USER MOD reduce.3.24.130724 H: found=0, std=0, add=597, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 594 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 166:sc= -0.0717 (180deg=-0.276) USER MOD Single : A 3 SER OG : rot 180:sc= 0.026 USER MOD Single : A 11 MET CE :methyl 164:sc= -0.242 (180deg=-0.724) USER MOD Single : A 13 ASN : amide:sc= -0.347 X(o=-0.35,f=-0.024) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=-0.11) USER MOD Single : B 101 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 103 SER OG : rot 180:sc= 0.0147 USER MOD Single : B 111 MET CE :methyl 165:sc= -0.897 (180deg=-1.34) USER MOD Single : B 113 ASN : amide:sc= -0.366 X(o=-0.37,f=-0.013) USER MOD Single : B 114 THR OG1 : rot 180:sc= 0 USER MOD Single : B 115 SER OG : rot 180:sc= 0 USER MOD Single : B 128 HIS : no HD1:sc= 0 X(o=0,f=-0.11) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.722 0.446 3.186 1.00 0.00 N ATOM 2 CA MET A 1 8.599 1.518 2.730 1.00 0.00 C ATOM 3 C MET A 1 9.941 0.961 2.265 1.00 0.00 C ATOM 4 O MET A 1 10.951 1.666 2.270 1.00 0.00 O ATOM 5 CB MET A 1 8.817 2.538 3.849 1.00 0.00 C ATOM 6 CG MET A 1 7.627 3.457 4.073 1.00 0.00 C ATOM 7 SD MET A 1 8.007 4.826 5.184 1.00 0.00 S ATOM 8 CE MET A 1 7.874 4.018 6.776 1.00 0.00 C ATOM 0 H1 MET A 1 6.922 0.852 3.711 1.00 0.00 H new ATOM 0 H2 MET A 1 7.365 -0.083 2.365 1.00 0.00 H new ATOM 0 H3 MET A 1 8.253 -0.197 3.807 1.00 0.00 H new ATOM 0 HA MET A 1 8.119 2.013 1.886 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.036 2.007 4.776 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.693 3.142 3.613 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.294 3.854 3.114 1.00 0.00 H new ATOM 0 HG3 MET A 1 6.799 2.879 4.484 1.00 0.00 H new ATOM 0 HE1 MET A 1 8.082 4.738 7.568 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.866 3.623 6.900 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.593 3.201 6.830 1.00 0.00 H new ATOM 18 N ASP A 2 9.944 -0.305 1.864 1.00 0.00 N ATOM 19 CA ASP A 2 11.162 -0.955 1.394 1.00 0.00 C ATOM 20 C ASP A 2 10.834 -2.101 0.442 1.00 0.00 C ATOM 21 O ASP A 2 10.224 -3.094 0.837 1.00 0.00 O ATOM 22 CB ASP A 2 11.975 -1.478 2.580 1.00 0.00 C ATOM 23 CG ASP A 2 12.407 -0.369 3.520 1.00 0.00 C ATOM 24 OD1 ASP A 2 13.441 0.275 3.243 1.00 0.00 O ATOM 25 OD2 ASP A 2 11.711 -0.146 4.531 1.00 0.00 O ATOM 0 H ASP A 2 9.117 -0.902 1.855 1.00 0.00 H new ATOM 0 HA ASP A 2 11.754 -0.216 0.854 1.00 0.00 H new ATOM 0 HB2 ASP A 2 11.380 -2.207 3.131 1.00 0.00 H new ATOM 0 HB3 ASP A 2 12.857 -2.001 2.210 1.00 0.00 H new ATOM 30 N SER A 3 11.243 -1.955 -0.814 1.00 0.00 N ATOM 31 CA SER A 3 10.988 -2.975 -1.825 1.00 0.00 C ATOM 32 C SER A 3 12.217 -3.855 -2.029 1.00 0.00 C ATOM 33 O SER A 3 12.502 -4.293 -3.144 1.00 0.00 O ATOM 34 CB SER A 3 10.588 -2.322 -3.149 1.00 0.00 C ATOM 35 OG SER A 3 11.354 -1.155 -3.395 1.00 0.00 O ATOM 0 H SER A 3 11.752 -1.140 -1.156 1.00 0.00 H new ATOM 0 HA SER A 3 10.168 -3.602 -1.476 1.00 0.00 H new ATOM 0 HB2 SER A 3 10.728 -3.031 -3.965 1.00 0.00 H new ATOM 0 HB3 SER A 3 9.528 -2.067 -3.127 1.00 0.00 H new ATOM 0 HG SER A 3 11.080 -0.758 -4.248 1.00 0.00 H new ATOM 41 N ALA A 4 12.941 -4.111 -0.945 1.00 0.00 N ATOM 42 CA ALA A 4 14.138 -4.940 -1.003 1.00 0.00 C ATOM 43 C ALA A 4 13.783 -6.399 -1.271 1.00 0.00 C ATOM 44 O ALA A 4 14.197 -6.991 -2.268 1.00 0.00 O ATOM 45 CB ALA A 4 14.930 -4.817 0.290 1.00 0.00 C ATOM 0 H ALA A 4 12.719 -3.756 -0.015 1.00 0.00 H new ATOM 0 HA ALA A 4 14.755 -4.585 -1.829 1.00 0.00 H new ATOM 0 HB1 ALA A 4 15.821 -5.442 0.232 1.00 0.00 H new ATOM 0 HB2 ALA A 4 15.224 -3.778 0.439 1.00 0.00 H new ATOM 0 HB3 ALA A 4 14.313 -5.143 1.127 1.00 0.00 H new ATOM 51 N PRO A 5 12.998 -6.994 -0.361 1.00 0.00 N ATOM 52 CA PRO A 5 12.570 -8.391 -0.478 1.00 0.00 C ATOM 53 C PRO A 5 11.576 -8.600 -1.615 1.00 0.00 C ATOM 54 O PRO A 5 11.449 -9.703 -2.147 1.00 0.00 O ATOM 55 CB PRO A 5 11.904 -8.672 0.872 1.00 0.00 C ATOM 56 CG PRO A 5 11.453 -7.338 1.357 1.00 0.00 C ATOM 57 CD PRO A 5 12.467 -6.349 0.852 1.00 0.00 C ATOM 0 HA PRO A 5 13.404 -9.055 -0.704 1.00 0.00 H new ATOM 0 HB2 PRO A 5 11.064 -9.358 0.764 1.00 0.00 H new ATOM 0 HB3 PRO A 5 12.603 -9.131 1.570 1.00 0.00 H new ATOM 0 HG2 PRO A 5 10.457 -7.102 0.981 1.00 0.00 H new ATOM 0 HG3 PRO A 5 11.396 -7.317 2.445 1.00 0.00 H new ATOM 0 HD2 PRO A 5 12.011 -5.385 0.628 1.00 0.00 H new ATOM 0 HD3 PRO A 5 13.251 -6.167 1.587 1.00 0.00 H new ATOM 65 N PHE A 6 10.874 -7.534 -1.984 1.00 0.00 N ATOM 66 CA PHE A 6 9.890 -7.601 -3.059 1.00 0.00 C ATOM 67 C PHE A 6 10.574 -7.598 -4.423 1.00 0.00 C ATOM 68 O PHE A 6 10.118 -8.254 -5.359 1.00 0.00 O ATOM 69 CB PHE A 6 8.916 -6.425 -2.962 1.00 0.00 C ATOM 70 CG PHE A 6 7.558 -6.723 -3.530 1.00 0.00 C ATOM 71 CD1 PHE A 6 6.570 -7.286 -2.739 1.00 0.00 C ATOM 72 CD2 PHE A 6 7.269 -6.439 -4.855 1.00 0.00 C ATOM 73 CE1 PHE A 6 5.320 -7.562 -3.259 1.00 0.00 C ATOM 74 CE2 PHE A 6 6.020 -6.712 -5.381 1.00 0.00 C ATOM 75 CZ PHE A 6 5.044 -7.273 -4.581 1.00 0.00 C ATOM 0 H PHE A 6 10.968 -6.613 -1.555 1.00 0.00 H new ATOM 0 HA PHE A 6 9.335 -8.533 -2.952 1.00 0.00 H new ATOM 0 HB2 PHE A 6 8.808 -6.138 -1.916 1.00 0.00 H new ATOM 0 HB3 PHE A 6 9.340 -5.568 -3.486 1.00 0.00 H new ATOM 0 HD1 PHE A 6 6.779 -7.512 -1.704 1.00 0.00 H new ATOM 0 HD2 PHE A 6 8.028 -5.999 -5.484 1.00 0.00 H new ATOM 0 HE1 PHE A 6 4.559 -8.003 -2.632 1.00 0.00 H new ATOM 0 HE2 PHE A 6 5.808 -6.487 -6.416 1.00 0.00 H new ATOM 0 HZ PHE A 6 4.067 -7.485 -4.988 1.00 0.00 H new ATOM 85 N GLU A 7 11.671 -6.854 -4.527 1.00 0.00 N ATOM 86 CA GLU A 7 12.417 -6.764 -5.777 1.00 0.00 C ATOM 87 C GLU A 7 12.919 -8.138 -6.210 1.00 0.00 C ATOM 88 O GLU A 7 12.807 -8.513 -7.378 1.00 0.00 O ATOM 89 CB GLU A 7 13.597 -5.802 -5.624 1.00 0.00 C ATOM 90 CG GLU A 7 13.435 -4.510 -6.407 1.00 0.00 C ATOM 91 CD GLU A 7 13.580 -4.712 -7.902 1.00 0.00 C ATOM 92 OE1 GLU A 7 13.361 -5.849 -8.371 1.00 0.00 O ATOM 93 OE2 GLU A 7 13.913 -3.734 -8.604 1.00 0.00 O ATOM 0 H GLU A 7 12.062 -6.305 -3.761 1.00 0.00 H new ATOM 0 HA GLU A 7 11.745 -6.383 -6.546 1.00 0.00 H new ATOM 0 HB2 GLU A 7 13.726 -5.563 -4.568 1.00 0.00 H new ATOM 0 HB3 GLU A 7 14.508 -6.303 -5.951 1.00 0.00 H new ATOM 0 HG2 GLU A 7 12.455 -4.082 -6.195 1.00 0.00 H new ATOM 0 HG3 GLU A 7 14.178 -3.788 -6.068 1.00 0.00 H new ATOM 100 N LEU A 8 13.474 -8.885 -5.262 1.00 0.00 N ATOM 101 CA LEU A 8 13.995 -10.218 -5.544 1.00 0.00 C ATOM 102 C LEU A 8 12.917 -11.104 -6.162 1.00 0.00 C ATOM 103 O LEU A 8 13.193 -11.903 -7.057 1.00 0.00 O ATOM 104 CB LEU A 8 14.527 -10.861 -4.263 1.00 0.00 C ATOM 105 CG LEU A 8 16.001 -10.606 -3.946 1.00 0.00 C ATOM 106 CD1 LEU A 8 16.894 -11.349 -4.926 1.00 0.00 C ATOM 107 CD2 LEU A 8 16.302 -9.115 -3.972 1.00 0.00 C ATOM 0 H LEU A 8 13.575 -8.590 -4.291 1.00 0.00 H new ATOM 0 HA LEU A 8 14.812 -10.118 -6.259 1.00 0.00 H new ATOM 0 HB2 LEU A 8 13.929 -10.503 -3.425 1.00 0.00 H new ATOM 0 HB3 LEU A 8 14.371 -11.938 -4.329 1.00 0.00 H new ATOM 0 HG LEU A 8 16.207 -10.980 -2.943 1.00 0.00 H new ATOM 0 HD11 LEU A 8 17.939 -11.155 -4.685 1.00 0.00 H new ATOM 0 HD12 LEU A 8 16.698 -12.419 -4.858 1.00 0.00 H new ATOM 0 HD13 LEU A 8 16.686 -11.006 -5.940 1.00 0.00 H new ATOM 0 HD21 LEU A 8 17.355 -8.952 -3.744 1.00 0.00 H new ATOM 0 HD22 LEU A 8 16.079 -8.716 -4.962 1.00 0.00 H new ATOM 0 HD23 LEU A 8 15.687 -8.607 -3.229 1.00 0.00 H new ATOM 119 N PHE A 9 11.688 -10.955 -5.679 1.00 0.00 N ATOM 120 CA PHE A 9 10.568 -11.741 -6.184 1.00 0.00 C ATOM 121 C PHE A 9 10.503 -11.678 -7.707 1.00 0.00 C ATOM 122 O PHE A 9 10.258 -12.685 -8.372 1.00 0.00 O ATOM 123 CB PHE A 9 9.253 -11.238 -5.585 1.00 0.00 C ATOM 124 CG PHE A 9 8.083 -12.134 -5.872 1.00 0.00 C ATOM 125 CD1 PHE A 9 7.435 -12.080 -7.096 1.00 0.00 C ATOM 126 CD2 PHE A 9 7.629 -13.030 -4.917 1.00 0.00 C ATOM 127 CE1 PHE A 9 6.357 -12.903 -7.361 1.00 0.00 C ATOM 128 CE2 PHE A 9 6.552 -13.856 -5.177 1.00 0.00 C ATOM 129 CZ PHE A 9 5.916 -13.793 -6.401 1.00 0.00 C ATOM 0 H PHE A 9 11.442 -10.298 -4.939 1.00 0.00 H new ATOM 0 HA PHE A 9 10.721 -12.778 -5.887 1.00 0.00 H new ATOM 0 HB2 PHE A 9 9.369 -11.139 -4.506 1.00 0.00 H new ATOM 0 HB3 PHE A 9 9.042 -10.242 -5.975 1.00 0.00 H new ATOM 0 HD1 PHE A 9 7.776 -11.387 -7.851 1.00 0.00 H new ATOM 0 HD2 PHE A 9 8.123 -13.083 -3.958 1.00 0.00 H new ATOM 0 HE1 PHE A 9 5.860 -12.850 -8.318 1.00 0.00 H new ATOM 0 HE2 PHE A 9 6.208 -14.550 -4.424 1.00 0.00 H new ATOM 0 HZ PHE A 9 5.075 -14.439 -6.607 1.00 0.00 H new ATOM 139 N PHE A 10 10.724 -10.487 -8.254 1.00 0.00 N ATOM 140 CA PHE A 10 10.689 -10.291 -9.699 1.00 0.00 