USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1068 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 27 TYR OH : rot 76:sc= 0.836 USER MOD Set 1.2: A 71 TYR OH : rot -80:sc= 0.217 USER MOD Set 1.3: A 140 GLN : amide:sc= -0.381 K(o=0.67,f=-0.59!) USER MOD Set 2.1: A 66 ASN : amide:sc= 0 K(o=-0.28,f=-1.2) USER MOD Set 2.2: A 68 HIS : no HD1:sc= -0.28 X(o=-0.28,f=-0.71) USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 GLN :FLIP amide:sc= -0.541 F(o=-1.1,f=-0.54) USER MOD Single : A 23 HIS : no HD1:sc= -0.946 K(o=-0.95,f=-1.8) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 3:sc= 0.642 USER MOD Single : A 64 LYS NZ :NH3+ -92:sc= -0.0116 (180deg=-0.0243) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0119) USER MOD Single : A 78 SER OG : rot 180:sc= 0.00757 USER MOD Single : A 80 ASN : amide:sc= -1.39 X(o=-1.4,f=-1.6) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot -158:sc= 1.47 USER MOD Single : A 101 ASN :FLIP amide:sc= -0.592 F(o=-2.2,f=-0.59) USER MOD Single : A 103 HIS :FLIP no HE2:sc= -0.531 F(o=-1.9,f=-0.53) USER MOD Single : A 109 THR OG1 : rot -48:sc= -1.34 USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.0713 USER MOD Single : A 117 ASN : amide:sc= -0.43 K(o=-0.43,f=-4.5!) USER MOD Single : A 119 ASN : amide:sc= -1.8! C(o=-1.8!,f=-3.4!) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 180:sc= -0.0192 USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 MET CE :methyl -114:sc= -0.104 (180deg=-1.63!) USER MOD Single : A 142 THR OG1 : rot -177:sc= 1.13 USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= -0.152 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 ASN : amide:sc= -1.44 K(o=-1.4,f=-4.5!) USER MOD Single : A 150 ASN : amide:sc= -0.133 K(o=-0.13,f=-1) USER MOD Single : A 152 ASN : amide:sc= -0.0219 X(o=-0.022,f=0) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 161 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD ----------------------------------------------------------------- ATOM 34 N ALA A 3 -13.769 6.251 30.477 1.00 0.00 N ATOM 35 CA ALA A 3 -14.541 5.092 30.045 1.00 0.00 C ATOM 36 C ALA A 3 -14.310 4.793 28.566 1.00 0.00 C ATOM 37 O ALA A 3 -14.521 3.669 28.112 1.00 0.00 O ATOM 38 CB ALA A 3 -16.021 5.316 30.314 1.00 0.00 C ATOM 0 HA ALA A 3 -14.203 4.229 30.618 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -16.586 4.443 29.987 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -16.177 5.470 31.382 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -16.361 6.195 29.767 1.00 0.00 H new ATOM 44 N ASP A 4 -13.875 5.804 27.819 1.00 0.00 N ATOM 45 CA ASP A 4 -13.615 5.643 26.393 1.00 0.00 C ATOM 46 C ASP A 4 -12.295 4.917 26.165 1.00 0.00 C ATOM 47 O ASP A 4 -12.252 3.871 25.518 1.00 0.00 O ATOM 48 CB ASP A 4 -13.589 7.006 25.699 1.00 0.00 C ATOM 49 CG ASP A 4 -14.196 6.958 24.311 1.00 0.00 C ATOM 50 OD1 ASP A 4 -13.515 6.474 23.382 1.00 0.00 O ATOM 51 OD2 ASP A 4 -15.351 7.405 24.152 1.00 0.00 O ATOM 0 H ASP A 4 -13.696 6.742 28.178 1.00 0.00 H new ATOM 0 HA ASP A 4 -14.419 5.044 25.966 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -14.133 7.730 26.306 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -12.559 7.357 25.631 1.00 0.00 H new ATOM 57 N GLU A 5 -11.219 5.478 26.707 1.00 0.00 N ATOM 58 CA GLU A 5 -9.897 4.883 26.569 1.00 0.00 C ATOM 59 C GLU A 5 -9.801 3.590 27.375 1.00 0.00 C ATOM 60 O GLU A 5 -9.008 2.705 27.054 1.00 0.00 O ATOM 61 CB GLU A 5 -8.818 5.869 27.028 1.00 0.00 C ATOM 62 CG GLU A 5 -8.068 6.526 25.881 1.00 0.00 C ATOM 63 CD GLU A 5 -7.136 7.627 26.347 1.00 0.00 C ATOM 64 OE1 GLU A 5 -7.395 8.803 26.017 1.00 0.00 O ATOM 65 OE2 GLU A 5 -6.149 7.314 27.045 1.00 0.00 O ATOM 0 H GLU A 5 -11.238 6.344 27.246 1.00 0.00 H new ATOM 0 HA GLU A 5 -9.737 4.649 25.517 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -9.281 6.643 27.639 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -8.105 5.345 27.664 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -7.492 5.769 25.348 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -8.786 6.939 25.172 1.00 0.00 H new ATOM 73 N TRP A 6 -10.615 3.489 28.421 1.00 0.00 N ATOM 74 CA TRP A 6 -10.623 2.304 29.271 1.00 0.00 C ATOM 75 C TRP A 6 -11.318 1.139 28.573 1.00 0.00 C ATOM 76 O TRP A 6 -10.962 -0.021 28.777 1.00 0.00 O ATOM 77 CB TRP A 6 -11.321 2.608 30.598 1.00 0.00 C ATOM 78 CG TRP A 6 -11.292 1.462 31.562 1.00 0.00 C ATOM 79 CD1 TRP A 6 -10.199 0.965 32.212 1.00 0.00 C ATOM 80 CD2 TRP A 6 -12.406 0.668 31.985 1.00 0.00 C ATOM 81 NE1 TRP A 6 -10.565 -0.088 33.013 1.00 0.00 N ATOM 82 CE2 TRP A 6 -11.915 -0.291 32.892 1.00 0.00 C ATOM 83 CE3 TRP A 6 -13.771 0.676 31.686 1.00 0.00 C ATOM 84 CZ2 TRP A 6 -12.743 -1.231 33.501 1.00 0.00 C ATOM 85 CZ3 TRP A 6 -14.591 -0.258 32.291 1.00 0.00 C ATOM 86 CH2 TRP A 6 -14.074 -1.200 33.190 1.00 0.00 C ATOM 0 H TRP A 6 -11.277 4.213 28.700 1.00 0.00 H new ATOM 0 HA TRP A 6 -9.589 2.021 29.468 1.00 0.00 H new ATOM 0 HB2 TRP A 6 -10.846 3.474 31.060 1.00 0.00 H new ATOM 0 HB3 TRP A 6 -12.358 2.881 30.401 1.00 0.00 H new ATOM 0 HD1 TRP A 6 -9.193 1.345 32.111 1.00 0.00 H new ATOM 0 HE1 TRP A 6 -9.934 -0.631 33.603 1.00 0.00 H new ATOM 0 HE3 TRP A 6 -14.178 1.399 30.995 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 -12.348 -1.959 34.194 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 -15.648 -0.262 32.067 1.00 0.00 H new ATOM 0 HH2 TRP A 6 -14.741 -1.916 33.647 1.00 0.00 H new ATOM 97 N MET A 7 -12.310 1.458 27.748 1.00 0.00 N ATOM 98 CA MET A 7 -13.055 0.438 27.019 1.00 0.00 C ATOM 99 C MET A 7 -12.262 -0.061 25.815 1.00 0.00 C ATOM 100 O MET A 7 -12.160 -1.265 25.581 1.00 0.00 O ATOM 101 CB MET A 7 -14.406 0.994 26.562 1.00 0.00 C ATOM 102 CG MET A 7 -15.552 0.657 27.501 1.00 0.00 C ATOM 103 SD MET A 7 -17.115 0.418 26.632 1.00 0.00 S ATOM 104 CE MET A 7 -18.157 -0.165 27.967 1.00 0.00 C ATOM 0 H MET A 7 -12.616 2.414 27.568 1.00 0.00 H new ATOM 0 HA MET A 7 -13.224 -0.403 27.691 1.00 0.00 H new ATOM 0 HB2 MET A 7 -14.331 2.077 26.468 1.00 0.00 H new ATOM 0 HB3 MET A 7 -14.633 0.603 25.570 1.00 0.00 H new ATOM 0 HG2 MET A 7 -15.307 -0.248 28.056 1.00 0.00 H new ATOM 0 HG3 MET A 7 -15.666 1.458 28.231 1.00 0.00 H new ATOM 0 HE1 MET A 7 -19.160 -0.358 27.588 1.00 0.00 H new ATOM 0 HE2 MET A 7 -17.741 -1.085 28.378 1.00 0.00 H new ATOM 0 HE3 MET A 7 -18.204 0.593 28.749 1.00 0.00 H new ATOM 114 N THR A 8 -11.705 0.874 25.052 1.00 0.00 N ATOM 115 CA THR A 8 -10.922 0.530 23.870 1.00 0.00 C ATOM 116 C THR A 8 -9.731 -0.348 24.238 1.00 0.00 C ATOM 117 O THR A 8 -9.474 -1.365 23.593 1.00 0.00 O ATOM 118 CB THR A 8 -10.436 1.800 23.168 1.00 0.00 C ATOM 119 OG1 THR A 8 -9.716 1.478 21.991 1.00 0.00 O ATOM 120 CG2 THR A 8 -9.539 2.657 24.035 1.00 0.00 C ATOM 0 H THR A 8 -11.781 1.875 25.231 1.00 0.00 H new ATOM 0 HA THR A 8 -11.565 -0.031 23.192 1.00 0.00 H new ATOM 0 HB THR A 8 -11.339 2.366 22.937 1.00 0.00 H new ATOM 0 HG1 THR A 8 -9.415 2.303 21.556 1.00 0.00 H new ATOM 0 HG21 THR A 8 -9.230 3.541 23.477 1.00 0.00 H new ATOM 0 HG22 THR A 8 -10.082 2.964 24.929 1.00 0.00 H new ATOM 0 HG23 THR A 8 -8.658 2.084 24.324 1.00 0.00 H new ATOM 128 N THR A 9 -9.006 0.050 25.279 1.00 0.00 N ATOM 129 CA THR A 9 -7.842 -0.702 25.731 1.00 0.00 C ATOM 130 C THR A 9 -8.231 -2.121 26.131 1.00 0.00 C ATOM 131 O THR A 9 -7.548 -3.085 25.781 1.00 0.00 O ATOM 132 CB THR A 9 -7.176 0.009 26.911 1.00 0.00 C ATOM 133 OG1 THR A 9 -5.988 -0.660 27.293 1.00 0.00 O ATOM 134 CG2 THR A 9 -8.064 0.101 28.134 1.00 0.00 C ATOM 0 H THR A 9 -9.204 0.889 25.825 1.00 0.00 H new ATOM 0 HA THR A 9 -7.135 -0.759 24.904 1.00 0.00 H new ATOM 0 HB THR A 9 -6.966 1.019 26.558 1.00 0.00 H new ATOM 0 HG1 THR A 9 -5.576 -0.190 28.048 1.00 0.00 H new ATOM 0 HG21 THR A 9 -7.531 0.616 28.933 1.00 0.00 H new ATOM 0 HG22 THR A 9 -8.969 0.655 27.886 1.00 0.00 H new ATOM 0 HG23 THR A 9 -8.332 -0.902 28.465 1.00 0.00 H new ATOM 142 N PHE A 10 -9.331 -2.244 26.867 1.00 0.00 N ATOM 143 CA PHE A 10 -9.809 -3.546 27.315 1.00 0.00 C ATOM 144 C PHE A 10 -10.315 -4.374 26.137 1.00 0.00 C ATOM 145 O PHE A 10 -9.990 -5.555 26.011 1.00 0.00 O ATOM 146 CB PHE A 10 -10.924 -3.376 28.348 1.00 0.00 C ATOM 147 CG PHE A 10 -10.987 -4.492 29.352 1.00 0.00 C ATOM 148 CD1 PHE A 10 -11.205 -5.798 28.943 1.00 0.00 C ATOM 149 CD2 PHE A 10 -10.829 -4.234 30.704 1.00 0.00 C ATOM 150 CE1 PHE A 10 -11.264 -6.826 29.864 1.00 0.00 C ATOM 151 CE2 PHE A 10 -10.886 -5.259 31.630 1.00 0.00 C ATOM 152 CZ PHE A 10 -11.104 -6.557 31.210 1.00 0.00 C ATOM 0 H PHE A 10 -9.908 -1.457 27.166 1.00 0.00 H new ATOM 0 HA PHE A 10 -8.973 -4.073 27.776 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -10.780 -2.432 28.874 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -11.881 -3.309 27.830 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -11.330 -6.015 27.892 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -10.659 -3.221 31.038 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -11.435 -7.839 29.532 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -10.760 -5.045 32.681 1.00 0.00 H new ATOM 0 HZ PHE A 10 -11.149 -7.359 31.932 1.00 0.00 H new ATOM 162 N ARG A 11 -11.111 -3.747 25.277 1.00 0.00 N ATOM 163 CA ARG A 11 -11.660 -4.427 24.109 1.00 0.00 C ATOM 164 C ARG A 11 -10.549 -4.850 23.153 1.00 0.00 C ATOM 165 O ARG A 11 -10.634 -5.896 22.510 1.00 0.00 O ATOM 166 CB ARG A 11 -12.655 -3.518 23.385 1.00 0.00 C ATOM 167 CG ARG A 11 -14.109 -3.834 23.698 1.00 0.00 C ATOM 168 CD ARG A 11 -14.968 -2.580 23.692 1.00 0.00 C ATOM 169 NE ARG A 11 -15.749 -2.457 22.464 1.00 0.00 N ATOM 170 CZ ARG A 11 -15.276 -1.947 21.328 1.00 0.00 C ATOM 171 NH1 ARG A 11 -14.024 -1.511 21.258 1.00 0.00 N ATOM 172 NH2 ARG A 11 -16.057 -1.872 20.259 1.00 0.00 N ATOM 0 H ARG A 11 -11.390 -2.770 25.367 1.00 0.00 H new ATOM 0 HA ARG A 11 -12.179 -5.322 24.451 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -12.451 -2.482 23.656 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -12.497 -3.604 22.310 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -14.494 -4.543 22.965 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -14.175 -4.316 24.673 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -15.641 -2.598 24.549 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -14.330 -1.703 23.805 1.00 0.00 H new ATOM 0 HE ARG A 11 -16.716 -2.782 22.477 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -13.418 -1.566 22.077 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -13.668 -1.122 20.385 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -17.020 -2.205 20.307 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -15.695 -1.481 19.389 1.00 0.00 H new ATOM 186 N GLU A 12 -9.506 -4.030 23.066 1.00 0.00 N ATOM 187 CA GLU A 12 -8.379 -4.319 22.187 1.00 0.00 C ATOM 188 C GLU A 12 -7.501 -5.420 22.772 1.00 0.00 C ATOM 189 O GLU A 12 -6.936 -6.232 22.039 1.00 0.00 O ATOM 190 CB GLU A 12 -7.548 -3.055 21.959 1.00 0.00 C ATOM 191 CG GLU A 12 -8.191 -2.068 20.999 1.00 0.00 C ATOM 192 CD GLU A 12 -7.608 -2.147 19.603 1.00 0.00 C ATOM 193 OE1 GLU A 12 -7.032 -3.201 19.259 1.00 0.00 O ATOM 194 OE2 GLU A 12 -7.727 -1.155 18.852 1.00 0.00 O ATOM 0 H GLU A 12 -9.418 -3.161 23.593 1.00 0.00 H new ATOM 0 HA GLU A 12 -8.774 -4.664 21.231 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -7.382 -2.562 22.917 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -6.569 -3.339 21.573 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -9.263 -2.259 20.952 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -8.064 -1.057 21.385 1.00 0.00 H new ATOM 202 N ASN A 13 -7.390 -5.442 24.096 1.00 0.00 N ATOM 203 CA ASN A 13 -6.580 -6.444 24.778 1.00 0.00 C ATOM 204 C ASN A 13 -7.190 -7.834 24.625 1.00 0.00 C ATOM 205 O ASN A 13 -6.515 -8.778 24.215 1.00 0.00 O ATOM 206 CB ASN A 13 -6.442 -6.096 26.261 1.00 0.00 C ATOM 207 CG ASN A 13 -5.077 -6.454 26.815 1.00 0.00 C ATOM 208 OD1 ASN A 13 -4.444 -7.410 26.367 1.00 0.00 O ATOM 209 ND2 ASN A 13 -4.616 -5.687 27.796 1.00 0.00 N ATOM 0 H ASN A 13 -7.851 -4.777 24.718 1.00 0.00 H new ATOM 0 HA ASN A 13 -5.591 -6.448 24.319 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -6.618 -5.029 26.399 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -7.210 -6.622 26.828 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -3.703 -5.880 28.209 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -5.174 -4.904 28.137 1.00 0.00 H new ATOM 216 N ILE A 14 -8.472 -7.952 24.957 1.00 0.00 N ATOM 217 CA ILE A 14 -9.173 -9.226 24.857 1.00 0.00 C ATOM 218 C ILE A 14 -9.256 -9.694 23.407 1.00 0.00 C ATOM 219 O ILE A 14 -9.228 -10.893 23.128 1.00 0.00 O ATOM 220 CB ILE A 14 -10.597 -9.129 25.443 1.00 0.00 C ATOM 221 CG1 ILE A 14 -11.274 -10.502 25.432 1.00 0.00 C ATOM 222 CG2 ILE A 14 -11.425 -8.116 24.667 1.00 0.00 C ATOM 223 CD1 ILE A 14 -10.749 -11.442 26.495 1.00 0.00 C ATOM 0 H ILE A 14 -9.046 -7.180 25.297 1.00 0.00 H new ATOM 0 HA ILE A 14 -8.601 -9.952 25.435 1.00 0.00 H new ATOM 0 HB ILE A 14 -10.524 -8.791 26.477 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -12.347 -10.370 25.572 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -11.134 -10.959 24.453 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -12.426 -8.061 25.094 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -10.951 -7.136 24.726 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -11.492 -8.424 23.624 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -11.273 -12.395 26.429 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -9.682 -11.603 26.343 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -10.913 -11.005 27.480 1.00 0.00 H new ATOM 235 N ALA A 15 -9.361 -8.741 22.488 1.00 0.00 N ATOM 236 CA ALA A 15 -9.448 -9.056 21.067 1.00 0.00 C ATOM 237 C ALA A 15 -8.096 -9.499 20.518 1.00 0.00 C ATOM 238 O ALA A 15 -8.026 -10.307 19.591 1.00 0.00 O ATOM 239 CB ALA A 15 -9.965 -7.854 20.292 1.00 0.00 C ATOM 0 H ALA A 15 -9.388 -7.744 22.701 1.00 0.00 H new ATOM 0 HA ALA A 15 -10.148 -9.883 20.946 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -10.025 -8.103 19.232 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -10.955 -7.584 20.658 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -9.285 -7.013 20.429 1.00 0.00 H new ATOM 245 N GLN A 16 -7.024 -8.967 21.095 1.00 0.00 N ATOM 246 CA GLN A 16 -5.674 -9.308 20.663 1.00 0.00 C ATOM 247 C GLN A 16 -5.256 -10.673 21.203 1.00 0.00 C ATOM 248 O GLN A 16 -4.774 -11.525 20.456 1.00 0.00 O ATOM 249 CB GLN A 16 -4.683 -8.236 21.123 1.00 0.00 C ATOM 250 CG GLN A 16 -4.200 -7.331 20.001 1.00 0.00 C ATOM 251 CD GLN A 16 -2.732 -7.535 19.678 1.00 0.00 C ATOM 252 OE1 GLN A 16 -2.361 -8.482 18.987 1.00 0.00 O ATOM 253 NE2 GLN A 16 -1.887 -6.640 20.179 1.00 0.00 N ATOM 0 H GLN A 16 -7.064 -8.298 21.863 1.00 0.00 H new ATOM 0 HA GLN A 16 -5.669 -9.354 19.574 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -5.153 -7.625 21.894 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -3.822 -8.722 21.582 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -4.794 -7.518 19.107 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -4.365 -6.291 20.282 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -2.238 -5.869 20.748 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -0.887 -6.724 19.995 1.00 0.00 H new ATOM 262 N THR A 17 -5.444 -10.873 22.503 1.00 0.00 N ATOM 263 CA THR A 17 -5.085 -12.135 23.142 1.00 0.00 C ATOM 264 C THR A 17 -5.828 -13.304 22.503 1.00 0.00 C ATOM 265 O THR A 17 -5.323 -14.426 22.463 1.00 0.00 O ATOM 266 CB THR A 17 -5.395 -12.078 24.639 1.00 0.00 C ATOM 267 OG1 THR A 17 -5.193 -13.345 25.241 1.00 0.00 O ATOM 268 CG2 THR A 17 -6.813 -11.645 24.941 1.00 0.00 C ATOM 0 H THR A 17 -5.842 -10.178 23.135 1.00 0.00 H new ATOM 0 HA THR A 17 -4.015 -12.290 23.003 1.00 0.00 H new ATOM 0 HB THR A 17 -4.712 -11.334 25.048 1.00 0.00 H new ATOM 0 HG1 THR A 17 -5.395 -13.288 26.198 1.00 0.00 H new ATOM 0 HG21 THR A 17 -6.966 -11.626 26.020 1.00 0.00 H new ATOM 0 HG22 THR A 17 -6.984 -10.649 24.533 1.00 0.00 H new ATOM 0 HG23 THR A 17 -7.512 -12.348 24.488 1.00 0.00 H new ATOM 276 N TRP A 18 -7.030 -13.034 22.003 1.00 0.00 N ATOM 277 CA TRP A 18 -7.842 -14.065 21.365 1.00 0.00 C ATOM 278 C TRP A 18 -7.347 -14.352 19.952 1.00 0.00 C ATOM 279 O TRP A 18 -7.014 -15.490 19.618 1.00 0.00 O ATOM 280 CB TRP A 18 -9.311 -13.638 21.332 1.00 0.00 C ATOM 281 CG TRP A 18 -10.205 -14.518 22.151 1.00 0.00 C ATOM 282 CD1 TRP A 18 -11.393 -15.069 21.764 1.00 0.00 C ATOM 283 CD2 TRP A 18 -9.982 -14.951 23.498 1.00 0.00 C ATOM 284 NE1 TRP A 18 -11.922 -15.817 22.788 1.00 0.00 N ATOM 285 CE2 TRP A 18 -11.074 -15.760 23.863 1.00 0.00 C ATOM 286 CE3 TRP A 18 -8.964 -14.733 24.431 1.00 0.00 C ATOM 287 CZ2 TRP A 18 -11.177 -16.350 25.121 1.00 0.00 C ATOM 288 CZ3 TRP A 18 -9.067 -15.319 25.679 1.00 0.00 C ATOM 289 CH2 TRP A 18 -10.166 -16.119 26.013 1.00 0.00 C ATOM 0 H TRP A 18 -7.463 -12.111 22.027 1.00 0.00 H new ATOM 0 HA TRP A 18 -7.752 -14.979 21.951 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -9.392 -12.613 21.694 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -9.659 -13.640 20.299 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -11.850 -14.936 20.795 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -12.802 -16.331 22.754 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -8.112 -14.118 24.181 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -12.024 -16.967 25.382 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -8.287 -15.157 26.408 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -10.217 -16.563 26.996 1.00 0.00 H new ATOM 300 N GLN A 19 -7.301 -13.312 19.124 1.00 0.00 N ATOM 301 CA GLN A 19 -6.847 -13.453 17.744 1.00 0.00 C ATOM 302 C GLN A 19 -5.424 -13.997 17.691 1.00 0.00 C ATOM 303 O GLN A 19 -5.177 -15.067 17.133 1.00 0.00 O ATOM 304 CB GLN A 19 -6.917 -12.105 17.024 1.00 0.00 C ATOM 305 CG GLN A 19 -7.318 -12.217 15.562 1.00 0.00 C ATOM 306 CD GLN A 19 -8.659 -12.897 15.375 1.00 0.00 C ATOM 307 OE1 GLN A 19 -8.636 -14.212 15.190 1.00 0.00 O flip ATOM 308 NE2 GLN A 19 -9.706 -12.249 15.398 1.00 0.00 N flip ATOM 0 H GLN A 19 -7.572 -12.364 19.384 1.00 0.00 H new ATOM 0 HA GLN A 19 -7.505 -14.162 17.242 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -7.631 -11.463 17.540 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -5.945 -11.617 17.089 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -7.356 -11.220 15.122 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -6.554 -12.775 15.021 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -9.678 -11.240 15.543 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -10.601 -12.722 15.272 1.00 0.00 H new ATOM 334 N PRO A 21 -2.240 -12.619 16.240 1.00 0.00 N ATOM 335 CA PRO A 21 -1.700 -12.586 14.877 1.00 0.00 C ATOM 336 C PRO A 21 -0.471 -13.475 14.720 1.00 0.00 C ATOM 337 O PRO A 21 0.054 -14.006 15.699 1.00 0.00 O ATOM 338 CB PRO A 21 -1.327 -11.117 14.676 1.00 0.00 C ATOM 339 CG PRO A 21 -2.217 -10.369 15.608 1.00 0.00 C ATOM 340 CD PRO A 21 -2.414 -11.265 16.799 1.00 0.00 C ATOM 0 HA PRO A 21 -2.417 -12.960 14.146 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -0.276 -10.941 14.905 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -1.485 -10.806 13.643 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -1.766 -9.421 15.903 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -3.170 -10.134 15.134 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -1.686 -11.057 17.583 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -3.403 -11.136 17.240 1.00 0.00 H new ATOM 348 N GLU A 22 -0.015 -13.633 13.482 1.00 0.00 N ATOM 349 CA GLU A 22 1.155 -14.456 13.196 1.00 0.00 C ATOM 350 C GLU A 22 2.415 -13.602 13.111 1.00 0.00 C ATOM 351 O GLU A 22 3.446 -13.939 13.693 1.00 0.00 O ATOM 352 CB GLU A 22 0.955 -15.224 11.888 1.00 0.00 C ATOM 353 CG GLU A 22 0.153 -16.505 12.050 1.00 0.00 C ATOM 354 CD GLU A 22 0.451 -17.520 10.964 1.00 0.00 C ATOM 355 OE1 GLU A 22 1.445 -18.263 11.102 1.00 0.00 O ATOM 356 OE2 GLU A 22 -0.311 -17.572 9.975 1.00 0.00 O ATOM 0 H GLU A 22 -0.438 -13.202 12.660 1.00 0.00 H new ATOM 0 HA GLU A 22 1.276 -15.167 14.013 1.00 0.00 H new ATOM 0 HB2 GLU A 22 0.450 -14.577 11.171 1.00 0.00 H new ATOM 0 HB3 GLU A 22 1.930 -15.467 11.466 1.00 0.00 H new ATOM 0 HG2 GLU A 22 0.371 -16.945 13.023 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -0.911 -16.267 12.038 1.00 0.00 H new ATOM 364 N HIS A 23 2.324 -12.494 12.383 1.00 0.00 N ATOM 365 CA HIS A 23 3.458 -11.590 12.222 1.00 0.00 C ATOM 366 C HIS A 23 2.991 -10.141 12.138 1.00 0.00 C ATOM 367 O HIS A 23 2.133 -9.801 11.323 1.00 0.00 O ATOM 368 CB HIS A 23 4.254 -11.956 10.967 1.00 0.00 C ATOM 369 CG HIS A 23 4.632 -13.404 10.899 1.00 0.00 C ATOM 370 ND1 HIS A 23 3.856 -14.356 10.272 1.00 0.00 N ATOM 371 CD2 HIS A 23 5.713 -14.061 11.384 1.00 0.00 C ATOM 372 CE1 HIS A 23 4.443 -15.536 10.374 1.00 0.00 C ATOM 373 NE2 HIS A 23 5.571 -15.383 11.044 1.00 0.00 N ATOM 0 H HIS A 23 1.478 -12.200 11.895 1.00 0.00 H new ATOM 0 HA HIS A 23 4.102 -11.695 13.096 1.00 0.00 H new ATOM 0 HB2 HIS A 23 3.665 -11.701 10.086 1.00 0.00 H new ATOM 0 HB3 HIS A 23 5.160 -11.350 10.932 1.00 0.00 H new ATOM 0 HD2 HIS A 23 6.533 -13.626 11.935 1.00 0.00 H new ATOM 0 HE1 HIS A 23 4.065 -16.467 9.977 1.00 0.00 H new ATOM 0 HE2 HIS A 23 6.230 -16.127 11.272 1.00 0.00 H new ATOM 382 N TYR A 24 3.562 -9.290 12.985 1.00 0.00 N ATOM 383 CA TYR A 24 3.203 -7.876 13.007 1.00 0.00 C ATOM 384 C TYR A 24 3.896 -7.122 11.876 1.00 0.00 C ATOM 385 O TYR A 24 5.096 -7.284 11.653 1.00 0.00 O ATOM 386 CB TYR A 24 3.576 -7.255 14.355 1.00 0.00 C ATOM 387 CG TYR A 24 2.531 -6.305 14.894 1.00 0.00 C ATOM 388 CD1 TYR A 24 2.070 -5.241 14.128 1.00 0.00 C ATOM 389 CD2 TYR A 24 2.004 -6.472 16.169 1.00 0.00 C ATOM 390 CE1 TYR A 24 1.115 -4.370 14.618 1.00 0.00 C ATOM 391 CE2 TYR A 24 1.048 -5.605 16.666 1.00 0.00 C ATOM 392 CZ TYR A 24 0.608 -4.557 15.887 1.00 0.00 C ATOM 393 OH TYR A 24 -0.343 -3.692 16.377 1.00 0.00 O ATOM 0 H TYR A 24 4.275 -9.555 13.665 1.00 0.00 H new ATOM 0 HA TYR A 24 2.125 -7.797 12.865 1.00 0.00 H new ATOM 0 HB2 TYR A 24 3.739 -8.052 15.080 1.00 0.00 H new ATOM 0 HB3 TYR A 24 4.521 -6.721 14.251 1.00 0.00 H new ATOM 0 HD1 TYR A 24 2.464 -5.092 13.134 1.00 0.00 H new ATOM 0 HD2 TYR A 24 2.347 -7.293 16.782 1.00 0.00 H new ATOM 0 HE1 TYR A 24 0.768 -3.547 14.010 1.00 0.00 H new ATOM 0 HE2 TYR A 24 0.649 -5.749 17.659 1.00 0.00 H new ATOM 0 HH TYR A 24 -0.596 -3.964 17.284 1.00 0.00 H new ATOM 403 N ASP A 25 3.133 -6.298 11.167 1.00 0.00 N ATOM 404 CA ASP A 25 3.673 -5.518 10.060 1.00 0.00 C ATOM 405 C ASP A 25 4.211 -4.177 10.551 1.00 0.00 C ATOM 406 O ASP A 25 3.724 -3.625 11.536 1.00 0.00 O ATOM 407 CB ASP A 25 2.597 -5.290 8.996 1.00 0.00 C ATOM 408 CG ASP A 25 2.262 -6.557 8.233 1.00 0.00 C ATOM 409 OD1 ASP A 25 3.099 -6.999 7.419 1.00 0.00 O ATOM 410 OD2 ASP A 25 1.162 -7.106 8.451 1.00 0.00 O ATOM 0 H ASP A 25 2.138 -6.153 11.339 1.00 0.00 H new ATOM 0 HA ASP A 25 4.496 -6.081 9.620 1.00 0.00 H new ATOM 0 HB2 ASP A 25 1.695 -4.906 9.472 1.00 0.00 H new ATOM 0 HB3 ASP A 25 2.938 -4.527 8.296 1.00 0.00 H new ATOM 416 N LEU A 26 5.220 -3.660 9.855 1.00 0.00 N ATOM 417 CA LEU A 26 5.823 -2.384 10.220 1.00 0.00 C ATOM 418 C LEU A 26 5.996 -1.494 8.994 1.00 0.00 C ATOM 419 O LEU A 26 6.606 -1.896 8.003 1.00 0.00 O ATOM 420 CB LEU A 26 7.178 -2.613 10.893 1.00 0.00 C ATOM 421 CG LEU A 26 7.519 -1.628 12.014 1.00 0.00 C ATOM 422 CD1 LEU A 26 8.679 -2.149 12.848 1.00 0.00 C ATOM 423 CD2 LEU A 26 7.845 -0.259 11.438 1.00 0.00 C ATOM 0 H LEU A 26 5.636 -4.105 9.037 1.00 0.00 H new ATOM 0 HA LEU A 26 5.156 -1.881 10.920 1.00 0.00 H new ATOM 0 HB2 LEU A 26 7.198 -3.624 11.300 1.00 0.00 H new ATOM 0 HB3 LEU A 26 7.958 -2.559 10.133 1.00 0.00 H new ATOM 0 HG LEU A 26 6.649 -1.529 12.663 1.00 0.00 H new ATOM 0 HD11 LEU A 26 8.907 -1.436 13.640 1.00 0.00 H new ATOM 0 HD12 LEU A 26 8.407 -3.107 13.290 1.00 0.00 H new ATOM 0 HD13 LEU A 26 9.555 -2.278 12.212 1.00 0.00 H new ATOM 0 HD21 LEU A 26 8.085 0.429 12.249 1.00 0.00 H new ATOM 0 HD22 LEU A 26 8.700 -0.341 10.766 1.00 0.00 H new ATOM 0 HD23 LEU A 26 6.984 0.118 10.885 1.00 0.00 H new ATOM 435 N TYR A 27 5.452 -0.283 9.068 1.00 0.00 N ATOM 436 CA TYR A 27 5.546 0.665 7.964 1.00 0.00 C ATOM 437 C TYR A 27 6.770 1.562 8.117 1.00 0.00 C ATOM 438 O TYR A 27 6.854 2.360 9.051 1.00 0.00 O ATOM 439 CB TYR A 27 4.276 1.518 7.889 1.00 0.00 C ATOM 440 CG TYR A 27 3.451 1.268 6.647 1.00 0.00 C ATOM 441 CD1 TYR A 27 3.766 1.886 5.444 1.00 0.00 C ATOM 442 CD2 TYR A 27 2.356 0.412 6.677 1.00 0.00 C ATOM 443 CE1 TYR A 27 3.014 1.660 4.307 1.00 0.00 C ATOM 444 CE2 TYR A 27 1.600 0.181 5.545 1.00 0.00 C ATOM 445 CZ TYR A 27 1.932 0.807 4.362 1.00 0.00 C ATOM 446 OH TYR A 27 1.181 0.579 3.232 1.00 0.00 O ATOM 0 H TYR A 27 4.942 0.064 9.880 1.00 0.00 H new ATOM 0 HA TYR A 27 5.650 0.099 7.039 1.00 0.00 H new ATOM 0 HB2 TYR A 27 3.663 1.320 8.768 1.00 0.00 H new ATOM 0 HB3 TYR A 27 4.553 2.572 7.925 1.00 0.00 H new ATOM 0 HD1 TYR A 27 4.613 2.554 5.396 1.00 0.00 H new ATOM 0 HD2 TYR A 27 2.092 -0.081 7.601 1.00 0.00 H new ATOM 0 HE1 TYR A 27 3.273 2.149 3.380 1.00 0.00 H new ATOM 0 HE2 TYR A 27 0.752 -0.487 5.586 1.00 0.00 H new ATOM 0 HH TYR A 27 1.666 -0.026 2.633 1.00 0.00 H new ATOM 456 N ILE A 28 7.717 1.426 7.196 1.00 0.00 N ATOM 457 CA ILE A 28 8.936 2.223 7.227 1.00 0.00 C ATOM 458 C ILE A 28 9.431 2.529 5.817 1.00 0.00 C ATOM 459 O ILE A 28 9.139 1.792 4.875 1.00 0.00 O ATOM 460 CB ILE A 28 10.056 1.509 8.008 1.00 0.00 C ATOM 461 CG1 ILE A 28 10.228 0.075 7.501 1.00 0.00 C ATOM 462 CG2 ILE A 28 9.752 1.517 9.499 1.00 0.00 C ATOM 463 CD1 ILE A 28 11.104 -0.030 6.272 1.00 0.00 C ATOM 0 H ILE A 28 7.663 0.770 6.417 1.00 0.00 H new ATOM 0 HA ILE A 28 8.689 3.156 7.733 1.00 0.00 H new ATOM 0 HB ILE A 28 10.990 2.046 7.845 1.00 0.00 H new ATOM 0 HG12 ILE A 28 10.657 -0.534 8.296 1.00 0.00 H new ATOM 0 HG13 ILE A 28 9.247 -0.342 7.275 1.00 0.00 H new ATOM 0 HG21 ILE A 28 10.553 1.009 10.036 1.00 0.00 H new ATOM 0 HG22 ILE A 28 9.676 2.546 9.849 1.00 0.00 H new ATOM 0 HG23 ILE A 28 8.809 1.002 9.681 1.00 0.00 H new ATOM 0 HD11 ILE A 28 11.182 -1.074 5.969 1.00 0.00 H new ATOM 0 HD12 ILE A 28 10.665 0.552 5.461 1.00 0.00 H new ATOM 0 HD13 ILE A 28 12.097 0.357 6.499 1.00 0.00 H new ATOM 475 N PRO A 29 10.192 3.625 5.651 1.00 0.00 N ATOM 476 CA PRO A 29 10.728 4.024 4.346 1.00 0.00 C ATOM 477 C PRO A 29 11.767 3.038 3.822 1.00 0.00 C ATOM 478 O PRO A 29 12.108 2.065 4.495 1.00 0.00 O ATOM 479 CB PRO A 29 11.374 5.385 4.622 1.00 0.00 C