1602 CD2 TRP B 216 -9.664 2.212 -11.895 1.00 0.00 C ATOM 1603 NE1 TRP B 216 -11.491 2.457 -10.673 1.00 0.00 N ATOM 1604 CE2 TRP B 216 -10.475 3.184 -11.261 1.00 0.00 C ATOM 1605 CE3 TRP B 216 -8.527 2.651 -12.595 1.00 0.00 C ATOM 1606 CZ2 TRP B 216 -10.169 4.544 -11.321 1.00 0.00 C ATOM 1607 CZ3 TRP B 216 -8.215 4.019 -12.657 1.00 0.00 C ATOM 1608 CH2 TRP B 216 -9.034 4.963 -12.021 1.00 0.00 C ATOM 0 H TRP B 216 -12.075 -1.380 -11.752 1.00 0.00 H new ATOM 0 HA TRP B 216 -10.674 -0.184 -14.032 1.00 0.00 H new ATOM 0 HB2 TRP B 216 -9.769 -1.146 -11.279 1.00 0.00 H new ATOM 0 HB3 TRP B 216 -8.726 -0.365 -12.451 1.00 0.00 H new ATOM 0 HD1 TRP B 216 -12.016 0.330 -10.549 1.00 0.00 H new ATOM 0 HE1 TRP B 216 -12.252 2.869 -10.133 1.00 0.00 H new ATOM 0 HE3 TRP B 216 -7.889 1.932 -13.088 1.00 0.00 H new ATOM 0 HZ2 TRP B 216 -10.804 5.267 -10.831 1.00 0.00 H new ATOM 0 HZ3 TRP B 216 -7.339 4.346 -13.198 1.00 0.00 H new ATOM 0 HH2 TRP B 216 -8.788 6.013 -12.072 1.00 0.00 H new ATOM 1619 N THR B 217 -9.848 -2.277 -15.088 1.00 0.00 N ATOM 1620 CA THR B 217 -9.342 -3.490 -15.735 1.00 0.00 C ATOM 1621 C THR B 217 -8.035 -3.210 -16.461 1.00 0.00 C ATOM 1622 O THR B 217 -7.873 -2.165 -17.097 1.00 0.00 O ATOM 1623 CB THR B 217 -10.380 -4.010 -16.737 1.00 0.00 C ATOM 1624 OG1 THR B 217 -11.656 -4.065 -16.113 1.00 0.00 O ATOM 1625 CG2 THR B 217 -9.994 -5.419 -17.205 1.00 0.00 C ATOM 0 H THR B 217 -9.965 -1.481 -15.715 1.00 0.00 H new ATOM 0 HA THR B 217 -9.160 -4.241 -14.966 1.00 0.00 H new ATOM 0 HB THR B 217 -10.414 -3.337 -17.594 1.00 0.00 H new ATOM 0 HG1 THR B 217 -12.320 -4.396 -16.754 1.00 0.00 H new ATOM 0 HG21 THR B 217 -10.736 -5.782 -17.916 1.00 0.00 H new ATOM 0 HG22 THR B 217 -9.016 -5.388 -17.685 1.00 0.00 H new ATOM 0 HG23 THR B 217 -9.956 -6.090 -16.347 1.00 0.00 H new ATOM 1633 N TRP B 218 -7.107 -4.163 -16.371 1.00 0.00 N ATOM 1634 CA TRP B 218 -5.811 -4.036 -17.032 1.00 0.00 C ATOM 1635 C TRP B 218 -5.797 -4.895 -18.294 1.00 0.00 C ATOM 1636 O TRP B 218 -5.712 -6.121 -18.226 1.00 0.00 O ATOM 1637 CB TRP B 218 -4.698 -4.492 -16.091 1.00 0.00 C ATOM 1638 CG TRP B 218 -3.381 -4.334 -16.775 1.00 0.00 C ATOM 1639 CD1 TRP B 218 -2.859 -5.209 -17.662 1.00 0.00 C ATOM 1640 CD2 TRP B 218 -2.411 -3.254 -16.644 1.00 0.00 C ATOM 1641 NE1 TRP B 218 -1.630 -4.737 -18.086 1.00 0.00 N ATOM 1642 CE2 TRP B 218 -1.310 -3.537 -17.484 1.00 0.00 C ATOM 1643 CE3 TRP B 218 -2.380 -2.070 -15.883 1.00 0.00 C ATOM 1644 CZ2 TRP B 218 -0.218 -2.676 -17.570 1.00 0.00 C ATOM 1645 CZ3 TRP B 218 -1.281 -1.201 -15.968 1.00 0.00 C ATOM 1646 CH2 TRP B 218 -0.201 -1.504 -16.810 1.00 0.00 C ATOM 