C ATOM 141 C PHE A 10 11.973 -10.800 -10.348 1.00 0.00 C ATOM 142 O PHE A 10 11.983 -11.168 -11.522 1.00 0.00 O ATOM 143 CB PHE A 10 10.489 -8.811 -10.029 1.00 0.00 C ATOM 144 CG PHE A 10 10.663 -8.493 -11.487 1.00 0.00 C ATOM 145 CD1 PHE A 10 11.912 -8.177 -11.996 1.00 0.00 C ATOM 146 CD2 PHE A 10 9.577 -8.510 -12.348 1.00 0.00 C ATOM 147 CE1 PHE A 10 12.076 -7.884 -13.337 1.00 0.00 C ATOM 148 CE2 PHE A 10 9.735 -8.219 -13.690 1.00 0.00 C ATOM 149 CZ PHE A 10 10.985 -7.904 -14.185 1.00 0.00 C ATOM 0 H PHE A 10 10.929 -9.643 -7.719 1.00 0.00 H new ATOM 0 HA PHE A 10 9.850 -10.862 -10.098 1.00 0.00 H new ATOM 0 HB2 PHE A 10 9.489 -8.509 -9.716 1.00 0.00 H new ATOM 0 HB3 PHE A 10 11.197 -8.219 -9.449 1.00 0.00 H new ATOM 0 HD1 PHE A 10 12.768 -8.159 -11.337 1.00 0.00 H new ATOM 0 HD2 PHE A 10 8.596 -8.753 -11.966 1.00 0.00 H new ATOM 0 HE1 PHE A 10 13.055 -7.640 -13.721 1.00 0.00 H new ATOM 0 HE2 PHE A 10 8.881 -8.238 -14.351 1.00 0.00 H new ATOM 0 HZ PHE A 10 11.110 -7.674 -15.233 1.00 0.00 H new ATOM 159 N MET A 11 13.054 -10.815 -9.575 1.00 0.00 N ATOM 160 CA MET A 11 14.343 -11.279 -10.074 1.00 0.00 C ATOM 161 C MET A 11 14.367 -12.800 -10.187 1.00 0.00 C ATOM 162 O MET A 11 15.128 -13.360 -10.977 1.00 0.00 O ATOM 163 CB MET A 11 15.470 -10.806 -9.153 1.00 0.00 C ATOM 164 CG MET A 11 16.042 -9.452 -9.539 1.00 0.00 C ATOM 165 SD MET A 11 17.107 -8.758 -8.260 1.00 0.00 S ATOM 166 CE MET A 11 16.234 -7.241 -7.879 1.00 0.00 C ATOM 0 H MET A 11 13.063 -10.511 -8.601 1.00 0.00 H new ATOM 0 HA MET A 11 14.494 -10.857 -11.067 1.00 0.00 H new ATOM 0 HB2 MET A 11 15.095 -10.755 -8.131 1.00 0.00 H new ATOM 0 HB3 MET A 11 16.271 -11.546 -9.163 1.00 0.00 H new ATOM 0 HG2 MET A 11 16.610 -9.552 -10.464 1.00 0.00 H new ATOM 0 HG3 MET A 11 15.224 -8.760 -9.740 1.00 0.00 H new ATOM 0 HE1 MET A 11 16.594 -6.843 -6.930 1.00 0.00 H new ATOM 0 HE2 MET A 11 16.411 -6.511 -8.669 1.00 0.00 H new ATOM 0 HE3 MET A 11 15.166 -7.445 -7.805 1.00 0.00 H new ATOM 176 N ILE A 12 13.531 -13.461 -9.394 1.00 0.00 N ATOM 177 CA ILE A 12 13.457 -14.917 -9.407 1.00 0.00 C ATOM 178 C ILE A 12 12.608 -15.414 -10.572 1.00 0.00 C ATOM 179 O ILE A 12 13.064 -16.214 -11.388 1.00 0.00 O ATOM 180 CB ILE A 12 12.872 -15.462 -8.091 1.00 0.00 C ATOM 181 CG1 ILE A 12 13.844 -15.216 -6.935 1.00 0.00 C ATOM 182 CG2 ILE A 12 12.564 -16.946 -8.223 1.00 0.00 C ATOM 183 CD1 ILE A 12 13.218 -14.489 -5.765 1.00 0.00 C ATOM 0 H ILE A 12 12.895 -13.012 -8.735 1.00 0.00 H new ATOM 0 HA ILE A 12 14.477 -15.284 -9.522 1.00 0.00 H new ATOM 0 HB ILE A 12 11.942 -14.935 -7.878 1.00 0.00 H new ATOM 0 HG12 ILE A 12 14.236 -16.173 -6.590 1.00 0.00 H new ATOM 0 HG13 ILE A 12 14.692 -14.637 -7.301 1.00 0.00 H new ATOM 0 HG21 ILE A 12 12.151 -17.317 -7.285 1.00 0.00 H new ATOM 0 HG22 ILE A 12 11.840 -17.097 -9.023 1.00 0.00 H new ATOM 0 HG23 ILE A 12 13.480 -17.488 -8.456 1.00 0.00 H new ATOM 0 HD11 ILE A 12 13.964 -14.349 -4.983 1.00 0.00 H new ATOM 0 HD12 ILE A 12 12.851 -13.517 -6.095 1.00 0.00 H new ATOM 0 HD13 ILE A 12 12.388 -15.077 -5.374 1.00 0.00 H new ATOM 195 N ASN A 13 11.372 -14.932 -10.644 1.00 0.00 N ATOM 196 CA ASN A 13 10.458 -15.327 -11.710 1.00 0.00 C ATOM 197 C ASN A 13 11.106 -15.138 -13.078 1.00 0.00 C ATOM 198 O ASN A 13 11.081 -16.037 -13.920 1.00 0.00 O ATOM 199 CB ASN A 13 9.165 -14.513 -11.629 1.00 0.00 C ATOM 200 CG ASN A 13 8.035 -15.144 -12.420 1.00 0.00 C ATOM 201 OD1 ASN A 13 7.401 -14.489 -13.247 1.00 0.00 O ATOM 202 ND2 ASN A 13 7.779 -16.422 -12.169 1.00 0.00 N ATOM 0 H ASN A 13 10.980 -14.267 -9.977 1.00 0.00 H new ATOM 0 HA ASN A 13 10.223 -16.383 -11.581 1.00 0.00 H new ATOM 0 HB2 ASN A 13 8.865 -14.416 -10.586 1.00 0.00 H new ATOM 0 HB3 ASN A 13 9.349 -13.506 -12.003 1.00 0.00 H new ATOM 0 HD21 ASN A 13 7.031 -16.900 -12.671 1.00 0.00 H new ATOM 0 HD22 ASN A 13 8.331 -16.926 -11.475 1.00 0.00 H new ATOM 209 N THR A 14 11.688 -13.962 -13.295 1.00 0.00 N ATOM 210 CA THR A 14 12.342 -13.654 -14.560 1.00 0.00 C ATOM 211 C THR A 14 13.535 -14.573 -14.800 1.00 0.00 C ATOM 212 O THR A 14 13.968 -14.760 -15.937 1.00 0.00 O ATOM 213 CB THR A 14 12.819 -12.190 -14.605 1.00 0.00 C ATOM 214 OG1 THR A 14 13.289 -11.868 -15.918 1.00 0.00 O ATOM 215 CG2 THR A 14 13.928 -11.952 -13.591 1.00 0.00 C ATOM 0 H THR A 14 11.719 -13.207 -12.610 1.00 0.00 H new ATOM 0 HA THR A 14 11.602 -13.811 -15.345 1.00 0.00 H new ATOM 0 HB THR A 14 11.975 -11.548 -14.355 1.00 0.00 H new ATOM 0 HG1 THR A 14 13.589 -10.935 -15.938 1.00 0.00 H new ATOM 0 HG21 THR A 14 14.249 -10.912 -13.641 1.00 0.00 H new ATOM 0 HG22 THR A 14 13.558 -12.170 -12.589 1.00 0.00 H new ATOM 0 HG23 THR A 14 14.772 -12.604 -13.816 1.00 0.00 H new ATOM 223 N SER A 15 14.062 -15.145 -13.722 1.00 0.00 N ATOM 224 CA SER A 15 15.207 -16.043 -13.816 1.00 0.00 C ATOM 225 C SER A 15 14.810 -17.365 -14.465 1.00 0.00 C ATOM 226 O SER A 15 15.293 -17.709 -15.544 1.00 0.00 O ATOM 227 CB SER A 15 15.795 -16.300 -12.427 1.00 0.00 C ATOM 228 OG SER A 15 17.192 -16.526 -12.499 1.00 0.00 O ATOM 0 H SER A 15 13.714 -15.003 -12.774 1.00 0.00 H new ATOM 0 HA SER A 15 15.962 -15.565 -14.440 1.00 0.00 H new ATOM 0 HB2 SER A 15 15.594 -15.446 -11.780 1.00 0.00 H new ATOM 0 HB3 SER A 15 15.306 -17.164 -11.976 1.00 0.00 H new ATOM 0 HG SER A 15 17.544 -16.686 -11.599 1.00 0.00 H new ATOM 234 N ILE A 16 13.926 -18.101 -13.799 1.00 0.00 N ATOM 235 CA ILE A 16 13.463 -19.385 -14.311 1.00 0.00 C ATOM 236 C ILE A 16 12.943 -19.252 -15.739 1.00 0.00 C ATOM 237 O ILE A 16 12.973 -20.210 -16.513 1.00 0.00 O ATOM 238 CB ILE A 16 12.351 -19.976 -13.425 1.00 0.00 C ATOM 239 CG1 ILE A 16 12.843 -20.125 -11.983 1.00 0.00 C ATOM 240 CG2 ILE A 16 11.891 -21.318 -13.975 1.00 0.00 C ATOM 241 CD1 ILE A 16 12.345 -19.036 -11.059 1.00 0.00 C ATOM 0 H ILE A 16 13.517 -17.830 -12.905 1.00 0.00 H new ATOM 0 HA ILE A 16 14.321 -20.057 -14.300 1.00 0.00 H new ATOM 0 HB ILE A 16 11.501 -19.293 -13.431 1.00 0.00 H new ATOM 0 HG12 ILE A 16 12.523 -21.093 -11.597 1.00 0.00 H new ATOM 0 HG13 ILE A 16 13.933 -20.124 -11.978 1.00 0.00 H new ATOM 0 HG21 ILE A 16 11.105 -21.722 -13.337 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.505 -21.184 -14.986 1.00 0.00 H new ATOM 0 HG23 ILE A 16 12.733 -22.010 -13.996 1.00 0.00 H new ATOM 0 HD11 ILE A 16 12.733 -19.206 -10.055 1.00 0.00 H new ATOM 0 HD12 ILE A 16 12.687 -18.067 -11.421 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.255 -19.050 -11.034 1.00 0.00 H new ATOM 253 N LEU A 17 12.469 -18.060 -16.081 1.00 0.00 N ATOM 254 CA LEU A 17 11.943 -17.800 -17.417 1.00 0.00 C ATOM 255 C LEU A 17 13.071 -17.478 -18.392 1.00 0.00 C ATOM 256 O LEU A 17 13.252 -18.166 -19.398 1.00 0.00 O ATOM 257 CB LEU A 17 10.943 -16.644 -17.377 1.00 0.00 C ATOM 258 CG LEU A 17 9.515 -16.977 -17.811 1.00 0.00 C ATOM 259 CD1 LEU A 17 8.578 -15.821 -17.497 1.00 0.00 C ATOM 260 CD2 LEU A 17 9.473 -17.312 -19.295 1.00 0.00 C ATOM 0 H LEU A 17 12.438 -17.258 -15.452 1.00 0.00 H new ATOM 0 HA LEU A 17 11.434 -18.700 -17.762 1.00 0.00 H new ATOM 0 HB2 LEU A 17 10.911 -16.253 -16.360 1.00 0.00 H new ATOM 0 HB3 LEU A 17 11.318 -15.843 -18.015 1.00 0.00 H new ATOM 0 HG LEU A 17 9.180 -17.851 -17.252 1.00 0.00 H new ATOM 0 HD11 LEU A 17 7.567 -16.076 -17.813 1.00 0.00 H new ATOM 0 HD12 LEU A 17 8.585 -15.628 -16.424 1.00 0.00 H new ATOM 0 HD13 LEU A 17 8.910 -14.929 -18.028 1.00 0.00 H new ATOM 0 HD21 LEU A 17 8.449 -17.546 -19.586 1.00 0.00 H new ATOM 0 HD22 LEU A 17 9.828 -16.457 -19.871 1.00 0.00 H new ATOM 0 HD23 LEU A 17 10.112 -18.173 -19.492 1.00 0.00 H new ATOM 272 N LEU A 18 13.828 -16.430 -18.088 1.00 0.00 N ATOM 273 CA LEU A 18 14.941 -16.017 -18.936 1.00 0.00 C ATOM 274 C LEU A 18 15.832 -17.206 -19.282 1.00 0.00 C ATOM 275 O LEU A 18 16.332 -17.314 -20.403 1.00 0.00 O ATOM 276 CB LEU A 18 15.765 -14.934 -18.239 1.00 0.00 C ATOM 277 CG LEU A 18 15.222 -13.508 -18.339 1.00 0.00 C ATOM 278 CD1 LEU A 18 16.259 -12.506 -17.856 1.00 0.00 C ATOM 279 CD2 LEU A 18 14.802 -13.197 -19.768 1.00 0.00 C ATOM 0 H LEU A 18 13.692 -15.850 -17.260 1.00 0.00 H new ATOM 0 HA LEU A 18 14.530 -15.613 -19.861 1.00 0.00 H new ATOM 0 HB2 LEU A 18 15.853 -15.195 -17.184 1.00 0.00 H new ATOM 0 HB3 LEU A 18 16.772 -14.948 -18.655 1.00 0.00 H new ATOM 0 HG LEU A 18 14.344 -13.428 -17.698 1.00 0.00 H new ATOM 0 HD11 LEU A 18 15.854 -11.497 -17.935 1.00 0.00 H new ATOM 0 HD12 LEU A 18 16.511 -12.716 -16.816 1.00 0.00 H new ATOM 0 HD13 LEU A 18 17.156 -12.586 -18.470 1.00 0.00 H new ATOM 0 HD21 LEU A 18 14.418 -12.178 -19.821 1.00 0.00 H new ATOM 0 HD22 LEU A 18 15.663 -13.295 -20.430 1.00 