ATOM 480 CG PRO A 29 11.675 5.375 6.081 1.00 0.00 C ATOM 481 CD PRO A 29 10.590 4.558 6.722 1.00 0.00 C ATOM 0 HA PRO A 29 9.952 4.056 3.581 1.00 0.00 H new ATOM 0 HB2 PRO A 29 12.281 5.519 4.032 1.00 0.00 H new ATOM 0 HB3 PRO A 29 10.701 6.202 4.363 1.00 0.00 H new ATOM 0 HG2 PRO A 29 12.656 4.941 6.274 1.00 0.00 H new ATOM 0 HG3 PRO A 29 11.690 6.388 6.483 1.00 0.00 H new ATOM 0 HD2 PRO A 29 10.952 4.028 7.603 1.00 0.00 H new ATOM 0 HD3 PRO A 29 9.755 5.180 7.045 1.00 0.00 H new ATOM 489 N ALA A 30 12.266 3.296 2.618 1.00 0.00 N ATOM 490 CA ALA A 30 13.265 2.431 2.004 1.00 0.00 C ATOM 491 C ALA A 30 14.521 2.345 2.865 1.00 0.00 C ATOM 492 O ALA A 30 14.816 1.301 3.448 1.00 0.00 O ATOM 493 CB ALA A 30 13.612 2.933 0.610 1.00 0.00 C ATOM 0 H ALA A 30 11.995 4.097 2.048 1.00 0.00 H new ATOM 0 HA ALA A 30 12.842 1.430 1.923 1.00 0.00 H new ATOM 0 HB1 ALA A 30 14.359 2.278 0.163 1.00 0.00 H new ATOM 0 HB2 ALA A 30 12.715 2.936 -0.009 1.00 0.00 H new ATOM 0 HB3 ALA A 30 14.010 3.945 0.677 1.00 0.00 H new ATOM 872 N TRP A 52 10.025 10.985 13.826 1.00 0.00 N ATOM 873 CA TRP A 52 9.214 9.790 13.627 1.00 0.00 C ATOM 874 C TRP A 52 8.906 9.580 12.148 1.00 0.00 C ATOM 875 O TRP A 52 9.320 10.370 11.299 1.00 0.00 O ATOM 876 CB TRP A 52 7.911 9.893 14.422 1.00 0.00 C ATOM 877 CG TRP A 52 8.055 9.473 15.854 1.00 0.00 C ATOM 878 CD1 TRP A 52 8.802 8.435 16.331 1.00 0.00 C ATOM 879 CD2 TRP A 52 7.434 10.080 16.992 1.00 0.00 C ATOM 880 NE1 TRP A 52 8.684 8.360 17.698 1.00 0.00 N ATOM 881 CE2 TRP A 52 7.850 9.359 18.128 1.00 0.00 C ATOM 882 CE3 TRP A 52 6.569 11.164 17.163 1.00 0.00 C ATOM 883 CZ2 TRP A 52 7.429 9.687 19.413 1.00 0.00 C ATOM 884 CZ3 TRP A 52 6.151 11.489 18.440 1.00 0.00 C ATOM 885 CH2 TRP A 52 6.581 10.753 19.551 1.00 0.00 C ATOM 0 HA TRP A 52 9.783 8.932 13.986 1.00 0.00 H new ATOM 0 HB2 TRP A 52 7.552 10.922 14.387 1.00 0.00 H new ATOM 0 HB3 TRP A 52 7.152 9.274 13.944 1.00 0.00 H new ATOM 0 HD1 TRP A 52 9.398 7.770 15.723 1.00 0.00 H new ATOM 0 HE1 TRP A 52 9.143 7.672 18.296 1.00 0.00 H new ATOM 0 HE3 TRP A 52 6.233 11.738 16.312 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 7.759 9.121 20.271 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 5.482 12.324 18.583 1.00 0.00 H new ATOM 0 HH2 TRP A 52 6.237 11.032 20.536 1.00 0.00 H new ATOM 896 N GLY A 53 8.177 8.510 11.847 1.00 0.00 N ATOM 897 CA GLY A 53 7.825 8.216 10.470 1.00 0.00 C ATOM 898 C GLY A 53 7.534 6.745 10.248 1.00 0.00 C ATOM 899 O GLY A 53 8.452 5.935 10.123 1.00 0.00 O ATOM 0 H GLY A 53 7.824 7.842 12.532 1.00 0.00 H new ATOM 0 HA2 GLY A 53 6.951 8.803 10.188 1.00 0.00 H new ATOM 0 HA3 GLY A 53 8.640 8.525 9.816 1.00 0.00 H new ATOM 903 N GLY A 54 6.251 6.399 10.199 1.00 0.00 N ATOM 904 CA GLY A 54 5.863 5.016 9.992 1.00 0.00 C ATOM 905 C GLY A 54 4.761 4.574 10.934 1.00 0.00 C ATOM 906 O GLY A 54 4.016 5.402 11.460 1.00 0.00 O ATOM 0 H GLY A 54 5.474 7.052 10.299 1.00 0.00 H new ATOM 0 HA2 GLY A 54 5.530 4.886 8.962 1.00 0.00 H new ATOM 0 HA3 GLY A 54 6.733 4.374 10.129 1.00 0.00 H new ATOM 910 N GLY A 55 4.656 3.266 11.148 1.00 0.00 N ATOM 911 CA GLY A 55 3.634 2.739 12.034 1.00 0.00 C ATOM 912 C GLY A 55 3.571 1.225 12.010 1.00 0.00 C ATOM 913 O GLY A 55 4.545 0.561 11.654 1.00 0.00 O ATOM 0 H GLY A 55 5.260 2.562 10.724 1.00 0.00 H new ATOM 0 HA2 GLY A 55 3.831 3.075 13.052 1.00 0.00 H new ATOM 0 HA3 GLY A 55 2.664 3.145 11.747 1.00 0.00 H new ATOM 917 N PHE A 56 2.422 0.677 12.392 1.00 0.00 N ATOM 918 CA PHE A 56 2.234 -0.769 12.414 1.00 0.00 C ATOM 919 C PHE A 56 0.876 -1.150 11.835 1.00 0.00 C ATOM 920 O PHE A 56 0.057 -0.285 11.527 1.00 0.00 O ATOM 921 CB PHE A 56 2.359 -1.299 13.843 1.00 0.00 C ATOM 922 CG PHE A 56 3.546 -0.755 14.584 1.00 0.00 C ATOM 923 CD1 PHE A 56 4.820 -1.237 14.328 1.00 0.00 C ATOM 924 CD2 PHE A 56 3.390 0.239 15.537 1.00 0.00 C ATOM 925 CE1 PHE A 56 5.914 -0.738 15.008 1.00 0.00 C ATOM 926 CE2 PHE A 56 4.481 0.742 16.221 1.00 0.00 C ATOM 927 CZ PHE A 56 5.745 0.253 15.956 1.00 0.00 C ATOM 0 H PHE A 56 1.607 1.213 12.691 1.00 0.00 H new ATOM 0 HA PHE A 56 3.011 -1.220 11.797 1.00 0.00 H new ATOM 0 HB2 PHE A 56 1.452 -1.051 14.394 1.00 0.00 H new ATOM 0 HB3 PHE A 56 2.427 -2.387 13.814 1.00 0.00 H new ATOM 0 HD1 PHE A 56 4.959 -2.012 13.588 1.00 0.00 H new ATOM 0 HD2 PHE A 56 2.404 0.625 15.748 1.00 0.00 H new ATOM 0 HE1 PHE A 56 6.901 -1.122 14.799 1.00 0.00 H new ATOM 0 HE2 PHE A 56 4.345 1.516 16.962 1.00 0.00 H new ATOM 0 HZ PHE A 56 6.599 0.644 16.488 1.00 0.00 H new ATOM 937 N GLY A 57 0.643 -2.451 11.690 1.00 0.00 N ATOM 938 CA GLY A 57 -0.618 -2.922 11.147 1.00 0.00 C ATOM 939 C GLY A 57 -0.728 -4.435 11.164 1.00 0.00 C ATOM 940 O GLY A 57 0.248 -5.132 11.440 1.00 0.00 O ATOM 0 H GLY A 57 1.304 -3.187 11.939 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -1.440 -2.495 11.722 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -0.725 -2.564 10.123 1.00 0.00 H new ATOM 944 N LEU A 58 -1.921 -4.941 10.867 1.00 0.00 N ATOM 945 CA LEU A 58 -2.157 -6.381 10.849 1.00 0.00 C ATOM 946 C LEU A 58 -2.781 -6.813 9.526 1.00 0.00 C ATOM 947 O LEU A 58 -3.056 -5.983 8.658 1.00 0.00 O ATOM 948 CB LEU A 58 -3.067 -6.784 12.010 1.00 0.00 C ATOM 949 CG LEU A 58 -2.639 -6.259 13.382 1.00 0.00 C ATOM 950 CD1 LEU A 58 -3.242 -4.887 13.640 1.00 0.00 C ATOM 951 CD2 LEU A 58 -3.045 -7.236 14.476 1.00 0.00 C ATOM 0 H LEU A 58 -2.738 -4.376 10.636 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.196 -6.883 10.958 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -4.076 -6.429 11.801 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -3.115 -7.872 12.053 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.553 -6.164 13.391 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -2.927 -4.530 14.620 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -2.903 -4.190 12.873 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -4.329 -4.956 13.612 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.733 -6.847 15.445 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -4.128 -7.363 14.467 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -2.566 -8.199 14.300 1.00 0.00 H new ATOM 963 N SER A 59 -3.001 -8.114 9.379 1.00 0.00 N ATOM 964 CA SER A 59 -3.593 -8.657 8.161 1.00 0.00 C ATOM 965 C SER A 59 -4.453 -9.878 8.471 1.00 0.00 C ATOM 966 O SER A 59 -4.271 -10.532 9.497 1.00 0.00 O ATOM 967 CB SER A 59 -2.499 -9.030 7.159 1.00 0.00 C ATOM 968 OG SER A 59 -2.938 -8.830 5.827 1.00 0.00 O ATOM 0 H SER A 59 -2.779 -8.813 10.088 1.00 0.00 H new ATOM 0 HA SER A 59 -4.230 -7.888 7.723 1.00 0.00 H new ATOM 0 HB2 SER A 59 -1.610 -8.428 7.346 1.00 0.00 H new ATOM 0 HB3 SER A 59 -2.214 -10.073 7.299 1.00 0.00 H new ATOM 0 HG SER A 59 -3.838 -8.443 5.834 1.00 0.00 H new ATOM 974 N ARG A 60 -5.390 -10.178 7.577 1.00 0.00 N ATOM 975 CA ARG A 60 -6.277 -11.321 7.754 1.00 0.00 C ATOM 976 C ARG A 60 -6.615 -11.962 6.413 1.00 0.00 C ATOM 977 O ARG A 60 -6.656 -11.287 5.384 1.00 0.00 O ATOM 978 CB ARG A 60 -7.562 -10.891 8.465 1.00 0.00 C ATOM 979 CG ARG A 60 -8.282 -9.743 7.775 1.00 0.00 C ATOM 980 CD ARG A 60 -9.660 -9.510 8.374 1.00 0.00 C ATOM 981 NE ARG A 60 -9.585 -9.017 9.746 1.00 0.00 N ATOM 982 CZ ARG A 60 -10.590 -8.407 10.371 1.00 0.00 C ATOM 983 NH1 ARG A 60 -11.748 -8.214 9.751 1.00 0.00 N ATOM 984 NH2 ARG A 60 -10.438 -7.988 11.619 1.00 0.00 N ATOM 0 H ARG A 60 -5.554 -9.645 6.723 1.00 0.00 H new ATOM 0 HA ARG A 60 -5.759 -12.058 8.368 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -8.236 -11.746 8.529 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -7.322 -10.597 9.487 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -7.687 -8.834 7.863 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -8.378 -9.959 6.711 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -10.205 -8.793 7.761 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -10.226 -10.441 8.354 1.00 0.00 H new ATOM 0 HE ARG A 60 -8.711 -9.148 10.256 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -11.872 -8.534 8.790 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -12.514 -7.746 10.235 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -9.551 -8.133 12.101 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -11.208 -7.521 12.097 1.00 0.00 H new ATOM 998 N TRP A 61 -6.854 -13.268 6.430 1.00 0.00 N ATOM 999 CA TRP A 61 -7.188 -14.001 5.214 1.00 0.00 C ATOM 1000 C TRP A 61 -8.700 -14.119 5.047 1.00 0.00 C ATOM 1001 O TRP A 61 -9.426 -14.345 6.015 1.00 0.00 O ATOM 1002 CB TRP A 61 -6.557 -15.394 5.243 1.00 0.00 C ATOM 1003 CG TRP A 61 -6.809 -16.135 6.520 1.00 0.00 C ATOM 1004 CD1 TRP A 61 -6.037 -16.116 7.645 1.00 0.00 C ATOM 1005 CD2 TRP A 61 -7.912 -17.005 6.803 1.00 0.00 C ATOM 1006 NE1 TRP A 61 -6.592 -16.922 8.611 1.00 0.00 N ATOM 1007 CE2 TRP A 61 -7.742 -17.478 8.118 1.00 0.00 C ATOM 1008 CE3 TRP A 61 -9.025 -17.429 6.073 1.00 0.00 C ATOM 1009 CZ2 TRP A 61 -8.645 -18.353 8.717 1.00 0.00 C ATOM 1010 CZ3 TRP A 61 -9.921 -18.298 6.668 1.00 0.00 C ATOM 1011 CH2 TRP A 61 -9.726 -18.752 7.978 1.00 0.00 C ATOM 0 H TRP A 61 -6.823 -13.842 7.273 1.00 0.00 H new ATOM 0 HA TRP A 61 -6.789 -13.446 4.365 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -6.947 -15.979 4.410 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -5.482 -15.301 5.092 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -5.124 -15.551 7.760 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -6.209 -17.080 9.543 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -9.183 -17.084 5.062 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -8.498 -18.704 9.728 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -10.785 -18.632 6.113 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -10.443 -19.431 8.415 1.00 0.00 H new ATOM 1022 N ASP A 62 -9.167 -13.966 3.812 1.00 0.00 N ATOM 1023 CA ASP A 62 -10.593 -14.055 3.518 1.00 0.00 C ATOM 1024 C ASP A 62 -10.890 -15.260 2.631 1.00 0.00 C ATOM 1025 O ASP A 62 -10.280 -15.433 1.575 1.00 0.00 O ATOM 1026 CB ASP A 62 -11.077 -12.774 2.836 1.00 0.00 C ATOM 1027 CG ASP A 62 -12.544 -12.498 3.100 1.00 0.00 C ATOM 1028 OD1 ASP A 62 -13.297 -12.303 2.123 1.00 0.00 O ATOM 1029 OD2 ASP A 62 -12.940 -12.476 4.285 1.00 0.00 O ATOM 0 H ASP A 62 -8.579 -13.780 2.999 1.00 0.00 H new ATOM 0 HA ASP A 62 -11.126 -14.179 4.461 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -10.482 -11.931 3.188 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -10.913 -12.853 1.761 1.00 0.00 H new ATOM 1035 N GLU A 63 -11.832 -16.091 3.073 1.00 0.00 N ATOM 1036 CA GLU A 63 -12.221 -17.289 2.332 1.00 0.00 C ATOM 1037 C GLU A 63 -12.549 -16.968 0.875 1.00 0.00 C ATOM 1038 O GLU A 63 -12.480 -17.841 0.010 1.00 0.00 O ATOM 1039 CB GLU A 63 -13.424 -17.956 3.000 1.00 0.00 C ATOM 1040 CG GLU A 63 -14.641 -17.051 3.102 1.00 0.00 C ATOM 1041 CD GLU A 63 -15.759 -17.668 3.919 1.00 0.00 C ATOM 1042 OE1 GLU A 63 -16.358 -18.661 3.453 1.00 0.00 O ATOM 1043 OE2 GLU A 63 -16.037 -17.159 5.025 1.00 0.00 O ATOM 0 H GLU A 63 -12.342 -15.955 3.946 1.00 0.00 H new ATOM 0 HA GLU A 63 -11.373 -17.974 2.343 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -13.692 -18.850 2.437 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -13.139 -18.282 4.000 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -14.347 -16.103 3.552 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -15.008 -16.828 2.100 1.00 0.00 H new ATOM 1051 N LYS A 64 -12.908 -15.715 0.607 1.00 0.00 N ATOM 1052 CA LYS A 64 -13.246 -15.293 -0.747 1.00 0.00 C ATOM 1053 C LYS A 64 -12.010 -14.803 -1.501 1.00 0.00 C ATOM 1054 O LYS A 64 -12.116 -13.992 -2.421 1.00 0.00 O ATOM 1055 CB LYS A 64 -14.303 -14.187 -0.708 1.00 0.00 C ATOM 1056 CG LYS A 64 -15.264 -14.223 -1.887 1.00 0.00 C ATOM 1057 CD LYS A 64 -15.023 -13.063 -2.841 1.00 0.00 C ATOM 1058 CE LYS A 64 -15.847 -11.845 -2.458 1.00 0.00 C ATOM 1059 NZ LYS A 64 -15.051 -10.859 -1.675 1.00 0.00 N ATOM 0 H LYS A 64 -12.972 -14.977 1.308 1.00 0.00 H new ATOM 0 HA LYS A 64 -13.647 -16.158 -1.276 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -14.873 -14.272 0.217 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -13.803 -13.219 -0.686 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -15.149 -15.165 -2.423 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -16.290 -14.187 -1.522 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -13.965 -12.803 -2.838 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -15.274 -13.368 -3.857 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -16.230 -11.368 -3.360 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -16.711 -12.161 -1.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -15.162 -11.052 -0.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -14.047 -10.938 -1.