USER MOD reduce.3.24.130724 H: found=0, std=0, add=656, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 656 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 28 HIS : no HE2:sc= -1.17 K(o=-2.7,f=-7.4!) USER MOD Set 1.2: B 128 HIS : no HD1:sc= -1.56 X(o=-2.7,f=-2.7) USER MOD Single : A 11 MET CE :methyl 146:sc= -3.72 (180deg=-5.94!) USER MOD Single : A 13 ASN : amide:sc= -0.223 X(o=-0.22,f=0) USER MOD Single : A 14 THR OG1 : rot 95:sc= 1.27 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : B 101 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 103 SER OG : rot 180:sc= 0 USER MOD Single : B 111 MET CE :methyl 146:sc= -3.97 (180deg=-6.47!) USER MOD Single : B 113 ASN : amide:sc= -0.21 X(o=-0.21,f=0) USER MOD Single : B 114 THR OG1 : rot 94:sc= 1.14 USER MOD Single : B 115 SER OG : rot 180:sc= 0 USER MOD Single : C 214 THR OG1 : rot 35:sc= 0.0505 USER MOD Single : C 215 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 51 N PRO A 5 -0.338 -9.873 0.159 1.00 0.00 N ATOM 52 CA PRO A 5 -1.221 -10.942 0.636 1.00 0.00 C ATOM 53 C PRO A 5 -2.689 -10.656 0.341 1.00 0.00 C ATOM 54 O PRO A 5 -3.438 -11.547 -0.060 1.00 0.00 O ATOM 55 CB PRO A 5 -0.973 -10.961 2.146 1.00 0.00 C ATOM 56 CG PRO A 5 -0.509 -9.582 2.470 1.00 0.00 C ATOM 57 CD PRO A 5 0.260 -9.110 1.268 1.00 0.00 C ATOM 0 HA PRO A 5 -1.012 -11.892 0.144 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -1.881 -11.212 2.693 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -0.223 -11.705 2.415 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -1.354 -8.924 2.676 1.00 0.00 H new ATOM 0 HG3 PRO A 5 0.120 -9.581 3.360 1.00 0.00 H new ATOM 0 HD2 PRO A 5 0.154 -8.035 1.120 1.00 0.00 H new ATOM 0 HD3 PRO A 5 1.326 -9.314 1.367 1.00 0.00 H new ATOM 65 N PHE A 6 -3.096 -9.407 0.541 1.00 0.00 N ATOM 66 CA PHE A 6 -4.475 -9.003 0.297 1.00 0.00 C ATOM 67 C PHE A 6 -4.884 -9.307 -1.141 1.00 0.00 C ATOM 68 O PHE A 6 -6.005 -9.745 -1.399 1.00 0.00 O ATOM 69 CB PHE A 6 -4.651 -7.510 0.585 1.00 0.00 C ATOM 70 CG PHE A 6 -4.384 -7.141 2.016 1.00 0.00 C ATOM 71 CD1 PHE A 6 -4.937 -7.878 3.051 1.00 0.00 C ATOM 72 CD2 PHE A 6 -3.581 -6.055 2.327 1.00 0.00 C ATOM 73 CE1 PHE A 6 -4.693 -7.540 4.369 1.00 0.00 C ATOM 74 CE2 PHE A 6 -3.333 -5.713 3.643 1.00 0.00 C ATOM 75 CZ PHE A 6 -3.891 -6.456 4.665 1.00 0.00 C ATOM 0 H PHE A 6 -2.489 -8.657 0.872 1.00 0.00 H new ATOM 0 HA PHE A 6 -5.118 -9.573 0.968 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -3.980 -6.942 -0.060 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -5.668 -7.215 0.326 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -5.566 -8.726 2.825 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -3.144 -5.469 1.532 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -5.129 -8.123 5.166 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -2.704 -4.866 3.872 1.00 0.00 H new ATOM 0 HZ PHE A 6 -3.700 -6.189 5.694 1.00 0.00 H new ATOM 85 N GLU A 7 -3.967 -9.069 -2.074 1.00 0.00 N ATOM 86 CA GLU A 7 -4.233 -9.316 -3.486 1.00 0.00 C ATOM 87 C GLU A 7 -4.715 -10.747 -3.707 1.00 0.00 C ATOM 88 O GLU A 7 -5.812 -10.972 -4.219 1.00 0.00 O ATOM 89 CB GLU A 7 -2.975 -9.055 -4.318 1.00 0.00 C ATOM 90 CG GLU A 7 -3.138 -7.935 -5.332 1.00 0.00 C ATOM 91 CD GLU A 7 -1.950 -7.818 -6.267 1.00 0.00 C ATOM 92 OE1 GLU A 7 -1.117 -8.749 -6.289 1.00 0.00 O ATOM 93 OE2 GLU A 7 -1.854 -6.796 -6.978 1.00 0.00 O ATOM 0 H GLU A 7 -3.034 -8.706 -1.877 1.00 0.00 H new ATOM 0 HA GLU A 7 -5.020 -8.633 -3.806 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -2.151 -8.810 -3.648 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -2.699 -9.970 -4.841 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -4.041 -8.108 -5.918 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -3.276 -6.991 -4.806 1.00 0.00 H new ATOM 100 N LEU A 8 -3.886 -11.710 -3.319 1.00 0.00 N ATOM 101 CA LEU A 8 -4.226 -13.120 -3.475 1.00 0.00 C ATOM 102 C LEU A 8 -5.563 -13.434 -2.812 1.00 0.00 C ATOM 103 O LEU A 8 -6.400 -14.136 -3.380 1.00 0.00 O ATOM 104 CB LEU A 8 -3.127 -13.999 -2.875 1.00 0.00 C ATOM 105 CG LEU A 8 -1.954 -14.331 -3.798 1.00 0.00 C ATOM 106 CD1 LEU A 8 -2.388 -15.304 -4.883 1.00 0.00 C ATOM 107 CD2 LEU A 8 -1.384 -13.062 -4.414 1.00 0.00 C ATOM 0 H LEU A 8 -2.974 -11.540 -2.894 1.00 0.00 H new ATOM 0 HA LEU A 8 -4.311 -13.332 -4.541 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.736 -13.501 -1.988 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -3.578 -14.934 -2.543 1.00 0.00 H new ATOM 0 HG LEU A 8 -1.172 -14.805 -3.204 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.540 -15.529 -5.530 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -2.748 -16.225 -4.423 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -3.187 -14.857 -5.474 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -0.550 -13.318 -5.068 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.158 -12.559 -4.993 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -1.035 -12.399 -3.623 1.00 0.00 H new ATOM 119 N PHE A 9 -5.759 -12.908 -1.608 1.00 0.00 N ATOM 120 CA PHE A 9 -6.995 -13.131 -0.867 1.00 0.00 C ATOM 121 C PHE A 9 -8.212 -12.802 -1.728 1.00 0.00 C ATOM 122 O PHE A 9 -9.211 -13.521 -1.712 1.00 0.00 O ATOM 123 CB PHE A 9 -7.012 -12.283 0.406 1.00 0.00 C ATOM 124 CG PHE A 9 -8.352 -12.248 1.085 1.00 0.00 C ATOM 125 CD1 PHE A 9 -9.088 -13.409 1.255 1.00 0.00 C ATOM 126 CD2 PHE A 9 -8.875 -11.053 1.552 1.00 0.00 C ATOM 127 CE1 PHE A 9 -10.321 -13.380 1.880 1.00 0.00 C ATOM 128 CE2 PHE A 9 -10.107 -11.018 2.177 1.00 0.00 C ATOM 129 CZ PHE A 9 -10.831 -12.183 2.340 1.00 0.00 C ATOM 0 H PHE A 9 -5.077 -12.324 -1.124 1.00 0.00 H new ATOM 0 HA PHE A 9 -7.040 -14.185 -0.593 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -6.270 -12.673 1.103 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -6.712 -11.265 0.159 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -8.694 -14.348 0.895 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -8.314 -10.139 1.426 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -10.884 -14.293 2.008 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -10.503 -10.080 2.538 1.00 0.00 H new ATOM 0 HZ PHE A 9 -11.795 -12.157 2.827 1.00 0.00 H new ATOM 139 N PHE A 10 -8.119 -11.709 -2.478 1.00 0.00 N ATOM 140 CA PHE A 10 -9.212 -11.281 -3.344 1.00 0.00 C ATOM 141 C PHE A 10 -9.318 -12.183 -4.571 1.00 0.00 C ATOM 142 O PHE A 10 -10.404 -12.386 -5.112 1.00 0.00 O ATOM 143 CB PHE A 10 -9.006 -9.829 -3.781 1.00 0.00 C ATOM 144 CG PHE A 10 -9.223 -8.834 -2.677 1.00 0.00 C ATOM 145 CD1 PHE A 10 -10.469 -8.697 -2.087 1.00 0.00 C ATOM 146 CD2 PHE A 10 -8.182 -8.037 -2.230 1.00 0.00 C ATOM 147 CE1 PHE A 10 -10.672 -7.781 -1.071 1.00 0.00 C ATOM 148 CE2 PHE A 10 -8.379 -7.121 -1.215 1.00 0.00 C ATOM 149 CZ PHE A 10 -9.625 -6.993 -0.634 1.00 0.00 C ATOM 0 H PHE A 10 -7.299 -11.104 -2.504 1.00 0.00 H new ATOM 0 HA PHE A 10 -10.141 -11.355 -2.779 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -7.994 -9.715 -4.168 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -9.688 -9.604 -4.601 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -11.290 -9.312 -2.424 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -7.205 -8.133 -2.680 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -11.648 -7.682 -0.620 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -7.559 -6.505 -0.876 1.00 0.00 H new ATOM 0 HZ PHE A 10 -9.781 -6.278 0.161 1.00 0.00 H new ATOM 159 N MET A 11 -8.182 -12.721 -5.003 1.00 0.00 N ATOM 160 CA MET A 11 -8.147 -13.601 -6.164 1.00 0.00 C ATOM 161 C MET A 11 -8.724 -14.972 -5.825 1.00 0.00 C ATOM 162 O MET A 11 -9.373 -15.605 -6.658 1.00 0.00 O ATOM 163 CB MET A 11 -6.712 -13.751 -6.674 1.00 0.00 C ATOM 164 CG MET A 11 -6.340 -12.740 -7.746 1.00 0.00 C ATOM 165 SD MET A 11 -4.702 -12.029 -7.492 1.00 0.00 S ATOM 166 CE MET A 11 -5.131 -10.379 -6.944 1.00 0.00 C ATOM 0 H MET A 11 -7.274 -12.563 -4.566 1.00 0.00 H new ATOM 0 HA MET A 11 -8.758 -13.152 -6.947 1.00 0.00 H new ATOM 0 HB2 MET A 11 -6.024 -13.648 -5.835 1.00 0.00 H new ATOM 0 HB3 MET A 11 -6.580 -14.757 -7.073 1.00 0.00 H new ATOM 0 HG2 MET A 11 -6.375 -13.223 -8.723 1.00 0.00 H new ATOM 0 HG3 MET A 11 -7.081 -11.941 -7.759 1.00 0.00 H new ATOM 0 HE1 MET A 11 -4.397 -10.035 -6.216 1.00 0.00 H new ATOM 0 HE2 MET A 11 -5.139 -9.702 -7.799 1.00 0.00 H new ATOM 0 HE3 MET A 11 -6.119 -10.394 -6.484 1.00 0.00 H new ATOM 176 N ILE A 12 -8.483 -15.423 -4.599 1.00 0.00 N ATOM 177 CA ILE A 12 -8.981 -16.718 -4.151 1.00 0.00 C ATOM 178 C ILE A 12 -10.416 -16.612 -3.648 1.00 0.00 C ATOM 179 O ILE A 12 -11.276 -17.409 -4.021 1.00 0.00 O ATOM 180 CB ILE A 12 -8.099 -17.303 -3.032 1.00 0.00 C ATOM 181 CG1 ILE A 12 -6.724 -17.686 -3.584 1.00 0.00 C ATOM 182 CG2 ILE A 12 -8.777 -18.510 -2.400 1.00 0.00 C ATOM 183 CD1 ILE A 12 -5.589 -16.880 -2.992 1.00 0.00 C ATOM 0 H ILE A 12 -7.946 -14.912 -3.898 1.00 0.00 H new ATOM 0 HA ILE A 12 -8.950 -17.383 -5.014 1.00 0.00 H new ATOM 0 HB ILE A 12 -7.962 -16.543 -2.263 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -6.546 -18.744 -3.392 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -6.726 -17.555 -4.666 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -8.142 -18.912 -1.611 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -9.735 -18.209 -1.976 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -8.941 -19.275 -3.159 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -4.645 -17.205 -3.429 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -5.743 -15.823 -3.207 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -5.560 -17.031 -1.913 1.00 0.00 H new ATOM 195 N ASN A 13 -10.669 -15.620 -2.800 1.00 0.00 N ATOM 196 CA ASN A 13 -12.001 -15.408 -2.247 1.00 0.00 C ATOM 197 C ASN A 13 -13.022 -15.185 -3.358 1.00 0.00 C ATOM 198 O ASN A 13 -14.007 -15.916 -3.469 1.00 0.00 O ATOM 199 CB ASN A 13 -11.996 -14.210 -1.295 1.00 0.00 C ATOM 200 CG ASN A 13 -13.324 -14.030 -0.585 1.00 0.00 C ATOM 201 OD1 ASN A 13 -13.897 -12.940 -0.583 1.00 0.00 O ATOM 202 ND2 ASN A 13 -13.820 -15.102 0.022 1.00 0.00 N ATOM 0 H ASN A 13 -9.969 -14.951 -2.481 1.00 0.00 H new ATOM 0 HA ASN A 13 -12.284 -16.303 -1.693 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -11.206 -14.341 -0.555 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -11.761 -13.305 -1.855 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -14.710 -15.042 0.516 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -13.310 -15.985 -0.006 1.00 0.00 H new ATOM 209 N THR A 14 -12.781 -14.169 -4.181 1.00 0.00 N ATOM 210 CA THR A 14 -13.679 -13.848 -5.283 1.00 0.00 C ATOM 211 C THR A 14 -13.960 -15.078 -6.139 1.00 0.00 C ATOM 212 O THR A 14 -15.047 -15.221 -6.699 1.00 0.00 O ATOM 213 CB THR A 14 -13.097 -12.737 -6.177 1.00 0.00 C ATOM 214 OG1 THR A 14 -12.865 -11.556 -5.402 1.00 0.00 O ATOM 215 CG2 THR A 14 -14.039 -12.419 -7.328 1.00 0.00 C ATOM 0 H THR A 14 -11.971 -13.554 -4.105 1.00 0.00 H new ATOM 0 HA THR A 14 -14.610 -13.496 -4.839 1.00 0.00 H new ATOM 0 HB THR A 14 -12.152 -13.091 -6.590 1.00 0.00 H new ATOM 0 HG1 THR A 14 -11.934 -11.543 -5.096 1.00 0.00 H new ATOM 0 HG21 THR A 14 -13.606 -11.632 -7.945 1.00 0.00 H new ATOM 0 HG22 THR A 14 -14.189 -13.313 -7.933 1.00 0.00 H new ATOM 0 HG23 THR A 14 -14.998 -12.084 -6.932 1.00 0.00 H new ATOM 223 N SER A 15 -12.974 -15.964 -6.235 1.00 0.00 N ATOM 224 CA SER A 15 -13.115 -17.182 -7.025 1.00 0.00 C ATOM 225 C SER A 15 -14.188 -18.092 -6.435 1.00 0.00 C ATOM 226 O SER A 15 -15.215 -18.347 -7.065 1.00 0.00 O ATOM 227 CB SER A 15 -11.780 -17.927 -7.095 1.00 0.00 C ATOM 228 OG SER A 15 -11.672 -18.668 -8.298 1.00 0.00 O ATOM 0 H SER A 15 -12.069 -15.861 -5.776 1.00 0.00 H new ATOM 0 HA SER A 15 -13.418 -16.899 -8.033 1.00 0.00 H new ATOM 0 HB2 SER A 15 -10.958 -17.214 -7.028 1.00 0.00 H new ATOM 0 HB3 SER A 15 -11.689 -18.599 -6.241 1.00 0.00 H new ATOM 0 HG SER A 15 -10.810 -19.133 -8.319 1.00 0.00 H new ATOM 234 N ILE A 16 -13.942 -18.578 -5.224 1.00 0.00 N ATOM 235 CA ILE A 16 -14.887 -19.458 -4.548 1.00 0.00 C ATOM 236 C ILE A 16 -16.285 -18.850 -4.524 1.00 0.00 C ATOM 237 O ILE A 16 -17.281 -19.548 -4.715 1.00 0.00 O ATOM 238 CB ILE A 16 -14.444 -19.756 -3.103 1.00 0.00 C ATOM 239 CG1 ILE A 16 -13.066 -20.421 -3.095 1.00 0.00 C ATOM 240 CG2 ILE A 16 -15.469 -20.639 -2.407 1.00 0.00 C ATOM 241 CD1 ILE A 16 -12.376 -20.366 -1.750 1.00 0.00 C ATOM 0 H ILE A 16 -13.096 -18.377 -4.690 1.00 0.00 H new ATOM 0 HA ILE A 16 -14.909 -20.390 -5.113 1.00 0.00 H new ATOM 0 HB ILE A 16 -14.374 -18.814 -2.558 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -13.173 -21.463 -3.397 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -12.433 -19.937 -3.839 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -15.142 -20.841 -1.387 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -16.433 -20.130 -2.385 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -15.567 -21.579 -2.949 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -11.405 -20.856 -1.819 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -12.237 -19.326 -1.454 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -12.988 -20.876 -1.006 1.00 0.00 H new ATOM 253 N LEU A 17 -16.352 -17.544 -4.290 1.00 0.00 N ATOM 254 CA LEU A 17 -17.628 -16.839 -4.244 1.00 0.00 C ATOM 255 C LEU A 17 -18.283 -16.807 -5.621 1.00 0.00 C ATOM 256 O LEU A 17 -19.406 -17.280 -5.797 1.00 0.00 O ATOM 257 CB LEU A 17 -17.427 -15.413 -3.728 1.00 0.00 C ATOM 258 CG LEU A 17 -18.225 -15.032 -2.480 1.00 0.00 C ATOM 259 CD1 LEU A 17 -17.911 -13.604 -2.062 1.00 0.00 C ATOM 260 CD2 LEU A 17 -19.716 -15.202 -2.727 1.00 0.00 C ATOM 0 H LEU A 17 -15.537 -16.952 -4.129 1.00 0.00 H new ATOM 0 HA LEU A 17 -18.287 -17.376 -3.562 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -16.368 -15.271 -3.515 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -17.687 -14.719 -4.527 1.00 0.00 H new ATOM 0 HG LEU A 17 -17.934 -15.699 -1.668 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -18.488 -13.350 -1.173 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -16.847 -13.515 -1.842 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -18.173 -12.922 -2.871 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -20.267 -14.926 -1.828 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -20.024 -14.560 -3.553 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -19.927 -16.242 -2.978 1.00 0.00 H new ATOM 272 N LEU A 18 -17.573 -16.248 -6.595 1.00 0.00 N ATOM 273 CA LEU A 18 -18.084 -16.156 -7.958 1.00 0.00 C ATOM 274 C LEU A 18 -18.534 -17.522 -8.464 1.00 0.00 C ATOM 275 O LEU A 18 -19.491 -17.626 -9.233 1.00 0.00 O ATOM 276 CB LEU A 18 -17.012 -15.583 -8.887 1.00 0.00 C ATOM 277 CG LEU A 18 -16.789 -14.072 -8.803 1.00 0.00 C ATOM 278 CD1 LEU A 18 -15.772 -13.625 -9.841 1.00 0.00 C ATOM 279 CD2 LEU A 18 -18.103 -13.328 -8.985 1.00 0.00 C ATOM 0 H LEU A 18 -16.642 -15.852 -6.466 1.00 0.00 H new ATOM 0 HA LEU A 18 -18.946 -15.489 -7.953 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -16.067 -16.082 -8.670 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -17.277 -15.834 -9.914 1.00 0.00 H new ATOM 0 HG LEU A 18 -16.396 -13.836 -7.814 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -15.626 -12.547 -9.767 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -14.824 -14.133 -9.664 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -16.136 -13.874 -10.838 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -17.925 -12.254 -8.922 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -18.526 -13.569 -9.960 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -18.801 -13.626 -8.203 1.00 0.00 H new ATOM 291 N ILE A 19 -17.841 -18.568 -8.027 1.00 0.00 N ATOM 292 CA ILE A 19 -18.172 -19.928 -8.433 1.00 0.00 C ATOM 293 C ILE A 19 -19.552 -20.332 -7.926 1.00 0.00 C ATOM 294 O ILE A 19 -20.442 -20.660 -8.712 1.00 0.00 O ATOM 295 CB ILE A 19 -17.131 -20.939 -7.916 1.00 0.00 C ATOM 296 CG1 ILE A 19 -15.786 -20.720 -8.612 1.00 0.00 C ATOM 297 CG2 ILE A 19 -17.621 -22.362 -8.135 1.00 0.00 C ATOM 298 CD1 ILE A 19 -14.596 -21.111 -7.764 1.00 0.00 C ATOM 0 H ILE A 19 -17.046 -18.499 -7.391 1.00 0.00 H new ATOM 0 HA ILE A 19 -18.169 -19.942 -9.523 1.00 0.00 H new ATOM 0 HB ILE A 19 -16.995 -20.783 -6.846 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -15.767 -21.295 -9.538 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -15.696 -19.669 -8.888 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -16.875 -23.065 -7.765 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -18.558 -22.511 -7.598 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -17.782 -22.532 -9.200 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -13.677 -20.929 -8.321 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -14.590 -20.518 -6.850 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -14.662 -22.169 -7.509 1.00 0.00 H new ATOM 310 N PHE A 20 -19.724 -20.305 -6.609 1.00 0.00 N ATOM 311 CA PHE A 20 -20.997 -20.668 -5.997 1.00 0.00 C ATOM 312 C PHE A 20 -22.109 -19.731 -6.458 1.00 0.00 C ATOM 313 O PHE A 20 -23.241 -20.160 -6.687 1.00 0.00 O ATOM 314 CB PHE A 20 -20.883 -20.629 -4.471 1.00 0.00 C ATOM 315 CG PHE A 20 -21.678 -21.702 -3.783 1.00 0.00 C ATOM 316 CD1 PHE A 20 -22.763 -22.290 -4.413 1.00 0.00 C ATOM 317 CD2 PHE A 20 -21.339 -22.123 -2.507 1.00 0.00 C ATOM 318 CE1 PHE A 20 -23.496 -23.277 -3.782 1.00 0.00 C ATOM 319 CE2 PHE A 20 -22.069 -23.110 -1.871 1.00 0.00 C ATOM 320 CZ PHE A 20 -23.148 -23.688 -2.510 1.00 0.00 C ATOM 0 H PHE A 20 -18.998 -20.036 -5.945 1.00 0.00 H new ATOM 0 HA PHE A 20 -21.246 -21.682 -6.311 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -19.834 -20.728 -4.190 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -21.218 -19.655 -4.114 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -23.039 -21.973 -5.408 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -20.495 -21.675 -2.004 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -24.340 -23.727 -4.283 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -21.796 -23.428 -0.876 1.00 0.00 H new ATOM 0 HZ PHE A 20 -23.719 -24.460 -2.016 1.00 0.00 H new ATOM 330 N ILE A 21 -21.779 -18.451 -6.593 1.00 0.00 N ATOM 331 CA ILE A 21 -22.749 -17.454 -7.028 1.00 0.00 C ATOM 332 C ILE A 21 -23.227 -17.735 -8.448 1.00 0.00 C ATOM 333 O ILE A 21 -24.428 -17.825 -8.704 1.00 0.00 O ATOM 334 CB ILE A 21 -22.160 -16.032 -6.967 1.00 0.00 C ATOM 335 CG1 ILE A 21 -21.931 -15.612 -5.514 1.00 0.00 C ATOM 336 CG2 ILE A 21 -23.082 -15.047 -7.670 1.00 0.00 C ATOM 337 CD1 ILE A 21 -21.203 -14.294 -5.373 1.00 0.00 C ATOM 0 H ILE A 21 -20.847 -18.080 -6.407 1.00 0.00 H new ATOM 0 HA ILE A 21 -23.595 -17.517 -6.344 1.00 0.00 H new ATOM 0 HB ILE A 21 -21.199 -16.031 -7.481 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -22.894 -15.541 -5.009 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -21.360 -16.389 -5.005 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -22.653 -14.046 -7.619 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -23.198 -15.339 -8.714 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -24.057 -15.049 -7.182 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -21.076 -14.060 -4.316 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -20.225 -14.366 -5.849 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -21.783 -13.505 -5.852 1.00 0.00 H new ATOM 349 N PHE A 22 -22.279 -17.873 -9.369 1.00 0.00 N ATOM 350 CA PHE A 22 -22.603 -18.144 -10.765 1.00 0.00 C ATOM 351 C PHE A 22 -23.223 -19.530 -10.919 1.00 0.00 C ATOM 352 O PHE A 22 -24.319 -19.673 -11.463 1.00 0.00 O ATOM 353 CB PHE A 22 -21.347 -18.036 -11.632 1.00 0.00 C ATOM 354 CG PHE A 22 -21.634 -17.672 -13.060 1.00 0.00 C ATOM 355 CD1 PHE A 22 -22.113 -16.413 -13.385 1.00 0.00 C ATOM 356 CD2 PHE A 22 -21.426 -18.588 -14.078 1.00 0.00 C ATOM 357 CE1 PHE A 22 -22.379 -16.075 -14.699 1.00 0.00 C ATOM 358 CE2 PHE A 22 -21.690 -18.256 -15.394 1.00 0.00 C ATOM 359 CZ PHE A 22 -22.166 -16.998 -15.705 1.00 0.00 C ATOM 0 H PHE A 22 -21.280 -17.802 -9.174 1.00 0.00 H new ATOM 0 HA PHE A 22 -23.329 -17.401 -11.095 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -20.681 -17.288 -11.202 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -20.816 -18.987 -11.608 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -22.280 -15.687 -12.603 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -21.053 -19.573 -13.841 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -22.753 -15.091 -14.939 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -21.524 -18.980 -16.178 1.00 0.00 H new ATOM 0 HZ PHE A 22 -22.371 -16.736 -16.732 1.00 0.00 H new ATOM 369 N ILE A 23 -22.515 -20.546 -10.439 1.00 0.00 N ATOM 370 CA ILE A 23 -22.996 -21.919 -10.523 1.00 0.00 C ATOM 371 C ILE A 23 -24.460 -22.016 -10.108 1.00 0.00 C ATOM 372 O ILE A 23 -25.293 -22.537 -10.849 1.00 0.00 O ATOM 373 CB ILE A 23 -22.160 -22.864 -9.638 1.00 0.00 C ATOM 374 CG1 ILE A 23 -20.836 -23.204 -10.326 1.00 0.00 C ATOM 375 CG2 ILE A 23 -22.943 -24.131 -9.329 1.00 0.00 C ATOM 376 CD1 ILE A 23 -19.919 -24.060 -9.482 1.00 0.00 C ATOM 0 H ILE A 23 -21.606 -20.444 -9.988 1.00 0.00 H new ATOM 0 HA ILE A 23 -22.895 -22.225 -11.564 1.00 0.00 H new ATOM 0 HB ILE A 23 -21.940 -22.358 -8.698 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -21.045 -23.723 -11.262 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -20.321 -22.278 -10.583 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -22.339 -24.788 -8.703 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -23.862 -23.872 -8.803 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -23.190 -24.642 -10.260 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -19.000 -24.261 -10.033 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -19.680 -23.535 -8.557 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -20.415 -25.002 -9.247 1.00 0.00 H new ATOM 388 N VAL A 24 -24.767 -21.507 -8.919 1.00 0.00 N ATOM 389 CA VAL A 24 -26.132 -21.532 -8.406 1.00 0.00 C ATOM 390 C VAL A 24 -27.097 -20.867 -9.380 1.00 0.00 C ATOM 391 O VAL A 24 -28.149 -21.421 -9.705 1.00 0.00 O ATOM 392 CB VAL A 24 -26.231 -20.828 -7.040 1.00 0.00 C ATOM 393 CG1 VAL A 24 -27.686 -20.591 -6.666 1.00 0.00 C ATOM 394 CG2 VAL A 24 -25.522 -21.642 -5.969 1.00 0.00 C ATOM 0 H VAL A 24 -24.089 -21.072 -8.293 1.00 0.00 H new ATOM 0 HA VAL A 24 -26.406 -22.580 -8.286 1.00 0.00 H new ATOM 0 HB VAL A 24 -25.737 -19.859 -7.113 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -27.736 -20.093 -5.698 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -28.158 -19.964 -7.422 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -28.207 -21.546 -6.610 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -25.602 -21.130 -5.010 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -25.984 -22.626 -5.894 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -24.471 -21.754 -6.234 1.00 0.00 H new ATOM 404 N LEU A 25 -26.734 -19.677 -9.845 1.00 0.00 N ATOM 405 CA LEU A 25 -27.568 -18.935 -10.784 1.00 0.00 C ATOM 406 C LEU A 25 -27.707 -19.689 -12.103 1.00 0.00 C ATOM 407 O LEU A 25 -28.764 -19.666 -12.735 1.00 0.00 O ATOM 408 CB LEU A 25 -26.976 -17.547 -11.037 1.00 0.00 C ATOM 409 CG LEU A 25 -27.214 -16.507 -9.942 1.00 0.00 C ATOM 410 CD1 LEU A 25 -26.748 -15.134 -10.401 1.00 0.00 C ATOM 411 CD2 LEU A 25 -28.684 -16.470 -9.551 1.00 0.00 C ATOM 0 H LEU A 25 -25.867 -19.205 -9.587 1.00 0.00 H new ATOM 0 HA LEU A 25 -28.559 -18.826 -10.343 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -25.901 -17.653 -11.182 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -27.387 -17.163 -11.971 1.00 0.00 H new ATOM 0 HG LEU A 25 -26.633 -16.792 -9.065 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -26.925 -14.406 -9.609 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -25.683 -15.169 -10.630 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -27.302 -14.841 -11.293 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -28.834 -15.724 -8.771 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -29.286 -16.210 -10.422 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -28.987 -17.449 -9.180 1.00 0.00 H new ATOM 423 N LEU A 26 -26.635 -20.358 -12.511 1.00 0.00 N ATOM 424 CA LEU A 26 -26.637 -21.122 -13.754 1.00 0.00 C ATOM 425 C LEU A 26 -27.710 -22.205 -13.726 1.00 0.00 C ATOM 426 O LEU A 26 -28.484 -22.351 -14.672 1.00 0.00 O ATOM 427 CB LEU A 26 -25.264 -21.754 -13.989 1.00 0.00 C ATOM 428 CG LEU A 26 -25.209 -22.871 -15.033 1.00 0.00 C ATOM 429 CD1 LEU A 26 -25.486 -22.317 -16.422 1.00 0.00 C ATOM 430 CD2 LEU A 26 -23.859 -23.570 -14.995 1.00 0.00 C ATOM 0 H LEU A 26 -25.753 -20.387 -12.000 1.00 0.00 H new ATOM 0 HA LEU A 26 -26.860 -20.437 -14.572 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -24.571 -20.968 -14.290 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -24.902 -22.152 -13.041 1.00 0.00 H new ATOM 0 HG LEU A 26 -25.981 -23.603 -14.796 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -25.443 -23.126 -17.152 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -26.477 -21.863 -16.442 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -24.737 -21.565 -16.670 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -23.838 -24.362 -15.744 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -23.070 -22.849 -15.207 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -23.700 -24.002 -14.007 1.00 0.00 H new ATOM 442 N ILE A 27 -27.752 -22.960 -12.633 1.00 0.00 N ATOM 443 CA ILE A 27 -28.733 -24.028 -12.481 1.00 0.00 C ATOM 444 C ILE A 27 -30.145 -23.464 -12.363 1.00 0.00 C ATOM 445 O ILE A 27 -31.062 -23.908 -13.054 1.00 0.00 O ATOM 446 CB ILE A 27 -28.434 -24.895 -11.243 1.00 0.00 C ATOM 447 CG1 ILE A 27 -27.516 -26.060 -11.620 1.00 0.00 C ATOM 448 CG2 ILE A 27 -29.728 -25.409 -10.631 1.00 0.00 C ATOM 449 CD1 ILE A 27 -26.163 -26.006 -10.946 1.00 0.00 C ATOM 0 H ILE A 27 -27.119 -22.852 -11.841 1.00 0.00 H new ATOM 0 HA ILE A 27 -28.665 -24.649 -13.374 1.00 0.00 H new ATOM 0 HB ILE A 27 -27.924 -24.280 -10.501 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -28.006 -26.998 -11.358 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -27.375 -26.065 -12.701 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -29.500 -26.020 -9.757 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -30.349 -24.565 -10.331 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -30.264 -26.011 -11.365 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -25.566 -26.862 -11.260 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -25.653 -25.085 -11.228 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -26.294 -26.032 -9.864 1.00 0.00 H new ATOM 461 N HIS A 28 -30.313 -22.481 -11.483 1.00 0.00 N ATOM 462 CA HIS A 28 -31.613 -21.854 -11.276 1.00 0.00 C ATOM 463 C HIS A 28 -32.219 -21.408 -12.604 1.00 0.00 C ATOM 464 O HIS A 28 -33.437 -21.424 -12.779 1.00 0.00 O ATOM 465 CB HIS A 28 -31.481 -20.657 -10.334 1.00 0.00 C ATOM 466 CG HIS A 28 -32.737 -19.849 -10.214 1.00 0.00 C ATOM 467 ND1 HIS A 28 -33.015 -18.766 -11.022 1.00 0.00 N ATOM 468 CD2 HIS A 28 -33.791 -19.971 -9.375 1.00 0.00 C ATOM 469 CE1 HIS A 28 -34.186 -18.257 -10.684 1.00 0.00 C ATOM 470 NE2 HIS A 28 -34.678 -18.970 -9.687 1.00 0.00 N ATOM 0 H HIS A 28 -29.565 -22.102 -10.902 1.00 0.00 H new ATOM 0 HA HIS A 28 -32.277 -22.591 -10.824 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -31.192 -21.013 -9.345 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -30.677 -20.013 -10.689 1.00 0.00 H new ATOM 0 HD1 HIS A 28 -32.411 -18.413 -11.764 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -33.912 -20.717 -8.603 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -34.660 -17.403 -11.145 1.00 0.00 H new ATOM 478 N PHE A 29 -31.359 -21.009 -13.536 1.00 0.00 N ATOM 479 CA PHE A 29 -31.810 -20.556 -14.847 1.00 0.00 C ATOM 480 C PHE A 29 -31.694 -21.675 -15.878 1.00 0.00 C ATOM 481 O PHE A 29 -32.339 -21.637 -16.925 1.00 0.00 O ATOM 482 CB PHE A 29 -30.993 -19.344 -15.300 1.00 0.00 C ATOM 483 CG PHE A 29 -31.388 -18.066 -14.616 1.00 0.00 C ATOM 484 CD1 PHE A 29 -32.683 -17.584 -14.715 1.00 0.00 C ATOM 485 CD2 PHE A 29 -30.465 -17.347 -13.874 1.00 0.00 C ATOM 486 CE1 PHE A 29 -33.049 -16.408 -14.088 1.00 0.00 C ATOM 487 CE2 PHE A 29 -30.825 -16.171 -13.244 1.00 0.00 C ATOM 488 CZ PHE A 29 -32.119 -15.701 -13.351 1.00 0.00 C ATOM 0 H PHE A 29 -30.347 -20.990 -13.408 1.00 0.00 H new ATOM 0 HA PHE A 29 -32.858 -20.269 -14.764 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -29.937 -19.537 -15.111 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -31.107 -19.221 -16.377 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -33.415 -18.133 -15.289 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -29.452 -17.710 -13.787 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -34.061 -16.042 -14.174 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -30.095 -15.620 -12.669 1.00 0.00 H new ATOM 0 HZ PHE A 29 -32.403 -14.782 -12.859 1.00 0.00 H new ATOM 498 N GLU A 30 -30.866 -22.670 -15.573 1.00 0.00 N ATOM 499 CA GLU A 30 -30.665 -23.799 -16.473 1.00 0.00 C ATOM 500 C GLU A 30 -31.910 -24.679 -16.530 1.00 0.00 C ATOM 501 O GLU A 30 -31.968 -25.643 -17.292 1.00 0.00 O ATOM 502 CB GLU A 30 -29.460 -24.629 -16.025 