0.00 H new ATOM 0 HD23 LEU A 18 14.024 -13.894 -20.079 1.00 0.00 H new ATOM 291 N ILE A 19 16.023 -18.097 -18.315 1.00 0.00 N ATOM 292 CA ILE A 19 16.851 -19.279 -18.519 1.00 0.00 C ATOM 293 C ILE A 19 16.297 -20.151 -19.642 1.00 0.00 C ATOM 294 O ILE A 19 16.922 -20.300 -20.692 1.00 0.00 O ATOM 295 CB ILE A 19 16.954 -20.122 -17.234 1.00 0.00 C ATOM 296 CG1 ILE A 19 17.629 -19.316 -16.123 1.00 0.00 C ATOM 297 CG2 ILE A 19 17.722 -21.408 -17.504 1.00 0.00 C ATOM 298 CD1 ILE A 19 17.207 -19.734 -14.731 1.00 0.00 C ATOM 0 H ILE A 19 15.616 -18.023 -17.383 1.00 0.00 H new ATOM 0 HA ILE A 19 17.845 -18.925 -18.793 1.00 0.00 H new ATOM 0 HB ILE A 19 15.948 -20.384 -16.907 1.00 0.00 H new ATOM 0 HG12 ILE A 19 18.710 -19.422 -16.213 1.00 0.00 H new ATOM 0 HG13 ILE A 19 17.400 -18.259 -16.261 1.00 0.00 H new ATOM 0 HG21 ILE A 19 17.786 -21.993 -16.586 1.00 0.00 H new ATOM 0 HG22 ILE A 19 17.204 -21.988 -18.268 1.00 0.00 H new ATOM 0 HG23 ILE A 19 18.726 -21.166 -17.851 1.00 0.00 H new ATOM 0 HD11 ILE A 19 17.725 -19.120 -13.994 1.00 0.00 H new ATOM 0 HD12 ILE A 19 16.131 -19.601 -14.622 1.00 0.00 H new ATOM 0 HD13 ILE A 19 17.461 -20.782 -14.573 1.00 0.00 H new ATOM 310 N PHE A 20 15.119 -20.722 -19.414 1.00 0.00 N ATOM 311 CA PHE A 20 14.480 -21.578 -20.406 1.00 0.00 C ATOM 312 C PHE A 20 14.251 -20.821 -21.711 1.00 0.00 C ATOM 313 O PHE A 20 14.232 -21.414 -22.790 1.00 0.00 O ATOM 314 CB PHE A 20 13.149 -22.109 -19.871 1.00 0.00 C ATOM 315 CG PHE A 20 12.850 -23.518 -20.298 1.00 0.00 C ATOM 316 CD1 PHE A 20 12.627 -23.820 -21.631 1.00 0.00 C ATOM 317 CD2 PHE A 20 12.792 -24.541 -19.365 1.00 0.00 C ATOM 318 CE1 PHE A 20 12.353 -25.115 -22.028 1.00 0.00 C ATOM 319 CE2 PHE A 20 12.519 -25.838 -19.755 1.00 0.00 C ATOM 320 CZ PHE A 20 12.298 -26.126 -21.088 1.00 0.00 C ATOM 0 H PHE A 20 14.588 -20.607 -18.551 1.00 0.00 H new ATOM 0 HA PHE A 20 15.144 -22.419 -20.606 1.00 0.00 H new ATOM 0 HB2 PHE A 20 13.160 -22.062 -18.782 1.00 0.00 H new ATOM 0 HB3 PHE A 20 12.344 -21.457 -20.210 1.00 0.00 H new ATOM 0 HD1 PHE A 20 12.668 -23.033 -22.370 1.00 0.00 H new ATOM 0 HD2 PHE A 20 12.962 -24.322 -18.321 1.00 0.00 H new ATOM 0 HE1 PHE A 20 12.182 -25.336 -23.071 1.00 0.00 H new ATOM 0 HE2 PHE A 20 12.478 -26.626 -19.018 1.00 0.00 H new ATOM 0 HZ PHE A 20 12.083 -27.139 -21.394 1.00 0.00 H new ATOM 330 N ILE A 21 14.077 -19.508 -21.603 1.00 0.00 N ATOM 331 CA ILE A 21 13.849 -18.669 -22.773 1.00 0.00 C ATOM 332 C ILE A 21 15.085 -18.624 -23.665 1.00 0.00 C ATOM 333 O ILE A 21 15.005 -18.869 -24.869 1.00 0.00 O ATOM 334 CB ILE A 21 13.467 -17.233 -22.371 1.00 0.00 C ATOM 335 CG1 ILE A 21 11.950 -17.111 -22.212 1.00 0.00 C ATOM 336 CG2 ILE A 21 13.979 -16.240 -23.404 1.00 0.00 C ATOM 337 CD1 ILE A 21 11.516 -15.840 -21.515 1.00 0.00 C ATOM 0 H ILE A 21 14.090 -19.002 -20.717 1.00 0.00 H new ATOM 0 HA ILE A 21 13.021 -19.115 -23.325 1.00 0.00 H new ATOM 0 HB ILE A 21 13.933 -17.003 -21.413 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.485 -17.153 -23.197 1.00 0.00 H new ATOM 0 HG13 ILE A 21 11.582 -17.969 -21.649 1.00 0.00 H new ATOM 0 HG21 ILE A 21 13.701 -15.229 -23.106 1.00 0.00 H new ATOM 0 HG22 ILE A 21 15.064 -16.313 -23.472 1.00 0.00 H new ATOM 0 HG23 ILE A 21 13.539 -16.466 -24.375 1.00 0.00 H new ATOM 0 HD11 ILE A 21 10.429 -15.821 -21.437 1.00 0.00 H new ATOM 0 HD12 ILE A 21 11.952 -15.805 -20.517 1.00 0.00 H new ATOM 0 HD13 ILE A 21 11.854 -14.977 -22.089 1.00 0.00 H new ATOM 349 N PHE A 22 16.229 -18.310 -23.066 1.00 0.00 N ATOM 350 CA PHE A 22 17.484 -18.233 -23.806 1.00 0.00 C ATOM 351 C PHE A 22 17.993 -19.627 -24.159 1.00 0.00 C ATOM 352 O PHE A 22 18.655 -19.818 -25.180 1.00 0.00 O ATOM 353 CB PHE A 22 18.538 -17.484 -22.988 1.00 0.00 C ATOM 354 CG PHE A 22 18.131 -16.086 -22.623 1.00 0.00 C ATOM 355 CD1 PHE A 22 17.477 -15.278 -23.540 1.00 0.00 C ATOM 356 CD2 PHE A 22 18.402 -15.578 -21.362 1.00 0.00 C ATOM 357 CE1 PHE A 22 17.101 -13.991 -23.207 1.00 0.00 C ATOM 358 CE2 PHE A 22 18.028 -14.291 -21.023 1.00 0.00 C ATOM 359 CZ PHE A 22 17.378 -13.496 -21.947 1.00 0.00 C ATOM 0 H PHE A 22 16.313 -18.105 -22.070 1.00 0.00 H new ATOM 0 HA PHE A 22 17.299 -17.688 -24.732 1.00 0.00 H new ATOM 0 HB2 PHE A 22 18.744 -18.044 -22.076 1.00 0.00 H new ATOM 0 HB3 PHE A 22 19.468 -17.447 -23.556 1.00 0.00 H new ATOM 0 HD1 PHE A 22 17.259 -15.659 -24.527 1.00 0.00 H new ATOM 0 HD2 PHE A 22 18.911 -16.195 -20.636 1.00 0.00 H new ATOM 0 HE1 PHE A 22 16.591 -13.372 -23.931 1.00 0.00 H new ATOM 0 HE2 PHE A 22 18.244 -13.907 -20.037 1.00 0.00 H new ATOM 0 HZ PHE A 22 17.087 -12.489 -21.685 1.00 0.00 H new ATOM 369 N ILE A 23 17.681 -20.598 -23.307 1.00 0.00 N ATOM 370 CA ILE A 23 18.107 -21.974 -23.529 1.00 0.00 C ATOM 371 C ILE A 23 17.417 -22.574 -24.749 1.00 0.00 C ATOM 372 O ILE A 23 18.012 -23.356 -25.491 1.00 0.00 O ATOM 373 CB ILE A 23 17.814 -22.859 -22.302 1.00 0.00 C ATOM 374 CG1 ILE A 23 19.054 -22.958 -21.410 1.00 0.00 C ATOM 375 CG2 ILE A 23 17.359 -24.242 -22.742 1.00 0.00 C ATOM 376 CD1 ILE A 23 19.365 -21.680 -20.663 1.00 0.00 C ATOM 0 H ILE A 23 17.135 -20.457 -22.457 1.00 0.00 H new ATOM 0 HA ILE A 23 19.183 -21.947 -23.700 1.00 0.00 H new ATOM 0 HB ILE A 23 17.010 -22.401 -21.726 1.00 0.00 H new ATOM 0 HG12 ILE A 23 18.910 -23.764 -20.690 1.00 0.00 H new ATOM 0 HG13 ILE A 23 19.913 -23.228 -22.024 1.00 0.00 H new ATOM 0 HG21 ILE A 23 17.156 -24.855 -21.864 1.00 0.00 H new ATOM 0 HG22 ILE A 23 16.452 -24.153 -23.340 1.00 0.00 H new ATOM 0 HG23 ILE A 23 18.142 -24.710 -23.338 1.00 0.00 H new ATOM 0 HD11 ILE A 23 20.256 -21.824 -20.051 1.00 0.00 H new ATOM 0 HD12 ILE A 23 19.541 -20.875 -21.377 1.00 0.00 H new ATOM 0 HD13 ILE A 23 18.523 -21.419 -20.022 1.00 0.00 H new ATOM 388 N VAL A 24 16.157 -22.200 -24.953 1.00 0.00 N ATOM 389 CA VAL A 24 15.386 -22.698 -26.086 1.00 0.00 C ATOM 390 C VAL A 24 15.879 -22.092 -27.395 1.00 0.00 C ATOM 391 O VAL A 24 16.056 -22.796 -28.390 1.00 0.00 O ATOM 392 CB VAL A 24 13.886 -22.389 -25.923 1.00 0.00 C ATOM 393 CG1 VAL A 24 13.149 -22.611 -27.234 1.00 0.00 C ATOM 394 CG2 VAL A 24 13.285 -23.239 -24.813 1.00 0.00 C ATOM 0 H VAL A 24 15.649 -21.554 -24.348 1.00 0.00 H new ATOM 0 HA VAL A 24 15.526 -23.779 -26.114 1.00 0.00 H new ATOM 0 HB VAL A 24 13.777 -21.340 -25.646 1.00 0.00 H new ATOM 0 HG11 VAL A 24 12.091 -22.388 -27.099 1.00 0.00 H new ATOM 0 HG12 VAL A 24 13.563 -21.955 -28.000 1.00 0.00 H new ATOM 0 HG13 VAL A 24 13.264 -23.649 -27.545 1.00 0.00 H new ATOM 0 HG21 VAL A 24 12.225 -23.008 -24.711 1.00 0.00 H new ATOM 0 HG22 VAL A 24 13.405 -24.294 -25.058 1.00 0.00 H new ATOM 0 HG23 VAL A 24 13.795 -23.024 -23.874 1.00 0.00 H new ATOM 404 N LEU A 25 16.099 -20.782 -27.388 1.00 0.00 N ATOM 405 CA LEU A 25 16.573 -20.079 -28.576 1.00 0.00 C ATOM 406 C LEU A 25 17.806 -20.764 -29.158 1.00 0.00 C ATOM 407 O LEU A 25 17.978 -20.826 -30.376 1.00 0.00 O ATOM 408 CB LEU A 25 16.897 -18.624 -28.236 1.00 0.00 C ATOM 409 CG LEU A 25 15.696 -17.702 -28.019 1.00 0.00 C ATOM 410 CD1 LEU A 25 16.147 -16.252 -27.923 1.00 0.00 C ATOM 411 CD2 LEU A 25 14.683 -17.874 -29.141 1.00 0.00 C ATOM 0 H LEU A 25 15.957 -20.185 -26.573 1.00 0.00 H new ATOM 0 HA LEU A 25 15.780 -20.103 -29.323 1.00 0.00 H new ATOM 0 HB2 LEU A 25 17.508 -18.610 -27.334 1.00 0.00 H new ATOM 0 HB3 LEU A 25 17.506 -18.211 -29.040 1.00 0.00 H new ATOM 0 HG LEU A 25 15.217 -17.975 -27.079 1.00 0.00 H new ATOM 0 HD11 LEU A 25 15.279 -15.611 -27.769 1.00 0.00 H new ATOM 0 HD12 LEU A 25 16.835 -16.140 -27.085 1.00 0.00 H new ATOM 0 HD13 LEU A 25 16.650 -15.966 -28.846 1.00 0.00 H new ATOM 0 HD21 LEU A 25 13.835 -17.211 -28.971 1.00 0.00 H new ATOM 0 HD22 LEU A 25 15.151 -17.628 -30.094 1.00 0.00 H new ATOM 0 HD23 LEU A 25 14.336 -18.907 -29.163 1.00 0.00 H new ATOM 423 N LEU A 26 18.659 -21.279 -28.280 1.00 0.00 N ATOM 424 CA LEU A 26 19.876 -21.962 -28.707 1.00 0.00 C ATOM 425 C LEU A 26 19.556 -23.074 -29.701 1.00 0.00 C ATOM 426 O LEU A 26 20.057 -23.078 -30.826 1.00 0.00 O ATOM 427 CB LEU A 26 20.611 -22.541 -27.496 1.00 0.00 C ATOM 428 CG LEU A 26 21.753 -21.692 -26.937 1.00 0.00 C ATOM 429 CD1 LEU A 26 22.810 -21.449 -28.003 1.00 0.00 C ATOM 430 CD2 LEU A 26 21.223 -20.372 -26.398 1.00 0.00 C ATOM 0 H LEU A 26 18.531 -21.237 -27.269 1.00 0.00 H new ATOM 0 HA LEU A 26 20.519 -21.233 -29.200 1.00 0.00 H new ATOM 0 HB2 LEU A 26 19.885 -22.707 -26.700 1.00 0.00 H new ATOM 0 HB3 LEU A 26 21.011 -23.517 -27.771 1.00 0.00 H new ATOM 0 HG LEU A 26 22.215 -22.237 -26.114 1.00 0.00 H new ATOM 0 HD11 LEU A 26 23.614 -20.843 -27.586 1.00 0.00 H new ATOM 0 HD12 