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -15.388 -9.897 -1.883 1.00 0.00 H new ATOM 1073 N GLY A 65 -10.840 -15.298 -1.107 1.00 0.00 N ATOM 1074 CA GLY A 65 -9.608 -14.895 -1.760 1.00 0.00 C ATOM 1075 C GLY A 65 -9.345 -13.409 -1.632 1.00 0.00 C ATOM 1076 O GLY A 65 -9.035 -12.739 -2.617 1.00 0.00 O ATOM 0 H GLY A 65 -10.724 -15.970 -0.348 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -8.774 -15.447 -1.328 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -9.655 -15.163 -2.815 1.00 0.00 H new ATOM 1080 N ASN A 66 -9.469 -12.889 -0.415 1.00 0.00 N ATOM 1081 CA ASN A 66 -9.242 -11.471 -0.165 1.00 0.00 C ATOM 1082 C ASN A 66 -8.330 -11.267 1.040 1.00 0.00 C ATOM 1083 O ASN A 66 -8.555 -11.841 2.105 1.00 0.00 O ATOM 1084 CB ASN A 66 -10.573 -10.750 0.057 1.00 0.00 C ATOM 1085 CG ASN A 66 -11.118 -10.134 -1.216 1.00 0.00 C ATOM 1086 OD1 ASN A 66 -11.150 -10.777 -2.265 1.00 0.00 O ATOM 1087 ND2 ASN A 66 -11.551 -8.882 -1.131 1.00 0.00 N ATOM 0 H ASN A 66 -9.725 -13.428 0.412 1.00 0.00 H new ATOM 0 HA ASN A 66 -8.751 -11.049 -1.042 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -11.302 -11.455 0.457 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -10.439 -9.970 0.806 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -11.929 -8.416 -1.956 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -11.506 -8.386 -0.241 1.00 0.00 H new ATOM 1094 N TRP A 67 -7.300 -10.446 0.863 1.00 0.00 N ATOM 1095 CA TRP A 67 -6.353 -10.165 1.937 1.00 0.00 C ATOM 1096 C TRP A 67 -6.534 -8.746 2.465 1.00 0.00 C ATOM 1097 O TRP A 67 -6.045 -7.785 1.872 1.00 0.00 O ATOM 1098 CB TRP A 67 -4.918 -10.363 1.444 1.00 0.00 C ATOM 1099 CG TRP A 67 -4.327 -11.679 1.846 1.00 0.00 C ATOM 1100 CD1 TRP A 67 -4.813 -12.921 1.550 1.00 0.00 C ATOM 1101 CD2 TRP A 67 -3.141 -11.888 2.620 1.00 0.00 C ATOM 1102 NE1 TRP A 67 -4.001 -13.887 2.092 1.00 0.00 N ATOM 1103 CE2 TRP A 67 -2.967 -13.279 2.754 1.00 0.00 C ATOM 1104 CE3 TRP A 67 -2.206 -11.033 3.212 1.00 0.00 C ATOM 1105 CZ2 TRP A 67 -1.899 -13.832 3.456 1.00 0.00 C ATOM 1106 CZ3 TRP A 67 -1.146 -11.584 3.908 1.00 0.00 C ATOM 1107 CH2 TRP A 67 -1.000 -12.972 4.024 1.00 0.00 C ATOM 0 H TRP A 67 -7.100 -9.964 -0.013 1.00 0.00 H new ATOM 0 HA TRP A 67 -6.548 -10.862 2.752 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -4.901 -10.282 0.357 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -4.294 -9.559 1.833 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -5.706 -13.115 0.974 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -4.144 -14.894 2.014 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -2.310 -9.961 3.127 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -1.785 -14.902 3.549 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -0.418 -10.933 4.370 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -0.160 -13.371 4.573 1.00 0.00 H new ATOM 1118 N HIS A 68 -7.240 -8.622 3.584 1.00 0.00 N ATOM 1119 CA HIS A 68 -7.485 -7.321 4.193 1.00 0.00 C ATOM 1120 C HIS A 68 -6.262 -6.843 4.968 1.00 0.00 C ATOM 1121 O HIS A 68 -5.612 -7.624 5.664 1.00 0.00 O ATOM 1122 CB HIS A 68 -8.698 -7.390 5.122 1.00 0.00 C ATOM 1123 CG HIS A 68 -9.989 -7.638 4.405 1.00 0.00 C ATOM 1124 ND1 HIS A 68 -10.054 -8.021 3.082 1.00 0.00 N ATOM 1125 CD2 HIS A 68 -11.272 -7.554 4.833 1.00 0.00 C ATOM 1126 CE1 HIS A 68 -11.319 -8.162 2.728 1.00 0.00 C ATOM 1127 NE2 HIS A 68 -12.077 -7.885 3.771 1.00 0.00 N ATOM 0 H HIS A 68 -7.652 -9.407 4.087 1.00 0.00 H new ATOM 0 HA HIS A 68 -7.688 -6.607 3.395 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -8.540 -8.183 5.853 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -8.774 -6.455 5.677 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -11.600 -7.278 5.824 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -11.672 -8.455 1.750 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -13.097 -7.912 3.786 1.00 0.00 H new ATOM 1136 N GLY A 69 -5.953 -5.557 4.843 1.00 0.00 N ATOM 1137 CA GLY A 69 -4.808 -4.997 5.537 1.00 0.00 C ATOM 1138 C GLY A 69 -5.124 -3.674 6.206 1.00 0.00 C ATOM 1139 O GLY A 69 -5.509 -2.712 5.542 1.00 0.00 O ATOM 0 H GLY A 69 -6.475 -4.892 4.273 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -4.460 -5.706 6.288 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -3.991 -4.856 4.829 1.00 0.00 H new ATOM 1143 N LEU A 70 -4.959 -3.625 7.524 1.00 0.00 N ATOM 1144 CA LEU A 70 -5.227 -2.410 8.284 1.00 0.00 C ATOM 1145 C LEU A 70 -3.999 -1.984 9.081 1.00 0.00 C ATOM 1146 O LEU A 70 -3.496 -2.736 9.915 1.00 0.00 O ATOM 1147 CB LEU A 70 -6.412 -2.625 9.228 1.00 0.00 C ATOM 1148 CG LEU A 70 -6.168 -3.635 10.352 1.00 0.00 C ATOM 1149 CD1 LEU A 70 -5.655 -2.930 11.600 1.00 0.00 C ATOM 1150 CD2 LEU A 70 -7.442 -4.408 10.661 1.00 0.00 C ATOM 0 H LEU A 70 -4.641 -4.413 8.088 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.472 -1.617 7.578 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -6.681 -1.667 9.673 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -7.269 -2.956 8.642 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.409 -4.343 10.020 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -5.487 -3.663 12.389 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -4.718 -2.422 11.372 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -6.392 -2.200 11.934 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -7.249 -5.121 11.462 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -8.222 -3.714 10.973 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.768 -4.943 9.769 1.00 0.00 H new ATOM 1162 N TYR A 71 -3.519 -0.773 8.816 1.00 0.00 N ATOM 1163 CA TYR A 71 -2.348 -0.247 9.509 1.00 0.00 C ATOM 1164 C TYR A 71 -2.519 1.236 9.818 1.00 0.00 C ATOM 1165 O TYR A 71 -3.370 1.909 9.235 1.00 0.00 O ATOM 1166 CB TYR A 71 -1.090 -0.462 8.665 1.00 0.00 C ATOM 1167 CG TYR A 71 -1.113 0.275 7.346 1.00 0.00 C ATOM 1168 CD1 TYR A 71 -1.668 -0.306 6.212 1.00 0.00 C ATOM 1169 CD2 TYR A 71 -0.580 1.553 7.232 1.00 0.00 C ATOM 1170 CE1 TYR A 71 -1.691 0.365 5.004 1.00 0.00 C ATOM 1171 CE2 TYR A 71 -0.598 2.230 6.028 1.00 0.00 C ATOM 1172 CZ TYR A 71 -1.155 1.633 4.918 1.00 0.00 C ATOM 1173 OH TYR A 71 -1.175 2.304 3.717 1.00 0.00 O ATOM 0 H TYR A 71 -3.922 -0.138 8.127 1.00 0.00 H new ATOM 0 HA TYR A 71 -2.242 -0.786 10.450 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -0.220 -0.140 9.237 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -0.969 -1.528 8.474 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -2.088 -1.299 6.276 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -0.144 2.025 8.100 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -2.126 -0.101 4.132 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -0.178 3.222 5.957 1.00 0.00 H new ATOM 0 HH TYR A 71 -0.447 1.978 3.148 1.00 0.00 H new ATOM 1183 N ALA A 72 -1.705 1.741 10.739 1.00 0.00 N ATOM 1184 CA ALA A 72 -1.766 3.146 11.125 1.00 0.00 C ATOM 1185 C ALA A 72 -0.369 3.747 11.230 1.00 0.00 C ATOM 1186 O ALA A 72 0.452 3.301 12.032 1.00 0.00 O ATOM 1187 CB ALA A 72 -2.508 3.298 12.444 1.00 0.00 C ATOM 0 H ALA A 72 -0.996 1.199 11.232 1.00 0.00 H new ATOM 0 HA ALA A 72 -2.309 3.687 10.350 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -2.546 4.352 12.721 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -3.522 2.914 12.337 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -1.988 2.738 13.221 1.00 0.00 H new ATOM 1193 N MET A 73 -0.106 4.765 10.417 1.00 0.00 N ATOM 1194 CA MET A 73 1.192 5.430 10.419 1.00 0.00 C ATOM 1195 C MET A 73 1.053 6.894 10.822 1.00 0.00 C ATOM 1196 O MET A 73 -0.059 7.406 10.961 1.00 0.00 O ATOM 1197 CB MET A 73 1.842 5.329 9.037 1.00 0.00 C ATOM 1198 CG MET A 73 0.916 5.729 7.899 1.00 0.00 C ATOM 1199 SD MET A 73 1.773 6.620 6.586 1.00 0.00 S ATOM 1200 CE MET A 73 2.526 5.263 5.693 1.00 0.00 C ATOM 0 H MET A 73 -0.775 5.147 9.748 1.00 0.00 H new ATOM 0 HA MET A 73 1.827 4.930 11.150 1.00 0.00 H new ATOM 0 HB2 MET A 73 2.728 5.964 9.014 1.00 0.00 H new ATOM 0 HB3 MET A 73 2.179 4.305 8.877 1.00 0.00 H new ATOM 0 HG2 MET A 73 0.451 4.835 7.483 1.00 0.00 H new ATOM 0 HG3 MET A 73 0.113 6.353 8.292 1.00 0.00 H new ATOM 0 HE1 MET A 73 3.093 5.654 4.848 1.00 0.00 H new ATOM 0 HE2 MET A 73 3.195 4.717 6.358 1.00 0.00 H new ATOM 0 HE3 MET A 73 1.749 4.591 5.329 1.00 0.00 H new ATOM 1210 N ALA A 74 2.186 7.562 11.008 1.00 0.00 N ATOM 1211 CA ALA A 74 2.189 8.968 11.395 1.00 0.00 C ATOM 1212 C ALA A 74 3.399 9.693 10.817 1.00 0.00 C ATOM 1213 O ALA A 74 4.494 9.135 10.744 1.00 0.00 O ATOM 1214 CB ALA A 74 2.169 9.097 12.911 1.00 0.00 C ATOM 0 H ALA A 74 3.114 7.153 10.897 1.00 0.00 H new ATOM 0 HA ALA A 74 1.291 9.434 10.989 1.00 0.00 H new ATOM 0 HB1 ALA A 74 2.171 10.152 13.186 1.00 0.00 H new ATOM 0 HB2 ALA A 74 1.271 8.621 13.305 1.00 0.00 H new ATOM 0 HB3 ALA A 74 3.050 8.611 13.329 1.00 0.00 H new ATOM 1220 N PHE A 75 3.194 10.941 10.405 1.00 0.00 N ATOM 1221 CA PHE A 75 4.268 11.743 9.831 1.00 0.00 C ATOM 1222 C PHE A 75 4.633 12.902 10.753 1.00 0.00 C ATOM 1223 O PHE A 75 3.771 13.686 11.151 1.00 0.00 O ATOM 1224 CB PHE A 75 3.857 12.277 8.459 1.00 0.00 C ATOM 1225 CG PHE A 75 4.247 11.376 7.321 1.00 0.00 C ATOM 1226 CD1 PHE A 75 3.946 10.024 7.357 1.00 0.00 C ATOM 1227 CD2 PHE A 75 4.915 11.881 6.218 1.00 0.00 C ATOM 1228 CE1 PHE A 75 4.305 9.193 6.313 1.00 0.00 C ATOM 1229 CE2 PHE A 75 5.276 11.055 5.171 1.00 0.00 C ATOM 1230 CZ PHE A 75 4.970 9.708 5.218 1.00 0.00 C ATOM 0 H PHE A 75 2.294 11.418 10.458 1.00 0.00 H new ATOM 0 HA PHE A 75 5.144 11.104 9.716 1.00 0.00 H new ATOM 0 HB2 PHE A 75 2.777 12.421 8.443 1.00 0.00 H new ATOM 0 HB3 PHE A 75 4.312 13.256 8.308 1.00 0.00 H new ATOM 0 HD1 PHE A 75 3.425 9.615 8.210 1.00 0.00 H new ATOM 0 HD2 PHE A 75 5.157 12.933 6.176 1.00 0.00 H new ATOM 0 HE1 PHE A 75 4.065 8.141 6.354 1.00 0.00 H new ATOM 0 HE2 PHE A 75 5.797 11.461 4.317 1.00 0.00 H new ATOM 0 HZ PHE A 75 5.250 9.060 4.401 1.00 0.00 H new ATOM 1240 N LYS A 76 5.914 13.004 11.090 1.00 0.00 N ATOM 1241 CA LYS A 76 6.394 14.069 11.965 1.00 0.00 C ATOM 1242 C LYS A 76 7.473 14.897 11.276 1.00 0.00 C ATOM 1243 O LYS A 76 8.551 14.392 10.961 1.00 0.00 O ATOM 1244 CB LYS A 76 6.941 13.478 13.266 1.00 0.00 C ATOM 1245 CG LYS A 76 6.942 14.460 14.426 1.00 0.00 C ATOM 1246 CD LYS A 76 7.940 14.053 15.499 1.00 0.00 C ATOM 1247 CE LYS A 76 8.354 15.240 16.354 1.00 0.00 C ATOM 1248 NZ LYS A 76 7.202 15.817 17.099 1.00 0.00 N ATOM 0 H LYS A 76 6.640 12.362 10.771 1.00 0.00 H new ATOM 0 HA LYS A 76 5.553 14.723 12.195 1.00 0.00 H new ATOM 0 HB2 LYS A 76 6.345 12.607 13.539 1.00 0.00 H new ATOM 0 HB3 LYS A 76 7.959 13.127 13.096 1.00 0.00 H new ATOM 0 HG2 LYS A 76 7.186 15.457 14.060 1.00 0.00 H new ATOM 0 HG3 LYS A 76 5.943 14.515 14.859 1.00 0.00 H new ATOM 0 HD2 LYS A 76 7.501 13.283 16.133 1.00 0.00 H new ATOM 0 HD3 LYS A 76 8.822 13.616 15.030 1.00 0.00 H new ATOM 0 HE2 LYS A 76 9.123 14.928 17.060 1.00 0.00 H new ATOM 0 HE3 LYS A 76 8.797 16.008 15.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 7.540 16.568 17.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 6.517 16.215 16.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 6.743 15.071 17.660 1.00 0.00 H new ATOM 1262 N ASP A 77 7.176 16.171 11.044 1.00 0.00 N ATOM 1263 CA ASP A 77 8.122 17.070 10.391 1.00 0.00 C ATOM 1264 C ASP A 77 9.278 17.414 11.325 1.00 0.00 C ATOM 1265 O ASP A 77 9.371 16.890 12.434 1.00 0.00 O ATOM 1266 CB ASP A 77 7.413 18.350 9.943 1.00 0.00 C ATOM 1267 CG ASP A 77 6.932 18.272 8.508 1.00 0.00 C ATOM 1268 OD1 ASP A 77 5.876 17.651 8.268 1.00 0.00 O ATOM 1269 OD2 ASP A 77 7.611 18.833 7.623 1.00 0.00 O ATOM 0 H ASP A 77 6.288 16.605 11.298 1.00 0.00 H new ATOM 0 HA ASP A 77 8.526 16.561 9.516 1.00 0.00 H new ATOM 0 HB2 ASP A 77 6.563 18.540 10.598 1.00 0.00 H new ATOM 0 HB3 ASP A 77 8.093 19.195 10.050 1.00 0.00 H new ATOM 1275 N SER A 78 10.157 18.300 10.867 1.00 0.00 N ATOM 1276 CA SER A 78 11.309 18.714 11.661 1.00 0.00 C ATOM 1277 C SER A 78 10.946 19.877 12.579 1.00 0.00 C ATOM 1278 O SER A 78 11.500 20.014 13.670 1.00 0.00 O ATOM 1279 CB SER A 78 12.468 19.114 10.745 1.00 0.00 C ATOM 1280 OG SER A 78 12.340 18.514 9.468 1.00 0.00 O ATOM 0 H SER A 78 10.094 18.745 9.951 1.00 0.00 H new ATOM 0 HA SER A 78 11.617 17.870 12.278 1.00 0.00 H new ATOM 0 HB2 SER A 78 12.494 20.199 10.640 1.00 0.00 H new ATOM 0 HB3 SER A 78 13.413 18.815 11.198 1.00 0.00 H new ATOM 0 HG SER A 78 13.092 18.787 8.902 1.00 0.00 H new ATOM 1286 N TRP A 79 10.015 20.712 12.131 1.00 0.00 N ATOM 1287 CA TRP A 79 9.582 21.864 12.913 1.00 0.00 C ATOM 1288 C TRP A 79 8.521 21.461 13.933 1.00 0.00 C ATOM 1289 O TRP A 79 8.813 21.313 15.120 1.00 0.00 O ATOM 1290 CB TRP A 79 9.034 22.956 11.992 1.00 0.00 C ATOM 1291 CG TRP A 79 10.094 23.875 11.465 1.00 0.00 C ATOM 1292 CD1 TRP A 79 11.323 23.520 10.987 1.00 0.00 C ATOM 1293 CD2 TRP A 79 10.020 25.301 11.363 1.00 0.00 C ATOM 1294 NE1 TRP A 79 12.018 24.639 10.595 1.00 0.00 N ATOM 1295 CE2 TRP A 79 11.239 25.744 10.816 1.00 0.00 C ATOM 1296 CE3 TRP A 79 9.041 26.247 11.682 1.00 0.00 C ATOM 1297 CZ2 TRP A 79 11.503 27.091 10.581 1.00 0.00 C ATOM 1298 CZ3 TRP A 79 9.305 27.584 11.448 1.00 0.00 C ATOM 1299 CH2 TRP A 79 10.527 27.995 10.901 1.00 0.00 C ATOM 0 H TRP A 79 9.546 20.613 11.231 1.00 0.00 H new ATOM 0 HA TRP A 79 10.447 22.253 13.450 1.00 0.00 H new ATOM 0 HB2 TRP A 79 8.518 22.489 11.153 1.00 0.00 H new ATOM 0 HB3 TRP A 79 8.293 23.542 12.536 1.00 0.00 H new ATOM 0 HD1 TRP A 79 11.695 22.508 10.926 1.00 0.00 H new ATOM 0 HE1 TRP A 79 12.960 24.646 10.204 1.00 0.00 H new ATOM 0 HE3 TRP A 79 8.096 25.939 12.104 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 12.445 27.411 10.161 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 8.556 28.324 11.691 1.00 0.00 H new ATOM 0 HH2 TRP A 79 10.702 29.047 10.728 1.00 0.00 H new ATOM 1310 N ASN A 80 7.290 21.284 13.463 1.00 0.00 N ATOM 1311 CA ASN A 80 6.188 20.897 14.336 1.00 0.00 C ATOM 1312 C ASN A 80 4.951 20.528 13.522 1.00 0.00 C ATOM 1313 O ASN A 80 3.822 20.781 13.939 1.00 0.00 O ATOM 1314 CB ASN A 80 5.854 22.033 15.305 1.00 0.00 C ATOM 1315 CG ASN A 80 6.600 21.910 16.620 1.00 0.00 C ATOM 1316 OD1 ASN A 80 6.557 20.868 17.276 1.00 0.00 O ATOM 1317 ND2 ASN A 80 7.290 22.975 17.012 1.00 0.00 N ATOM 0 H ASN A 80 7.031 21.402 12.484 1.00 0.00 H new ATOM 0 HA ASN A 80 6.500 20.022 14.906 1.00 0.00 H new ATOM 0 HB2 ASN A 80 6.099 22.988 14.839 1.00 0.00 H new ATOM 0 HB3 ASN A 80 4.781 22.038 15.498 1.00 0.00 H new ATOM 0 HD21 ASN A 80 7.812 22.950 17.888 1.00 0.00 H new ATOM 0 HD22 ASN A 80 7.298 23.818 16.437 1.00 0.00 H new ATOM 1324 N LYS A 81 5.174 19.928 12.358 1.00 0.00 N ATOM 1325 CA LYS A 81 4.078 19.524 11.484 1.00 0.00 C ATOM 1326 C LYS A 81 3.818 18.025 11.597 1.00 0.00 C ATOM 1327 O LYS A 81 4.270 17.242 10.761 1.00 0.00 O ATOM 1328 CB LYS A 81 4.391 19.895 10.033 1.00 0.00 C ATOM 1329 CG LYS A 81 3.688 21.158 9.564 1.00 0.00 C ATOM 1330 CD LYS A 81 4.290 22.400 10.200 1.00 0.00 C ATOM 1331 CE LYS A 81 5.528 22.865 9.450 1.00 0.00 C ATOM 1332 NZ LYS A 81 6.007 24.189 9.936 1.00 0.00 N ATOM 0 H LYS A 81 6.103 19.711 11.998 1.00 0.00 H new ATOM 0 HA LYS A 81 3.179 20.054 11.799 1.00 0.00 H new ATOM 0 HB2 LYS A 81 5.468 20.026 9.924 1.00 0.00 H new ATOM 0 HB3 LYS A 81 4.104 19.067 9.385 1.00 0.00 H new ATOM 0 HG2 LYS A 81 3.758 21.233 8.479 1.00 0.00 H new ATOM 0 HG3 LYS A 81 2.628 21.099 9.811 1.00 0.00 H new ATOM 0 HD2 LYS A 81 3.549 23.199 10.212 1.00 0.00 H new ATOM 0 HD3 LYS A 81 4.549 22.190 11.238 1.00 0.00 H new ATOM 0 HE2 LYS A 81 6.322 22.127 9.566 1.00 0.00 H new ATOM 0 HE3 LYS A 81 5.305 22.928 8.