1.00 0.00 C ATOM 503 CG GLU A 30 -28.184 -24.309 -16.785 1.00 0.00 C ATOM 504 CD GLU A 30 -28.218 -24.807 -18.217 1.00 0.00 C ATOM 505 OE1 GLU A 30 -28.341 -26.033 -18.417 1.00 0.00 O ATOM 506 OE2 GLU A 30 -28.122 -23.969 -19.138 1.00 0.00 O ATOM 0 H GLU A 30 -30.324 -22.717 -14.710 1.00 0.00 H new ATOM 0 HA GLU A 30 -30.475 -23.405 -17.471 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -29.291 -24.463 -14.961 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -29.692 -25.687 -16.150 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -28.025 -23.231 -16.783 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -27.335 -24.757 -16.268 1.00 0.00 H new ATOM 513 N GLY A 31 -32.906 -24.338 -15.717 1.00 0.00 N ATOM 514 CA GLY A 31 -34.136 -25.107 -15.689 1.00 0.00 C ATOM 515 C GLY A 31 -34.494 -25.578 -14.293 1.00 0.00 C ATOM 516 O GLY A 31 -34.765 -26.759 -14.080 1.00 0.00 O ATOM 0 H GLY A 31 -32.883 -23.543 -15.078 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -34.950 -24.499 -16.084 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -34.036 -25.971 -16.346 1.00 0.00 H new ATOM 520 N TRP A 32 -34.493 -24.652 -13.340 1.00 0.00 N ATOM 521 CA TRP A 32 -34.819 -24.980 -11.957 1.00 0.00 C ATOM 522 C TRP A 32 -36.054 -24.216 -11.493 1.00 0.00 C ATOM 523 O TRP A 32 -36.286 -24.063 -10.293 1.00 0.00 O ATOM 524 CB TRP A 32 -33.634 -24.661 -11.043 1.00 0.00 C ATOM 525 CG TRP A 32 -33.147 -25.847 -10.267 1.00 0.00 C ATOM 526 CD1 TRP A 32 -33.125 -25.984 -8.908 1.00 0.00 C ATOM 527 CD2 TRP A 32 -32.609 -27.061 -10.804 1.00 0.00 C ATOM 528 NE1 TRP A 32 -32.606 -27.211 -8.568 1.00 0.00 N ATOM 529 CE2 TRP A 32 -32.283 -27.890 -9.713 1.00 0.00 C ATOM 530 CE3 TRP A 32 -32.374 -27.529 -12.099 1.00 0.00 C ATOM 531 CZ2 TRP A 32 -31.734 -29.158 -9.881 1.00 0.00 C ATOM 532 CZ3 TRP A 32 -31.829 -28.787 -12.264 1.00 0.00 C ATOM 533 CH2 TRP A 32 -31.514 -29.591 -11.160 1.00 0.00 C ATOM 0 H TRP A 32 -34.270 -23.669 -13.500 1.00 0.00 H new ATOM 0 HA TRP A 32 -35.034 -26.047 -11.904 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -32.815 -24.269 -11.646 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -33.923 -23.874 -10.347 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -33.465 -25.239 -8.204 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -32.482 -27.559 -7.617 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -32.614 -26.918 -12.956 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -31.490 -29.778 -9.031 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -31.642 -29.158 -13.261 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -31.090 -30.571 -11.322 1.00 0.00 H new ATOM 544 N ARG A 33 -36.844 -23.740 -12.449 1.00 0.00 N ATOM 545 CA ARG A 33 -38.055 -22.991 -12.137 1.00 0.00 C ATOM 546 C ARG A 33 -39.292 -23.713 -12.664 1.00 0.00 C ATOM 547 O ARG A 33 -40.246 -23.081 -13.118 1.00 0.00 O ATOM 548 CB ARG A 33 -37.980 -21.585 -12.735 1.00 0.00 C ATOM 549 CG ARG A 33 -36.633 -20.910 -12.535 1.00 0.00 C ATOM 550 CD ARG A 33 -36.709 -19.418 -12.822 1.00 0.00 C ATOM 551 NE ARG A 33 -37.076 -19.146 -14.209 1.00 0.00 N ATOM 552 CZ ARG A 33 -37.229 -17.922 -14.702 1.00 0.00 C ATOM 553 NH1 ARG A 33 -37.048 -16.863 -13.925 1.00 0.00 N ATOM 554 NH2 ARG A 33 -37.564 -17.756 -15.975 1.00 0.00 N ATOM 0 H ARG A 33 -36.667 -23.860 -13.446 1.00 0.00 H new ATOM 0 HA ARG A 33 -38.134 -22.914 -11.053 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -38.194 -21.641 -13.802 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -38.757 -20.966 -12.286 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -36.294 -21.068 -11.511 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -35.893 -21.370 -13.190 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -37.439 -18.958 -12.157 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -35.745 -18.957 -12.605 1.00 0.00 H new ATOM 0 HE ARG A 33 -37.223 -19.939 -14.833 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -36.791 -16.987 -12.946 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -37.166 -15.924 -14.306 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -37.704 -18.568 -16.576 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -37.681 -16.816 -16.353 1.00 0.00 H new ATOM 568 N ILE A 34 -39.267 -25.040 -12.602 1.00 0.00 N ATOM 569 CA ILE A 34 -40.385 -25.848 -13.072 1.00 0.00 C ATOM 570 C ILE A 34 -41.601 -25.684 -12.167 1.00 0.00 C ATOM 571 O ILE A 34 -42.675 -25.340 -12.657 1.00 0.00 O ATOM 572 CB ILE A 34 -40.011 -27.340 -13.145 1.00 0.00 C ATOM 573 CG1 ILE A 34 -38.783 -27.538 -14.037 1.00 0.00 C ATOM 574 CG2 ILE A 34 -41.186 -28.156 -13.663 1.00 0.00 C ATOM 575 CD1 ILE A 34 -38.254 -28.955 -14.030 1.00 0.00 C ATOM 0 H ILE A 34 -38.484 -25.578 -12.231 1.00 0.00 H new ATOM 0 HA ILE A 34 -40.630 -25.494 -14.073 1.00 0.00 H new ATOM 0 HB ILE A 34 -39.767 -27.688 -12.141 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -39.038 -27.259 -15.059 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -37.993 -26.862 -13.709 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -40.906 -29.208 -13.709 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -42.036 -28.036 -12.992 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -41.458 -27.809 -14.660 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -37.384 -29.022 -14.683 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -37.968 -29.231 -13.015 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -39.028 -29.634 -14.386 1.00 0.00 H new ATOM 588 N MET B 101 2.596 -24.864 6.470 1.00 0.00 N ATOM 589 CA MET B 101 2.482 -26.235 6.952 1.00 0.00 C ATOM 590 C MET B 101 1.478 -26.327 8.097 1.00 0.00 C ATOM 591 O MET B 101 1.616 -27.163 8.991 1.00 0.00 O ATOM 592 CB MET B 101 3.846 -26.752 7.413 1.00 0.00 C ATOM 593 CG MET B 101 4.926 -26.651 6.347 1.00 0.00 C ATOM 594 SD MET B 101 4.741 -27.891 5.051 1.00 0.00 S ATOM 595 CE MET B 101 4.487 -26.848 3.618 1.00 0.00 C ATOM 0 HA MET B 101 2.126 -26.854 6.129 1.00 0.00 H new ATOM 0 HB2 MET B 101 4.161 -26.189 8.292 1.00 0.00 H new ATOM 0 HB3 MET B 101 3.746 -27.793 7.720 1.00 0.00 H new ATOM 0 HG2 MET B 101 4.898 -25.657 5.900 1.00 0.00 H new ATOM 0 HG3 MET B 101 5.904 -26.763 6.815 1.00 0.00 H new ATOM 0 HE1 MET B 101 4.356 -27.471 2.733 1.00 0.00 H new ATOM 0 HE2 MET B 101 3.597 -26.237 3.766 1.00 0.00 H new ATOM 0 HE3 MET B 101 5.353 -26.201 3.481 1.00 0.00 H new ATOM 605 N ASP B 102 0.469 -25.464 8.064 1.00 0.00 N ATOM 606 CA ASP B 102 -0.559 -25.448 9.098 1.00 0.00 C ATOM 607 C ASP B 102 -1.836 -24.790 8.585 1.00 0.00 C ATOM 608 O ASP B 102 -1.846 -23.604 8.258 1.00 0.00 O ATOM 609 CB ASP B 102 -0.053 -24.711 10.339 1.00 0.00 C ATOM 610 CG ASP B 102 0.851 -25.574 11.197 1.00 0.00 C ATOM 611 OD1 ASP B 102 0.391 -26.641 11.654 1.00 0.00 O ATOM 612 OD2 ASP B 102 2.017 -25.182 11.413 1.00 0.00 O ATOM 0 H ASP B 102 0.341 -24.766 7.332 1.00 0.00 H new ATOM 0 HA ASP B 102 -0.786 -26.480 9.366 1.00 0.00 H new ATOM 0 HB2 ASP B 102 0.489 -23.817 10.031 1.00 0.00 H new ATOM 0 HB3 ASP B 102 -0.904 -24.379 10.933 1.00 0.00 H new ATOM 617 N SER B 103 -2.911 -25.569 8.518 1.00 0.00 N ATOM 618 CA SER B 103 -4.193 -25.063 8.040 1.00 0.00 C ATOM 619 C SER B 103 -5.136 -24.785 9.207 1.00 0.00 C ATOM 620 O SER B 103 -6.317 -25.127 9.159 1.00 0.00 O ATOM 621 CB SER B 103 -4.834 -26.065 7.078 1.00 0.00 C ATOM 622 OG SER B 103 -3.920 -26.459 6.070 1.00 0.00 O ATOM 0 H SER B 103 -2.920 -26.552 8.788 1.00 0.00 H new ATOM 0 HA SER B 103 -4.012 -24.127 7.511 1.00 0.00 H new ATOM 0 HB2 SER B 103 -5.170 -26.942 7.632 1.00 0.00 H new ATOM 0 HB3 SER B 103 -5.717 -25.620 6.619 1.00 0.00 H new ATOM 0 HG SER B 103 -4.353 -27.101 5.469 1.00 0.00 H new ATOM 628 N ALA B 104 -4.604 -24.164 10.254 1.00 0.00 N ATOM 629 CA ALA B 104 -5.398 -23.838 11.433 1.00 0.00 C ATOM 630 C ALA B 104 -6.391 -22.720 11.134 1.00 0.00 C ATOM 631 O ALA B 104 -7.605 -22.885 11.260 1.00 0.00 O ATOM 632 CB ALA B 104 -4.490 -23.445 12.589 1.00 0.00 C ATOM 0 H ALA B 104 -3.627 -23.876 10.310 1.00 0.00 H new ATOM 0 HA ALA B 104 -5.964 -24.725 11.716 1.00 0.00 H new ATOM 0 HB1 ALA B 104 -5.096 -23.204 13.462 1.00 0.00 H new ATOM 0 HB2 ALA B 104 -3.824 -24.275 12.827 1.00 0.00 H new ATOM 0 HB3 ALA B 104 -3.898 -22.574 12.307 1.00 0.00 H new ATOM 638 N PRO B 105 -5.867 -21.554 10.730 1.00 0.00 N ATOM 639 CA PRO B 105 -6.691 -20.386 10.405 1.00 0.00 C ATOM 640 C PRO B 105 -7.494 -20.581 9.124 1.00 0.00 C ATOM 641 O PRO B 105 -8.669 -20.220 9.055 1.00 0.00 O ATOM 642 CB PRO B 105 -5.663 -19.265 10.226 1.00 0.00 C ATOM 643 CG PRO B 105 -4.405 -19.964 9.841 1.00 0.00 C ATOM 644 CD PRO B 105 -4.429 -21.286 10.557 1.00 0.00 C ATOM 0 HA PRO B 105 -7.433 -20.184 11.177 1.00 0.00 H new ATOM 0 HB2 PRO B 105 -5.976 -18.560 9.456 1.00 0.00 H new ATOM 0 HB3 PRO B 105 -5.534 -18.695 11.146 1.00 0.00 H new ATOM 0 HG2 PRO B 105 -4.352 -20.106 8.762 1.00 0.00 H new ATOM 0 HG3 PRO B 105 -3.531 -19.380 10.129 1.00 0.00 H new ATOM 0 HD2 PRO B 105 -3.942 -22.068 9.974 1.00 0.00 H new ATOM 0 HD3 PRO B 105 -3.912 -21.234 11.515 1.00 0.00 H new ATOM 652 N PHE B 106 -6.854 -21.155 8.111 1.00 0.00 N ATOM 653 CA PHE B 106 -7.509 -21.398 6.831 1.00 0.00 C ATOM 654 C PHE B 106 -8.773 -22.234 7.017 1.00 0.00 C ATOM 655 O PHE B 106 -9.798 -21.974 6.388 1.00 0.00 O ATOM 656 CB PHE B 106 -6.552 -22.107 5.870 1.00 0.00 C ATOM 657 CG PHE B 106 -5.324 -21.305 5.547 1.00 0.00 C ATOM 658 CD1 PHE B 106 -5.427 -19.973 5.178 1.00 0.00 C ATOM 659 CD2 PHE B 106 -4.067 -21.883 5.612 1.00 0.00 C ATOM 660 CE1 PHE B 106 -4.299 -19.232 4.881 1.00 0.00 C ATOM 661 CE2 PHE B 106 -2.935 -21.147 5.316 1.00 0.00 C ATOM 662 CZ PHE B 106 -3.051 -19.820 4.948 1.00 0.00 C ATOM 0 H PHE B 106 -5.882 -21.461 8.152 1.00 0.00 H new ATOM 0 HA PHE B 106 -7.791 -20.434 6.407 1.00 0.00 