LEU A 26 23.213 -22.404 -28.341 1.00 0.00 H new ATOM 0 HD13 LEU A 26 22.362 -20.926 -28.847 1.00 0.00 H new ATOM 0 HD21 LEU A 26 22.050 -19.781 -26.004 1.00 0.00 H new ATOM 0 HD22 LEU A 26 20.734 -19.821 -27.201 1.00 0.00 H new ATOM 0 HD23 LEU A 26 20.505 -20.566 -25.602 1.00 0.00 H new ATOM 442 N ILE A 27 18.718 -24.015 -29.279 1.00 0.00 N ATOM 443 CA ILE A 27 18.328 -25.130 -30.133 1.00 0.00 C ATOM 444 C ILE A 27 17.661 -24.635 -31.412 1.00 0.00 C ATOM 445 O ILE A 27 18.024 -25.049 -32.514 1.00 0.00 O ATOM 446 CB ILE A 27 17.369 -26.089 -29.405 1.00 0.00 C ATOM 447 CG1 ILE A 27 18.157 -27.191 -28.693 1.00 0.00 C ATOM 448 CG2 ILE A 27 16.375 -26.691 -30.387 1.00 0.00 C ATOM 449 CD1 ILE A 27 18.141 -27.068 -27.186 1.00 0.00 C ATOM 0 H ILE A 27 18.296 -24.027 -28.350 1.00 0.00 H new ATOM 0 HA ILE A 27 19.242 -25.668 -30.387 1.00 0.00 H new ATOM 0 HB ILE A 27 16.814 -25.524 -28.656 1.00 0.00 H new ATOM 0 HG12 ILE A 27 17.746 -28.160 -28.975 1.00 0.00 H new ATOM 0 HG13 ILE A 27 19.190 -27.170 -29.040 1.00 0.00 H new ATOM 0 HG21 ILE A 27 15.704 -27.367 -29.857 1.00 0.00 H new ATOM 0 HG22 ILE A 27 15.795 -25.894 -30.852 1.00 0.00 H new ATOM 0 HG23 ILE A 27 16.913 -27.244 -31.157 1.00 0.00 H new ATOM 0 HD11 ILE A 27 18.719 -27.882 -26.748 1.00 0.00 H new ATOM 0 HD12 ILE A 27 18.580 -26.114 -26.894 1.00 0.00 H new ATOM 0 HD13 ILE A 27 17.113 -27.120 -26.828 1.00 0.00 H new ATOM 461 N HIS A 28 16.685 -23.747 -31.258 1.00 0.00 N ATOM 462 CA HIS A 28 15.968 -23.193 -32.402 1.00 0.00 C ATOM 463 C HIS A 28 16.942 -22.701 -33.468 1.00 0.00 C ATOM 464 O HIS A 28 16.649 -22.754 -34.662 1.00 0.00 O ATOM 465 CB HIS A 28 15.061 -22.046 -31.955 1.00 0.00 C ATOM 466 CG HIS A 28 14.430 -21.304 -33.092 1.00 0.00 C ATOM 467 ND1 HIS A 28 13.801 -21.934 -34.146 1.00 0.00 N ATOM 468 CD2 HIS A 28 14.332 -19.976 -33.337 1.00 0.00 C ATOM 469 CE1 HIS A 28 13.345 -21.026 -34.990 1.00 0.00 C ATOM 470 NE2 HIS A 28 13.653 -19.830 -34.522 1.00 0.00 N ATOM 0 H HIS A 28 16.372 -23.395 -30.353 1.00 0.00 H new ATOM 0 HA HIS A 28 15.355 -23.985 -32.833 1.00 0.00 H new ATOM 0 HB2 HIS A 28 14.276 -22.444 -31.311 1.00 0.00 H new ATOM 0 HB3 HIS A 28 15.642 -21.347 -31.354 1.00 0.00 H new ATOM 0 HD2 HIS A 28 14.716 -19.180 -32.716 1.00 0.00 H new ATOM 0 HE1 HIS A 28 12.811 -21.227 -35.907 1.00 0.00 H new ATOM 0 HE2 HIS A 28 13.424 -18.942 -34.968 1.00 0.00 H new ATOM 478 N PHE A 29 18.101 -22.223 -33.028 1.00 0.00 N ATOM 479 CA PHE A 29 19.118 -21.720 -33.944 1.00 0.00 C ATOM 480 C PHE A 29 20.181 -22.781 -34.213 1.00 0.00 C ATOM 481 O PHE A 29 20.901 -22.715 -35.208 1.00 0.00 O ATOM 482 CB PHE A 29 19.772 -20.460 -33.372 1.00 0.00 C ATOM 483 CG PHE A 29 18.969 -19.212 -33.600 1.00 0.00 C ATOM 484 CD1 PHE A 29 18.712 -18.763 -34.886 1.00 0.00 C ATOM 485 CD2 PHE A 29 18.472 -18.486 -32.530 1.00 0.00 C ATOM 486 CE1 PHE A 29 17.973 -17.614 -35.100 1.00 0.00 C ATOM 487 CE2 PHE A 29 17.732 -17.338 -32.737 1.00 0.00 C ATOM 488 CZ PHE A 29 17.484 -16.900 -34.024 1.00 0.00 C ATOM 0 H PHE A 29 18.359 -22.173 -32.043 1.00 0.00 H new ATOM 0 HA PHE A 29 18.631 -21.472 -34.887 1.00 0.00 H new ATOM 0 HB2 PHE A 29 19.925 -20.594 -32.301 1.00 0.00 H new ATOM 0 HB3 PHE A 29 20.757 -20.336 -33.821 1.00 0.00 H new ATOM 0 HD1 PHE A 29 19.093 -19.317 -35.731 1.00 0.00 H new ATOM 0 HD2 PHE A 29 18.665 -18.822 -31.522 1.00 0.00 H new ATOM 0 HE1 PHE A 29 17.779 -17.276 -36.107 1.00 0.00 H new ATOM 0 HE2 PHE A 29 17.348 -16.783 -31.894 1.00 0.00 H new ATOM 0 HZ PHE A 29 16.909 -16.001 -34.188 1.00 0.00 H new ATOM 498 N GLU A 30 20.272 -23.759 -33.317 1.00 0.00 N ATOM 499 CA GLU A 30 21.248 -24.834 -33.456 1.00 0.00 C ATOM 500 C GLU A 30 20.897 -25.738 -34.634 1.00 0.00 C ATOM 501 O GLU A 30 21.655 -26.641 -34.986 1.00 0.00 O ATOM 502 CB GLU A 30 21.318 -25.659 -32.170 1.00 0.00 C ATOM 503 CG GLU A 30 20.488 -26.931 -32.216 1.00 0.00 C ATOM 504 CD GLU A 30 21.267 -28.117 -32.750 1.00 0.00 C ATOM 505 OE1 GLU A 30 22.487 -28.191 -32.489 1.00 0.00 O ATOM 506 OE2 GLU A 30 20.659 -28.971 -33.428 1.00 0.00 O ATOM 0 H GLU A 30 19.682 -23.829 -32.488 1.00 0.00 H new ATOM 0 HA GLU A 30 22.223 -24.383 -33.643 1.00 0.00 H new ATOM 0 HB2 GLU A 30 22.358 -25.921 -31.972 1.00 0.00 H new ATOM 0 HB3 GLU A 30 20.980 -25.045 -31.336 1.00 0.00 H new ATOM 0 HG2 GLU A 30 20.126 -27.160 -31.214 1.00 0.00 H new ATOM 0 HG3 GLU A 30 19.611 -26.766 -32.842 1.00 0.00 H new ATOM 513 N GLY A 31 19.740 -25.487 -35.241 1.00 0.00 N ATOM 514 CA GLY A 31 19.308 -26.287 -36.372 1.00 0.00 C ATOM 515 C GLY A 31 17.911 -26.846 -36.187 1.00 0.00 C ATOM 516 O GLY A 31 17.674 -28.031 -36.422 1.00 0.00 O ATOM 0 H GLY A 31 19.095 -24.745 -34.970 1.00 0.00 H new ATOM 0 HA2 GLY A 31 19.336 -25.678 -37.276 1.00 0.00 H new ATOM 0 HA3 GLY A 31 20.008 -27.109 -36.520 1.00 0.00 H new ATOM 520 N TRP A 32 16.986 -25.994 -35.762 1.00 0.00 N ATOM 521 CA TRP A 32 15.605 -26.411 -35.543 1.00 0.00 C ATOM 522 C TRP A 32 14.656 -25.660 -36.471 1.00 0.00 C ATOM 523 O TRP A 32 13.451 -25.604 -36.227 1.00 0.00 O ATOM 524 CB TRP A 32 15.205 -26.177 -34.086 1.00 0.00 C ATOM 525 CG TRP A 32 14.487 -27.341 -33.473 1.00 0.00 C ATOM 526 CD1 TRP A 32 13.153 -27.425 -33.191 1.00 0.00 C ATOM 527 CD2 TRP A 32 15.065 -28.586 -33.064 1.00 0.00 C ATOM 528 NE1 TRP A 32 12.867 -28.647 -32.632 1.00 0.00 N ATOM 529 CE2 TRP A 32 14.023 -29.378 -32.544 1.00 0.00 C ATOM 530 CE3 TRP A 32 16.361 -29.109 -33.088 1.00 0.00 C ATOM 531 CZ2 TRP A 32 14.239 -30.663 -32.053 1.00 0.00 C ATOM 532 CZ3 TRP A 32 16.573 -30.384 -32.600 1.00 0.00 C ATOM 533 CH2 TRP A 32 15.517 -31.150 -32.089 1.00 0.00 C ATOM 0 H TRP A 32 17.166 -25.010 -35.562 1.00 0.00 H new ATOM 0 HA TRP A 32 15.533 -27.476 -35.765 1.00 0.00 H new ATOM 0 HB2 TRP A 32 16.099 -25.962 -33.501 1.00 0.00 H new ATOM 0 HB3 TRP A 32 14.567 -25.295 -34.029 1.00 0.00 H new ATOM 0 HD1 TRP A 32 12.430 -26.646 -33.380 1.00 0.00 H new ATOM 0 HE1 TRP A 32 11.944 -28.960 -32.331 1.00 0.00 H new ATOM 0 HE3 TRP A 32 17.182 -28.527 -33.481 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 13.426 -31.254 -31.658 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 17.571 -30.798 -32.613 1.00 0.00 H new ATOM 0 HH2 TRP A 32 15.716 -32.144 -31.716 1.00 0.00 H new ATOM 544 N ARG A 33 15.207 -25.084 -37.534 1.00 0.00 N ATOM 545 CA ARG A 33 14.408 -24.336 -38.497 1.00 0.00 C ATOM 546 C ARG A 33 14.321 -25.080 -39.826 1.00 0.00 C ATOM 547 O ARG A 33 14.352 -24.468 -40.895 1.00 0.00 O ATOM 548 CB ARG A 33 15.007 -22.945 -38.717 1.00 0.00 C ATOM 549 CG ARG A 33 16.424 -22.972 -39.268 1.00 0.00 C ATOM 550 CD ARG A 33 16.974 -21.568 -39.460 1.00 0.00 C ATOM 551 NE ARG A 33 16.243 -20.830 -40.487 1.00 0.00 N ATOM 552 CZ ARG A 33 16.416 -19.534 -40.725 1.00 0.00 C ATOM 553 NH1 ARG A 33 17.290 -18.837 -40.012 1.00 0.00 N ATOM 554 NH2 ARG A 33 15.713 -18.933 -41.677 1.00 0.00 N ATOM 0 H ARG A 33 16.203 -25.121 -37.750 1.00 0.00 H new ATOM 0 HA ARG A 33 13.401 -24.231 -38.093 1.00 0.00 H new ATOM 0 HB2 ARG A 33 14.370 -22.389 -39.404 1.00 0.00 H new ATOM 0 HB3 ARG A 33 15.004 -22.404 -37.771 1.00 0.00 H new ATOM 0 HG2 ARG A 33 17.070 -23.527 -38.587 1.00 0.00 H new ATOM 0 HG3 ARG A 33 16.435 -23.502 -40.221 1.00 0.00 H new ATOM 0 HD2 ARG A 33 16.920 -21.025 -38.516 1.00 0.00 H new ATOM 0 HD3 ARG A 33 18.027 -21.626 -39.735 1.00 0.00 H new ATOM 0 HE ARG A 33 15.562 -21.337 -41.053 1.00 0.00 H new ATOM 0 HH11 ARG A 33 17.831 -19.295 -39.279 1.00 0.00 H new ATOM 0 HH12 ARG A 33 17.421 -17.842 -40.197 1.00 0.00 H new ATOM 0 HH21 ARG A 33 15.039 -19.466 -42.227 1.00 0.00 H new ATOM 0 HH22 ARG A 33 15.847 -17.938 -41.859 1.00 0.00 H new ATOM 568 N ILE A 34 14.213 -26.402 -39.752 1.00 0.00 N ATOM 569 CA ILE A 34 14.121 -27.229 -40.949 1.00 0.00 C ATOM 570 C ILE A 34 12.795 -27.007 -41.670 1.00 0.00 C ATOM 571 O ILE A 34 11.749 -27.011 -41.022 1.00 0.00 O ATOM 572 CB ILE A 34 14.265 -28.725 -40.612 1.00 0.00 C ATOM 573 CG1 ILE A 34 15.603 -28.987 -39.918 1.00 0.00 C ATOM 574 CG2 ILE A 34 14.144 -29.566 -41.874 1.00 0.00 C ATOM 575 CD1 ILE A 34 15.645 -30.295 -39.160 1.00 0.00 C ATOM 0 H ILE A 34 14.187 -26.924 -38.876 1.00 0.00 H new ATOM 0 HA ILE A 34 14.941 -26.931 -41.602 1.00 0.00 H new ATOM 0 HB ILE A 34 13.462 -29.008 -39.931 1.00 0.00 H new ATOM 0 HG12 ILE A 34 16.397 -28.984 -40.665 1.00 0.00 H new ATOM 0 HG13 ILE A 34 15.811 -28.170 -39.228 1.00 0.00 H new ATOM 0 HG21 ILE A 34 14.248 -30.621 -41.620 1.00 0.00 H new ATOM 0 HG22 ILE A 34 13.169 -29.397 -42.332 1.00 0.00 H new ATOM 0 HG23 ILE A 34 14.928 -29.283 -42.576 1.00 0.00 H new ATOM 0 HD11 ILE A 34 16.623 -30.414 -38.694 