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 6.852 24.471 9.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 5.259 24.899 9.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 6.244 24.123 10.946 1.00 0.00 H new ATOM 1346 N TRP A 82 3.085 17.631 12.634 1.00 0.00 N ATOM 1347 CA TRP A 82 2.763 16.226 12.855 1.00 0.00 C ATOM 1348 C TRP A 82 1.275 15.969 12.641 1.00 0.00 C ATOM 1349 O TRP A 82 0.428 16.692 13.167 1.00 0.00 O ATOM 1350 CB TRP A 82 3.167 15.806 14.269 1.00 0.00 C ATOM 1351 CG TRP A 82 2.924 14.353 14.549 1.00 0.00 C ATOM 1352 CD1 TRP A 82 3.588 13.292 14.005 1.00 0.00 C ATOM 1353 CD2 TRP A 82 1.949 13.803 15.441 1.00 0.00 C ATOM 1354 NE1 TRP A 82 3.085 12.115 14.505 1.00 0.00 N ATOM 1355 CE2 TRP A 82 2.078 12.402 15.388 1.00 0.00 C ATOM 1356 CE3 TRP A 82 0.979 14.359 16.281 1.00 0.00 C ATOM 1357 CZ2 TRP A 82 1.274 11.551 16.142 1.00 0.00 C ATOM 1358 CZ3 TRP A 82 0.181 13.513 17.029 1.00 0.00 C ATOM 1359 CH2 TRP A 82 0.333 12.123 16.956 1.00 0.00 C ATOM 0 H TRP A 82 2.703 18.266 13.335 1.00 0.00 H new ATOM 0 HA TRP A 82 3.323 15.632 12.133 1.00 0.00 H new ATOM 0 HB2 TRP A 82 4.224 16.025 14.417 1.00 0.00 H new ATOM 0 HB3 TRP A 82 2.613 16.406 14.991 1.00 0.00 H new ATOM 0 HD1 TRP A 82 4.391 13.367 13.287 1.00 0.00 H new ATOM 0 HE1 TRP A 82 3.409 11.180 14.259 1.00 0.00 H new ATOM 0 HE3 TRP A 82 0.855 15.430 16.344 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 1.388 10.479 16.087 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 -0.572 13.931 17.680 1.00 0.00 H new ATOM 0 HH2 TRP A 82 -0.305 11.489 17.554 1.00 0.00 H new ATOM 1370 N GLU A 83 0.962 14.935 11.867 1.00 0.00 N ATOM 1371 CA GLU A 83 -0.424 14.583 11.585 1.00 0.00 C ATOM 1372 C GLU A 83 -0.595 13.067 11.497 1.00 0.00 C ATOM 1373 O GLU A 83 0.270 12.368 10.969 1.00 0.00 O ATOM 1374 CB GLU A 83 -0.882 15.239 10.279 1.00 0.00 C ATOM 1375 CG GLU A 83 -1.748 16.469 10.488 1.00 0.00 C ATOM 1376 CD GLU A 83 -2.685 16.727 9.325 1.00 0.00 C ATOM 1377 OE1 GLU A 83 -3.899 16.466 9.471 1.00 0.00 O ATOM 1378 OE2 GLU A 83 -2.208 17.190 8.268 1.00 0.00 O ATOM 0 H GLU A 83 1.650 14.326 11.424 1.00 0.00 H new ATOM 0 HA GLU A 83 -1.041 14.951 12.404 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.005 15.517 9.695 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -1.438 14.509 9.691 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -2.332 16.347 11.400 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -1.108 17.339 10.634 1.00 0.00 H new ATOM 1386 N PRO A 84 -1.717 12.537 12.015 1.00 0.00 N ATOM 1387 CA PRO A 84 -1.994 11.099 11.992 1.00 0.00 C ATOM 1388 C PRO A 84 -2.433 10.615 10.614 1.00 0.00 C ATOM 1389 O PRO A 84 -2.933 11.395 9.802 1.00 0.00 O ATOM 1390 CB PRO A 84 -3.131 10.948 13.000 1.00 0.00 C ATOM 1391 CG PRO A 84 -3.850 12.252 12.949 1.00 0.00 C ATOM 1392 CD PRO A 84 -2.803 13.297 12.666 1.00 0.00 C ATOM 0 HA PRO A 84 -1.111 10.507 12.231 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -3.790 10.121 12.735 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -2.750 10.744 14.001 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -4.614 12.245 12.171 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -4.357 12.454 13.892 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -3.187 14.083 12.016 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -2.461 13.779 13.582 1.00 0.00 H new ATOM 1400 N ILE A 85 -2.246 9.325 10.357 1.00 0.00 N ATOM 1401 CA ILE A 85 -2.625 8.738 9.078 1.00 0.00 C ATOM 1402 C ILE A 85 -3.005 7.270 9.240 1.00 0.00 C ATOM 1403 O ILE A 85 -2.223 6.468 9.751 1.00 0.00 O ATOM 1404 CB ILE A 85 -1.485 8.849 8.047 1.00 0.00 C ATOM 1405 CG1 ILE A 85 -0.942 10.280 8.007 1.00 0.00 C ATOM 1406 CG2 ILE A 85 -1.974 8.422 6.671 1.00 0.00 C ATOM 1407 CD1 ILE A 85 0.166 10.480 6.995 1.00 0.00 C ATOM 0 H ILE A 85 -1.834 8.666 11.018 1.00 0.00 H new ATOM 0 HA ILE A 85 -3.487 9.298 8.716 1.00 0.00 H new ATOM 0 HB ILE A 85 -0.676 8.183 8.346 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -1.760 10.964 7.778 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -0.571 10.547 8.997 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -1.158 8.506 5.953 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -2.317 7.388 6.712 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -2.797 9.066 6.361 1.00 0.00 H new ATOM 0 HD11 ILE A 85 0.501 11.517 7.023 1.00 0.00 H new ATOM 0 HD12 ILE A 85 1.001 9.822 7.235 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -0.206 10.245 5.998 1.00 0.00 H new ATOM 1419 N ALA A 86 -4.211 6.924 8.802 1.00 0.00 N ATOM 1420 CA ALA A 86 -4.695 5.552 8.899 1.00 0.00 C ATOM 1421 C ALA A 86 -4.887 4.938 7.515 1.00 0.00 C ATOM 1422 O ALA A 86 -5.041 5.651 6.525 1.00 0.00 O ATOM 1423 CB ALA A 86 -5.997 5.507 9.683 1.00 0.00 C ATOM 0 H ALA A 86 -4.871 7.575 8.376 1.00 0.00 H new ATOM 0 HA ALA A 86 -3.944 4.964 9.427 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -6.347 4.477 9.748 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -5.831 5.898 10.687 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -6.748 6.114 9.177 1.00 0.00 H new ATOM 1429 N GLY A 87 -4.877 3.610 7.458 1.00 0.00 N ATOM 1430 CA GLY A 87 -5.052 2.922 6.192 1.00 0.00 C ATOM 1431 C GLY A 87 -5.791 1.607 6.344 1.00 0.00 C ATOM 1432 O GLY A 87 -5.520 0.839 7.268 1.00 0.00 O ATOM 0 H GLY A 87 -4.751 2.999 8.265 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -5.601 3.566 5.505 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -4.075 2.737 5.745 1.00 0.00 H new ATOM 1436 N TYR A 88 -6.726 1.348 5.437 1.00 0.00 N ATOM 1437 CA TYR A 88 -7.507 0.116 5.474 1.00 0.00 C ATOM 1438 C TYR A 88 -8.070 -0.212 4.095 1.00 0.00 C ATOM 1439 O TYR A 88 -8.695 0.631 3.452 1.00 0.00 O ATOM 1440 CB TYR A 88 -8.647 0.242 6.487 1.00 0.00 C ATOM 1441 CG TYR A 88 -9.414 -1.044 6.699 1.00 0.00 C ATOM 1442 CD1 TYR A 88 -10.248 -1.549 5.710 1.00 0.00 C ATOM 1443 CD2 TYR A 88 -9.303 -1.753 7.889 1.00 0.00 C ATOM 1444 CE1 TYR A 88 -10.951 -2.723 5.900 1.00 0.00 C ATOM 1445 CE2 TYR A 88 -10.003 -2.929 8.087 1.00 0.00 C ATOM 1446 CZ TYR A 88 -10.824 -3.410 7.089 1.00 0.00 C ATOM 1447 OH TYR A 88 -11.522 -4.579 7.283 1.00 0.00 O ATOM 0 H TYR A 88 -6.962 1.974 4.667 1.00 0.00 H new ATOM 0 HA TYR A 88 -6.847 -0.696 5.779 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -8.238 0.573 7.442 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -9.337 1.016 6.150 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -10.349 -1.015 4.777 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -8.660 -1.379 8.672 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -11.597 -3.101 5.121 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -9.907 -3.468 9.018 1.00 0.00 H new ATOM 0 HH TYR A 88 -11.320 -4.937 8.172 1.00 0.00 H new ATOM 1457 N GLY A 89 -7.846 -1.444 3.648 1.00 0.00 N ATOM 1458 CA GLY A 89 -8.338 -1.861 2.349 1.00 0.00 C ATOM 1459 C GLY A 89 -8.216 -3.358 2.135 1.00 0.00 C ATOM 1460 O GLY A 89 -8.104 -4.122 3.095 1.00 0.00 O ATOM 0 H GLY A 89 -7.333 -2.160 4.162 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -9.383 -1.567 2.248 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -7.783 -1.339 1.569 1.00 0.00 H new ATOM 1464 N TRP A 90 -8.238 -3.778 0.874 1.00 0.00 N ATOM 1465 CA TRP A 90 -8.129 -5.193 0.538 1.00 0.00 C ATOM 1466 C TRP A 90 -7.216 -5.397 -0.667 1.00 0.00 C ATOM 1467 O TRP A 90 -7.118 -4.532 -1.538 1.00 0.00 O ATOM 1468 CB TRP A 90 -9.513 -5.777 0.247 1.00 0.00 C ATOM 1469 CG TRP A 90 -10.254 -5.044 -0.829 1.00 0.00 C ATOM 1470 CD1 TRP A 90 -11.256 -4.134 -0.659 1.00 0.00 C ATOM 1471 CD2 TRP A 90 -10.052 -5.162 -2.243 1.00 0.00 C ATOM 1472 NE1 TRP A 90 -11.689 -3.676 -1.881 1.00 0.00 N ATOM 1473 CE2 TRP A 90 -10.967 -4.293 -2.868 1.00 0.00 C ATOM 1474 CE3 TRP A 90 -9.187 -5.917 -3.040 1.00 0.00 C ATOM 1475 CZ2 TRP A 90 -11.039 -4.159 -4.253 1.00 0.00 C ATOM 1476 CZ3 TRP A 90 -9.261 -5.784 -4.414 1.00 0.00 C ATOM 1477 CH2 TRP A 90 -10.180 -4.910 -5.007 1.00 0.00 C ATOM 0 H TRP A 90 -8.330 -3.159 0.069 1.00 0.00 H new ATOM 0 HA TRP A 90 -7.695 -5.712 1.393 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -9.404 -6.822 -0.044 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -10.106 -5.761 1.162 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -11.651 -3.819 0.296 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -12.428 -2.988 -2.029 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -8.474 -6.592 -2.591 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -11.747 -3.487 -4.714 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -8.599 -6.364 -5.040 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -10.211 -4.827 -6.083 1.00 0.00 H new ATOM 1488 N GLU A 91 -6.549 -6.545 -0.710 1.00 0.00 N ATOM 1489 CA GLU A 91 -5.644 -6.862 -1.808 1.00 0.00 C ATOM 1490 C GLU A 91 -5.737 -8.338 -2.181 1.00 0.00 C ATOM 1491 O GLU A 91 -5.897 -9.199 -1.315 1.00 0.00 O ATOM 1492 CB GLU A 91 -4.205 -6.510 -1.429 1.00 0.00 C ATOM 1493 CG GLU A 91 -3.844 -5.058 -1.693 1.00 0.00 C ATOM 1494 CD GLU A 91 -3.839 -4.218 -0.430 1.00 0.00 C ATOM 1495 OE1 GLU A 91 -4.929 -3.776 -0.007 1.00 0.00 O ATOM 1496 OE2 GLU A 91 -2.748 -4.003 0.136 1.00 0.00 O ATOM 0 H GLU A 91 -6.618 -7.271 0.003 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.940 -6.268 -2.672 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -4.053 -6.727 -0.372 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -3.524 -7.152 -1.987 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -2.860 -5.011 -2.160 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.554 -4.635 -2.403 1.00 0.00 H new ATOM 1504 N SER A 92 -5.635 -8.625 -3.475 1.00 0.00 N ATOM 1505 CA SER A 92 -5.707 -9.996 -3.963 1.00 0.00 C ATOM 1506 C SER A 92 -4.327 -10.645 -3.967 1.00 0.00 C ATOM 1507 O SER A 92 -3.457 -10.273 -4.754 1.00 0.00 O ATOM 1508 CB SER A 92 -6.302 -10.028 -5.372 1.00 0.00 C ATOM 1509 OG SER A 92 -7.682 -9.704 -5.351 1.00 0.00 O ATOM 0 H SER A 92 -5.502 -7.925 -4.205 1.00 0.00 H new ATOM 0 HA SER A 92 -6.353 -10.561 -3.291 1.00 0.00 H new ATOM 0 HB2 SER A 92 -5.770 -9.323 -6.011 1.00 0.00 H new ATOM 0 HB3 SER A 92 -6.164 -11.018 -5.806 1.00 0.00 H new ATOM 0 HG SER A 92 -8.038 -9.730 -6.264 1.00 0.00 H new ATOM 1515 N THR A 93 -4.133 -11.619 -3.083 1.00 0.00 N ATOM 1516 CA THR A 93 -2.858 -12.319 -2.985 1.00 0.00 C ATOM 1517 C THR A 93 -2.736 -13.380 -4.073 1.00 0.00 C ATOM 1518 O THR A 93 -3.731 -13.965 -4.500 1.00 0.00 O ATOM 1519 CB THR A 93 -2.712 -12.966 -1.606 1.00 0.00 C ATOM 1520 OG1 THR A 93 -3.953 -13.483 -1.161 1.00 0.00 O ATOM 1521 CG2 THR A 93 -2.206 -12.011 -0.547 1.00 0.00 C ATOM 0 H THR A 93 -4.843 -11.941 -2.425 1.00 0.00 H new ATOM 0 HA THR A 93 -2.060 -11.590 -3.122 1.00 0.00 H new ATOM 0 HB THR A 93 -1.977 -13.760 -1.736 1.00 0.00 H new ATOM 0 HG1 THR A 93 -3.943 -13.562 -0.184 1.00 0.00 H new ATOM 0 HG21 THR A 93 -2.126 -12.534 0.406 1.00 0.00 H new ATOM 0 HG22 THR A 93 -1.226 -11.632 -0.837 1.00 0.00 H new ATOM 0 HG23 THR A 93 -2.902 -11.178 -0.446 1.00 0.00 H new ATOM 1529 N TRP A 94 -1.507 -13.626 -4.516 1.00 0.00 N ATOM 1530 CA TRP A 94 -1.254 -14.618 -5.554 1.00 0.00 C ATOM 1531 C TRP A 94 0.133 -15.234 -5.388 1.00 0.00 C ATOM 1532 O TRP A 94 1.110 -14.530 -5.138 1.00 0.00 O ATOM 1533 CB TRP A 94 -1.384 -13.982 -6.940 1.00 0.00 C ATOM 1534 CG TRP A 94 -2.396 -14.659 -7.811 1.00 0.00 C ATOM 1535 CD1 TRP A 94 -2.737 -15.980 -7.797 1.00 0.00 C ATOM 1536 CD2 TRP A 94 -3.200 -14.047 -8.828 1.00 0.00 C ATOM 1537 NE1 