0 H TRP B 218 -7.230 -5.030 -15.847 1.00 0.00 H new ATOM 0 HA TRP B 218 -5.646 -2.992 -17.299 1.00 0.00 H new ATOM 0 HB2 TRP B 218 -4.718 -3.904 -15.174 1.00 0.00 H new ATOM 0 HB3 TRP B 218 -4.850 -5.533 -15.806 1.00 0.00 H new ATOM 0 HD1 TRP B 218 -3.325 -6.127 -17.987 1.00 0.00 H new ATOM 0 HE1 TRP B 218 -1.034 -5.217 -18.760 1.00 0.00 H new ATOM 0 HE3 TRP B 218 -3.206 -1.829 -15.230 1.00 0.00 H new ATOM 0 HZ2 TRP B 218 0.611 -2.913 -18.221 1.00 0.00 H new ATOM 0 HZ3 TRP B 218 -1.267 -0.294 -15.382 1.00 0.00 H new ATOM 0 HH2 TRP B 218 0.642 -0.832 -16.871 1.00 0.00 H new ATOM 1657 N LYS B 219 -5.894 -4.238 -19.444 1.00 0.00 N ATOM 1658 CA LYS B 219 -5.908 -4.926 -20.740 1.00 0.00 C ATOM 1659 C LYS B 219 -4.922 -4.285 -21.700 1.00 0.00 C ATOM 1660 O LYS B 219 -4.423 -3.188 -21.457 1.00 0.00 O ATOM 1661 CB LYS B 219 -7.322 -4.873 -21.336 1.00 0.00 C ATOM 1662 CG LYS B 219 -8.216 -5.907 -20.654 1.00 0.00 C ATOM 1663 CD LYS B 219 -9.657 -5.736 -21.146 1.00 0.00 C ATOM 1664 CE LYS B 219 -10.484 -6.961 -20.749 1.00 0.00 C ATOM 1665 NZ LYS B 219 -11.935 -6.635 -20.820 1.00 0.00 N ATOM 0 H LYS B 219 -5.965 -3.223 -19.510 1.00 0.00 H new ATOM 0 HA LYS B 219 -5.614 -5.964 -20.586 1.00 0.00 H new ATOM 0 HB2 LYS B 219 -7.742 -3.876 -21.208 1.00 0.00 H new ATOM 0 HB3 LYS B 219 -7.281 -5.066 -22.408 1.00 0.00 H new ATOM 0 HG2 LYS B 219 -7.861 -6.914 -20.876 1.00 0.00 H new ATOM 0 HG3 LYS B 219 -8.172 -5.785 -19.572 1.00 0.00 H new ATOM 0 HD2 LYS B 219 -10.094 -4.835 -20.716 1.00 0.00 H new ATOM 0 HD3 LYS B 219 -9.670 -5.611 -22.229 1.00 0.00 H new ATOM 0 HE2 LYS B 219 -10.257 -7.795 -21.413 1.00 0.00 H new ATOM 0 HE3 LYS B 219 -10.222 -7.276 -19.739 1.00 0.00 H new ATOM 0 HZ1 LYS B 219 -12.492 -7.470 -20.549 1.00 0.00 H new ATOM 0 HZ2 LYS B 219 -12.147 -5.852 -20.169 1.00 0.00 H new ATOM 0 HZ3 LYS B 219 -12.181 -6.355 -21.791 1.00 0.00 H new ATOM 1679 N GLY B 220 -4.658 -4.981 -22.797 1.00 0.00 N ATOM 1680 CA GLY B 220 -3.742 -4.474 -23.800 1.00 0.00 C ATOM 1681 C GLY B 220 -3.639 -5.432 -24.980 1.00 0.00 C ATOM 1682 O GLY B 220 -4.506 -6.284 -25.172 1.00 0.00 O ATOM 0 H GLY B 220 -5.064 -5.892 -23.011 1.00 0.00 H new ATOM 0 HA2 GLY B 220 -4.082 -3.498 -24.148 1.00 0.00 H new ATOM 0 HA3 GLY B 220 -2.756 -4.329 -23.357 1.00 0.00 H new ATOM 1686 N ILE B 221 -2.594 -5.270 -25.781 1.00 0.00 N ATOM 1687 CA ILE B 221 -2.420 -6.115 -26.956 1.00 0.00 C ATOM 1688 C ILE B 221 -2.432 -7.586 -26.567 1.00 0.00 C ATOM 1689 O ILE B 221 -3.408 -8.289 -26.817 1.00 0.00 O ATOM 1690 CB ILE B 221 -1.083 -5.777 -27.642 1.00 0.00 C ATOM 1691 CG1 ILE B 221 -0.896 -4.234 -27.703 1.00 0.00 C