1.00 0.00 H new ATOM 0 HD12 ILE A 34 14.874 -30.294 -38.390 1.00 0.00 H new ATOM 0 HD13 ILE A 34 15.469 -31.121 -39.849 1.00 0.00 H new TER 587 ILE A 34 ATOM 588 N MET B 101 9.483 10.236 -8.222 1.00 0.00 N ATOM 589 CA MET B 101 8.439 9.490 -7.529 1.00 0.00 C ATOM 590 C MET B 101 7.900 8.365 -8.407 1.00 0.00 C ATOM 591 O MET B 101 6.769 7.913 -8.228 1.00 0.00 O ATOM 592 CB MET B 101 7.300 10.425 -7.121 1.00 0.00 C ATOM 593 CG MET B 101 7.630 11.298 -5.921 1.00 0.00 C ATOM 594 SD MET B 101 6.190 12.177 -5.284 1.00 0.00 S ATOM 595 CE MET B 101 6.091 13.545 -6.436 1.00 0.00 C ATOM 0 HA MET B 101 8.876 9.049 -6.633 1.00 0.00 H new ATOM 0 HB2 MET B 101 7.046 11.065 -7.966 1.00 0.00 H new ATOM 0 HB3 MET B 101 6.416 9.829 -6.894 1.00 0.00 H new ATOM 0 HG2 MET B 101 8.051 10.677 -5.130 1.00 0.00 H new ATOM 0 HG3 MET B 101 8.397 12.020 -6.202 1.00 0.00 H new ATOM 0 HE1 MET B 101 5.246 14.182 -6.173 1.00 0.00 H new ATOM 0 HE2 MET B 101 7.012 14.127 -6.390 1.00 0.00 H new ATOM 0 HE3 MET B 101 5.955 13.160 -7.447 1.00 0.00 H new ATOM 605 N ASP B 102 8.715 7.919 -9.356 1.00 0.00 N ATOM 606 CA ASP B 102 8.320 6.847 -10.262 1.00 0.00 C ATOM 607 C ASP B 102 9.543 6.107 -10.795 1.00 0.00 C ATOM 608 O ASP B 102 10.363 6.678 -11.513 1.00 0.00 O ATOM 609 CB ASP B 102 7.502 7.409 -11.426 1.00 0.00 C ATOM 610 CG ASP B 102 6.226 8.084 -10.964 1.00 0.00 C ATOM 611 OD1 ASP B 102 5.220 7.373 -10.755 1.00 0.00 O ATOM 612 OD2 ASP B 102 6.232 9.323 -10.810 1.00 0.00 O ATOM 0 H ASP B 102 9.654 8.283 -9.518 1.00 0.00 H new ATOM 0 HA ASP B 102 7.705 6.141 -9.703 1.00 0.00 H new ATOM 0 HB2 ASP B 102 8.109 8.125 -11.980 1.00 0.00 H new ATOM 0 HB3 ASP B 102 7.254 6.602 -12.115 1.00 0.00 H new ATOM 617 N SER B 103 9.660 4.832 -10.436 1.00 0.00 N ATOM 618 CA SER B 103 10.785 4.015 -10.873 1.00 0.00 C ATOM 619 C SER B 103 10.395 3.145 -12.064 1.00 0.00 C ATOM 620 O SER B 103 10.854 2.011 -12.196 1.00 0.00 O ATOM 621 CB SER B 103 11.280 3.133 -9.725 1.00 0.00 C ATOM 622 OG SER B 103 10.195 2.629 -8.965 1.00 0.00 O ATOM 0 H SER B 103 8.989 4.343 -9.844 1.00 0.00 H new ATOM 0 HA SER B 103 11.589 4.684 -11.181 1.00 0.00 H new ATOM 0 HB2 SER B 103 11.864 2.304 -10.125 1.00 0.00 H new ATOM 0 HB3 SER B 103 11.944 3.709 -9.080 1.00 0.00 H new ATOM 0 HG SER B 103 10.537 2.067 -8.239 1.00 0.00 H new ATOM 628 N ALA B 104 9.544 3.686 -12.930 1.00 0.00 N ATOM 629 CA ALA B 104 9.092 2.962 -14.112 1.00 0.00 C ATOM 630 C ALA B 104 10.220 2.809 -15.126 1.00 0.00 C ATOM 631 O ALA B 104 10.618 1.700 -15.485 1.00 0.00 O ATOM 632 CB ALA B 104 7.904 3.671 -14.743 1.00 0.00 C ATOM 0 H ALA B 104 9.154 4.624 -12.835 1.00 0.00 H new ATOM 0 HA ALA B 104 8.781 1.965 -13.801 1.00 0.00 H new ATOM 0 HB1 ALA B 104 7.577 3.119 -15.624 1.00 0.00 H new ATOM 0 HB2 ALA B 104 7.087 3.722 -14.023 1.00 0.00 H new ATOM 0 HB3 ALA B 104 8.195 4.680 -15.034 1.00 0.00 H new ATOM 638 N PRO B 105 10.748 3.946 -15.602 1.00 0.00 N ATOM 639 CA PRO B 105 11.837 3.964 -16.582 1.00 0.00 C ATOM 640 C PRO B 105 13.158 3.484 -15.990 1.00 0.00 C ATOM 641 O PRO B 105 14.033 3.000 -16.709 1.00 0.00 O ATOM 642 CB PRO B 105 11.934 5.440 -16.978 1.00 0.00 C ATOM 643 CG PRO B 105 11.390 6.183 -15.806 1.00 0.00 C ATOM 644 CD PRO B 105 10.322 5.303 -15.218 1.00 0.00 C ATOM 0 HA PRO B 105 11.641 3.295 -17.420 1.00 0.00 H new ATOM 0 HB2 PRO B 105 12.965 5.727 -17.185 1.00 0.00 H new ATOM 0 HB3 PRO B 105 11.358 5.647 -17.880 1.00 0.00 H new ATOM 0 HG2 PRO B 105 12.173 6.388 -15.076 1.00 0.00 H new ATOM 0 HG3 PRO B 105 10.979 7.145 -16.111 1.00 0.00 H new ATOM 0 HD2 PRO B 105 10.261 5.414 -14.135 1.00 0.00 H new ATOM 0 HD3 PRO B 105 9.337 5.544 -15.619 1.00 0.00 H new ATOM 652 N PHE B 106 13.296 3.620 -14.675 1.00 0.00 N ATOM 653 CA PHE B 106 14.511 3.200 -13.986 1.00 0.00 C ATOM 654 C PHE B 106 14.553 1.682 -13.834 1.00 0.00 C ATOM 655 O PHE B 106 15.617 1.070 -13.910 1.00 0.00 O ATOM 656 CB PHE B 106 14.598 3.864 -12.611 1.00 0.00 C ATOM 657 CG PHE B 106 16.007 4.056 -12.127 1.00 0.00 C ATOM 658 CD1 PHE B 106 16.716 5.201 -12.454 1.00 0.00 C ATOM 659 CD2 PHE B 106 16.622 3.093 -11.344 1.00 0.00 C ATOM 660 CE1 PHE B 106 18.013 5.380 -12.010 1.00 0.00 C ATOM 661 CE2 PHE B 106 17.918 3.266 -10.896 1.00 0.00 C ATOM 662 CZ PHE B 106 18.614 4.412 -11.229 1.00 0.00 C ATOM 0 H PHE B 106 12.582 4.018 -14.065 1.00 0.00 H new ATOM 0 HA PHE B 106 15.366 3.511 -14.587 1.00 0.00 H new ATOM 0 HB2 PHE B 106 14.101 4.833 -12.652 1.00 0.00 H new ATOM 0 HB3 PHE B 106 14.053 3.257 -11.888 1.00 0.00 H new ATOM 0 HD1 PHE B 106 16.250 5.962 -13.062 1.00 0.00 H new ATOM 0 HD2 PHE B 106 16.082 2.196 -11.080 1.00 0.00 H new ATOM 0 HE1 PHE B 106 18.556 6.276 -12.274 1.00 0.00 H new ATOM 0 HE2 PHE B 106 18.386 2.507 -10.287 1.00 0.00 H new ATOM 0 HZ PHE B 106 19.626 4.551 -10.879 1.00 0.00 H new ATOM 672 N GLU B 107 13.386 1.083 -13.618 1.00 0.00 N ATOM 673 CA GLU B 107 13.290 -0.363 -13.454 1.00 0.00 C ATOM 674 C GLU B 107 13.806 -1.087 -14.694 1.00 0.00 C ATOM 675 O GLU B 107 14.569 -2.048 -14.593 1.00 0.00 O ATOM 676 CB GLU B 107 11.841 -0.772 -13.176 1.00 0.00 C ATOM 677 CG GLU B 107 11.614 -1.286 -11.765 1.00 0.00 C ATOM 678 CD GLU B 107 12.218 -2.659 -11.540 1.00 0.00 C ATOM 679 OE1 GLU B 107 13.155 -3.022 -12.282 1.00 0.00 O ATOM 680 OE2 GLU B 107 11.755 -3.368 -10.623 1.00 0.00 O ATOM 0 H GLU B 107 12.495 1.576 -13.553 1.00 0.00 H new ATOM 0 HA GLU B 107 13.910 -0.649 -12.604 1.00 0.00 H new ATOM 0 HB2 GLU B 107 11.191 0.085 -13.350 1.00 0.00 H new ATOM 0 HB3 GLU B 107 11.548 -1.545 -13.887 1.00 0.00 H new ATOM 0 HG2 GLU B 107 12.045 -0.583 -11.052 1.00 0.00 H new ATOM 0 HG3 GLU B 107 10.543 -1.327 -11.565 1.00 0.00 H new ATOM 687 N LEU B 108 13.383 -0.620 -15.863 1.00 0.00 N ATOM 688 CA LEU B 108 13.801 -1.222 -17.124 1.00 0.00 C ATOM 689 C LEU B 108 15.321 -1.241 -17.241 1.00 0.00 C ATOM 690 O LEU B 108 15.904 -2.203 -17.742 1.00 0.00 O ATOM 691 CB LEU B 108 13.197 -0.457 -18.303 1.00 0.00 C ATOM 692 CG LEU B 108 11.832 -0.944 -18.791 1.00 0.00 C ATOM 693 CD1 LEU B 108 11.960 -2.300 -19.468 1.00 0.00 C ATOM 694 CD2 LEU B 108 10.846 -1.015 -17.633 1.00 0.00 C ATOM 0 H LEU B 108 12.751 0.174 -15.964 1.00 0.00 H new ATOM 0 HA LEU B 108 13.441 -2.250 -17.144 1.00 0.00 H new ATOM 0 HB2 LEU B 108 13.107 0.592 -18.021 1.00 0.00 H new ATOM 0 HB3 LEU B 108 13.897 -0.504 -19.137 1.00 0.00 H new ATOM 0 HG LEU B 108 11.453 -0.230 -19.522 1.00 0.00 H new ATOM 0 HD11 LEU B 108 10.979 -2.631 -19.809 1.00 0.00 H new ATOM 0 HD12 LEU B 108 12.632 -2.218 -20.322 1.00 0.00 H new ATOM 0 HD13 LEU B 108 12.361 -3.024 -18.759 1.00 0.00 H new ATOM 0 HD21 LEU B 108 9.880 -1.363 -17.998 1.00 0.00 H new ATOM 0 HD22 LEU B 108 11.220 -1.707 -16.879 1.00 0.00 H new ATOM 0 HD23 LEU B 108 10.731 -0.025 -17.192 1.00 0.00 H new ATOM 706 N PHE B 109 15.959 -0.173 -16.773 1.00 0.00 N ATOM 707 CA PHE B 109 17.412 -0.067 -16.824 1.00 0.00 C ATOM 708 C PHE B 109 18.070 -1.319 -16.251 1.00 0.00 C ATOM 709 O PHE B 109 19.050 -1.824 -16.797 1.00 0.00 O ATOM 710 CB PHE B 109 17.882 1.168 -16.052 1.00 0.00 C ATOM 711 CG PHE B 109 19.338 1.481 -16.249 1.00 0.00 C ATOM 712 CD1 PHE B 109 20.310 0.782 -15.552 1.00 0.00 C ATOM 713 CD2 PHE B 109 19.734 2.472 -17.132 1.00 0.00 C ATOM 714 CE1 PHE B 109 21.651 1.069 -15.731 1.00 0.00 C ATOM 715 CE2 PHE B 109 21.073 2.762 -17.316 1.00 0.00 C ATOM 716 CZ PHE B 109 22.032 2.059 -16.615 1.00 0.00 C ATOM 0 H PHE B 109 15.492 0.631 -16.354 1.00 0.00 H new ATOM 0 HA PHE B 109 17.707 0.031 -17.869 1.00 0.00 H new ATOM 0 HB2 PHE B 109 17.289 2.028 -16.362 1.00 0.00 H new ATOM 0 HB3 PHE B 109 17.692 1.016 -14.989 1.00 0.00 H new ATOM 0 HD1 PHE B 109 20.017 0.005 -14.862 1.00 0.00 H new ATOM 0 HD2 PHE B 109 18.988 3.025 -17.683 1.00 0.00 H new ATOM 0 HE1 PHE B 109 22.400 0.519 -15.180 1.00 0.00 H new ATOM 0 HE2 PHE B 109 21.368 3.537 -18.007 1.00 0.00 H new ATOM 0 HZ PHE B 109 23.079 2.283 -16.758 1.00 0.00 H new ATOM 726 N PHE B 110 17.522 -1.814 -15.146 1.00 0.00 N ATOM 727 CA PHE B 110 18.055 -3.006 -14.496 1.00 0.00 C ATOM 728 C PHE B 110 17.632 -4.268 -15.244 1.00 0.00 C ATOM 729 O PHE B 110 18.309 -5.293 -15.184 1.00 0.00 O ATOM 730 CB PHE B 110 17.580 -3.077 -13.044 1.00 0.00 C ATOM 731 CG PHE B 110 17.912 -4.376 -12.367 1.00 0.00 C ATOM 732 CD1 PHE B 110 17.030 -5.444 -12.417 1.00 0.00 C ATOM 733 CD2 PHE B 110 19.105 -4.530 -11.680 1.00 0.00 C ATOM 734 CE1 PHE B 110 17.332 -6.641 -11.796 1.00 0.00 C ATOM 735 CE2 PHE B 110 19.413 -5.725 -11.058 1.00 0.00 C ATOM 736 CZ PHE B 110 18.525 -6.781 -11.114 1.00 0.00 C ATOM 0 H PHE B 110 16.709 -1.408 -14.682 1.00 0.00 H new ATOM 0 