TRP A 94 -3.703 -16.229 -8.742 1.00 0.00 N ATOM 1538 CE2 TRP A 94 -4.004 -15.059 -9.388 1.00 0.00 C ATOM 1539 CE3 TRP A 94 -3.318 -12.743 -9.317 1.00 0.00 C ATOM 1540 CZ2 TRP A 94 -4.913 -14.804 -10.412 1.00 0.00 C ATOM 1541 CZ3 TRP A 94 -4.220 -12.493 -10.334 1.00 0.00 C ATOM 1542 CH2 TRP A 94 -5.007 -13.519 -10.872 1.00 0.00 C ATOM 0 H TRP A 94 -0.672 -13.152 -4.172 1.00 0.00 H new ATOM 0 HA TRP A 94 -1.997 -15.410 -5.457 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -1.657 -12.933 -6.826 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -0.414 -14.007 -7.436 1.00 0.00 H new ATOM 0 HD1 TRP A 94 -2.310 -16.722 -7.139 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -4.127 -17.137 -8.932 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -2.716 -11.946 -8.908 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -5.522 -15.593 -10.828 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -4.320 -11.489 -10.720 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -5.702 -13.291 -11.666 1.00 0.00 H new ATOM 1553 N ARG A 95 0.208 -16.554 -5.528 1.00 0.00 N ATOM 1554 CA ARG A 95 1.474 -17.266 -5.392 1.00 0.00 C ATOM 1555 C ARG A 95 1.780 -18.076 -6.649 1.00 0.00 C ATOM 1556 O ARG A 95 0.870 -18.508 -7.357 1.00 0.00 O ATOM 1557 CB ARG A 95 1.435 -18.190 -4.173 1.00 0.00 C ATOM 1558 CG ARG A 95 1.073 -17.476 -2.881 1.00 0.00 C ATOM 1559 CD ARG A 95 0.142 -18.317 -2.021 1.00 0.00 C ATOM 1560 NE ARG A 95 -1.253 -17.905 -2.163 1.00 0.00 N ATOM 1561 CZ ARG A 95 -2.288 -18.664 -1.812 1.00 0.00 C ATOM 1562 NH1 ARG A 95 -2.091 -19.873 -1.299 1.00 0.00 N ATOM 1563 NH2 ARG A 95 -3.524 -18.213 -1.975 1.00 0.00 N ATOM 0 H ARG A 95 -0.592 -17.152 -5.735 1.00 0.00 H new ATOM 0 HA ARG A 95 2.265 -16.528 -5.255 1.00 0.00 H new ATOM 0 HB2 ARG A 95 0.712 -18.986 -4.354 1.00 0.00 H new ATOM 0 HB3 ARG A 95 2.409 -18.665 -4.056 1.00 0.00 H new ATOM 0 HG2 ARG A 95 1.981 -17.250 -2.322 1.00 0.00 H new ATOM 0 HG3 ARG A 95 0.596 -16.524 -3.112 1.00 0.00 H new ATOM 0 HD2 ARG A 95 0.241 -19.366 -2.299 1.00 0.00 H new ATOM 0 HD3 ARG A 95 0.440 -18.235 -0.976 1.00 0.00 H new ATOM 0 HE ARG A 95 -1.444 -16.982 -2.554 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -1.142 -20.225 -1.172 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -2.889 -20.450 -1.032 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -3.681 -17.285 -2.369 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -4.318 -18.794 -1.706 1.00 0.00 H new ATOM 1577 N PRO A 96 3.073 -18.294 -6.945 1.00 0.00 N ATOM 1578 CA PRO A 96 3.496 -19.057 -8.123 1.00 0.00 C ATOM 1579 C PRO A 96 3.184 -20.546 -7.995 1.00 0.00 C ATOM 1580 O PRO A 96 3.071 -21.253 -8.996 1.00 0.00 O ATOM 1581 CB PRO A 96 5.009 -18.831 -8.169 1.00 0.00 C ATOM 1582 CG PRO A 96 5.391 -18.541 -6.759 1.00 0.00 C ATOM 1583 CD PRO A 96 4.222 -17.814 -6.153 1.00 0.00 C ATOM 0 HA PRO A 96 2.975 -18.734 -9.024 1.00 0.00 H new ATOM 0 HB2 PRO A 96 5.529 -19.711 -8.547 1.00 0.00 H new ATOM 0 HB3 PRO A 96 5.266 -18.001 -8.827 1.00 0.00 H new ATOM 0 HG2 PRO A 96 5.602 -19.462 -6.215 1.00 0.00 H new ATOM 0 HG3 PRO A 96 6.294 -17.932 -6.717 1.00 0.00 H new ATOM 0 HD2 PRO A 96 4.107 -18.049 -5.095 1.00 0.00 H new ATOM 0 HD3 PRO A 96 4.338 -16.733 -6.228 1.00 0.00 H new ATOM 1591 N LEU A 97 3.046 -21.014 -6.758 1.00 0.00 N ATOM 1592 CA LEU A 97 2.747 -22.419 -6.501 1.00 0.00 C ATOM 1593 C LEU A 97 3.865 -23.316 -7.021 1.00 0.00 C ATOM 1594 O LEU A 97 3.751 -23.912 -8.091 1.00 0.00 O ATOM 1595 CB LEU A 97 1.419 -22.809 -7.153 1.00 0.00 C ATOM 1596 CG LEU A 97 0.182 -22.607 -6.276 1.00 0.00 C ATOM 1597 CD1 LEU A 97 -1.086 -22.850 -7.078 1.00 0.00 C ATOM 1598 CD2 LEU A 97 0.234 -23.527 -5.066 1.00 0.00 C ATOM 0 H LEU A 97 3.136 -20.442 -5.919 1.00 0.00 H new ATOM 0 HA LEU A 97 2.667 -22.556 -5.423 1.00 0.00 H new ATOM 0 HB2 LEU A 97 1.296 -22.228 -8.067 1.00 0.00 H new ATOM 0 HB3 LEU A 97 1.470 -23.858 -7.446 1.00 0.00 H new ATOM 0 HG LEU A 97 0.172 -21.575 -5.925 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -1.956 -22.702 -6.438 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -1.127 -22.151 -7.914 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -1.086 -23.871 -7.459 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -0.653 -23.371 -4.452 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.267 -24.564 -5.399 1.00 0.00 H new ATOM 0 HD23 LEU A 97 1.125 -23.306 -4.479 1.00 0.00 H new ATOM 1610 N ALA A 98 4.949 -23.407 -6.255 1.00 0.00 N ATOM 1611 CA ALA A 98 6.089 -24.232 -6.639 1.00 0.00 C ATOM 1612 C ALA A 98 7.148 -24.249 -5.542 1.00 0.00 C ATOM 1613 O ALA A 98 7.459 -25.300 -4.982 1.00 0.00 O ATOM 1614 CB ALA A 98 6.686 -23.731 -7.945 1.00 0.00 C ATOM 0 H ALA A 98 5.061 -22.920 -5.366 1.00 0.00 H new ATOM 0 HA ALA A 98 5.736 -25.253 -6.782 1.00 0.00 H new ATOM 0 HB1 ALA A 98 7.536 -24.356 -8.220 1.00 0.00 H new ATOM 0 HB2 ALA A 98 5.932 -23.777 -8.731 1.00 0.00 H new ATOM 0 HB3 ALA A 98 7.018 -22.700 -7.821 1.00 0.00 H new ATOM 1620 N ASP A 99 7.699 -23.077 -5.241 1.00 0.00 N ATOM 1621 CA ASP A 99 8.725 -22.956 -4.211 1.00 0.00 C ATOM 1622 C ASP A 99 8.185 -22.231 -2.981 1.00 0.00 C ATOM 1623 O ASP A 99 8.678 -22.424 -1.871 1.00 0.00 O ATOM 1624 CB ASP A 99 9.944 -22.214 -4.760 1.00 0.00 C ATOM 1625 CG ASP A 99 10.887 -23.129 -5.518 1.00 0.00 C ATOM 1626 OD1 ASP A 99 10.814 -24.359 -5.309 1.00 0.00 O ATOM 1627 OD2 ASP A 99 11.695 -22.617 -6.320 1.00 0.00 O ATOM 0 H ASP A 99 7.452 -22.198 -5.696 1.00 0.00 H new ATOM 0 HA ASP A 99 9.023 -23.962 -3.914 1.00 0.00 H new ATOM 0 HB2 ASP A 99 9.611 -21.413 -5.420 1.00 0.00 H new ATOM 0 HB3 ASP A 99 10.482 -21.745 -3.936 1.00 0.00 H new ATOM 1633 N GLU A 100 7.171 -21.396 -3.187 1.00 0.00 N ATOM 1634 CA GLU A 100 6.566 -20.642 -2.095 1.00 0.00 C ATOM 1635 C GLU A 100 7.571 -19.672 -1.482 1.00 0.00 C ATOM 1636 O GLU A 100 8.146 -19.943 -0.427 1.00 0.00 O ATOM 1637 CB GLU A 100 6.033 -21.593 -1.020 1.00 0.00 C ATOM 1638 CG GLU A 100 4.561 -21.934 -1.186 1.00 0.00 C ATOM 1639 CD GLU A 100 3.648 -20.807 -0.742 1.00 0.00 C ATOM 1640 OE1 GLU A 100 3.401 -19.889 -1.550 1.00 0.00 O ATOM 1641 OE2 GLU A 100 3.181 -20.844 0.416 1.00 0.00 O ATOM 0 H GLU A 100 6.751 -21.225 -4.101 1.00 0.00 H new ATOM 0 HA GLU A 100 5.735 -20.067 -2.502 1.00 0.00 H new ATOM 0 HB2 GLU A 100 6.615 -22.514 -1.040 1.00 0.00 H new ATOM 0 HB3 GLU A 100 6.185 -21.142 -0.040 1.00 0.00 H new ATOM 0 HG2 GLU A 100 4.362 -22.168 -2.232 1.00 0.00 H new ATOM 0 HG3 GLU A 100 4.332 -22.831 -0.610 1.00 0.00 H new ATOM 1649 N ASN A 101 7.776 -18.541 -2.149 1.00 0.00 N ATOM 1650 CA ASN A 101 8.711 -17.529 -1.670 1.00 0.00 C ATOM 1651 C ASN A 101 8.307 -16.142 -2.158 1.00 0.00 C ATOM 1652 O ASN A 101 8.287 -15.183 -1.387 1.00 0.00 O ATOM 1653 CB ASN A 101 10.132 -17.854 -2.135 1.00 0.00 C ATOM 1654 CG ASN A 101 10.210 -18.092 -3.630 1.00 0.00 C ATOM 1655 OD1 ASN A 101 9.882 -19.307 -4.054 1.00 0.00 O flip ATOM 1656 ND2 ASN A 101 10.561 -17.194 -4.396 1.00 0.00 N flip ATOM 0 H ASN A 101 7.307 -18.302 -3.023 1.00 0.00 H new ATOM 0 HA ASN A 101 8.685 -17.533 -0.580 1.00 0.00 H new ATOM 0 HB2 ASN A 101 10.796 -17.033 -1.865 1.00 0.00 H new ATOM 0 HB3 ASN A 101 10.490 -18.739 -1.610 1.00 0.00 H new ATOM 0 HD21 ASN A 101 10.804 -16.275 -4.027 1.00 0.00 H new ATOM 0 HD22 ASN A 101 10.608 -17.369 -5.400 1.00 0.00 H new ATOM 1663 N PHE A 102 7.986 -16.042 -3.445 1.00 0.00 N ATOM 1664 CA PHE A 102 7.582 -14.772 -4.035 1.00 0.00 C ATOM 1665 C PHE A 102 6.074 -14.576 -3.923 1.00 0.00 C ATOM 1666 O PHE A 102 5.297 -15.275 -4.574 1.00 0.00 O ATOM 1667 CB PHE A 102 8.010 -14.708 -5.503 1.00 0.00 C ATOM 1668 CG PHE A 102 8.524 -13.359 -5.920 1.00 0.00 C ATOM 1669 CD1 PHE A 102 7.754 -12.222 -5.735 1.00 0.00 C ATOM 1670 CD2 PHE A 102 9.777 -13.229 -6.495 1.00 0.00 C ATOM 1671 CE1 PHE A 102 8.223 -10.980 -6.117 1.00 0.00 C ATOM 1672 CE2 PHE A 102 10.253 -11.989 -6.879 1.00 0.00 C ATOM 1673 CZ PHE A 102 9.475 -10.863 -6.689 1.00 0.00 C ATOM 0 H PHE A 102 7.998 -16.826 -4.098 1.00 0.00 H new ATOM 0 HA PHE A 102 8.076 -13.971 -3.485 1.00 0.00 H new ATOM 0 HB2 PHE A 102 8.785 -15.454 -5.680 1.00 0.00 H new ATOM 0 HB3 PHE A 102 7.161 -14.975 -6.133 1.00 0.00 H new ATOM 0 HD1 PHE A 102 6.775 -12.308 -5.287 1.00 0.00 H new ATOM 0 HD2 PHE A 102 10.389 -14.106 -6.645 1.00 0.00 H new ATOM 0 HE1 PHE A 102 7.612 -10.102 -5.969 1.00 0.00 H new ATOM 0 HE2 PHE A 102 11.232 -11.901 -7.327 1.00 0.00 H new ATOM 0 HZ PHE A 102 9.845 -9.893 -6.987 1.00 0.00 H new ATOM 1683 N HIS A 103 5.667 -13.622 -3.093 1.00 0.00 N ATOM 1684 CA HIS A 103 4.250 -13.335 -2.894 1.00 0.00 C ATOM 1685 C HIS A 103 3.869 -12.002 -3.531 1.00 0.00 C ATOM 1686 O HIS A 103 4.382 -10.950 -3.147 1.00 0.00 O ATOM 1687 CB HIS A 103 3.919 -13.314 -1.400 1.00 0.00 C ATOM 1688 CG HIS A 103 2.662 -14.049 -1.056 1.00 0.00 C ATOM 1689 ND1 HIS A 103 2.348 -14.817 0.015 1.00 0.00 N flip ATOM 1690 CD2 HIS A 103 1.542 -14.045 -1.861 1.00 0.00 C flip ATOM 1691 CE1 HIS A 103 1.060 -15.257 -0.161 1.00 0.00 C flip ATOM 1692 NE2 HIS A 103 0.595 -14.777 -1.299 1.00 0.00 N flip ATOM 0 H HIS A 103 6.297 -13.034 -2.547 1.00 0.00 H new ATOM 0 HA HIS A 103 3.673 -14.124 -3.376 1.00 0.00 H new ATOM 0 HB2 HIS A 103 4.749 -13.752 -0.846 1.00 0.00 H new ATOM 0 HB3 HIS A 103 3.827 -12.279 -1.071 1.00 0.00 H new ATOM 0 HD1 HIS A 103 2.956 -15.029 0.806 1.00 0.00 H new ATOM 0 HD2 HIS A 103 1.452 -13.525 -2.803 1.00 0.00 H new ATOM 0 HE1 HIS A 103 0.515 -15.893 0.521 1.00 0.00 H new ATOM 1701 N LEU A 104 2.967 -12.054 -4.506 1.00 0.00 N ATOM 1702 CA LEU A 104 2.517 -10.850 -5.196 1.00 0.00 C ATOM 1703 C LEU A 104 1.063 -10.540 -4.855 1.00 0.00 C ATOM 1704 O LEU A 104 0.264 -11.446 -4.618 1.00 0.00 O ATOM 1705 CB LEU A 104 2.675 -11.014 -6.709 1.00 0.00 C ATOM 1706 CG LEU A 104 1.760 -12.063 -7.344 1.00 0.00 C ATOM 1707 CD1 LEU A 104 0.447 -11.432 -7.780 1.00 0.00 C ATOM 1708 CD2 LEU A 104 2.453 -12.727 -8.526 1.00 0.00 C ATOM 0 H LEU A 104 2.533 -12.916 -4.836 1.00 0.00 H new ATOM 0 HA LEU A 104 3.136 -10.017 -4.862 1.00 0.00 H new ATOM 0 HB2 LEU A 104 2.486 -10.052 -7.185 1.00 0.00 H new ATOM 0 HB3 LEU A 104 3.710 -11.278 -6.925 1.00 0.00 H new ATOM 0 HG LEU A 104 1.542 -12.828 -6.598 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -0.191 -12.193 -8.229 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -0.056 -11.003 -6.913 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.645 -10.647 -8.510 1.00 0.00 H new ATOM 0 HD21 LEU A 104 1.789 -13.471 -8.966 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.700 -11.973 -9.273 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.367 -13.213 -8.185 1.00 0.00 H new ATOM 1720 N GLY A 105 0.726 -9.254 -4.834 1.00 0.00 N ATOM 1721 CA GLY A 105 -0.632 -8.849 -4.521 1.00 0.00 C ATOM 1722 C GLY A 105 -0.987 -7.501 -5.118 1.00 0.00 C ATOM 1723 O GLY A 105 -0.103 -6.723 -5.479 1.00 0.00 O ATOM 0 H GLY A 105 1.369 -8.486 -5.028 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -1.327 -9.602 -4.892 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -0.755 -8.808 -3.439 1.00 0.00 H new ATOM 1727 N LEU A 106 -2.282 -7.225 -5.223 1.00 0.00 N ATOM 1728 CA LEU A 106 -2.752 -5.962 -5.780 1.00 0.00 C ATOM 1729 C LEU A 106 -4.186 -5.674 -5.345 1.00 0.00 C ATOM 1730 O LEU A 106 -5.019 -6.578 -5.282 1.00 0.00 O ATOM 1731 CB LEU A 106 -2.665 -5.990 -7.307 1.00 0.00 C ATOM 1732 CG LEU A 106 -3.062 -4.687 -8.003 1.00 0.00 C ATOM 1733 CD1 LEU A 106 -2.287 -4.518 -9.300 1.00 0.00 C ATOM 1734 CD2 LEU A 106 -4.559 -4.659 -8.266 1.00 0.00 C ATOM 0 H LEU A 106 -3.025 -7.859 -4.930 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.111 -5.166 -5.401 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -1.643 -6.240 -7.593 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.305 -6.791 -7.677 1.00 0.00 H new ATOM 0 HG LEU A 106 -2.814 -3.854 -7.345 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.582 -3.586 -9.781 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -1.219 -4.493 -9.085 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.504 -5.354 -9.965 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.824 -3.725 -8.762 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -4.832 -5.499 -8.905 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -5.096 -4.733 -7.320 1.00 0.00 H new ATOM 1746 N GLY A 107 -4.465 -4.410 -5.048 1.00 0.00 N ATOM 1747 CA GLY A 107 -5.799 -4.025 -4.624 1.00 0.00 C ATOM 1748 C GLY A 107 -5.918 -2.536 -4.367 1.00 0.00 C ATOM 1749 O GLY A 107 -5.106 -1.749 -4.850 1.00 0.00 O ATOM 0 H GLY A 107 -3.792 -3.645 -5.093 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.519 -4.317 -5.389 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -6.060 -4.569 -3.716 1.00 0.00 H new ATOM 1753 N PHE A 108 -6.935 -2.149 -3.602 1.00 0.00 N ATOM 1754 CA PHE A 108 -7.158 -0.744 -3.280 1.00 0.00 C ATOM 1755 C PHE A 108 -7.112 -0.517 -1.772 1.00 0.00 C ATOM 1756 O PHE A 108 -7.463 -1.400 -0.991 1.00 0.00 O ATOM 1757 CB PHE A 108 -8.506 -0.282 -3.836 1.00 0.00 C ATOM 1758 CG PHE A 108 -8.408 0.357 -5.193 1.00 0.00 C ATOM 1759 CD1 PHE A 108 -8.346 -0.422 -6.337 1.00 0.00 C ATOM 1760 CD2 PHE A 108 -8.374 1.736 -5.324 1.00 0.00 C ATOM 1761 CE1 PHE A 108 -8.255 0.161 -7.586 1.00 0.00 C ATOM 1762 CE2 PHE A 108 -8.283 2.325 -6.570 1.00 0.00 C ATOM 1763 CZ PHE A 108 -8.224 