H new ATOM 0 HB2 PHE B 106 -6.250 -23.059 6.307 1.00 0.00 H new ATOM 0 HB3 PHE B 106 -7.081 -22.335 4.945 1.00 0.00 H new ATOM 0 HD1 PHE B 106 -6.400 -19.509 5.122 1.00 0.00 H new ATOM 0 HD2 PHE B 106 -3.970 -22.920 5.897 1.00 0.00 H new ATOM 0 HE1 PHE B 106 -4.393 -18.194 4.597 1.00 0.00 H new ATOM 0 HE2 PHE B 106 -1.960 -21.609 5.372 1.00 0.00 H new ATOM 0 HZ PHE B 106 -2.168 -19.244 4.713 1.00 0.00 H new ATOM 672 N GLU B 107 -8.689 -23.237 7.885 1.00 0.00 N ATOM 673 CA GLU B 107 -9.825 -24.112 8.152 1.00 0.00 C ATOM 674 C GLU B 107 -11.059 -23.299 8.532 1.00 0.00 C ATOM 675 O GLU B 107 -12.095 -23.375 7.869 1.00 0.00 O ATOM 676 CB GLU B 107 -9.485 -25.097 9.272 1.00 0.00 C ATOM 677 CG GLU B 107 -9.521 -26.552 8.835 1.00 0.00 C ATOM 678 CD GLU B 107 -9.370 -27.515 9.996 1.00 0.00 C ATOM 679 OE1 GLU B 107 -9.495 -27.070 11.156 1.00 0.00 O ATOM 680 OE2 GLU B 107 -9.128 -28.714 9.745 1.00 0.00 O ATOM 0 H GLU B 107 -7.847 -23.464 8.415 1.00 0.00 H new ATOM 0 HA GLU B 107 -10.044 -24.670 7.242 1.00 0.00 H new ATOM 0 HB2 GLU B 107 -8.492 -24.867 9.658 1.00 0.00 H new ATOM 0 HB3 GLU B 107 -10.187 -24.956 10.094 1.00 0.00 H new ATOM 0 HG2 GLU B 107 -10.463 -26.750 8.324 1.00 0.00 H new ATOM 0 HG3 GLU B 107 -8.723 -26.730 8.114 1.00 0.00 H new ATOM 687 N LEU B 108 -10.942 -22.522 9.603 1.00 0.00 N ATOM 688 CA LEU B 108 -12.048 -21.695 10.073 1.00 0.00 C ATOM 689 C LEU B 108 -12.561 -20.788 8.959 1.00 0.00 C ATOM 690 O LEU B 108 -13.769 -20.653 8.760 1.00 0.00 O ATOM 691 CB LEU B 108 -11.607 -20.851 11.270 1.00 0.00 C ATOM 692 CG LEU B 108 -11.702 -21.527 12.639 1.00 0.00 C ATOM 693 CD1 LEU B 108 -13.156 -21.687 13.055 1.00 0.00 C ATOM 694 CD2 LEU B 108 -11.000 -22.877 12.617 1.00 0.00 C ATOM 0 H LEU B 108 -10.092 -22.447 10.162 1.00 0.00 H new ATOM 0 HA LEU B 108 -12.858 -22.356 10.381 1.00 0.00 H new ATOM 0 HB2 LEU B 108 -10.574 -20.542 11.110 1.00 0.00 H new ATOM 0 HB3 LEU B 108 -12.211 -19.944 11.292 1.00 0.00 H new ATOM 0 HG LEU B 108 -11.203 -20.893 13.372 1.00 0.00 H new ATOM 0 HD11 LEU B 108 -13.204 -22.170 14.031 1.00 0.00 H new ATOM 0 HD12 LEU B 108 -13.628 -20.706 13.111 1.00 0.00 H new ATOM 0 HD13 LEU B 108 -13.679 -22.300 12.321 1.00 0.00 H new ATOM 0 HD21 LEU B 108 -11.078 -23.343 13.599 1.00 0.00 H new ATOM 0 HD22 LEU B 108 -11.470 -23.519 11.872 1.00 0.00 H new ATOM 0 HD23 LEU B 108 -9.949 -22.737 12.364 1.00 0.00 H new ATOM 706 N PHE B 109 -11.635 -20.169 8.233 1.00 0.00 N ATOM 707 CA PHE B 109 -11.994 -19.276 7.138 1.00 0.00 C ATOM 708 C PHE B 109 -12.977 -19.950 6.185 1.00 0.00 C ATOM 709 O PHE B 109 -13.928 -19.327 5.713 1.00 0.00 O ATOM 710 CB PHE B 109 -10.741 -18.843 6.373 1.00 0.00 C ATOM 711 CG PHE B 109 -11.040 -18.140 5.080 1.00 0.00 C ATOM 712 CD1 PHE B 109 -12.029 -17.172 5.015 1.00 0.00 C ATOM 713 CD2 PHE B 109 -10.333 -18.448 3.929 1.00 0.00 C ATOM 714 CE1 PHE B 109 -12.307 -16.523 3.827 1.00 0.00 C ATOM 715 CE2 PHE B 109 -10.606 -17.803 2.738 1.00 0.00 C ATOM 716 CZ PHE B 109 -11.595 -16.840 2.687 1.00 0.00 C ATOM 0 H PHE B 109 -10.631 -20.270 8.384 1.00 0.00 H new ATOM 0 HA PHE B 109 -12.474 -18.395 7.564 1.00 0.00 H new ATOM 0 HB2 PHE B 109 -10.148 -18.184 7.007 1.00 0.00 H new ATOM 0 HB3 PHE B 109 -10.130 -19.721 6.167 1.00 0.00 H new ATOM 0 HD1 PHE B 109 -12.590 -16.922 5.904 1.00 0.00 H new ATOM 0 HD2 PHE B 109 -9.560 -19.201 3.963 1.00 0.00 H new ATOM 0 HE1 PHE B 109 -13.080 -15.769 3.790 1.00 0.00 H new ATOM 0 HE2 PHE B 109 -10.047 -18.051 1.848 1.00 0.00 H new ATOM 0 HZ PHE B 109 -11.811 -16.336 1.757 1.00 0.00 H new ATOM 726 N PHE B 110 -12.740 -21.228 5.907 1.00 0.00 N ATOM 727 CA PHE B 110 -13.602 -21.988 5.010 1.00 0.00 C ATOM 728 C PHE B 110 -14.920 -22.342 5.692 1.00 0.00 C ATOM 729 O PHE B 110 -15.954 -22.475 5.038 1.00 0.00 O ATOM 730 CB PHE B 110 -12.895 -23.263 4.547 1.00 0.00 C ATOM 731 CG PHE B 110 -11.769 -23.010 3.586 1.00 0.00 C ATOM 732 CD1 PHE B 110 -12.015 -22.456 2.340 1.00 0.00 C ATOM 733 CD2 PHE B 110 -10.464 -23.326 3.929 1.00 0.00 C ATOM 734 CE1 PHE B 110 -10.981 -22.223 1.454 1.00 0.00 C ATOM 735 CE2 PHE B 110 -9.425 -23.094 3.047 1.00 0.00 C ATOM 736 CZ PHE B 110 -9.684 -22.541 1.808 1.00 0.00 C ATOM 0 H PHE B 110 -11.958 -21.759 6.290 1.00 0.00 H new ATOM 0 HA PHE B 110 -13.819 -21.366 4.142 1.00 0.00 H new ATOM 0 HB2 PHE B 110 -12.507 -23.790 5.418 1.00 0.00 H new ATOM 0 HB3 PHE B 110 -13.624 -23.922 4.075 1.00 0.00 H new ATOM 0 HD1 PHE B 110 -13.027 -22.203 2.058 1.00 0.00 H new ATOM 0 HD2 PHE B 110 -10.256 -23.759 4.897 1.00 0.00 H new ATOM 0 HE1 PHE B 110 -11.186 -21.792 0.485 1.00 0.00 H new ATOM 0 HE2 PHE B 110 -8.412 -23.345 3.326 1.00 0.00 H new ATOM 0 HZ PHE B 110 -8.874 -22.358 1.117 1.00 0.00 H new ATOM 746 N MET B 111 -14.874 -22.493 7.012 1.00 0.00 N ATOM 747 CA MET B 111 -16.064 -22.831 7.784 1.00 0.00 C ATOM 748 C MET B 111 -16.971 -21.616 7.944 1.00 0.00 C ATOM 749 O MET B 111 -18.189 -21.751 8.065 1.00 0.00 O ATOM 750 CB MET B 111 -15.668 -23.372 9.160 1.00 0.00 C ATOM 751 CG MET B 111 -15.525 -24.885 9.199 1.00 0.00 C ATOM 752 SD MET B 111 -14.079 -25.421 10.133 1.00 0.00 S ATOM 753 CE MET B 111 -12.991 -25.936 8.807 1.00 0.00 C ATOM 0 H MET B 111 -14.026 -22.387 7.569 1.00 0.00 H new ATOM 0 HA MET B 111 -16.612 -23.602 7.242 1.00 0.00 H new ATOM 0 HB2 MET B 111 -14.724 -22.918 9.462 1.00 0.00 H new ATOM 0 HB3 MET B 111 -16.417 -23.067 9.891 1.00 0.00 H new ATOM 0 HG2 MET B 111 -16.421 -25.320 9.642 1.00 0.00 H new ATOM 0 HG3 MET B 111 -15.457 -25.266 8.180 1.00 0.00 H new ATOM 0 HE1 MET B 111 -11.958 -25.720 9.079 1.00 0.00 H new ATOM 0 HE2 MET B 111 -13.105 -27.007 8.638 1.00 0.00 H new ATOM 0 HE3 MET B 111 -13.247 -25.395 7.896 1.00 0.00 H new ATOM 763 N ILE B 112 -16.371 -20.431 7.946 1.00 0.00 N ATOM 764 CA ILE B 112 -17.126 -19.192 8.091 1.00 0.00 C ATOM 765 C ILE B 112 -17.680 -18.726 6.749 1.00 0.00 C ATOM 766 O ILE B 112 -18.869 -18.435 6.624 1.00 0.00 O ATOM 767 CB ILE B 112 -16.258 -18.071 8.692 1.00 0.00 C ATOM 768 CG1 ILE B 112 -15.962 -18.360 10.165 1.00 0.00 C ATOM 769 CG2 ILE B 112 -16.952 -16.725 8.540 1.00 0.00 C ATOM 770 CD1 ILE B 112 -14.485 -18.459 10.477 1.00 0.00 C ATOM 0 H ILE B 112 -15.364 -20.302 7.849 1.00 0.00 H new ATOM 0 HA ILE B 112 -17.953 -19.404 8.769 1.00 0.00 H new ATOM 0 HB ILE B 112 -15.312 -18.034 8.151 1.00 0.00 H new ATOM 0 HG12 ILE B 112 -16.402 -17.573 10.777 1.00 0.00 H new ATOM 0 HG13 ILE B 112 -16.448 -19.293 10.448 1.00 0.00 H new ATOM 0 HG21 ILE B 112 -16.326 -15.943 8.969 1.00 0.00 H new ATOM 0 HG22 ILE B 112 -17.117 -16.518 7.483 1.00 0.00 H new ATOM 0 HG23 ILE B 112 -17.910 -16.749 9.059 1.00 0.00 H new ATOM 0 HD11 ILE B 112 -14.350 -18.665 11.539 1.00 0.00 H new ATOM 0 HD12 ILE B 112 -14.043 -19.265 9.892 1.00 0.00 H new ATOM 0 HD13 ILE B 112 -13.996 -17.518 10.225 1.00 0.00 H new ATOM 782 N ASN B 113 -16.810 -18.660 5.746 1.00 0.00 N ATOM 783 CA ASN B 113 -17.213 -18.231 4.412 1.00 0.00 C ATOM 784 C ASN B 113 -18.326 -19.121 3.867 1.00 0.00 C ATOM 785 O ASN B 113 -19.407 -18.643 3.522 1.00 0.00 O ATOM 786 CB ASN B 113 -16.014 -18.255 3.462 1.00 0.00 C ATOM 787 CG ASN B 113 -16.346 -17.686 2.096 1.00 0.00 C ATOM 788 OD1 ASN B 113 -16.085 -18.313 1.070 1.00 0.00 O ATOM 789 ND2 ASN B 113 -16.926 -16.491 2.078 1.00 0.00 N ATOM 0 H ASN B 113 -15.822 -18.898 5.832 1.00 0.00 H new ATOM 0 HA ASN B 113 -17.591 -17.211 4.484 1.00 0.00 H new ATOM 0 HB2 ASN B 113 -15.195 -17.685 3.901 1.00 0.00 H new ATOM 0 HB3 ASN B 113 -15.664 -19.281 3.350 1.00 0.00 H new ATOM 0 HD21 ASN B 113 -17.173 -16.058 1.188 1.00 0.00 H new ATOM 0 HD22 ASN B 113 -17.124 -16.007 2.954 1.00 0.00 H new ATOM 796 N THR B 114 -18.054 -20.420 3.792 1.00 0.00 N ATOM 797 CA THR B 114 -19.030 -21.378 3.288 1.00 0.00 C ATOM 798 C THR B 114 -20.379 -21.202 3.977 1.00 0.00 C ATOM 799 O THR B 114 -21.429 -21.354 3.354 1.00 0.00 O ATOM 800 CB THR B 114 -18.550 -22.828 3.488 1.00 0.00 C ATOM 801 OG1 THR B 114 -17.321 -23.039 2.784 1.00 0.00 O ATOM 802 CG2 THR B 114 -19.597 -23.817 2.999 1.00 0.00 C ATOM 0 H THR B 114 -17.165 -20.833 4.074 1.00 0.00 H new ATOM 0 HA THR B 114 -19.141 -21.184 2.221 1.00 0.00 H new ATOM 0 HB THR B 114 -18.390 -22.990 4.554 1.00 0.00 H new ATOM 0 HG1 THR B 114 -16.566 -22.893 3.392 1.00 0.00 H new ATOM 0 HG21 THR B 114 -19.236 -24.834 3.151 1.00 0.00 H new ATOM 0 HG22 THR B 114 -20.522 -23.674 3.558 1.00 0.00 H new ATOM 0 HG23 THR B 114 -19.785 -23.653 1.938 1.00 0.00 H new ATOM 810 N SER B 115 -20.342 -20.879 5.266 1.00 0.00 N ATOM 811 CA SER B 115 -21.562 -20.684 6.041 1.00 0.00 C ATOM 812 C SER B 115 -22.389 -19.535 5.472 1.00 0.00 C ATOM 813 O SER B 115 -23.523 -19.730 5.035 1.00 0.00 O ATOM 814 CB SER B 115 -21.222 -20.407 7.506 1.00 0.00 C ATOM 815 OG SER B 115 -22.253 -20.866 8.364 1.00 0.00 O ATOM 0 H SER B 115 -19.480 -20.747 5.796 1.00 0.00 H new ATOM 0 HA SER B 115 -22.152 -21.598 5.980 1.00 0.00 H new ATOM 0 HB2 SER B 115 -20.284 -20.898 7.764 1.00 0.00 H new ATOM 0 HB3 SER B 115 -21.072 -19.337 7.652 1.00 0.00 H new ATOM 0 HG SER B 115 -22.011 -20.679 9.295 1.00 0.00 H new ATOM 821 N ILE B 116 -21.812 -18.338 5.483 1.00 0.00 N ATOM 822 CA ILE B 116 -22.495 -17.158 4.968 1.00 0.00 C ATOM 823 C ILE B 116 -23.052 -17.410 3.571 1.00 0.00 C ATOM 824 O ILE B 116 -24.223 -17.141 3.300 1.00 0.00 O ATOM 825 CB ILE B 116 -21.553 -15.939 4.920 1.00 0.00 C ATOM 826 CG1 ILE B 116 -21.136 -15.534 6.335 1.00 0.00 C ATOM 827 CG2 ILE B 116 -22.228 -14.777 4.208 1.00 0.00 C ATOM 828 CD1 ILE B 116 -19.890 -14.677 6.375 1.00 0.00 C ATOM 0 H ILE B 116 -20.874 -18.160 5.843 1.00 0.00 H new ATOM 0 HA ILE B 116 -23.317 -16.946 5.651 1.00 0.00 H new ATOM 0 HB ILE B 116 -20.657 -16.211 4.361 1.00 0.00 H new ATOM 0 HG12 ILE B 116 -21.956 -14.991 6.806 1.00 0.00 H new ATOM 0 HG13 ILE B 116 -20.968 -16.434 6.927 1.00 0.00 