HA PHE B 110 19.143 -2.942 -14.512 1.00 0.00 H new ATOM 0 HB2 PHE B 110 18.030 -2.258 -12.482 1.00 0.00 H new ATOM 0 HB3 PHE B 110 16.501 -2.927 -13.016 1.00 0.00 H new ATOM 0 HD1 PHE B 110 16.095 -5.339 -12.948 1.00 0.00 H new ATOM 0 HD2 PHE B 110 19.802 -3.707 -11.630 1.00 0.00 H new ATOM 0 HE1 PHE B 110 16.636 -7.466 -11.844 1.00 0.00 H new ATOM 0 HE2 PHE B 110 20.348 -5.833 -10.528 1.00 0.00 H new ATOM 0 HZ PHE B 110 18.763 -7.714 -10.626 1.00 0.00 H new ATOM 746 N MET B 111 16.507 -4.183 -15.947 1.00 0.00 N ATOM 747 CA MET B 111 15.994 -5.317 -16.706 1.00 0.00 C ATOM 748 C MET B 111 16.836 -5.561 -17.954 1.00 0.00 C ATOM 749 O MET B 111 16.864 -6.670 -18.488 1.00 0.00 O ATOM 750 CB MET B 111 14.536 -5.076 -17.100 1.00 0.00 C ATOM 751 CG MET B 111 13.537 -5.585 -16.073 1.00 0.00 C ATOM 752 SD MET B 111 11.877 -4.932 -16.335 1.00 0.00 S ATOM 753 CE MET B 111 11.606 -4.067 -14.791 1.00 0.00 C ATOM 0 H MET B 111 15.934 -3.341 -16.007 1.00 0.00 H new ATOM 0 HA MET B 111 16.050 -6.202 -16.072 1.00 0.00 H new ATOM 0 HB2 MET B 111 14.380 -4.007 -17.248 1.00 0.00 H new ATOM 0 HB3 MET B 111 14.341 -5.562 -18.056 1.00 0.00 H new ATOM 0 HG2 MET B 111 13.505 -6.674 -16.112 1.00 0.00 H new ATOM 0 HG3 MET B 111 13.877 -5.311 -15.074 1.00 0.00 H new ATOM 0 HE1 MET B 111 10.753 -3.396 -14.894 1.00 0.00 H new ATOM 0 HE2 MET B 111 11.406 -4.789 -14.000 1.00 0.00 H new ATOM 0 HE3 MET B 111 12.494 -3.488 -14.538 1.00 0.00 H new ATOM 763 N ILE B 112 17.521 -4.519 -18.414 1.00 0.00 N ATOM 764 CA ILE B 112 18.364 -4.622 -19.599 1.00 0.00 C ATOM 765 C ILE B 112 19.728 -5.208 -19.253 1.00 0.00 C ATOM 766 O ILE B 112 20.143 -6.217 -19.820 1.00 0.00 O ATOM 767 CB ILE B 112 18.562 -3.250 -20.270 1.00 0.00 C ATOM 768 CG1 ILE B 112 17.241 -2.751 -20.860 1.00 0.00 C ATOM 769 CG2 ILE B 112 19.631 -3.337 -21.348 1.00 0.00 C ATOM 770 CD1 ILE B 112 16.832 -1.385 -20.357 1.00 0.00 C ATOM 0 H ILE B 112 17.509 -3.594 -17.984 1.00 0.00 H new ATOM 0 HA ILE B 112 17.851 -5.286 -20.295 1.00 0.00 H new ATOM 0 HB ILE B 112 18.893 -2.537 -19.515 1.00 0.00 H new ATOM 0 HG12 ILE B 112 17.327 -2.718 -21.946 1.00 0.00 H new ATOM 0 HG13 ILE B 112 16.454 -3.467 -20.624 1.00 0.00 H new ATOM 0 HG21 ILE B 112 19.759 -2.359 -21.813 1.00 0.00 H new ATOM 0 HG22 ILE B 112 20.574 -3.653 -20.901 1.00 0.00 H new ATOM 0 HG23 ILE B 112 19.327 -4.061 -22.104 1.00 0.00 H new ATOM 0 HD11 ILE B 112 15.887 -1.096 -20.817 1.00 0.00 H new ATOM 0 HD12 ILE B 112 16.713 -1.417 -19.274 1.00 0.00 H new ATOM 0 HD13 ILE B 112 17.600 -0.657 -20.617 1.00 0.00 H new ATOM 782 N ASN B 113 20.421 -4.568 -18.317 1.00 0.00 N ATOM 783 CA ASN B 113 21.740 -5.026 -17.894 1.00 0.00 C ATOM 784 C ASN B 113 21.707 -6.505 -17.520 1.00 0.00 C ATOM 785 O ASN B 113 22.542 -7.290 -17.970 1.00 0.00 O ATOM 786 CB ASN B 113 22.233 -4.199 -16.705 1.00 0.00 C ATOM 787 CG ASN B 113 23.728 -4.335 -16.487 1.00 0.00 C ATOM 788 OD1 ASN B 113 24.180 -4.641 -15.383 1.00 0.00 O ATOM 789 ND2 ASN B 113 24.503 -4.108 -17.541 1.00 0.00 N ATOM 0 H ASN B 113 20.091 -3.731 -17.837 1.00 0.00 H new ATOM 0 HA ASN B 113 22.428 -4.895 -18.729 1.00 0.00 H new ATOM 0 HB2 ASN B 113 21.986 -3.150 -16.868 1.00 0.00 H new ATOM 0 HB3 ASN B 113 21.707 -4.514 -15.804 1.00 0.00 H new ATOM 0 HD21 ASN B 113 25.516 -4.185 -17.455 1.00 0.00 H new ATOM 0 HD22 ASN B 113 24.085 -3.857 -18.437 1.00 0.00 H new ATOM 796 N THR B 114 20.736 -6.879 -16.693 1.00 0.00 N ATOM 797 CA THR B 114 20.594 -8.263 -16.257 1.00 0.00 C ATOM 798 C THR B 114 20.304 -9.184 -17.437 1.00 0.00 C ATOM 799 O THR B 114 20.546 -10.389 -17.370 1.00 0.00 O ATOM 800 CB THR B 114 19.468 -8.412 -15.216 1.00 0.00 C ATOM 801 OG1 THR B 114 19.486 -9.731 -14.661 1.00 0.00 O ATOM 802 CG2 THR B 114 18.110 -8.139 -15.845 1.00 0.00 C ATOM 0 H THR B 114 20.036 -6.243 -16.311 1.00 0.00 H new ATOM 0 HA THR B 114 21.541 -8.549 -15.800 1.00 0.00 H new ATOM 0 HB THR B 114 19.637 -7.683 -14.424 1.00 0.00 H new ATOM 0 HG1 THR B 114 18.768 -9.817 -13.999 1.00 0.00 H new ATOM 0 HG21 THR B 114 17.331 -8.250 -15.091 1.00 0.00 H new ATOM 0 HG22 THR B 114 18.090 -7.124 -16.241 1.00 0.00 H new ATOM 0 HG23 THR B 114 17.935 -8.847 -16.655 1.00 0.00 H new ATOM 810 N SER B 115 19.785 -8.609 -18.517 1.00 0.00 N ATOM 811 CA SER B 115 19.460 -9.379 -19.712 1.00 0.00 C ATOM 812 C SER B 115 20.728 -9.841 -20.422 1.00 0.00 C ATOM 813 O SER B 115 20.994 -11.039 -20.525 1.00 0.00 O ATOM 814 CB SER B 115 18.603 -8.544 -20.665 1.00 0.00 C ATOM 815 OG SER B 115 17.719 -9.366 -21.408 1.00 0.00 O ATOM 0 H SER B 115 19.580 -7.612 -18.589 1.00 0.00 H new ATOM 0 HA SER B 115 18.896 -10.259 -19.405 1.00 0.00 H new ATOM 0 HB2 SER B 115 18.031 -7.810 -20.097 1.00 0.00 H new ATOM 0 HB3 SER B 115 19.247 -7.988 -21.346 1.00 0.00 H new ATOM 0 HG SER B 115 17.181 -8.809 -22.008 1.00 0.00 H new ATOM 821 N ILE B 116 21.508 -8.882 -20.911 1.00 0.00 N ATOM 822 CA ILE B 116 22.749 -9.190 -21.611 1.00 0.00 C ATOM 823 C ILE B 116 23.645 -10.092 -20.770 1.00 0.00 C ATOM 824 O ILE B 116 24.467 -10.840 -21.303 1.00 0.00 O ATOM 825 CB ILE B 116 23.523 -7.909 -21.973 1.00 0.00 C ATOM 826 CG1 ILE B 116 22.647 -6.976 -22.811 1.00 0.00 C ATOM 827 CG2 ILE B 116 24.802 -8.256 -22.720 1.00 0.00 C ATOM 828 CD1 ILE B 116 22.047 -5.836 -22.018 1.00 0.00 C ATOM 0 H ILE B 116 21.302 -7.886 -20.835 1.00 0.00 H new ATOM 0 HA ILE B 116 22.474 -9.710 -22.529 1.00 0.00 H new ATOM 0 HB ILE B 116 23.792 -7.393 -21.051 1.00 0.00 H new ATOM 0 HG12 ILE B 116 23.243 -6.566 -23.626 1.00 0.00 H new ATOM 0 HG13 ILE B 116 21.843 -7.556 -23.264 1.00 0.00 H new ATOM 0 HG21 ILE B 116 25.338 -7.340 -22.969 1.00 0.00 H new ATOM 0 HG22 ILE B 116 25.432 -8.885 -22.091 1.00 0.00 H new ATOM 0 HG23 ILE B 116 24.554 -8.792 -23.636 1.00 0.00 H new ATOM 0 HD11 ILE B 116 21.438 -5.216 -22.676 1.00 0.00 H new ATOM 0 HD12 ILE B 116 21.424 -6.237 -21.219 1.00 0.00 H new ATOM 0 HD13 ILE B 116 22.846 -5.233 -21.587 1.00 0.00 H new ATOM 840 N LEU B 117 23.481 -10.019 -19.454 1.00 0.00 N ATOM 841 CA LEU B 117 24.274 -10.831 -18.538 1.00 0.00 C ATOM 842 C LEU B 117 23.675 -12.226 -18.389 1.00 0.00 C ATOM 843 O LEU B 117 24.331 -13.229 -18.675 1.00 0.00 O ATOM 844 CB LEU B 117 24.363 -10.153 -17.170 1.00 0.00 C ATOM 845 CG LEU B 117 25.769 -9.798 -16.686 1.00 0.00 C ATOM 846 CD1 LEU B 117 25.702 -8.944 -15.430 1.00 0.00 C ATOM 847 CD2 LEU B 117 26.580 -11.061 -16.432 1.00 0.00 C ATOM 0 H LEU B 117 22.806 -9.406 -18.997 1.00 0.00 H new ATOM 0 HA LEU B 117 25.277 -10.929 -18.954 1.00 0.00 H new ATOM 0 HB2 LEU B 117 23.770 -9.239 -17.201 1.00 0.00 H new ATOM 0 HB3 LEU B 117 23.901 -10.808 -16.432 1.00 0.00 H new ATOM 0 HG LEU B 117 26.266 -9.221 -17.466 1.00 0.00 H new ATOM 0 HD11 LEU B 117 26.712 -8.701 -15.101 1.00 0.00 H new ATOM 0 HD12 LEU B 117 25.159 -8.023 -15.645 1.00 0.00 H new ATOM 0 HD13 LEU B 117 25.186 -9.494 -14.643 1.00 0.00 H new ATOM 0 HD21 LEU B 117 27.578 -10.790 -16.088 1.00 0.00 H new ATOM 0 HD22 LEU B 117 26.085 -11.664 -15.671 1.00 0.00 H new ATOM 0 HD23 LEU B 117 26.658 -11.635 -17.355 1.00 0.00 H new ATOM 859 N LEU B 118 22.426 -12.283 -17.941 1.00 0.00 N ATOM 860 CA LEU B 118 21.737 -13.555 -17.756 1.00 0.00 C ATOM 861 C LEU B 118 21.857 -14.426 -19.002 1.00 0.00 C ATOM 862 O LEU B 118 22.014 -15.644 -18.907 1.00 0.00 O ATOM 863 CB LEU B 118 20.262 -13.316 -17.428 1.00 0.00 C ATOM 864 CG LEU B 118 19.946 -12.962 -15.974 1.00 0.00 C ATOM 865 CD1 LEU B 118 18.448 -13.030 -15.722 1.00 0.00 C ATOM 866 CD2 LEU B 118 20.691 -13.890 -15.026 1.00 0.00 C ATOM 0 H LEU B 118 21.870 -11.463 -17.699 1.00 0.00 H new ATOM 0 HA LEU B 118 22.208 -14.077 -16.923 1.00 0.00 H new ATOM 0 HB2 LEU B 118 19.895 -12.511 -18.065 1.00 0.00 H new ATOM 0 HB3 LEU B 118 19.702 -14.213 -17.693 1.00 0.00 H new ATOM 0 HG LEU B 118 20.279 -11.941 -15.788 1.00 0.00 H new ATOM 0 HD11 LEU B 118 18.242 -12.775 -14.682 1.00 0.00 H new ATOM 0 HD12 LEU B 118 17.936 -12.325 -16.377 1.00 0.00 H new ATOM 0 HD13 LEU B 118 18.090 -14.039 -15.926 1.00 0.00 H new ATOM 0 HD21 LEU B 118 20.455 -13.624 -13.996 1.00 0.00 H new ATOM 0 HD22 LEU B 118 20.389 -14.920 -15.213 1.00 0.00 H new ATOM 0 HD23 LEU B 118 21.764 -13.791 -15.189 1.00 0.00 H new ATOM 878 N ILE B 119 21.786 -13.794 -20.169 1.00 0.00 N ATOM 879 CA ILE B 119 21.890 -14.512 -21.433 1.00 0.00 C ATOM 880 C ILE B 119 23.214 -15.263 -21.531 1.00 0.00 C ATOM 881 O ILE B 119 23.242 -16.493 -21.554 1.00 0.00 O ATOM 882 CB ILE B 119 21.765 -13.556 -22.634 1.00 0.00 C ATOM 883 CG1 ILE B 119 20.383 -12.899 -22.650 1.00 0.00 C ATOM 884 CG2 ILE B 119 22.016 -14.304 -23.935 1.00 0.00 C ATOM 885 CD1 ILE