ATOM 1692 CG2 ILE B 221 -1.081 -6.364 -29.061 1.00 0.00 C ATOM 1693 CD1 ILE B 221 0.092 -3.771 -26.621 1.00 0.00 C ATOM 0 H ILE B 221 -1.863 -4.572 -25.642 1.00 0.00 H new ATOM 0 HA ILE B 221 -3.246 -5.928 -27.643 1.00 0.00 H new ATOM 0 HB ILE B 221 -0.260 -6.207 -27.071 1.00 0.00 H new ATOM 0 HG12 ILE B 221 -0.529 -3.944 -28.688 1.00 0.00 H new ATOM 0 HG13 ILE B 221 -1.857 -3.739 -27.563 1.00 0.00 H new ATOM 0 HG21 ILE B 221 -0.137 -6.128 -29.551 1.00 0.00 H new ATOM 0 HG22 ILE B 221 -1.201 -7.446 -29.007 1.00 0.00 H new ATOM 0 HG23 ILE B 221 -1.904 -5.936 -29.633 1.00 0.00 H new ATOM 0 HD11 ILE B 221 0.212 -2.689 -26.677 1.00 0.00 H new ATOM 0 HD12 ILE B 221 -0.291 -4.043 -25.638 1.00 0.00 H new ATOM 0 HD13 ILE B 221 1.057 -4.252 -26.780 1.00 0.00 H new ATOM 1705 N ILE B 222 -1.347 -8.035 -25.955 1.00 0.00 N ATOM 1706 CA ILE B 222 -1.220 -9.427 -25.534 1.00 0.00 C ATOM 1707 C ILE B 222 -0.137 -9.560 -24.469 1.00 0.00 C ATOM 1708 O ILE B 222 0.302 -8.563 -23.892 1.00 0.00 O ATOM 1709 CB ILE B 222 -0.867 -10.314 -26.725 1.00 0.00 C ATOM 1710 CG1 ILE B 222 0.338 -9.718 -27.443 1.00 0.00 C ATOM 1711 CG2 ILE B 222 -2.045 -10.409 -27.697 1.00 0.00 C ATOM 1712 CD1 ILE B 222 0.851 -10.737 -28.441 1.00 0.00 C ATOM 0 H ILE B 222 -0.537 -7.455 -25.737 1.00 0.00 H new ATOM 0 HA ILE B 222 -2.176 -9.746 -25.120 1.00 0.00 H new ATOM 0 HB ILE B 222 -0.635 -11.317 -26.366 1.00 0.00 H new ATOM 0 HG12 ILE B 222 0.058 -8.796 -27.952 1.00 0.00 H new ATOM 0 HG13 ILE B 222 1.119 -9.462 -26.726 1.00 0.00 H new ATOM 0 HG21 ILE B 222 -1.772 -11.046 -28.538 1.00 0.00 H new ATOM 0 HG22 ILE B 222 -2.907 -10.836 -27.184 1.00 0.00 H new ATOM 0 HG23 ILE B 222 -2.297 -9.413 -28.062 1.00 0.00 H new ATOM 0 HD11 ILE B 222 1.715 -10.329 -28.966 1.00 0.00 H new ATOM 0 HD12 ILE B 222 1.142 -11.646 -27.915 1.00 0.00 H new ATOM 0 HD13 ILE B 222 0.066 -10.969 -29.160 1.00 0.00 H new ATOM 1724 N ARG B 223 0.300 -10.796 -24.229 1.00 0.00 N ATOM 1725 CA ARG B 223 1.354 -11.073 -23.261 1.00 0.00 C ATOM 1726 C ARG B 223 2.470 -10.033 -23.370 1.00 0.00 C ATOM 1727 O ARG B 223 2.478 -9.195 -24.270 1.00 0.00 O ATOM 1728 CB ARG B 223 1.919 -12.462 -23.486 1.00 0.00 C ATOM 1729 CG ARG B 223 2.468 -12.567 -24.902 1.00 0.00 C ATOM 1730 CD ARG B 223 2.934 -13.996 -25.130 1.00 0.00 C ATOM 1731 NE ARG B 223 3.490 -14.135 -26.473 1.00 0.00 N ATOM 1732 CZ ARG B 223 2.707 -14.377 -27.519 1.00 0.00 C ATOM 1733 NH1 ARG B 223 1.419 -14.510 -27.353 1.00 0.00 N ATOM 1734 NH2 ARG B 223 3.226 -14.482 -28.710 1.00 0.00 N ATOM 0 H ARG B 223 -0.065 -11.625 -24.697 1.00 0.00 H new ATOM 0 HA ARG B 223 0.925 -11.021 -22.260 1.00 