H new ATOM 0 HG21 ILE B 116 -21.551 -13.923 4.182 1.00 0.00 H new ATOM 0 HG22 ILE B 116 -22.480 -15.071 3.189 1.00 0.00 H new ATOM 0 HG23 ILE B 116 -23.138 -14.502 4.742 1.00 0.00 H new ATOM 0 HD11 ILE B 116 -19.653 -14.427 7.409 1.00 0.00 H new ATOM 0 HD12 ILE B 116 -19.057 -15.225 5.934 1.00 0.00 H new ATOM 0 HD13 ILE B 116 -20.061 -13.760 5.811 1.00 0.00 H new ATOM 840 N LEU B 117 -22.207 -17.930 2.688 1.00 0.00 N ATOM 841 CA LEU B 117 -22.615 -18.222 1.318 1.00 0.00 C ATOM 842 C LEU B 117 -23.749 -19.242 1.294 1.00 0.00 C ATOM 843 O LEU B 117 -24.796 -19.007 0.689 1.00 0.00 O ATOM 844 CB LEU B 117 -21.426 -18.745 0.511 1.00 0.00 C ATOM 845 CG LEU B 117 -20.967 -17.867 -0.653 1.00 0.00 C ATOM 846 CD1 LEU B 117 -19.845 -18.546 -1.423 1.00 0.00 C ATOM 847 CD2 LEU B 117 -22.135 -17.551 -1.576 1.00 0.00 C ATOM 0 H LEU B 117 -21.235 -18.158 2.896 1.00 0.00 H new ATOM 0 HA LEU B 117 -22.973 -17.297 0.866 1.00 0.00 H new ATOM 0 HB2 LEU B 117 -20.584 -18.883 1.190 1.00 0.00 H new ATOM 0 HB3 LEU B 117 -21.683 -19.729 0.118 1.00 0.00 H new ATOM 0 HG LEU B 117 -20.586 -16.929 -0.248 1.00 0.00 H new ATOM 0 HD11 LEU B 117 -19.531 -17.906 -2.248 1.00 0.00 H new ATOM 0 HD12 LEU B 117 -19.000 -18.720 -0.757 1.00 0.00 H new ATOM 0 HD13 LEU B 117 -20.199 -19.499 -1.817 1.00 0.00 H new ATOM 0 HD21 LEU B 117 -21.790 -16.925 -2.399 1.00 0.00 H new ATOM 0 HD22 LEU B 117 -22.546 -18.479 -1.974 1.00 0.00 H new ATOM 0 HD23 LEU B 117 -22.907 -17.022 -1.017 1.00 0.00 H new ATOM 859 N LEU B 118 -23.535 -20.373 1.956 1.00 0.00 N ATOM 860 CA LEU B 118 -24.540 -21.429 2.013 1.00 0.00 C ATOM 861 C LEU B 118 -25.856 -20.898 2.572 1.00 0.00 C ATOM 862 O LEU B 118 -26.935 -21.340 2.174 1.00 0.00 O ATOM 863 CB LEU B 118 -24.040 -22.591 2.872 1.00 0.00 C ATOM 864 CG LEU B 118 -23.030 -23.529 2.209 1.00 0.00 C ATOM 865 CD1 LEU B 118 -22.682 -24.681 3.138 1.00 0.00 C ATOM 866 CD2 LEU B 118 -23.577 -24.054 0.889 1.00 0.00 C ATOM 0 H LEU B 118 -22.674 -20.583 2.461 1.00 0.00 H new ATOM 0 HA LEU B 118 -24.715 -21.785 0.998 1.00 0.00 H new ATOM 0 HB2 LEU B 118 -23.587 -22.181 3.775 1.00 0.00 H new ATOM 0 HB3 LEU B 118 -24.901 -23.181 3.187 1.00 0.00 H new ATOM 0 HG LEU B 118 -22.120 -22.966 2.005 1.00 0.00 H new ATOM 0 HD11 LEU B 118 -21.962 -25.338 2.649 1.00 0.00 H new ATOM 0 HD12 LEU B 118 -22.249 -24.288 4.058 1.00 0.00 H new ATOM 0 HD13 LEU B 118 -23.585 -25.244 3.374 1.00 0.00 H new ATOM 0 HD21 LEU B 118 -22.845 -24.720 0.431 1.00 0.00 H new ATOM 0 HD22 LEU B 118 -24.502 -24.601 1.070 1.00 0.00 H new ATOM 0 HD23 LEU B 118 -23.776 -23.217 0.219 1.00 0.00 H new ATOM 878 N ILE B 119 -25.760 -19.947 3.496 1.00 0.00 N ATOM 879 CA ILE B 119 -26.943 -19.354 4.107 1.00 0.00 C ATOM 880 C ILE B 119 -27.781 -18.608 3.074 1.00 0.00 C ATOM 881 O ILE B 119 -28.939 -18.950 2.834 1.00 0.00 O ATOM 882 CB ILE B 119 -26.564 -18.384 5.242 1.00 0.00 C ATOM 883 CG1 ILE B 119 -25.998 -19.157 6.435 1.00 0.00 C ATOM 884 CG2 ILE B 119 -27.774 -17.562 5.661 1.00 0.00 C ATOM 885 CD1 ILE B 119 -24.987 -18.370 7.239 1.00 0.00 C ATOM 0 H ILE B 119 -24.875 -19.571 3.837 1.00 0.00 H new ATOM 0 HA ILE B 119 -27.529 -20.175 4.522 1.00 0.00 H new ATOM 0 HB ILE B 119 -25.795 -17.703 4.878 1.00 0.00 H new ATOM 0 HG12 ILE B 119 -26.819 -19.453 7.088 1.00 0.00 H new ATOM 0 HG13 ILE B 119 -25.530 -20.073 6.075 1.00 0.00 H new ATOM 0 HG21 ILE B 119 -27.491 -16.881 6.464 1.00 0.00 H new ATOM 0 HG22 ILE B 119 -28.136 -16.987 4.809 1.00 0.00 H new ATOM 0 HG23 ILE B 119 -28.563 -18.228 6.011 1.00 0.00 H new ATOM 0 HD11 ILE B 119 -24.628 -18.979 8.068 1.00 0.00 H new ATOM 0 HD12 ILE B 119 -24.148 -18.096 6.600 1.00 0.00 H new ATOM 0 HD13 ILE B 119 -25.456 -17.467 7.629 1.00 0.00 H new ATOM 897 N PHE B 120 -27.186 -17.588 2.463 1.00 0.00 N ATOM 898 CA PHE B 120 -27.877 -16.794 1.454 1.00 0.00 C ATOM 899 C PHE B 120 -28.260 -17.654 0.253 1.00 0.00 C ATOM 900 O PHE B 120 -29.346 -17.506 -0.307 1.00 0.00 O ATOM 901 CB PHE B 120 -26.995 -15.629 1.001 1.00 0.00 C ATOM 902 CG PHE B 120 -27.581 -14.839 -0.135 1.00 0.00 C ATOM 903 CD1 PHE B 120 -28.950 -14.644 -0.226 1.00 0.00 C ATOM 904 CD2 PHE B 120 -26.764 -14.293 -1.111 1.00 0.00 C ATOM 905 CE1 PHE B 120 -29.492 -13.919 -1.270 1.00 0.00 C ATOM 906 CE2 PHE B 120 -27.300 -13.567 -2.157 1.00 0.00 C ATOM 907 CZ PHE B 120 -28.666 -13.378 -2.236 1.00 0.00 C ATOM 0 H PHE B 120 -26.228 -17.292 2.649 1.00 0.00 H new ATOM 0 HA PHE B 120 -28.789 -16.398 1.900 1.00 0.00 H new ATOM 0 HB2 PHE B 120 -26.825 -14.963 1.847 1.00 0.00 H new ATOM 0 HB3 PHE B 120 -26.022 -16.016 0.700 1.00 0.00 H new ATOM 0 HD1 PHE B 120 -29.600 -15.063 0.527 1.00 0.00 H new ATOM 0 HD2 PHE B 120 -25.695 -14.437 -1.054 1.00 0.00 H new ATOM 0 HE1 PHE B 120 -30.561 -13.775 -1.331 1.00 0.00 H new ATOM 0 HE2 PHE B 120 -26.652 -13.148 -2.912 1.00 0.00 H new ATOM 0 HZ PHE B 120 -29.087 -12.809 -3.051 1.00 0.00 H new ATOM 917 N ILE B 121 -27.360 -18.551 -0.136 1.00 0.00 N ATOM 918 CA ILE B 121 -27.604 -19.434 -1.269 1.00 0.00 C ATOM 919 C ILE B 121 -28.772 -20.374 -0.992 1.00 0.00 C ATOM 920 O ILE B 121 -29.731 -20.434 -1.763 1.00 0.00 O ATOM 921 CB ILE B 121 -26.356 -20.271 -1.609 1.00 0.00 C ATOM 922 CG1 ILE B 121 -25.257 -19.376 -2.185 1.00 0.00 C ATOM 923 CG2 ILE B 121 -26.712 -21.379 -2.588 1.00 0.00 C ATOM 924 CD1 ILE B 121 -23.923 -20.075 -2.330 1.00 0.00 C ATOM 0 H ILE B 121 -26.456 -18.685 0.317 1.00 0.00 H new ATOM 0 HA ILE B 121 -27.847 -18.797 -2.119 1.00 0.00 H new ATOM 0 HB ILE B 121 -25.983 -20.729 -0.693 1.00 0.00 H new ATOM 0 HG12 ILE B 121 -25.573 -19.008 -3.161 1.00 0.00 H new ATOM 0 HG13 ILE B 121 -25.134 -18.505 -1.541 1.00 0.00 H new ATOM 0 HG21 ILE B 121 -25.820 -21.961 -2.818 1.00 0.00 H new ATOM 0 HG22 ILE B 121 -27.465 -22.029 -2.143 1.00 0.00 H new ATOM 0 HG23 ILE B 121 -27.106 -20.941 -3.505 1.00 0.00 H new ATOM 0 HD11 ILE B 121 -23.192 -19.381 -2.744 1.00 0.00 H new ATOM 0 HD12 ILE B 121 -23.584 -20.419 -1.353 1.00 0.00 H new ATOM 0 HD13 ILE B 121 -24.031 -20.930 -2.998 1.00 0.00 H new ATOM 936 N PHE B 122 -28.687 -21.105 0.114 1.00 0.00 N ATOM 937 CA PHE B 122 -29.738 -22.042 0.494 1.00 0.00 C ATOM 938 C PHE B 122 -31.046 -21.308 0.775 1.00 0.00 C ATOM 939 O PHE B 122 -32.092 -21.650 0.223 1.00 0.00 O ATOM 940 CB PHE B 122 -29.315 -22.843 1.727 1.00 0.00 C ATOM 941 CG PHE B 122 -30.033 -24.155 1.865 1.00 0.00 C ATOM 942 CD1 PHE B 122 -29.808 -25.182 0.962 1.00 0.00 C ATOM 943 CD2 PHE B 122 -30.933 -24.362 2.898 1.00 0.00 C ATOM 944 CE1 PHE B 122 -30.468 -26.390 1.086 1.00 0.00 C ATOM 945 CE2 PHE B 122 -31.596 -25.568 3.027 1.00 0.00 C ATOM 946 CZ PHE B 122 -31.362 -26.584 2.121 1.00 0.00 C ATOM 0 H PHE B 122 -27.901 -21.067 0.763 1.00 0.00 H new ATOM 0 HA PHE B 122 -29.898 -22.727 -0.339 1.00 0.00 H new ATOM 0 HB2 PHE B 122 -28.242 -23.028 1.679 1.00 0.00 H new ATOM 0 HB3 PHE B 122 -29.496 -22.244 2.619 1.00 0.00 H new ATOM 0 HD1 PHE B 122 -29.109 -25.037 0.152 1.00 0.00 H new ATOM 0 HD2 PHE B 122 -31.119 -23.572 3.611 1.00 0.00 H new ATOM 0 HE1 PHE B 122 -30.285 -27.181 0.374 1.00 0.00 H new ATOM 0 HE2 PHE B 122 -32.296 -25.716 3.836 1.00 0.00 H new ATOM 0 HZ PHE B 122 -31.877 -27.528 2.222 1.00 0.00 H new ATOM 956 N ILE B 123 -30.977 -20.299 1.637 1.00 0.00 N ATOM 957 CA ILE B 123 -32.155 -19.516 1.990 1.00 0.00 C ATOM 958 C ILE B 123 -32.952 -19.130 0.749 1.00 0.00 C ATOM 959 O ILE B 123 -34.176 -19.262 0.717 1.00 0.00 O ATOM 960 CB ILE B 123 -31.771 -18.238 2.759 1.00 0.00 C ATOM 961 CG1 ILE B 123 -31.447 -18.571 4.217 1.00 0.00 C ATOM 962 CG2 ILE B 123 -32.895 -17.215 2.680 1.00 0.00 C ATOM 963 CD1 ILE B 123 -30.890 -17.399 4.994 1.00 0.00 C ATOM 0 H ILE B 123 -30.119 -20.005 2.103 1.00 0.00 H new ATOM 0 HA ILE B 123 -32.771 -20.145 2.632 1.00 0.00 H new ATOM 0 HB ILE B 123 -30.881 -17.808 2.299 1.00 0.00 H new ATOM 0 HG12 ILE B 123 -32.352 -18.926 4.710 1.00 0.00 H new ATOM 0 HG13 ILE B 123 -30.727 -19.389 4.243 1.00 0.00 H new ATOM 0 HG21 ILE B 123 -32.609 -16.317 3.228 1.00 0.00 H new ATOM 0 HG22 ILE B 123 -33.082 -16.959 1.637 1.00 0.00 H new ATOM 0 HG23 ILE B 123 -33.800 -17.635 3.118 1.00 0.00 H new ATOM 0 HD11 ILE B 123 -30.683 -17.707 6.019 1.00 0.00 H new ATOM 0 HD12 ILE B 123 -29.967 -17.057 4.525 1.00 0.00 H new ATOM 0 HD13 ILE B 123 -31.617 -16.587 4.999 1.00 0.00 H new ATOM 975 N VAL B 124 -32.249 -18.654 -0.274 1.00 0.00 N ATOM 976 CA VAL B 124 -32.890 -18.251 -1.520 1.00 0.00 C ATOM 977 C VAL B 124 -33.591 -19.431 -2.184 1.00 0.00 C ATOM 978 O VAL B 124 -34.771 -19.353 -2.528 1.00 0.00 O ATOM 979 CB VAL B 124 -31.871 -17.651 -2.507 1.00 0.00 C ATOM 980 CG1 VAL B 124 -32.493 -17.492 -3.886 1.00 0.00 C ATOM 981 CG2 VAL B 124 -31.352 -16.317 -1.991 1.00 0.00 C ATOM 0 H VAL B 124 -31.236 -18.538 -0.264 1.00 0.00 H new ATOM 0 HA VAL B 124 -33.628 -17.491 -1.265 1.00 0.00 H new ATOM 0 HB VAL B 124 -31.027 -18.336 -2.592 1.00 0.00 H new ATOM 0 HG11 VAL B 124 -31.758 -17.067 -4.570 1.00 0.00 H new ATOM 0 HG12 VAL B 124 -32.812 -18.467 -4.256 1.00 0.00 H new ATOM 0 HG13 VAL B 124 -33.355 -16.829 -3.822 1.00 0.00 H new ATOM 0 HG21 VAL B 124 -30.633 -15.907 -2.701 1.00 0.00 H new ATOM 0 HG22 VAL B 124 -32.184 -15.623 -1.876 1.00 0.00 H new ATOM 0 HG23 VAL B 124 -30.866 -16.464 -1.026 1.00 0.00 H new ATOM 991 N LEU B 125 -32.856 -20.523 -2.362 1.00 0.00 N ATOM 992 CA LEU B 125 -33.407 -21.722 -2.985 1.00 0.00 C ATOM 993 C LEU B 125 -34.591 -22.257 -2.186 1.00 0.00 C ATOM 994 O LEU B 125 -35.563 -22.755 -2.754 1.00 0.00 O ATOM 995 CB LEU B 125 -32.328 -22.800 -3.104 1.00 0.00 C ATOM 996 CG LEU B 125 -31.273 -22.577 -4.187 1.00 0.00 C ATOM 997 CD1 LEU B 125 -30.420 -23.824 -4.367 1.00 0.00 C ATOM 998 CD2 LEU B 125 -31.932 -22.186 -5.502 1.00 0.00 C ATOM 0 H LEU B 125 -31.878 -20.603 -2.084 1.00 0.00 H new ATOM 0 HA LEU B 125 -33.757 -21.455 -3.982 1.00 