1.537 -7.703 1.00 0.00 C ATOM 0 H PHE A 108 -7.617 -2.789 -3.194 1.00 0.00 H new ATOM 0 HA PHE A 108 -6.362 -0.160 -3.741 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -9.179 -1.138 -3.894 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -8.953 0.428 -3.140 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -8.369 -1.498 -6.251 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -8.419 2.357 -4.442 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -8.208 -0.458 -8.470 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -8.258 3.401 -6.658 1.00 0.00 H new ATOM 0 HZ PHE A 108 -8.154 1.996 -8.678 1.00 0.00 H new ATOM 1773 N THR A 109 -6.675 0.673 -1.373 1.00 0.00 N ATOM 1774 CA THR A 109 -6.582 1.017 0.042 1.00 0.00 C ATOM 1775 C THR A 109 -7.253 2.359 0.321 1.00 0.00 C ATOM 1776 O THR A 109 -7.084 3.317 -0.434 1.00 0.00 O ATOM 1777 CB THR A 109 -5.118 1.067 0.481 1.00 0.00 C ATOM 1778 OG1 THR A 109 -4.400 2.027 -0.274 1.00 0.00 O ATOM 1779 CG2 THR A 109 -4.403 -0.259 0.333 1.00 0.00 C ATOM 0 H THR A 109 -6.380 1.415 -2.008 1.00 0.00 H new ATOM 0 HA THR A 109 -7.100 0.246 0.612 1.00 0.00 H new ATOM 0 HB THR A 109 -5.143 1.333 1.538 1.00 0.00 H new ATOM 0 HG1 THR A 109 -4.589 1.902 -1.227 1.00 0.00 H new ATOM 0 HG21 THR A 109 -3.369 -0.154 0.662 1.00 0.00 H new ATOM 0 HG22 THR A 109 -4.903 -1.012 0.943 1.00 0.00 H new ATOM 0 HG23 THR A 109 -4.422 -0.568 -0.712 1.00 0.00 H new ATOM 1787 N ALA A 110 -8.017 2.419 1.406 1.00 0.00 N ATOM 1788 CA ALA A 110 -8.714 3.643 1.783 1.00 0.00 C ATOM 1789 C ALA A 110 -8.108 4.254 3.042 1.00 0.00 C ATOM 1790 O ALA A 110 -8.180 3.673 4.124 1.00 0.00 O ATOM 1791 CB ALA A 110 -10.195 3.363 1.992 1.00 0.00 C ATOM 0 H ALA A 110 -8.169 1.634 2.040 1.00 0.00 H new ATOM 0 HA ALA A 110 -8.601 4.361 0.971 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -10.704 4.285 2.273 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -10.626 2.978 1.068 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -10.317 2.625 2.785 1.00 0.00 H new ATOM 1797 N GLY A 111 -7.510 5.432 2.891 1.00 0.00 N ATOM 1798 CA GLY A 111 -6.901 6.105 4.023 1.00 0.00 C ATOM 1799 C GLY A 111 -7.803 7.168 4.620 1.00 0.00 C ATOM 1800 O GLY A 111 -8.432 7.935 3.893 1.00 0.00 O ATOM 0 H GLY A 111 -7.437 5.932 2.005 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -6.655 5.370 4.789 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -5.964 6.563 3.708 1.00 0.00 H new ATOM 1804 N VAL A 112 -7.865 7.213 5.947 1.00 0.00 N ATOM 1805 CA VAL A 112 -8.697 8.189 6.638 1.00 0.00 C ATOM 1806 C VAL A 112 -7.848 9.148 7.466 1.00 0.00 C ATOM 1807 O VAL A 112 -6.880 8.740 8.108 1.00 0.00 O ATOM 1808 CB VAL A 112 -9.721 7.502 7.561 1.00 0.00 C ATOM 1809 CG1 VAL A 112 -10.733 6.715 6.744 1.00 0.00 C ATOM 1810 CG2 VAL A 112 -9.016 6.601 8.563 1.00 0.00 C ATOM 0 H VAL A 112 -7.349 6.585 6.564 1.00 0.00 H new ATOM 0 HA VAL A 112 -9.230 8.749 5.870 1.00 0.00 H new ATOM 0 HB VAL A 112 -10.258 8.272 8.115 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -11.448 6.237 7.413 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -11.261 7.390 6.071 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -10.216 5.953 6.161 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -9.755 6.124 9.207 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -8.451 5.836 8.030 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -8.335 7.196 9.172 1.00 0.00 H new ATOM 1820 N THR A 113 -8.218 10.425 7.447 1.00 0.00 N ATOM 1821 CA THR A 113 -7.490 11.443 8.196 1.00 0.00 C ATOM 1822 C THR A 113 -8.438 12.524 8.704 1.00 0.00 C ATOM 1823 O THR A 113 -9.258 13.049 7.951 1.00 0.00 O ATOM 1824 CB THR A 113 -6.403 12.070 7.321 1.00 0.00 C ATOM 1825 OG1 THR A 113 -5.743 11.079 6.555 1.00 0.00 O ATOM 1826 CG2 THR A 113 -5.352 12.813 8.115 1.00 0.00 C ATOM 0 H THR A 113 -9.017 10.779 6.921 1.00 0.00 H new ATOM 0 HA THR A 113 -7.022 10.963 9.055 1.00 0.00 H new ATOM 0 HB THR A 113 -6.922 12.783 6.680 1.00 0.00 H new ATOM 0 HG1 THR A 113 -5.053 11.500 6.001 1.00 0.00 H new ATOM 0 HG21 THR A 113 -4.611 13.233 7.435 1.00 0.00 H new ATOM 0 HG22 THR A 113 -5.824 13.617 8.680 1.00 0.00 H new ATOM 0 HG23 THR A 113 -4.862 12.125 8.804 1.00 0.00 H new ATOM 1834 N ALA A 114 -8.319 12.852 9.986 1.00 0.00 N ATOM 1835 CA ALA A 114 -9.167 13.872 10.595 1.00 0.00 C ATOM 1836 C ALA A 114 -8.408 15.183 10.770 1.00 0.00 C ATOM 1837 O ALA A 114 -7.296 15.203 11.297 1.00 0.00 O ATOM 1838 CB ALA A 114 -9.697 13.384 11.934 1.00 0.00 C ATOM 0 H ALA A 114 -7.645 12.428 10.623 1.00 0.00 H new ATOM 0 HA ALA A 114 -10.009 14.057 9.928 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -10.328 14.154 12.378 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -10.282 12.477 11.785 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -8.861 13.171 12.600 1.00 0.00 H new ATOM 1844 N ARG A 115 -9.017 16.276 10.322 1.00 0.00 N ATOM 1845 CA ARG A 115 -8.399 17.594 10.429 1.00 0.00 C ATOM 1846 C ARG A 115 -9.459 18.689 10.484 1.00 0.00 C ATOM 1847 O ARG A 115 -10.041 19.054 9.463 1.00 0.00 O ATOM 1848 CB ARG A 115 -7.458 17.836 9.247 1.00 0.00 C ATOM 1849 CG ARG A 115 -6.483 18.980 9.471 1.00 0.00 C ATOM 1850 CD ARG A 115 -5.450 18.635 10.533 1.00 0.00 C ATOM 1851 NE ARG A 115 -5.381 19.651 11.581 1.00 0.00 N ATOM 1852 CZ ARG A 115 -4.652 19.527 12.687 1.00 0.00 C ATOM 1853 NH1 ARG A 115 -3.928 18.434 12.893 1.00 0.00 N ATOM 1854 NH2 ARG A 115 -4.646 20.499 13.589 1.00 0.00 N ATOM 0 H ARG A 115 -9.937 16.276 9.882 1.00 0.00 H new ATOM 0 HA ARG A 115 -7.824 17.625 11.354 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -6.896 16.924 9.048 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -8.052 18.045 8.357 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -5.978 19.217 8.535 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -7.031 19.873 9.772 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -5.696 17.671 10.978 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -4.471 18.529 10.066 1.00 0.00 H new ATOM 0 HE ARG A 115 -5.924 20.506 11.457 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -3.929 17.684 12.202 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -3.371 18.344 13.743 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -5.200 21.341 13.435 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -4.087 20.404 14.437 1.00 0.00 H new ATOM 1868 N ASP A 116 -9.703 19.211 11.682 1.00 0.00 N ATOM 1869 CA ASP A 116 -10.692 20.265 11.868 1.00 0.00 C ATOM 1870 C ASP A 116 -10.572 20.883 13.258 1.00 0.00 C ATOM 1871 O ASP A 116 -9.701 20.508 14.043 1.00 0.00 O ATOM 1872 CB ASP A 116 -12.103 19.711 11.665 1.00 0.00 C ATOM 1873 CG ASP A 116 -13.022 20.703 10.980 1.00 0.00 C ATOM 1874 OD1 ASP A 116 -12.765 21.921 11.086 1.00 0.00 O ATOM 1875 OD2 ASP A 116 -13.998 20.263 10.337 1.00 0.00 O ATOM 0 H ASP A 116 -9.229 18.921 12.538 1.00 0.00 H new ATOM 0 HA ASP A 116 -10.504 21.041 11.126 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -12.050 18.799 11.070 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -12.525 19.437 12.632 1.00 0.00 H new ATOM 1881 N ASN A 117 -11.452 21.834 13.554 1.00 0.00 N ATOM 1882 CA ASN A 117 -11.445 22.505 14.849 1.00 0.00 C ATOM 1883 C ASN A 117 -12.576 21.992 15.734 1.00 0.00 C ATOM 1884 O ASN A 117 -13.751 22.225 15.454 1.00 0.00 O ATOM 1885 CB ASN A 117 -11.574 24.019 14.663 1.00 0.00 C ATOM 1886 CG ASN A 117 -11.292 24.784 15.941 1.00 0.00 C ATOM 1887 OD1 ASN A 117 -11.393 24.239 17.040 1.00 0.00 O ATOM 1888 ND2 ASN A 117 -10.934 26.055 15.802 1.00 0.00 N ATOM 0 H ASN A 117 -12.179 22.157 12.915 1.00 0.00 H new ATOM 0 HA ASN A 117 -10.496 22.285 15.339 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -10.883 24.347 13.886 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -12.580 24.255 14.316 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -10.730 26.620 16.626 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -10.863 26.466 14.871 1.00 0.00 H new ATOM 1895 N TRP A 118 -12.212 21.292 16.803 1.00 0.00 N ATOM 1896 CA TRP A 118 -13.196 20.745 17.730 1.00 0.00 C ATOM 1897 C TRP A 118 -14.138 19.780 17.018 1.00 0.00 C ATOM 1898 O TRP A 118 -15.329 19.719 17.325 1.00 0.00 O ATOM 1899 CB TRP A 118 -14.000 21.874 18.380 1.00 0.00 C ATOM 1900 CG TRP A 118 -13.182 22.748 19.281 1.00 0.00 C ATOM 1901 CD1 TRP A 118 -11.975 22.445 19.844 1.00 0.00 C ATOM 1902 CD2 TRP A 118 -13.514 24.068 19.725 1.00 0.00 C ATOM 1903 NE1 TRP A 118 -11.536 23.498 20.612 1.00 0.00 N ATOM 1904 CE2 TRP A 118 -12.463 24.506 20.554 1.00 0.00 C ATOM 1905 CE3 TRP A 118 -14.596 24.923 19.503 1.00 0.00 C ATOM 1906 CZ2 TRP A 118 -12.465 25.760 21.160 1.00 0.00 C ATOM 1907 CZ3 TRP A 118 -14.597 26.169 20.104 1.00 0.00 C ATOM 1908 CH2 TRP A 118 -13.537 26.576 20.924 1.00 0.00 C ATOM 0 H TRP A 118 -11.243 21.090 17.049 1.00 0.00 H new ATOM 0 HA TRP A 118 -12.661 20.196 18.505 1.00 0.00 H new ATOM 0 HB2 TRP A 118 -14.446 22.488 17.598 1.00 0.00 H new ATOM 0 HB3 TRP A 118 -14.820 21.442 18.953 1.00 0.00 H new ATOM 0 HD1 TRP A 118 -11.443 21.515 19.706 1.00 0.00 H new ATOM 0 HE1 TRP A 118 -10.663 23.525 21.139 1.00 0.00 H new ATOM 0 HE3 TRP A 118 -15.418 24.617 18.873 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 -11.650 26.077 21.793 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 -15.428 26.838 19.938 1.00 0.00 H new ATOM 0 HH2 TRP A 118 -13.567 27.555 21.380 1.00 0.00 H new ATOM 1919 N ASN A 119 -13.597 19.027 16.065 1.00 0.00 N ATOM 1920 CA ASN A 119 -14.391 18.064 15.310 1.00 0.00 C ATOM 1921 C ASN A 119 -13.566 16.829 14.963 1.00 0.00 C ATOM 1922 O ASN A 119 -12.336 16.861 15.005 1.00 0.00 O ATOM 1923 CB ASN A 119 -14.930 18.707 14.030 1.00 0.00 C ATOM 1924 CG ASN A 119 -16.321 18.217 13.679 1.00 0.00 C ATOM 1925 OD1 ASN A 119 -16.481 17.266 12.914 1.00 0.00 O ATOM 1926 ND2 ASN A 119 -17.336 18.868 14.236 1.00 0.00 N ATOM 0 H ASN A 119 -12.613 19.065 15.798 1.00 0.00 H new ATOM 0 HA ASN A 119 -15.229 17.755 15.935 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -14.949 19.790 14.151 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -14.252 18.490 13.204 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -18.295 18.585 14.035 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -17.156 19.651 14.864 1.00 0.00 H new ATOM 1933 N TYR A 120 -14.251 15.743 14.620 1.00 0.00 N ATOM 1934 CA TYR A 120 -13.581 14.497 14.265 1.00 0.00 C ATOM 1935 C TYR A 120 -14.270 13.829 13.079 1.00 0.00 C ATOM 1936 O TYR A 120 -15.017 12.864 13.245 1.00 0.00 O ATOM 1937 CB TYR A 120 -13.562 13.546 15.462 1.00 0.00 C ATOM 1938 CG TYR A 120 -12.326 13.681 16.324 1.00 0.00 C ATOM 1939 CD1 TYR A 120 -11.106 13.165 15.908 1.00 0.00 C ATOM 1940 CD2 TYR A 120 -12.382 14.324 17.555 1.00 0.00 C ATOM 1941 CE1 TYR A 120 -9.975 13.286 16.694 1.00 0.00 C ATOM 1942 CE2 TYR A 120 -11.255 14.449 18.345 1.00 0.00 C ATOM 1943 CZ TYR A 120 -10.055 13.929 17.910 1.00 0.00 C ATOM 1944 OH TYR A 120 -8.931 14.052 18.695 1.00 0.00 O ATOM 0 H TYR A 120 -15.269 15.700 14.580 1.00 0.00 H new ATOM 0 HA TYR A 120 -12.555 14.732 13.981 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -14.444 13.730 16.075 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -13.633 12.520 15.101 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -11.039 12.661 14.955 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -13.321 14.732 17.899 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -9.033 12.879 16.357 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -11.314 14.952 19.299 1.00 0.00 H new ATOM 0 HH TYR A 120 -9.158 14.532 19.519 1.00 0.00 H new ATOM 1954 N ILE A 121 -14.013 14.348 11.882 1.00 0.00 N ATOM 1955 CA ILE A 121 -14.608 13.802 10.669 1.00 0.00 C ATOM 1956 C ILE A 121 -13.566 13.064 9.830 1.00 0.00 C ATOM 1957 O ILE A 121 -12.678 13.686 9.247 1.00 0.00 O ATOM 1958 CB ILE A 121 -15.249 14.909 9.811 1.00 0.00 C ATOM 1959 CG1 ILE A 121 -14.283 16.085 9.649 1.00 0.00 C ATOM 1960 CG2 ILE A 121 -16.556 15.374 10.436 1.00 0.00 C ATOM 1961 CD1 ILE A 121 -14.282 16.677 8.255 1.00 0.00 C ATOM 0 H ILE A 121 -13.397 15.146 11.727 1.00 0.00 H new ATOM 0 HA ILE A 121 -15.382 13.101 10.983 1.00 0.00 H new ATOM 0 HB ILE A 121 -15.465 14.502 8.823 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -14.546 16.863 10.366 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -13.274 15.753 9.895 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -16.997 16.156 9.818 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -17.246 14.533 10.504 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -16.363 15.766 11.434 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -13.575 17.506 8.212 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -13.989 15.913 7.535 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -15.281 17.040 8.013 1.00 0.00 H new ATOM 1973 N PRO A 122 -13.656 11.723 9.754 1.00 0.00 N ATOM 1974 CA PRO A 122 -12.710 10.914 8.978 1.00 0.00 C ATOM 1975 C PRO A 122 -12.835 11.158 7.478 1.00 0.00 C ATOM 1976 O PRO A 122 -13.893 10.935 6.888 1.00 0.00 O ATOM 1977 CB PRO A 122 -13.101 9.473 9.320 1.00 0.00 C ATOM 1978 CG PRO A 122 -14.526 9.555 9.744 1.00 0.00 C ATOM 1979 CD PRO A 122 -14.681 10.892 10.414 1.00 0.00 C ATOM 0 HA PRO A 122 -11.675 11.155 9.222 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -12.982 