0.00 H new ATOM 0 HB2 ARG B 223 2.709 -12.666 -22.763 1.00 0.00 H new ATOM 0 HB3 ARG B 223 1.143 -13.211 -23.330 1.00 0.00 H new ATOM 0 HG2 ARG B 223 1.700 -12.298 -25.628 1.00 0.00 H new ATOM 0 HG3 ARG B 223 3.296 -11.871 -25.041 1.00 0.00 H new ATOM 0 HD2 ARG B 223 3.685 -14.264 -24.387 1.00 0.00 H new ATOM 0 HD3 ARG B 223 2.098 -14.684 -25.001 1.00 0.00 H new ATOM 0 HE ARG B 223 4.497 -14.045 -26.611 1.00 0.00 H new ATOM 0 HH11 ARG B 223 1.014 -14.428 -26.421 1.00 0.00 H new ATOM 0 HH12 ARG B 223 0.818 -14.696 -28.156 1.00 0.00 H new ATOM 0 HH21 ARG B 223 4.233 -14.378 -28.839 1.00 0.00 H new ATOM 0 HH22 ARG B 223 2.626 -14.668 -29.513 1.00 0.00 H new ATOM 1748 N LEU B 224 3.407 -10.099 -22.452 1.00 0.00 N ATOM 1749 CA LEU B 224 4.517 -9.156 -22.447 1.00 0.00 C ATOM 1750 C LEU B 224 5.380 -9.331 -23.685 1.00 0.00 C ATOM 1751 O LEU B 224 6.080 -10.332 -23.839 1.00 0.00 O ATOM 1752 CB LEU B 224 5.372 -9.346 -21.185 1.00 0.00 C ATOM 1753 CG LEU B 224 4.497 -9.259 -19.914 1.00 0.00 C ATOM 1754 CD1 LEU B 224 3.635 -7.984 -19.960 1.00 0.00 C ATOM 1755 CD2 LEU B 224 3.589 -10.498 -19.783 1.00 0.00 C ATOM 0 H LEU B 224 3.429 -10.789 -21.701 1.00 0.00 H new ATOM 0 HA LEU B 224 4.104 -8.147 -22.451 1.00 0.00 H new ATOM 0 HB2 LEU B 224 5.874 -10.313 -21.222 1.00 0.00 H new ATOM 0 HB3 LEU B 224 6.151 -8.584 -21.149 1.00 0.00 H new ATOM 0 HG LEU B 224 5.156 -9.223 -19.046 1.00 0.00 H new ATOM 0 HD11 LEU B 224 3.020 -7.928 -19.062 1.00 0.00 H new ATOM 0 HD12 LEU B 224 4.283 -7.109 -20.012 1.00 0.00 H new ATOM 0 HD13 LEU B 224 2.991 -8.012 -20.839 1.00 0.00 H new ATOM 0 HD21 LEU B 224 2.984 -10.412 -18.881 1.00 0.00 H new ATOM 0 HD22 LEU B 224 2.936 -10.564 -20.653 1.00 0.00 H new ATOM 0 HD23 LEU B 224 4.205 -11.395 -19.723 1.00 0.00 H new ATOM 1767 N GLU B 225 5.318 -8.336 -24.565 1.00 0.00 N ATOM 1768 CA GLU B 225 6.090 -8.351 -25.805 1.00 0.00 C ATOM 1769 C GLU B 225 7.365 -7.531 -25.646 1.00 0.00 C ATOM 1770 O GLU B 225 7.409 -6.587 -24.862 1.00 0.00 O ATOM 1771 CB GLU B 225 5.256 -7.776 -26.947 1.00 0.00 C ATOM 1772 CG GLU B 225 6.034 -7.902 -28.256 1.00 0.00 C ATOM 1773 CD GLU B 225 5.167 -7.452 -29.427 1.00 0.00 C ATOM 1774 OE1 GLU B 225 4.121 -6.879 -29.178 1.00 0.00 O ATOM 1775 OE2 GLU B 225 5.564 -7.691 -30.555 1.00 0.00 O ATOM 0 H GLU B 225 4.739 -7.505 -24.442 1.00 0.00 H new ATOM 0 HA GLU B 225 6.356 -9.383 -26.034 1.00 0.00 H new ATOM 0 HB2 GLU B 225 4.307 -8.307 -27.022 1.00 0.00 H new ATOM 0 HB3 GLU B 225 5.021 -6.730 -26.750 1.00 0.00 H new ATOM 0 HG2 GLU B 225 6.939 -7.296 -28.210 1.00 0.00 H new ATOM 0 HG3 GLU B 225 6.349 -8.935 -28.403 1.00 0.00 H new