0.00 H new ATOM 0 HB2 LEU B 125 -31.821 -22.886 -2.143 1.00 0.00 H new ATOM 0 HB3 LEU B 125 -32.817 -23.756 -3.293 1.00 0.00 H new ATOM 0 HG LEU B 125 -30.624 -21.760 -3.871 1.00 0.00 H new ATOM 0 HD11 LEU B 125 -29.675 -23.646 -5.142 1.00 0.00 H new ATOM 0 HD12 LEU B 125 -29.918 -24.060 -3.429 1.00 0.00 H new ATOM 0 HD13 LEU B 125 -31.055 -24.660 -4.659 1.00 0.00 H new ATOM 0 HD21 LEU B 125 -31.165 -22.031 -6.261 1.00 0.00 H new ATOM 0 HD22 LEU B 125 -32.605 -22.981 -5.822 1.00 0.00 H new ATOM 0 HD23 LEU B 125 -32.498 -21.265 -5.365 1.00 0.00 H new ATOM 1010 N LEU B 126 -34.503 -22.148 -0.865 1.00 0.00 N ATOM 1011 CA LEU B 126 -35.568 -22.618 0.014 1.00 0.00 C ATOM 1012 C LEU B 126 -36.878 -21.894 -0.282 1.00 0.00 C ATOM 1013 O LEU B 126 -37.929 -22.522 -0.417 1.00 0.00 O ATOM 1014 CB LEU B 126 -35.178 -22.411 1.478 1.00 0.00 C ATOM 1015 CG LEU B 126 -36.315 -22.503 2.496 1.00 0.00 C ATOM 1016 CD1 LEU B 126 -36.852 -23.923 2.570 1.00 0.00 C ATOM 1017 CD2 LEU B 126 -35.843 -22.037 3.866 1.00 0.00 C ATOM 0 H LEU B 126 -33.705 -21.738 -0.379 1.00 0.00 H new ATOM 0 HA LEU B 126 -35.713 -23.683 -0.170 1.00 0.00 H new ATOM 0 HB2 LEU B 126 -34.422 -23.152 1.740 1.00 0.00 H new ATOM 0 HB3 LEU B 126 -34.710 -21.431 1.573 1.00 0.00 H new ATOM 0 HG LEU B 126 -37.123 -21.848 2.170 1.00 0.00 H new ATOM 0 HD11 LEU B 126 -37.660 -23.969 3.300 1.00 0.00 H new ATOM 0 HD12 LEU B 126 -37.229 -24.221 1.592 1.00 0.00 H new ATOM 0 HD13 LEU B 126 -36.052 -24.599 2.872 1.00 0.00 H new ATOM 0 HD21 LEU B 126 -36.665 -22.109 4.578 1.00 0.00 H new ATOM 0 HD22 LEU B 126 -35.018 -22.666 4.200 1.00 0.00 H new ATOM 0 HD23 LEU B 126 -35.508 -21.002 3.803 1.00 0.00 H new ATOM 1029 N ILE B 127 -36.807 -20.571 -0.384 1.00 0.00 N ATOM 1030 CA ILE B 127 -37.986 -19.763 -0.667 1.00 0.00 C ATOM 1031 C ILE B 127 -38.487 -20.000 -2.088 1.00 0.00 C ATOM 1032 O ILE B 127 -39.671 -20.257 -2.305 1.00 0.00 O ATOM 1033 CB ILE B 127 -37.697 -18.261 -0.481 1.00 0.00 C ATOM 1034 CG1 ILE B 127 -38.000 -17.837 0.958 1.00 0.00 C ATOM 1035 CG2 ILE B 127 -38.515 -17.439 -1.465 1.00 0.00 C ATOM 1036 CD1 ILE B 127 -36.780 -17.361 1.716 1.00 0.00 C ATOM 0 H ILE B 127 -35.945 -20.036 -0.275 1.00 0.00 H new ATOM 0 HA ILE B 127 -38.755 -20.068 0.043 1.00 0.00 H new ATOM 0 HB ILE B 127 -36.640 -18.081 -0.678 1.00 0.00 H new ATOM 0 HG12 ILE B 127 -38.744 -17.040 0.945 1.00 0.00 H new ATOM 0 HG13 ILE B 127 -38.444 -18.678 1.491 1.00 0.00 H new ATOM 0 HG21 ILE B 127 -38.300 -16.380 -1.321 1.00 0.00 H new ATOM 0 HG22 ILE B 127 -38.256 -17.727 -2.484 1.00 0.00 H new ATOM 0 HG23 ILE B 127 -39.577 -17.620 -1.296 1.00 0.00 H new ATOM 0 HD11 ILE B 127 -37.068 -17.077 2.728 1.00 0.00 H new ATOM 0 HD12 ILE B 127 -36.043 -18.163 1.761 1.00 0.00 H new ATOM 0 HD13 ILE B 127 -36.348 -16.500 1.206 1.00 0.00 H new ATOM 1048 N HIS B 128 -37.576 -19.914 -3.052 1.00 0.00 N ATOM 1049 CA HIS B 128 -37.925 -20.122 -4.453 1.00 0.00 C ATOM 1050 C HIS B 128 -38.693 -21.428 -4.634 1.00 0.00 C ATOM 1051 O HIS B 128 -39.556 -21.537 -5.506 1.00 0.00 O ATOM 1052 CB HIS B 128 -36.664 -20.135 -5.318 1.00 0.00 C ATOM 1053 CG HIS B 128 -36.935 -20.394 -6.768 1.00 0.00 C ATOM 1054 ND1 HIS B 128 -37.091 -21.662 -7.289 1.00 0.00 N ATOM 1055 CD2 HIS B 128 -37.079 -19.541 -7.809 1.00 0.00 C ATOM 1056 CE1 HIS B 128 -37.317 -21.576 -8.588 1.00 0.00 C ATOM 1057 NE2 HIS B 128 -37.315 -20.300 -8.928 1.00 0.00 N ATOM 0 H HIS B 128 -36.592 -19.702 -2.889 1.00 0.00 H new ATOM 0 HA HIS B 128 -38.565 -19.298 -4.768 1.00 0.00 H new ATOM 0 HB2 HIS B 128 -36.155 -19.177 -5.218 1.00 0.00 H new ATOM 0 HB3 HIS B 128 -35.983 -20.899 -4.942 1.00 0.00 H new ATOM 0 HD2 HIS B 128 -37.019 -18.463 -7.767 1.00 0.00 H new ATOM 0 HE1 HIS B 128 -37.476 -22.408 -9.258 1.00 0.00 H new ATOM 0 HE2 HIS B 128 -37.465 -19.937 -9.870 1.00 0.00 H new ATOM 1065 N PHE B 129 -38.373 -22.416 -3.805 1.00 0.00 N ATOM 1066 CA PHE B 129 -39.032 -23.715 -3.875 1.00 0.00 C ATOM 1067 C PHE B 129 -40.153 -23.813 -2.845 1.00 0.00 C ATOM 1068 O PHE B 129 -41.061 -24.633 -2.976 1.00 0.00 O ATOM 1069 CB PHE B 129 -38.017 -24.838 -3.648 1.00 0.00 C ATOM 1070 CG PHE B 129 -37.328 -25.286 -4.905 1.00 0.00 C ATOM 1071 CD1 PHE B 129 -38.055 -25.819 -5.957 1.00 0.00 C ATOM 1072 CD2 PHE B 129 -35.953 -25.172 -5.035 1.00 0.00 C ATOM 1073 CE1 PHE B 129 -37.422 -26.233 -7.115 1.00 0.00 C ATOM 1074 CE2 PHE B 129 -35.315 -25.584 -6.190 1.00 0.00 C ATOM 1075 CZ PHE B 129 -36.051 -26.114 -7.232 1.00 0.00 C ATOM 0 H PHE B 129 -37.662 -22.342 -3.077 1.00 0.00 H new ATOM 0 HA PHE B 129 -39.466 -23.821 -4.869 1.00 0.00 H new ATOM 0 HB2 PHE B 129 -37.267 -24.500 -2.933 1.00 0.00 H new ATOM 0 HB3 PHE B 129 -38.525 -25.691 -3.198 1.00 0.00 H new ATOM 0 HD1 PHE B 129 -39.128 -25.912 -5.872 1.00 0.00 H new ATOM 0 HD2 PHE B 129 -35.373 -24.756 -4.224 1.00 0.00 H new ATOM 0 HE1 PHE B 129 -37.999 -26.649 -7.927 1.00 0.00 H new ATOM 0 HE2 PHE B 129 -34.243 -25.492 -6.278 1.00 0.00 H new ATOM 0 HZ PHE B 129 -35.555 -26.435 -8.136 1.00 0.00 H new ATOM 1085 N GLU B 130 -40.082 -22.969 -1.819 1.00 0.00 N ATOM 1086 CA GLU B 130 -41.090 -22.961 -0.766 1.00 0.00 C ATOM 1087 C GLU B 130 -42.414 -22.406 -1.284 1.00 0.00 C ATOM 1088 O GLU B 130 -43.412 -22.382 -0.566 1.00 0.00 O ATOM 1089 CB GLU B 130 -40.608 -22.131 0.426 1.00 0.00 C ATOM 1090 CG GLU B 130 -40.013 -22.966 1.548 1.00 0.00 C ATOM 1091 CD GLU B 130 -41.057 -23.783 2.283 1.00 0.00 C ATOM 1092 OE1 GLU B 130 -41.969 -23.179 2.884 1.00 0.00 O ATOM 1093 OE2 GLU B 130 -40.961 -25.028 2.258 1.00 0.00 O ATOM 0 H GLU B 130 -39.337 -22.283 -1.696 1.00 0.00 H new ATOM 0 HA GLU B 130 -41.249 -23.990 -0.443 1.00 0.00 H new ATOM 0 HB2 GLU B 130 -39.861 -21.415 0.082 1.00 0.00 H new ATOM 0 HB3 GLU B 130 -41.445 -21.554 0.819 1.00 0.00 H new ATOM 0 HG2 GLU B 130 -39.257 -23.635 1.137 1.00 0.00 H new ATOM 0 HG3 GLU B 130 -39.507 -22.309 2.255 1.00 0.00 H new ATOM 1100 N GLY B 131 -42.412 -21.960 -2.537 1.00 0.00 N ATOM 1101 CA GLY B 131 -43.617 -21.411 -3.130 1.00 0.00 C ATOM 1102 C GLY B 131 -43.396 -20.032 -3.721 1.00 0.00 C ATOM 1103 O GLY B 131 -44.144 -19.099 -3.432 1.00 0.00 O ATOM 0 H GLY B 131 -41.598 -21.969 -3.151 1.00 0.00 H new ATOM 0 HA2 GLY B 131 -43.974 -22.084 -3.910 1.00 0.00 H new ATOM 0 HA3 GLY B 131 -44.399 -21.357 -2.373 1.00 0.00 H new ATOM 1107 N TRP B 132 -42.366 -19.904 -4.549 1.00 0.00 N ATOM 1108 CA TRP B 132 -42.047 -18.629 -5.181 1.00 0.00 C ATOM 1109 C TRP B 132 -41.981 -18.774 -6.697 1.00 0.00 C ATOM 1110 O TRP B 132 -41.378 -17.948 -7.383 1.00 0.00 O ATOM 1111 CB TRP B 132 -40.718 -18.091 -4.649 1.00 0.00 C ATOM 1112 CG TRP B 132 -40.813 -16.692 -4.119 1.00 0.00 C ATOM 1113 CD1 TRP B 132 -40.182 -15.585 -4.610 1.00 0.00 C ATOM 1114 CD2 TRP B 132 -41.583 -16.252 -2.995 1.00 0.00 C ATOM 1115 NE1 TRP B 132 -40.513 -14.483 -3.859 1.00 0.00 N ATOM 1116 CE2 TRP B 132 -41.372 -14.865 -2.863 1.00 0.00 C ATOM 1117 CE3 TRP B 132 -42.432 -16.893 -2.089 1.00 0.00 C ATOM 1118 CZ2 TRP B 132 -41.978 -14.113 -1.861 1.00 0.00 C ATOM 1119 CZ3 TRP B 132 -43.033 -16.145 -1.095 1.00 0.00 C ATOM 1120 CH2 TRP B 132 -42.805 -14.766 -0.988 1.00 0.00 C ATOM 0 H TRP B 132 -41.737 -20.667 -4.799 1.00 0.00 H new ATOM 0 HA TRP B 132 -42.840 -17.923 -4.937 1.00 0.00 H new ATOM 0 HB2 TRP B 132 -40.359 -18.748 -3.857 1.00 0.00 H new ATOM 0 HB3 TRP B 132 -39.977 -18.120 -5.448 1.00 0.00 H new ATOM 0 HD1 TRP B 132 -39.520 -15.577 -5.463 1.00 0.00 H new ATOM 0 HE1 TRP B 132 -40.174 -13.534 -4.018 1.00 0.00 H new ATOM 0 HE3 TRP B 132 -42.615 -17.955 -2.164 1.00 0.00 H new ATOM 0 HZ2 TRP B 132 -41.802 -13.051 -1.775 1.00 0.00 H new ATOM 0 HZ3 TRP B 132 -43.690 -16.631 -0.388 1.00 0.00 H new ATOM 0 HH2 TRP B 132 -43.291 -14.208 -0.201 1.00 0.00 H new ATOM 1131 N ARG B 133 -42.603 -19.828 -7.214 1.00 0.00 N ATOM 1132 CA ARG B 133 -42.613 -20.081 -8.650 1.00 0.00 C ATOM 1133 C ARG B 133 -44.009 -19.873 -9.229 1.00 0.00 C ATOM 1134 O ARG B 133 -44.446 -20.620 -10.106 1.00 0.00 O ATOM 1135 CB ARG B 133 -42.135 -21.505 -8.942 1.00 0.00 C ATOM 1136 CG ARG B 133 -40.830 -21.863 -8.251 1.00 0.00 C ATOM 1137 CD ARG B 133 -40.264 -23.174 -8.774 1.00 0.00 C ATOM 1138 NE ARG B 133 -41.072 -24.320 -8.367 1.00 0.00 N ATOM 1139 CZ ARG B 133 -40.809 -25.570 -8.730 1.00 0.00 C ATOM 1140 NH1 ARG B 133 -39.764 -25.834 -9.503 1.00 0.00 N ATOM 1141 NH2 ARG B 133 -41.591 -26.560 -8.320 1.00 0.00 N ATOM 0 H ARG B 133 -43.107 -20.521 -6.660 1.00 0.00 H new ATOM 0 HA ARG B 133 -41.933 -19.373 -9.123 1.00 0.00 H new ATOM 0 HB2 ARG B 133 -42.906 -22.209 -8.630 1.00 0.00 H new ATOM 0 HB3 ARG B 133 -42.011 -21.624 -10.018 1.00 0.00 H new ATOM 0 HG2 ARG B 133 -40.104 -21.065 -8.406 1.00 0.00 H new ATOM 0 HG3 ARG B 133 -40.995 -21.940 -7.176 1.00 0.00 H new ATOM 0 HD2 ARG B 133 -40.210 -23.137 -9.862 1.00 0.00 H new ATOM 0 HD3 ARG B 133 -39.245 -23.301 -8.408 1.00 0.00 H new ATOM 0 HE ARG B 133 -41.883 -24.151 -7.771 1.00 0.00 H new ATOM 0 HH11 ARG B 133 -39.160 -25.076 -9.820 1.00 0.00 H new ATOM 0 HH12 ARG B 133 -39.565 -26.795 -9.780 1.00 0.00 H new ATOM 0 HH21 ARG B 133 -42.395 -26.362 -7.725 1.00 0.00 H new ATOM 0 HH22 ARG B 133 -41.388 -27.520 -8.600 1.00 0.00 H new ATOM 1155 N ILE B 134 -44.705 -18.856 -8.733 1.00 0.00 N ATOM 1156 CA ILE B 134 -46.051 -18.550 -9.201 1.00 0.00 C ATOM 1157 C ILE B 134 -46.044 -18.156 -10.674 1.00 0.00 C ATOM 1158 O ILE B 134 -46.745 -18.781 -11.468 1.00 0.00 O ATOM 1159 CB ILE B 134 -46.687 -17.413 -8.380 1.00 0.00 C ATOM 1160 CG1 ILE B 134 -46.689 -17.768 -6.892 1.00 0.00 C ATOM 1161 CG2 ILE B 134 -48.102 -17.137 -8.866 1.00 0.00 C ATOM 1162 CD1 ILE B 134 -47.151 -16.636 -6.001 1.00 0.00 C ATOM 0 H ILE B 134 -44.359 -18.229 -8.006 1.00 0.00 H new ATOM 0 HA ILE B 134 -46.644 -19.456 -9.072 1.00 0.00 H new ATOM 0 HB ILE B 134 -46.093 -16.509 -8.518 