B 119 20.369 -11.537 -23.306 1.00 0.00 C ATOM 0 H ILE B 119 21.657 -12.787 -20.265 1.00 0.00 H new ATOM 0 HA ILE B 119 21.067 -15.226 -21.460 1.00 0.00 H new ATOM 0 HB ILE B 119 22.518 -12.774 -22.536 1.00 0.00 H new ATOM 0 HG12 ILE B 119 19.685 -13.553 -23.173 1.00 0.00 H new ATOM 0 HG13 ILE B 119 20.023 -12.804 -21.626 1.00 0.00 H new ATOM 0 HG21 ILE B 119 21.924 -13.615 -24.774 1.00 0.00 H new ATOM 0 HG22 ILE B 119 23.020 -14.729 -23.923 1.00 0.00 H new ATOM 0 HG23 ILE B 119 21.284 -15.105 -24.041 1.00 0.00 H new ATOM 0 HD11 ILE B 119 19.357 -11.132 -23.281 1.00 0.00 H new ATOM 0 HD12 ILE B 119 21.041 -10.868 -22.769 1.00 0.00 H new ATOM 0 HD13 ILE B 119 20.698 -11.628 -24.341 1.00 0.00 H new ATOM 897 N PHE B 120 24.310 -14.514 -21.587 1.00 0.00 N ATOM 898 CA PHE B 120 25.638 -15.108 -21.681 1.00 0.00 C ATOM 899 C PHE B 120 25.921 -16.003 -20.478 1.00 0.00 C ATOM 900 O PHE B 120 26.707 -16.947 -20.564 1.00 0.00 O ATOM 901 CB PHE B 120 26.704 -14.015 -21.779 1.00 0.00 C ATOM 902 CG PHE B 120 28.068 -14.536 -22.133 1.00 0.00 C ATOM 903 CD1 PHE B 120 28.367 -14.906 -23.434 1.00 0.00 C ATOM 904 CD2 PHE B 120 29.051 -14.657 -21.163 1.00 0.00 C ATOM 905 CE1 PHE B 120 29.620 -15.387 -23.762 1.00 0.00 C ATOM 906 CE2 PHE B 120 30.306 -15.137 -21.485 1.00 0.00 C ATOM 907 CZ PHE B 120 30.591 -15.501 -22.786 1.00 0.00 C ATOM 0 H PHE B 120 24.305 -13.494 -21.569 1.00 0.00 H new ATOM 0 HA PHE B 120 25.671 -15.720 -22.583 1.00 0.00 H new ATOM 0 HB2 PHE B 120 26.397 -13.286 -22.529 1.00 0.00 H new ATOM 0 HB3 PHE B 120 26.761 -13.488 -20.826 1.00 0.00 H new ATOM 0 HD1 PHE B 120 27.612 -14.817 -24.201 1.00 0.00 H new ATOM 0 HD2 PHE B 120 28.833 -14.373 -20.144 1.00 0.00 H new ATOM 0 HE1 PHE B 120 29.840 -15.673 -24.780 1.00 0.00 H new ATOM 0 HE2 PHE B 120 31.063 -15.227 -20.720 1.00 0.00 H new ATOM 0 HZ PHE B 120 31.572 -15.874 -23.040 1.00 0.00 H new ATOM 917 N ILE B 121 25.274 -15.699 -19.358 1.00 0.00 N ATOM 918 CA ILE B 121 25.454 -16.476 -18.138 1.00 0.00 C ATOM 919 C ILE B 121 24.854 -17.870 -18.280 1.00 0.00 C ATOM 920 O ILE B 121 25.504 -18.871 -17.976 1.00 0.00 O ATOM 921 CB ILE B 121 24.814 -15.775 -16.925 1.00 0.00 C ATOM 922 CG1 ILE B 121 25.820 -14.829 -16.266 1.00 0.00 C ATOM 923 CG2 ILE B 121 24.312 -16.804 -15.923 1.00 0.00 C ATOM 924 CD1 ILE B 121 25.191 -13.872 -15.277 1.00 0.00 C ATOM 0 H ILE B 121 24.621 -14.921 -19.270 1.00 0.00 H new ATOM 0 HA ILE B 121 26.528 -16.561 -17.974 1.00 0.00 H new ATOM 0 HB ILE B 121 23.963 -15.187 -17.270 1.00 0.00 H new ATOM 0 HG12 ILE B 121 26.581 -15.419 -15.755 1.00 0.00 H new ATOM 0 HG13 ILE B 121 26.329 -14.256 -17.041 1.00 0.00 H new ATOM 0 HG21 ILE B 121 23.862 -16.293 -15.071 1.00 0.00 H new ATOM 0 HG22 ILE B 121 23.567 -17.442 -16.399 1.00 0.00 H new ATOM 0 HG23 ILE B 121 25.147 -17.415 -15.580 1.00 0.00 H new ATOM 0 HD11 ILE B 121 25.963 -13.232 -14.849 1.00 0.00 H new ATOM 0 HD12 ILE B 121 24.451 -13.256 -15.787 1.00 0.00 H new ATOM 0 HD13 ILE B 121 24.706 -14.438 -14.481 1.00 0.00 H new ATOM 936 N PHE B 122 23.611 -17.929 -18.745 1.00 0.00 N ATOM 937 CA PHE B 122 22.922 -19.201 -18.929 1.00 0.00 C ATOM 938 C PHE B 122 23.437 -19.924 -20.170 1.00 0.00 C ATOM 939 O PHE B 122 23.479 -21.154 -20.212 1.00 0.00 O ATOM 940 CB PHE B 122 21.413 -18.977 -19.044 1.00 0.00 C ATOM 941 CG PHE B 122 20.817 -18.286 -17.851 1.00 0.00 C ATOM 942 CD1 PHE B 122 21.231 -18.608 -16.569 1.00 0.00 C ATOM 943 CD2 PHE B 122 19.842 -17.315 -18.012 1.00 0.00 C ATOM 944 CE1 PHE B 122 20.684 -17.974 -15.469 1.00 0.00 C ATOM 945 CE2 PHE B 122 19.292 -16.677 -16.916 1.00 0.00 C ATOM 946 CZ PHE B 122 19.713 -17.007 -15.643 1.00 0.00 C ATOM 0 H PHE B 122 23.060 -17.110 -19.002 1.00 0.00 H new ATOM 0 HA PHE B 122 23.124 -19.824 -18.057 1.00 0.00 H new ATOM 0 HB2 PHE B 122 21.209 -18.385 -19.936 1.00 0.00 H new ATOM 0 HB3 PHE B 122 20.920 -19.940 -19.180 1.00 0.00 H new ATOM 0 HD1 PHE B 122 21.990 -19.363 -16.427 1.00 0.00 H new ATOM 0 HD2 PHE B 122 19.508 -17.054 -19.005 1.00 0.00 H new ATOM 0 HE1 PHE B 122 21.015 -18.234 -14.475 1.00 0.00 H new ATOM 0 HE2 PHE B 122 18.533 -15.921 -17.055 1.00 0.00 H new ATOM 0 HZ PHE B 122 19.284 -16.510 -14.785 1.00 0.00 H new ATOM 956 N ILE B 123 23.826 -19.151 -21.178 1.00 0.00 N ATOM 957 CA ILE B 123 24.338 -19.717 -22.420 1.00 0.00 C ATOM 958 C ILE B 123 25.679 -20.407 -22.198 1.00 0.00 C ATOM 959 O ILE B 123 25.961 -21.446 -22.795 1.00 0.00 O ATOM 960 CB ILE B 123 24.503 -18.636 -23.505 1.00 0.00 C ATOM 961 CG1 ILE B 123 23.250 -18.566 -24.381 1.00 0.00 C ATOM 962 CG2 ILE B 123 25.734 -18.920 -24.353 1.00 0.00 C ATOM 963 CD1 ILE B 123 22.090 -17.854 -23.722 1.00 0.00 C ATOM 0 H ILE B 123 23.796 -18.132 -21.159 1.00 0.00 H new ATOM 0 HA ILE B 123 23.606 -20.451 -22.758 1.00 0.00 H new ATOM 0 HB ILE B 123 24.637 -17.670 -23.018 1.00 0.00 H new ATOM 0 HG12 ILE B 123 23.496 -18.057 -25.313 1.00 0.00 H new ATOM 0 HG13 ILE B 123 22.943 -19.579 -24.643 1.00 0.00 H new ATOM 0 HG21 ILE B 123 25.837 -18.148 -25.115 1.00 0.00 H new ATOM 0 HG22 ILE B 123 26.620 -18.924 -23.718 1.00 0.00 H new ATOM 0 HG23 ILE B 123 25.628 -19.892 -24.834 1.00 0.00 H new ATOM 0 HD11 ILE B 123 21.237 -17.843 -24.401 1.00 0.00 H new ATOM 0 HD12 ILE B 123 21.817 -18.375 -22.805 1.00 0.00 H new ATOM 0 HD13 ILE B 123 22.379 -16.830 -23.485 1.00 0.00 H new ATOM 975 N VAL B 124 26.503 -19.823 -21.334 1.00 0.00 N ATOM 976 CA VAL B 124 27.815 -20.383 -21.030 1.00 0.00 C ATOM 977 C VAL B 124 27.689 -21.662 -20.210 1.00 0.00 C ATOM 978 O VAL B 124 28.373 -22.651 -20.474 1.00 0.00 O ATOM 979 CB VAL B 124 28.690 -19.376 -20.260 1.00 0.00 C ATOM 980 CG1 VAL B 124 29.873 -20.081 -19.615 1.00 0.00 C ATOM 981 CG2 VAL B 124 29.162 -18.264 -21.185 1.00 0.00 C ATOM 0 H VAL B 124 26.285 -18.962 -20.832 1.00 0.00 H new ATOM 0 HA VAL B 124 28.291 -20.612 -21.984 1.00 0.00 H new ATOM 0 HB VAL B 124 28.088 -18.929 -19.469 1.00 0.00 H new ATOM 0 HG11 VAL B 124 30.480 -19.354 -19.075 1.00 0.00 H new ATOM 0 HG12 VAL B 124 29.510 -20.838 -18.920 1.00 0.00 H new ATOM 0 HG13 VAL B 124 30.478 -20.557 -20.387 1.00 0.00 H new ATOM 0 HG21 VAL B 124 29.779 -17.562 -20.624 1.00 0.00 H new ATOM 0 HG22 VAL B 124 29.747 -18.692 -21.999 1.00 0.00 H new ATOM 0 HG23 VAL B 124 28.298 -17.741 -21.595 1.00 0.00 H new ATOM 991 N LEU B 125 26.811 -21.635 -19.214 1.00 0.00 N ATOM 992 CA LEU B 125 26.594 -22.793 -18.354 1.00 0.00 C ATOM 993 C LEU B 125 26.285 -24.037 -19.182 1.00 0.00 C ATOM 994 O LEU B 125 26.700 -25.144 -18.838 1.00 0.00 O ATOM 995 CB LEU B 125 25.450 -22.521 -17.376 1.00 0.00 C ATOM 996 CG LEU B 125 25.786 -21.626 -16.182 1.00 0.00 C ATOM 997 CD1 LEU B 125 24.635 -21.607 -15.189 1.00 0.00 C ATOM 998 CD2 LEU B 125 27.067 -22.096 -15.508 1.00 0.00 C ATOM 0 H LEU B 125 26.238 -20.824 -18.982 1.00 0.00 H new ATOM 0 HA LEU B 125 27.510 -22.972 -17.791 1.00 0.00 H new ATOM 0 HB2 LEU B 125 24.628 -22.064 -17.927 1.00 0.00 H new ATOM 0 HB3 LEU B 125 25.087 -23.477 -16.998 1.00 0.00 H new ATOM 0 HG LEU B 125 25.942 -20.610 -16.545 1.00 0.00 H new ATOM 0 HD11 LEU B 125 24.892 -20.965 -14.346 1.00 0.00 H new ATOM 0 HD12 LEU B 125 23.739 -21.223 -15.677 1.00 0.00 H new ATOM 0 HD13 LEU B 125 24.447 -22.619 -14.830 1.00 0.00 H new ATOM 0 HD21 LEU B 125 27.291 -21.448 -14.661 1.00 0.00 H new ATOM 0 HD22 LEU B 125 26.939 -23.120 -15.158 1.00 0.00 H new ATOM 0 HD23 LEU B 125 27.889 -22.057 -16.222 1.00 0.00 H new ATOM 1010 N LEU B 126 25.556 -23.846 -20.276 1.00 0.00 N ATOM 1011 CA LEU B 126 25.193 -24.951 -21.156 1.00 0.00 C ATOM 1012 C LEU B 126 26.431 -25.728 -21.594 1.00 0.00 C ATOM 1013 O LEU B 126 26.524 -26.937 -21.381 1.00 0.00 O ATOM 1014 CB LEU B 126 24.445 -24.428 -22.383 1.00 0.00 C ATOM 1015 CG LEU B 126 22.919 -24.521 -22.330 1.00 0.00 C ATOM 1016 CD1 LEU B 126 22.480 -25.961 -22.109 1.00 0.00 C ATOM 1017 CD2 LEU B 126 22.368 -23.620 -21.235 1.00 0.00 C ATOM 0 H LEU B 126 25.205 -22.936 -20.575 1.00 0.00 H new ATOM 0 HA LEU B 126 24.541 -25.625 -20.601 1.00 0.00 H new ATOM 0 HB2 LEU B 126 24.720 -23.384 -22.534 1.00 0.00 H new ATOM 0 HB3 LEU B 126 24.792 -24.979 -23.257 1.00 0.00 H new ATOM 0 HG LEU B 126 22.520 -24.183 -23.286 1.00 0.00 H new ATOM 0 HD11 LEU B 126 21.392 -26.008 -22.074 1.00 0.00 H new ATOM 0 HD12 LEU B 126 22.844 -26.582 -22.927 1.00 0.00 H new ATOM 0 HD13 LEU B 126 22.889 -26.326 -21.167 1.00 0.00 H new ATOM 0 HD21 LEU B 126 21.281 -23.699 -21.212 1.00 0.00 H new ATOM 0 HD22 LEU B 126 22.775 -23.928 -20.272 1.00 0.00 H new ATOM 0 HD23 LEU B 126 22.653 -22.587 -21.436 1.00 0.00 H new ATOM 1029 N ILE B 127 27.379 -25.025 -22.204 1.00 0.00 N ATOM 1030 CA ILE B 127 28.612 -25.648 -22.668 1.00 0.00 C ATOM 1031 C ILE B 127 29.379 -26.278 -21.511 1.00 0.00 C ATOM 1032 O ILE B 127 29.793 -27.435 -21.582 1.00 0.00 O ATOM 1033 CB ILE B 127 29.523 -24.631 -23.381 1.00 0.00 C ATOM 1034 CG1 ILE B 127 29.225 -24.610 -24.881 1.00 0.00 C ATOM 1035 CG2 ILE B 127 30.986 -24.964 -23.131 1.00 0.00 C ATOM 1036 CD1 ILE B 127 28.561 -23.333 -25.348 1.00 0.00 C ATOM 0 H ILE B 127 27.317 -24.024 -22.388 1.00 0.00 H new ATOM 0 HA ILE B 127 28.326 -26.425 -23.376 1.00 0.00 H new ATOM 0 HB ILE B 127 29.322 -23.639 -22.976 1.00 0.00 H new ATOM 0 HG12 ILE B 127 30.157 -24.747 -25.430 1.00 0.00 H new ATOM 0 HG13 ILE B 127 28.582 -25.455 -25.127 1.00 0.00 H new ATOM 0 HG21 ILE B 127 31.617 -24.236 -23.641 1.00 0.00 H new ATOM 0 HG22 ILE B 127 31.189 -24.932 -22.060 1.00 0.00 H new ATOM 0 HG23 ILE B 127 31.202 -25.962 -23.512 1.00 0.00 H new ATOM 0 HD11 ILE B 127 28.380 -23.389 -26.421 1.00 0.00 H new ATOM 0 HD12 ILE B 127 27.613 -23.204 -24.826 1.00 0.00 H new ATOM 0 HD13 ILE B 127 29.212 -22.485 -25.134 1.00 0.00 H new ATOM 1048 N HIS B 128 29.565 -25.508 -20.443 1.00 0.00 N ATOM 1049 CA HIS B 128 30.281 -25.991 -19.268 1.00 0.00 C ATOM 1050 C HIS B 128 29.738 -27.345 -18.819 1.00 0.00 C ATOM 1051 O HIS B 128 30.471 -28.168 -18.271 1.00 0.00 O ATOM 1052 CB HIS B 128 30.171 -24.980 -18.126 1.00 0.00 C ATOM 1053 CG HIS B 128 30.714 -25.485 -16.825 1.00 0.00 C ATOM 1054 ND1 HIS B 128 31.954 -26.078 -16.706 1.00 0.00 N ATOM 1055 CD2 HIS B 128 30.181 -25.481 -15.581 1.00 0.00 C ATOM 1056 CE1 HIS B 128 32.158 -26.418 -15.446 1.00 0.00 C ATOM 1057 NE2 HIS B 128 31.097 -26.066 -14.742 1.00 0.00 N ATOM 0 H HIS B 128 29.230 -24.548 -20.368 1.00 0.00 H new ATOM 0 HA HIS B 128 31.330 -26.111 -19.537 1.00 0.00 H new ATOM 0 HB2 HIS B 128 30.704 -24.071 -18.404 1.00 0.00 H new ATOM 0 HB3 HIS B 128 29.124 -24.708 -17.992 1.00 0.00 H new ATOM 0 HD2 HIS B 128 29.214 -25.090 -15.300 1.00 0.00 H new ATOM 0 HE1 HIS B 128 33.042 -26.902 -15.057 1.00 0.00 H new ATOM 0 HE2 HIS B 128 30.978 -26.206 -13.739 1.00 0.00 H new ATOM 1065 N PHE B 129 28.450 -27.568 -19.055 1.00 0.00 N ATOM 1066 CA PHE B 129 27.809 -28.821 -18.674 1.00 0.00 C ATOM 1067 C PHE B 129 27.708 -29.765 -19.868 1.00 0.00 C ATOM 1068 O PHE B 129 27.570 -30.977 -19.704 1.00 0.00 O ATOM 1069 CB PHE B 129 26.415 -28.551 -18.103 1.00 0.00 C ATOM 1070 CG PHE B 129 26.427 -28.150 -16.656 1.00 0.00 C ATOM 1071 CD1 PHE B 129 26.909 -29.016 -15.687 1.00 0.00 C ATOM 1072 CD2 PHE B 129 25.957 -26.907 -16.264 1.00 0.00 C ATOM 1073 CE1 PHE B 129 26.922 -28.650 -14.354 1.00 0.00 C ATOM 1074 CE2 PHE B 129 25.968 -26.536 -14.933 1.00 0.00 C ATOM 1075 CZ PHE B 129 26.450 -27.408 -13.977 1.00 0.00 C ATOM 0 H PHE B 129 27.829 -26.897 -19.508 1.00 0.00 H new ATOM 0 HA PHE B 129 28.422 -29.297 -17.909 1.00 0.00 H new ATOM 0 HB2 PHE B 129 25.939 -27.763 -18.686 1.00 0.00 H new ATOM 0 HB3 PHE B 129 25.804 -29.446 -18.219 1.00 0.00 H new ATOM 0 HD1 PHE B 129 27.279 -29.988 -15.977 1.00 0.00 H new ATOM 0 HD2 PHE B 129 25.578 -26.221 -17.007 1.00 0.00 H new ATOM 0 HE1 PHE B 129 27.301 -29.334 -13.609 1.00 0.00 H new ATOM 0 HE2 PHE B 129 25.600 -25.564 -14.640 1.00 0.00 H new ATOM 0 HZ PHE B 129 26.458 -27.119 -12.936 1.00 0.00 H new ATOM 1085 N GLU B 130 27.777 -29.200 -21.070 1.00 0.00 N ATOM 1086 CA GLU B 130 27.692 -29.992 -22.291 1.00 0.00 C ATOM 1087 C GLU B 130 28.930 -30.867 -22.459 1.00 0.00 C ATOM 1088 O GLU B 130 29.005 -31.687 -23.374 1.00 0.00 O ATOM 1089 CB GLU B 130 27.531 -29.078 -23.507 1.00 0.00 C ATOM 1090 CG GLU B 130 28.840 -28.764 -24.210 1.00 0.00 C ATOM 1091 CD GLU B 130 29.192 -29.787 -25.273 1.00 0.00 C ATOM 1092 OE1 GLU B 130 28.267 -30.274 -25.956 1.00 0.00 O ATOM 1093 OE2 GLU B 130 30.392 -30.100 -25.422 1.00 0.00 O ATOM 0 H GLU B 130 27.891 -28.198 -21.224 1.00 0.00 H new ATOM 0 HA GLU B 130 26.819 -30.640 -22.214 1.00 0.00 H new ATOM 0 HB2 GLU B 130 26.851 -29.549 -24.217 1.00 0.00 H new ATOM 0 HB3 GLU B 130 27.066 -28.145 -23.190 1.00 0.00 H new ATOM 0 HG2 GLU B 130 28.774 -27.777 -24.668 1.00 0.00 H new ATOM 0 HG3 GLU B 130 29.642 -28.720 -23.473 1.00 0.00 H new ATOM 1100 N GLY B 131 29.901 -30.686 -21.569 1.00 0.00 N ATOM 1101 CA GLY B 131 31.124 -31.465 -21.637 1.00 0.00 C ATOM 1102 C GLY B 131 32.366 -30.596 -21.635 1.00 0.00 C ATOM 1103 O GLY B 131 33.278 -30.804 -22.435 1.00 0.00 O ATOM 0 H GLY B 131 29.863 -30.014 -20.802 1.00 0.00 H new ATOM 0 HA2 GLY B 131 31.162 -32.150 -20.790 1.00 0.00 H new ATOM 0 HA3 GLY B 131 31.113 -32.075 -22.540 1.00 0.00 H new ATOM 1107 N TRP B 132 32.401 -29.620 -20.735 1.00 0.00 N ATOM 1108 CA TRP B 132 33.541 -28.715 -20.634 1.00 0.00 C ATOM 1109 C TRP B 132 34.180 -28.797 -19.252 1.00 0.00 C ATOM 1110 O TRP B 132 34.921 -27.902 -18.847 1.00 0.00 O ATOM 1111 CB TRP B 132 33.104 -27.278 -20.923 1.00 0.00 C ATOM 1112 CG TRP B 132 33.965 -26.588 -21.936 1.00 0.00 C ATOM 1113 CD1 TRP B 132 34.894 -25.615 -21.697 1.00 0.00 C ATOM 1114 CD2 TRP B 132 33.976 -26.817 -23.350 1.00 0.00 C ATOM 1115 NE1 TRP B 132 35.481 -25.225 -22.876 1.00 0.00 N ATOM 1116 CE2 TRP B 132 34.936 -25.948 -23.905 1.00 0.00 C ATOM 1117 CE3 TRP B 132 33.270 -27.672 -24.200 1.00 0.00 C ATOM 1118 CZ2 TRP B 132 35.205 -25.911 -25.270 1.00 0.00 C ATOM 1119 CZ3 TRP B 132 33.538 -27.634 -25.555 1.00 0.00 C ATOM 1120 CH2 TRP B 132 34.499 -26.759 -26.080 1.00 0.00 C ATOM 0 H TRP B 132 31.654 -29.435 -20.065 1.00 0.00 H new ATOM 0 HA TRP B 132 34.281 -29.018 -21.374 1.00 0.00 H new ATOM 0 HB2 TRP B 132 32.073 -27.284 -21.276 1.00 0.00 H new ATOM 0 HB3 TRP B 132 33.120 -26.707 -19.994 1.00 0.00 H new ATOM 0 HD1 TRP B 132 35.132 -25.212 -20.724 1.00 0.00 H new ATOM 0 HE1 TRP B 132 36.205 -24.513 -22.970 1.00 0.00 H new ATOM 0 HE3 TRP B 132 32.528 -28.350 -23.805 1.00 0.00 H new ATOM 0 HZ2 TRP B 132 35.945 -25.237 -25.676 1.00 0.00 H new ATOM 0 HZ3 TRP B 132 32.998 -28.290 -26.221 1.00 0.00 H new ATOM 0 HH2 TRP B 132 34.686 -26.754 -27.144 1.00 0.00 H new ATOM 1131 N ARG B 133 33.889 -29.877 -18.534 1.00 0.00 N ATOM 1132 CA ARG B 133 34.436 -30.075 -17.196 1.00 0.00 C ATOM 1133 C ARG B 133 35.464 -31.202 -17.191 1.00 0.00 C ATOM 1134 O ARG B 133 35.519 -32.000 -16.254 1.00 0.00 O ATOM 1135 CB ARG B 133 33.314 -30.388 -16.205 1.00 0.00 C ATOM 1136 CG ARG B 133 32.523 -31.637 -16.555 1.00 0.00 C ATOM 1137 CD ARG B 133 31.422 -31.903 -15.540 1.00 0.00 C ATOM 1138 NE ARG B 133 31.960 -32.225 -14.221 1.00 0.00 N ATOM 1139 CZ ARG B 133 31.212 -32.328 -13.127 1.00 0.00 C ATOM 1140 NH1 ARG B 133 29.902 -32.136 -13.196 1.00 0.00 N ATOM 1141 NH2 ARG B 133 31.775 -32.625 -11.963 1.00 0.00 N ATOM 0 H ARG B 133 33.278 -30.628 -18.856 1.00 0.00 H new ATOM 0 HA ARG B 133 34.932 -29.153 -16.893 1.00 0.00 H new ATOM 0 HB2 ARG B 133 33.742 -30.507 -15.210 1.00 0.00 H new ATOM 0 HB3 ARG B 133 32.633 -29.538 -16.160 1.00 0.00 H new ATOM 0 HG2 ARG B 133 32.085 -31.526 -17.547 1.00 0.00 H new ATOM 0 HG3 ARG B 133 33.195 -32.494 -16.597 1.00 0.00 H new ATOM 0 HD2 ARG B 133 30.779 -31.026 -15.465 1.00 0.00 H new ATOM 0 HD3 ARG B 133 30.799 -32.727 -15.888 1.00 0.00 H new ATOM 0 HE ARG B 133 32.965 -32.379 -14.135 1.00 0.00 H new ATOM 0 HH11 ARG B 133 29.466 -31.909 -14.090 1.00 0.00 H new ATOM 0 HH12 ARG B 133 29.330 -32.216 -12.355 1.00 0.00 H new ATOM 0 HH21 ARG B 133 32.782 -32.774 -11.907 1.00 0.00 H new ATOM 0 HH22 ARG B 133 31.200 -32.704 -11.124 1.00 0.00 H new ATOM 1155 N ILE B 134 36.275 -31.262 -18.241 1.00 0.00 N ATOM 1156 CA ILE B 134 37.301 -32.291 -18.356 1.00 0.00 C ATOM 1157 C ILE B 134 38.341 -32.157 -17.248 1.00 0.00 C ATOM 1158 O ILE B 134 38.852 -31.067 -16.990 1.00 0.00 O ATOM 1159 CB ILE B 134 38.011 -32.228 -19.721 1.00 0.00 C ATOM 1160 CG1 ILE B 134 36.996 -32.382 -20.856 1.00 0.00 C ATOM 1161 CG2 ILE B 134 39.082 -33.305 -19.812 1.00 0.00 C ATOM 1162 CD1 ILE B 134 37.510 -31.903 -22.196 1.00 0.00 C ATOM 0 H ILE B 134 36.242 -30.610 -19.025 1.00 0.00 H new ATOM 0 HA ILE B 134 36.796 -33.252 -18.262 1.00 0.00 H new ATOM 0 HB ILE B 134 38.493 -31.255 -19.818 1.00 0.00 H new ATOM 0 HG12 ILE B 134 36.712 -33.431 -20.939 1.00 0.00 H new ATOM 0 HG13 ILE B 134 36.093 -31.827 -20.603 1.00 0.00 H new ATOM 0 HG21 ILE B 134 39.575 -33.247 -20.783 1.00 0.00 H new ATOM 0 HG22 ILE B 134 39.818 -33.154 -19.022 1.00 0.00 H new ATOM 0 HG23 ILE B 134 38.622 -34.286 -19.696 1.00 0.00 H new ATOM 0 HD11 ILE B 134 36.738 -32.042 -22.953 1.00 0.00 H new ATOM 0 HD12 ILE B 134 37.767 -30.846 -22.130 1.00 0.00 H new ATOM 0 HD13 ILE B 134 38.396 -32.475 -22.472 1.00 0.00 H new TER 1174 ILE B 134