1.00 0.00 H new ATOM 0 HG12 ILE B 134 -47.335 -18.631 -6.734 1.00 0.00 H new ATOM 0 HG13 ILE B 134 -45.683 -18.065 -6.596 1.00 0.00 H new ATOM 0 HG21 ILE B 134 -48.539 -16.331 -8.276 1.00 0.00 H new ATOM 0 HG22 ILE B 134 -48.076 -16.845 -9.916 1.00 0.00 H new ATOM 0 HG23 ILE B 134 -48.707 -18.037 -8.755 1.00 0.00 H new ATOM 0 HD11 ILE B 134 -47.127 -16.959 -4.960 1.00 0.00 H new ATOM 0 HD12 ILE B 134 -46.491 -15.779 -6.130 1.00 0.00 H new ATOM 0 HD13 ILE B 134 -48.169 -16.354 -6.270 1.00 0.00 H new ATOM 1383 N THR C 214 -19.206 -7.823 5.572 1.00 0.00 N ATOM 1384 CA THR C 214 -20.543 -7.243 5.576 1.00 0.00 C ATOM 1385 C THR C 214 -20.848 -6.556 4.250 1.00 0.00 C ATOM 1386 O THR C 214 -21.970 -6.625 3.748 1.00 0.00 O ATOM 1387 CB THR C 214 -20.710 -6.224 6.719 1.00 0.00 C ATOM 1388 OG1 THR C 214 -20.478 -6.861 7.981 1.00 0.00 O ATOM 1389 CG2 THR C 214 -22.103 -5.614 6.701 1.00 0.00 C ATOM 0 HA THR C 214 -21.243 -8.065 5.726 1.00 0.00 H new ATOM 0 HB THR C 214 -19.980 -5.427 6.575 1.00 0.00 H new ATOM 0 HG1 THR C 214 -19.779 -7.540 7.881 1.00 0.00 H new ATOM 0 HG21 THR C 214 -22.197 -4.898 7.517 1.00 0.00 H new ATOM 0 HG22 THR C 214 -22.265 -5.105 5.751 1.00 0.00 H new ATOM 0 HG23 THR C 214 -22.847 -6.402 6.822 1.00 0.00 H new ATOM 1397 N SER C 215 -19.843 -5.894 3.686 1.00 0.00 N ATOM 1398 CA SER C 215 -20.005 -5.191 2.419 1.00 0.00 C ATOM 1399 C SER C 215 -20.301 -6.172 1.288 1.00 0.00 C ATOM 1400 O SER C 215 -21.374 -6.134 0.684 1.00 0.00 O ATOM 1401 CB SER C 215 -18.747 -4.385 2.093 1.00 0.00 C ATOM 1402 OG SER C 215 -19.062 -3.235 1.328 1.00 0.00 O ATOM 0 H SER C 215 -18.907 -5.830 4.087 1.00 0.00 H new ATOM 0 HA SER C 215 -20.849 -4.509 2.516 1.00 0.00 H new ATOM 0 HB2 SER C 215 -18.253 -4.086 3.018 1.00 0.00 H new ATOM 0 HB3 SER C 215 -18.043 -5.010 1.543 1.00 0.00 H new ATOM 0 HG SER C 215 -18.241 -2.736 1.134 1.00 0.00 H new ATOM 1408 N ILE C 216 -19.343 -7.049 1.008 1.00 0.00 N ATOM 1409 CA ILE C 216 -19.500 -8.040 -0.049 1.00 0.00 C ATOM 1410 C ILE C 216 -20.789 -8.835 0.131 1.00 0.00 C ATOM 1411 O ILE C 216 -21.428 -9.232 -0.844 1.00 0.00 O ATOM 1412 CB ILE C 216 -18.309 -9.016 -0.087 1.00 0.00 C ATOM 1413 CG1 ILE C 216 -17.006 -8.255 -0.339 1.00 0.00 C ATOM 1414 CG2 ILE C 216 -18.526 -10.074 -1.158 1.00 0.00 C ATOM 1415 CD1 ILE C 216 -15.771 -9.011 0.098 1.00 0.00 C ATOM 0 H ILE C 216 -18.450 -7.093 1.499 1.00 0.00 H new ATOM 0 HA ILE C 216 -19.541 -7.493 -0.991 1.00 0.00 H new ATOM 0 HB ILE C 216 -18.236 -9.515 0.879 1.00 0.00 H new ATOM 0 HG12 ILE C 216 -16.927 -8.029 -1.402 1.00 0.00 H new ATOM 0 HG13 ILE C 216 -17.044 -7.301 0.188 1.00 0.00 H new ATOM 0 HG21 ILE C 216 -17.676 -10.756 -1.173 1.00 0.00 H new ATOM 0 HG22 ILE C 216 -19.436 -10.632 -0.939 1.00 0.00 H new ATOM 0 HG23 ILE C 216 -18.622 -9.592 -2.131 1.00 0.00 H new ATOM 0 HD11 ILE C 216 -14.885 -8.412 -0.111 1.00 0.00 H new ATOM 0 HD12 ILE C 216 -15.828 -9.214 1.167 1.00 0.00 H new ATOM 0 HD13 ILE C 216 -15.709 -9.953 -0.447 1.00 0.00 H new ATOM 1427 N LEU C 217 -21.167 -9.064 1.384 1.00 0.00 N ATOM 1428 CA LEU C 217 -22.381 -9.811 1.693 1.00 0.00 C ATOM 1429 C LEU C 217 -23.623 -9.024 1.284 1.00 0.00 C ATOM 1430 O LEU C 217 -24.416 -9.479 0.460 1.00 0.00 O ATOM 1431 CB LEU C 217 -22.438 -10.135 3.187 1.00 0.00 C ATOM 1432 CG LEU C 217 -22.560 -11.616 3.548 1.00 0.00 C ATOM 1433 CD1 LEU C 217 -22.786 -11.784 5.042 1.00 0.00 C ATOM 1434 CD2 LEU C 217 -23.687 -12.266 2.759 1.00 0.00 C ATOM 0 H LEU C 217 -20.650 -8.743 2.203 1.00 0.00 H new ATOM 0 HA LEU C 217 -22.360 -10.742 1.126 1.00 0.00 H new ATOM 0 HB2 LEU C 217 -21.539 -9.739 3.659 1.00 0.00 H new ATOM 0 HB3 LEU C 217 -23.285 -9.605 3.621 1.00 0.00 H new ATOM 0 HG LEU C 217 -21.626 -12.113 3.285 1.00 0.00 H new ATOM 0 HD11 LEU C 217 -22.870 -12.844 5.280 1.00 0.00 H new ATOM 0 HD12 LEU C 217 -21.945 -11.355 5.588 1.00 0.00 H new ATOM 0 HD13 LEU C 217 -23.704 -11.273 5.331 1.00 0.00 H new ATOM 0 HD21 LEU C 217 -23.759 -13.320 3.029 1.00 0.00 H new ATOM 0 HD22 LEU C 217 -24.628 -11.767 2.990 1.00 0.00 H new ATOM 0 HD23 LEU C 217 -23.482 -12.178 1.692 1.00 0.00 H new ATOM 1446 N LEU C 218 -23.784 -7.840 1.865 1.00 0.00 N ATOM 1447 CA LEU C 218 -24.928 -6.988 1.560 1.00 0.00 C ATOM 1448 C LEU C 218 -25.015 -6.709 0.063 1.00 0.00 C ATOM 1449 O LEU C 218 -26.107 -6.563 -0.488 1.00 0.00 O ATOM 1450 CB LEU C 218 -24.827 -5.670 2.331 1.00 0.00 C ATOM 1451 CG LEU C 218 -25.009 -5.763 3.846 1.00 0.00 C ATOM 1452 CD1 LEU C 218 -25.079 -4.374 4.461 1.00 0.00 C ATOM 1453 CD2 LEU C 218 -26.260 -6.562 4.185 1.00 0.00 C ATOM 0 H LEU C 218 -23.137 -7.448 2.550 1.00 0.00 H new ATOM 0 HA LEU C 218 -25.833 -7.513 1.866 1.00 0.00 H new ATOM 0 HB2 LEU C 218 -23.851 -5.228 2.129 1.00 0.00 H new ATOM 0 HB3 LEU C 218 -25.576 -4.983 1.937 1.00 0.00 H new ATOM 0 HG LEU C 218 -24.146 -6.281 4.265 1.00 0.00 H new ATOM 0 HD11 LEU C 218 -25.209 -4.460 5.540 1.00 0.00 H new ATOM 0 HD12 LEU C 218 -24.156 -3.835 4.248 1.00 0.00 H new ATOM 0 HD13 LEU C 218 -25.923 -3.830 4.036 1.00 0.00 H new ATOM 0 HD21 LEU C 218 -26.374 -6.618 5.268 1.00 0.00 H new ATOM 0 HD22 LEU C 218 -27.133 -6.072 3.753 1.00 0.00 H new ATOM 0 HD23 LEU C 218 -26.170 -7.569 3.777 1.00 0.00 H new ATOM 1465 N ILE C 219 -23.860 -6.639 -0.589 1.00 0.00 N ATOM 1466 CA ILE C 219 -23.807 -6.382 -2.023 1.00 0.00 C ATOM 1467 C ILE C 219 -24.471 -7.507 -2.808 1.00 0.00 C ATOM 1468 O ILE C 219 -25.432 -7.282 -3.545 1.00 0.00 O ATOM 1469 CB ILE C 219 -22.356 -6.217 -2.512 1.00 0.00 C ATOM 1470 CG1 ILE C 219 -21.745 -4.936 -1.940 1.00 0.00 C ATOM 1471 CG2 ILE C 219 -22.308 -6.201 -4.032 1.00 0.00 C ATOM 1472 CD1 ILE C 219 -20.237 -4.985 -1.825 1.00 0.00 C ATOM 0 H ILE C 219 -22.948 -6.757 -0.147 1.00 0.00 H new ATOM 0 HA ILE C 219 -24.348 -5.452 -2.197 1.00 0.00 H new ATOM 0 HB ILE C 219 -21.770 -7.066 -2.159 1.00 0.00 H new ATOM 0 HG12 ILE C 219 -22.026 -4.095 -2.574 1.00 0.00 H new ATOM 0 HG13 ILE C 219 -22.171 -4.749 -0.954 1.00 0.00 H new ATOM 0 HG21 ILE C 219 -21.276 -6.084 -4.362 1.00 0.00 H new ATOM 0 HG22 ILE C 219 -22.708 -7.138 -4.419 1.00 0.00 H new ATOM 0 HG23 ILE C 219 -22.905 -5.370 -4.406 1.00 0.00 H new ATOM 0 HD11 ILE C 219 -19.873 -4.044 -1.412 1.00 0.00 H new ATOM 0 HD12 ILE C 219 -19.949 -5.805 -1.168 1.00 0.00 H new ATOM 0 HD13 ILE C 219 -19.802 -5.141 -2.812 1.00 0.00 H new ATOM 1484 N PHE C 220 -23.954 -8.721 -2.646 1.00 0.00 N ATOM 1485 CA PHE C 220 -24.497 -9.883 -3.339 1.00 0.00 C ATOM 1486 C PHE C 220 -25.946 -10.132 -2.930 1.00 0.00 C ATOM 1487 O PHE C 220 -26.791 -10.456 -3.764 1.00 0.00 O ATOM 1488 CB PHE C 220 -23.651 -11.122 -3.042 1.00 0.00 C ATOM 1489 CG PHE C 220 -24.234 -12.392 -3.592 1.00 0.00 C ATOM 1490 CD1 PHE C 220 -24.914 -12.392 -4.800 1.00 0.00 C ATOM 1491 CD2 PHE C 220 -24.101 -13.587 -2.903 1.00 0.00 C ATOM 1492 CE1 PHE C 220 -25.452 -13.559 -5.308 1.00 0.00 C ATOM 1493 CE2 PHE C 220 -24.637 -14.757 -3.407 1.00 0.00 C ATOM 1494 CZ PHE C 220 -25.312 -14.743 -4.611 1.00 0.00 C ATOM 0 H PHE C 220 -23.159 -8.925 -2.040 1.00 0.00 H new ATOM 0 HA PHE C 220 -24.470 -9.682 -4.410 1.00 0.00 H new ATOM 0 HB2 PHE C 220 -22.654 -10.979 -3.458 1.00 0.00 H new ATOM 0 HB3 PHE C 220 -23.535 -11.223 -1.963 1.00 0.00 H new ATOM 0 HD1 PHE C 220 -25.025 -11.469 -5.350 1.00 0.00 H new ATOM 0 HD2 PHE C 220 -23.572 -13.604 -1.961 1.00 0.00 H new ATOM 0 HE1 PHE C 220 -25.981 -13.545 -6.249 1.00 0.00 H new ATOM 0 HE2 PHE C 220 -24.528 -15.681 -2.859 1.00 0.00 H new ATOM 0 HZ PHE C 220 -25.730 -15.657 -5.007 1.00 0.00 H new ATOM 1504 N ILE C 221 -26.224 -9.979 -1.639 1.00 0.00 N ATOM 1505 CA ILE C 221 -27.570 -10.187 -1.119 1.00 0.00 C ATOM 1506 C ILE C 221 -28.543 -9.159 -1.685 1.00 0.00 C ATOM 1507 O ILE C 221 -29.565 -9.514 -2.273 1.00 0.00 O ATOM 1508 CB ILE C 221 -27.597 -10.111 0.419 1.00 0.00 C ATOM 1509 CG1 ILE C 221 -26.845 -11.298 1.024 1.00 0.00 C ATOM 1510 CG2 ILE C 221 -29.032 -10.074 0.923 1.00 0.00 C ATOM 1511 CD1 ILE C 221 -26.693 -11.215 2.527 1.00 0.00 C ATOM 0 H ILE C 221 -25.536 -9.712 -0.935 1.00 0.00 H new ATOM 0 HA ILE C 221 -27.878 -11.185 -1.431 1.00 0.00 H new ATOM 0 HB ILE C 221 -27.099 -9.193 0.731 1.00 0.00 H new ATOM 0 HG12 ILE C 221 -27.371 -12.218 0.770 1.00 0.00 H new ATOM 0 HG13 ILE C 221 -25.856 -11.361 0.570 1.00 0.00 H new ATOM 0 HG21 ILE C 221 -29.034 -10.020 2.012 1.00 0.00 H new ATOM 0 HG22 ILE C 221 -29.538 -9.199 0.516 1.00 0.00 H new ATOM 0 HG23 ILE C 221 -29.553 -10.976 0.603 1.00 0.00 H new ATOM 0 HD11 ILE C 221 -26.151 -12.089 2.887 1.00 0.00 H new ATOM 0 HD12 ILE C 221 -26.140 -10.312 2.788 1.00 0.00 H new ATOM 0 HD13 ILE C 221 -27.679 -11.183 2.991 1.00 0.00 H new ATOM 1523 N PHE C 222 -28.218 -7.883 -1.505 1.00 0.00 N ATOM 1524 CA PHE C 222 -29.063 -6.802 -1.999 1.00 0.00 C ATOM 1525 C PHE C 222 -29.185 -6.857 -3.519 1.00 0.00 C ATOM 1526 O PHE C 222 -30.289 -6.850 -4.064 1.00 0.00 O ATOM 1527 CB PHE C 222 -28.497 -5.447 -1.570 1.00 0.00 C ATOM 1528 CG PHE C 222 -29.528 -4.356 -1.515 1.00 0.00 C ATOM 1529 CD1 PHE C 222 -30.539 -4.388 -0.569 1.00 0.00 C ATOM 1530 CD2 PHE C 222 -29.485 -3.299 -2.410 1.00 0.00 C ATOM 1531 CE1 PHE C 222 -31.490 -3.386 -0.517 1.00 0.00 C ATOM 1532 CE2 PHE C 222 -30.433 -2.294 -2.362 1.00 0.00 C ATOM 1533 CZ PHE C 222 -31.436 -2.337 -1.414 1.00 0.00 C ATOM 0 H PHE C 222 -27.376 -7.572 -1.021 1.00 0.00 H new ATOM 0 HA PHE C 222 -30.057 -6.926 -1.568 1.00 0.00 H new ATOM 0 HB2 PHE C 222 -28.036 -5.550 -0.588 1.00 0.00 H new ATOM 0 HB3 PHE C 222 -27.708 -5.156 -2.264 1.00 0.00 H new ATOM 0 HD1 PHE C 222 -30.585 -5.205 0.136 1.00 0.00 H new ATOM 0 HD2 PHE C 222 -28.702 -3.260 -3.153 1.00 0.00 H new ATOM 0 HE1 PHE C 222 -32.274 -3.423 0.224 1.00 0.00 H new ATOM 0 HE2 PHE C 222 -30.389 -1.476 -3.066 1.00 0.00 H new ATOM 0 HZ PHE C 222 -32.177 -1.552 -1.374 1.00 0.00 H new