8.816 8.458 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -12.474 9.071 10.116 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -15.194 9.468 8.887 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -14.777 8.744 10.428 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -15.682 11.300 10.272 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -14.514 10.825 11.489 1.00 0.00 H new ATOM 1987 N LEU A 123 -11.750 11.618 6.865 1.00 0.00 N ATOM 1988 CA LEU A 123 -11.736 11.894 5.434 1.00 0.00 C ATOM 1989 C LEU A 123 -11.081 10.747 4.665 1.00 0.00 C ATOM 1990 O LEU A 123 -9.855 10.664 4.589 1.00 0.00 O ATOM 1991 CB LEU A 123 -10.992 13.201 5.153 1.00 0.00 C ATOM 1992 CG LEU A 123 -11.683 14.462 5.671 1.00 0.00 C ATOM 1993 CD1 LEU A 123 -10.656 15.530 6.018 1.00 0.00 C ATOM 1994 CD2 LEU A 123 -12.673 14.987 4.640 1.00 0.00 C ATOM 0 H LEU A 123 -10.867 11.808 7.339 1.00 0.00 H new ATOM 0 HA LEU A 123 -12.768 11.992 5.098 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -9.999 13.140 5.599 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -10.852 13.298 4.076 1.00 0.00 H new ATOM 0 HG LEU A 123 -12.232 14.207 6.578 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -11.167 16.420 6.385 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -9.985 15.153 6.790 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -10.080 15.783 5.128 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -13.157 15.885 5.024 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -12.145 15.226 3.717 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -13.427 14.226 4.440 1.00 0.00 H new ATOM 2006 N PRO A 124 -11.891 9.846 4.080 1.00 0.00 N ATOM 2007 CA PRO A 124 -11.374 8.705 3.315 1.00 0.00 C ATOM 2008 C PRO A 124 -10.720 9.134 2.006 1.00 0.00 C ATOM 2009 O PRO A 124 -11.016 10.203 1.474 1.00 0.00 O ATOM 2010 CB PRO A 124 -12.624 7.865 3.037 1.00 0.00 C ATOM 2011 CG PRO A 124 -13.752 8.837 3.089 1.00 0.00 C ATOM 2012 CD PRO A 124 -13.365 9.864 4.116 1.00 0.00 C ATOM 0 HA PRO A 124 -10.597 8.169 3.860 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -12.565 7.378 2.064 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -12.745 7.077 3.781 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -13.914 9.300 2.116 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -14.683 8.341 3.364 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -13.761 10.849 3.868 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -13.746 9.607 5.104 1.00 0.00 H new ATOM 2020 N VAL A 125 -9.827 8.294 1.494 1.00 0.00 N ATOM 2021 CA VAL A 125 -9.129 8.586 0.248 1.00 0.00 C ATOM 2022 C VAL A 125 -8.790 7.305 -0.506 1.00 0.00 C ATOM 2023 O VAL A 125 -8.236 6.365 0.065 1.00 0.00 O ATOM 2024 CB VAL A 125 -7.832 9.377 0.503 1.00 0.00 C ATOM 2025 CG1 VAL A 125 -7.221 9.840 -0.811 1.00 0.00 C ATOM 2026 CG2 VAL A 125 -8.099 10.560 1.422 1.00 0.00 C ATOM 0 H VAL A 125 -9.570 7.405 1.923 1.00 0.00 H new ATOM 0 HA VAL A 125 -9.803 9.193 -0.357 1.00 0.00 H new ATOM 0 HB VAL A 125 -7.118 8.718 0.996 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -6.306 10.397 -0.610 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -6.990 8.973 -1.430 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -7.929 10.482 -1.335 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -7.171 11.107 1.590 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -8.831 11.222 0.960 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -8.486 10.200 2.375 1.00 0.00 H new ATOM 2036 N LEU A 126 -9.123 7.275 -1.792 1.00 0.00 N ATOM 2037 CA LEU A 126 -8.853 6.109 -2.625 1.00 0.00 C ATOM 2038 C LEU A 126 -7.426 6.145 -3.162 1.00 0.00 C ATOM 2039 O LEU A 126 -7.042 7.076 -3.870 1.00 0.00 O ATOM 2040 CB LEU A 126 -9.847 6.042 -3.786 1.00 0.00 C ATOM 2041 CG LEU A 126 -11.306 6.299 -3.405 1.00 0.00 C ATOM 2042 CD1 LEU A 126 -12.208 6.142 -4.619 1.00 0.00 C ATOM 2043 CD2 LEU A 126 -11.738 5.356 -2.291 1.00 0.00 C ATOM 0 H LEU A 126 -9.580 8.045 -2.280 1.00 0.00 H new ATOM 0 HA LEU A 126 -8.968 5.218 -2.008 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -9.551 6.771 -4.540 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -9.776 5.058 -4.249 1.00 0.00 H new ATOM 0 HG LEU A 126 -11.394 7.323 -3.042 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -13.242 6.328 -4.330 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -11.912 6.856 -5.387 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -12.118 5.129 -5.011 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -12.778 5.552 -2.032 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -11.636 4.324 -2.628 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -11.109 5.516 -1.415 1.00 0.00 H new ATOM 2055 N LEU A 127 -6.645 5.124 -2.823 1.00 0.00 N ATOM 2056 CA LEU A 127 -5.260 5.039 -3.273 1.00 0.00 C ATOM 2057 C LEU A 127 -4.868 3.589 -3.550 1.00 0.00 C ATOM 2058 O LEU A 127 -4.558 2.836 -2.627 1.00 0.00 O ATOM 2059 CB LEU A 127 -4.325 5.640 -2.222 1.00 0.00 C ATOM 2060 CG LEU A 127 -4.535 5.125 -0.796 1.00 0.00 C ATOM 2061 CD1 LEU A 127 -3.209 5.046 -0.056 1.00 0.00 C ATOM 2062 CD2 LEU A 127 -5.513 6.019 -0.048 1.00 0.00 C ATOM 0 H LEU A 127 -6.947 4.345 -2.239 1.00 0.00 H new ATOM 0 HA LEU A 127 -5.167 5.606 -4.199 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.295 5.438 -2.517 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -4.451 6.723 -2.223 1.00 0.00 H new ATOM 0 HG LEU A 127 -4.957 4.121 -0.850 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -3.378 4.678 0.956 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -2.539 4.366 -0.582 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -2.758 6.037 -0.011 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -5.652 5.639 0.964 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -5.118 7.034 -0.004 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -6.471 6.025 -0.568 1.00 0.00 H new ATOM 2074 N PRO A 128 -4.873 3.174 -4.830 1.00 0.00 N ATOM 2075 CA PRO A 128 -4.513 1.806 -5.216 1.00 0.00 C ATOM 2076 C PRO A 128 -3.026 1.524 -5.033 1.00 0.00 C ATOM 2077 O PRO A 128 -2.184 2.382 -5.298 1.00 0.00 O ATOM 2078 CB PRO A 128 -4.891 1.742 -6.697 1.00 0.00 C ATOM 2079 CG PRO A 128 -4.815 3.153 -7.168 1.00 0.00 C ATOM 2080 CD PRO A 128 -5.228 4.002 -5.998 1.00 0.00 C ATOM 0 HA PRO A 128 -5.021 1.063 -4.601 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -4.206 1.102 -7.253 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -5.892 1.333 -6.833 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -3.805 3.402 -7.494 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -5.474 3.316 -8.021 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -4.701 4.956 -5.989 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -6.294 4.227 -6.022 1.00 0.00 H new ATOM 2088 N LEU A 129 -2.710 0.317 -4.578 1.00 0.00 N ATOM 2089 CA LEU A 129 -1.324 -0.080 -4.359 1.00 0.00 C ATOM 2090 C LEU A 129 -1.176 -1.595 -4.434 1.00 0.00 C ATOM 2091 O LEU A 129 -2.166 -2.324 -4.487 1.00 0.00 O ATOM 2092 CB LEU A 129 -0.834 0.429 -3.002 1.00 0.00 C ATOM 2093 CG LEU A 129 -1.818 0.239 -1.846 1.00 0.00 C ATOM 2094 CD1 LEU A 129 -1.616 -1.119 -1.191 1.00 0.00 C ATOM 2095 CD2 LEU A 129 -1.660 1.356 -0.825 1.00 0.00 C ATOM 0 H LEU A 129 -3.395 -0.404 -4.353 1.00 0.00 H new ATOM 0 HA LEU A 129 -0.714 0.365 -5.145 1.00 0.00 H new ATOM 0 HB2 LEU A 129 0.097 -0.081 -2.754 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.602 1.490 -3.091 1.00 0.00 H new ATOM 0 HG LEU A 129 -2.832 0.279 -2.245 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -2.324 -1.236 -0.371 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -1.779 -1.906 -1.927 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -0.599 -1.189 -0.805 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -2.367 1.206 -0.009 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -0.644 1.347 -0.431 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.856 2.316 -1.303 1.00 0.00 H new ATOM 2107 N ALA A 130 0.068 -2.064 -4.437 1.00 0.00 N ATOM 2108 CA ALA A 130 0.344 -3.493 -4.505 1.00 0.00 C ATOM 2109 C ALA A 130 1.626 -3.842 -3.756 1.00 0.00 C ATOM 2110 O ALA A 130 2.490 -2.988 -3.553 1.00 0.00 O ATOM 2111 CB ALA A 130 0.439 -3.944 -5.955 1.00 0.00 C ATOM 0 H ALA A 130 0.900 -1.475 -4.393 1.00 0.00 H new ATOM 0 HA ALA A 130 -0.481 -4.020 -4.025 1.00 0.00 H new ATOM 0 HB1 ALA A 130 0.646 -5.014 -5.991 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -0.504 -3.739 -6.462 1.00 0.00 H new ATOM 0 HB3 ALA A 130 1.244 -3.402 -6.453 1.00 0.00 H new ATOM 2117 N SER A 131 1.744 -5.101 -3.350 1.00 0.00 N ATOM 2118 CA SER A 131 2.920 -5.565 -2.625 1.00 0.00 C ATOM 2119 C SER A 131 3.469 -6.847 -3.243 1.00 0.00 C ATOM 2120 O SER A 131 2.726 -7.797 -3.487 1.00 0.00 O ATOM 2121 CB SER A 131 2.578 -5.802 -1.153 1.00 0.00 C ATOM 2122 OG SER A 131 1.922 -7.045 -0.974 1.00 0.00 O ATOM 0 H SER A 131 1.038 -5.819 -3.511 1.00 0.00 H new ATOM 0 HA SER A 131 3.686 -4.792 -2.693 1.00 0.00 H new ATOM 0 HB2 SER A 131 3.490 -5.780 -0.557 1.00 0.00 H new ATOM 0 HB3 SER A 131 1.940 -4.996 -0.790 1.00 0.00 H new ATOM 0 HG SER A 131 1.716 -7.173 -0.024 1.00 0.00 H new ATOM 2128 N VAL A 132 4.774 -6.865 -3.496 1.00 0.00 N ATOM 2129 CA VAL A 132 5.421 -8.030 -4.087 1.00 0.00 C ATOM 2130 C VAL A 132 6.775 -8.294 -3.439 1.00 0.00 C ATOM 2131 O VAL A 132 7.581 -7.380 -3.266 1.00 0.00 O ATOM 2132 CB VAL A 132 5.616 -7.854 -5.604 1.00 0.00 C ATOM 2133 CG1 VAL A 132 4.275 -7.872 -6.322 1.00 0.00 C ATOM 2134 CG2 VAL A 132 6.370 -6.565 -5.899 1.00 0.00 C ATOM 0 H VAL A 132 5.403 -6.086 -3.301 1.00 0.00 H new ATOM 0 HA VAL A 132 4.764 -8.881 -3.909 1.00 0.00 H new ATOM 0 HB VAL A 132 6.210 -8.689 -5.974 1.00 0.00 H new ATOM 0 HG11 VAL A 132 4.434 -7.746 -7.393 1.00 0.00 H new ATOM 0 HG12 VAL A 132 3.777 -8.824 -6.138 1.00 0.00 H new ATOM 0 HG13 VAL A 132 3.652 -7.059 -5.950 1.00 0.00 H new ATOM 0 HG21 VAL A 132 6.499 -6.457 -6.976 1.00 0.00 H new ATOM 0 HG22 VAL A 132 5.804 -5.716 -5.514 1.00 0.00 H new ATOM 0 HG23 VAL A 132 7.348 -6.597 -5.418 1.00 0.00 H new ATOM 2144 N GLY A 133 7.021 -9.551 -3.083 1.00 0.00 N ATOM 2145 CA GLY A 133 8.280 -9.912 -2.460 1.00 0.00 C ATOM 2146 C GLY A 133 8.126 -11.013 -1.430 1.00 0.00 C ATOM 2147 O GLY A 133 7.256 -11.875 -1.555 1.00 0.00 O ATOM 0 H GLY A 133 6.371 -10.326 -3.215 1.00 0.00 H new ATOM 0 HA2 GLY A 133 8.982 -10.234 -3.229 1.00 0.00 H new ATOM 0 HA3 GLY A 133 8.711 -9.031 -1.984 1.00 0.00 H new ATOM 2151 N TYR A 134 8.977 -10.985 -0.409 1.00 0.00 N ATOM 2152 CA TYR A 134 8.939 -11.988 0.650 1.00 0.00 C ATOM 2153 C TYR A 134 8.101 -11.503 1.830 1.00 0.00 C ATOM 2154 O TYR A 134 8.058 -10.309 2.124 1.00 0.00 O ATOM 2155 CB TYR A 134 10.359 -12.322 1.115 1.00 0.00 C ATOM 2156 CG TYR A 134 10.702 -13.791 1.006 1.00 0.00 C ATOM 2157 CD1 TYR A 134 10.007 -14.742 1.743 1.00 0.00 C ATOM 2158 CD2 TYR A 134 11.719 -14.225 0.167 1.00 0.00 C ATOM 2159 CE1 TYR A 134 10.318 -16.085 1.646 1.00 0.00 C ATOM 2160 CE2 TYR A 134 12.035 -15.567 0.064 1.00 0.00 C ATOM 2161 CZ TYR A 134 11.332 -16.492 0.805 1.00 0.00 C ATOM 2162 OH TYR A 134 11.644 -17.828 0.706 1.00 0.00 O ATOM 0 H TYR A 134 9.702 -10.277 -0.292 1.00 0.00 H new ATOM 0 HA TYR A 134 8.476 -12.889 0.248 1.00 0.00 H new ATOM 0 HB2 TYR A 134 11.071 -11.746 0.523 1.00 0.00 H new ATOM 0 HB3 TYR A 134 10.477 -12.006 2.151 1.00 0.00 H new ATOM 0 HD1 TYR A 134 9.211 -14.427 2.402 1.00 0.00 H new ATOM 0 HD2 TYR A 134 12.272 -13.503 -0.415 1.00 0.00 H new ATOM 0 HE1 TYR A 134 9.769 -16.812 2.226 1.00 0.00 H new ATOM 0 HE2 TYR A 134 12.829 -15.889 -0.594 1.00 0.00 H new ATOM 0 HH TYR A 134 12.380 -17.946 0.070 1.00 0.00 H new ATOM 2172 N GLY A 135 7.435 -12.438 2.501 1.00 0.00 N ATOM 2173 CA GLY A 135 6.605 -12.094 3.643 1.00 0.00 C ATOM 2174 C GLY A 135 7.289 -11.140 4.609 1.00 0.00 C ATOM 2175 O GLY A 135 6.778 -10.051 4.870 1.00 0.00 O ATOM 0 H GLY A 135 7.455 -13.432 2.273 1.00 0.00 H new ATOM 0 HA2 GLY A 135 5.679 -11.641 3.289 1.00 0.00 H new ATOM 0 HA3 GLY A 135 6.331 -13.006 4.174 1.00 0.00 H new ATOM 2179 N PRO A 136 8.454 -11.523 5.162 1.00 0.00 N ATOM 2180 CA PRO A 136 9.193 -10.676 6.106 1.00 0.00 C ATOM 2181 C PRO A 136 9.643 -9.361 5.477 1.00 0.00 C ATOM 2182 O PRO A 136 9.748 -8.341 6.156 1.00 0.00 O ATOM 2183 CB PRO A 136 10.408 -11.529 6.492 1.00 0.00 C ATOM 2184 CG PRO A 136 10.537 -12.537 5.401 1.00 0.00 C ATOM 2185 CD PRO A 136 9.141 -12.801 4.915 1.00 0.00 C ATOM 0 HA PRO A 136 8.575 -10.389 6.957 1.00 0.00 H new ATOM 0 HB2 PRO A 136 11.308 -10.919 6.574 1.00 0.00 H new ATOM 0 HB3 PRO A 136 10.260 -12.011 7.459 1.00 0.00 H new ATOM 0 HG2 PRO A 136 11.166 -12.161 4.595 1.00 0.00 H new ATOM 0 HG3 PRO A 136 11.002 -13.452 5.768 1.00 0.00 H new ATOM 0 HD2 PRO A 136 9.126 -13.069 3.859 1.00 0.00 H new ATOM 0 HD3 PRO A 136 8.673 -13.622 5.459 1.00 0.00 H new ATOM 2193 N VAL A 137 9.905 -9.394 4.175 1.00 0.00 N ATOM 2194 CA VAL A 137 10.342 -8.203 3.454 1.00 0.00 C ATOM 2195 C VAL A 137 9.628 -8.082 2.112 1.00 0.00 C ATOM 2196 O VAL A 137 9.863 -8.874 1.199 1.00 0.00 O ATOM 2197 CB VAL A 137 11.863 -8.218 3.214 1.00 0.00 C ATOM 2198 CG1 VAL A 137 12.610 -7.912 4.503 1.00 0.00 C ATOM 2199 CG2 VAL A 137 12.300 -9.557 2.639 1.00 0.00 C ATOM 0 H VAL A 137 9.823 -10.231 3.598 1.00 0.00 H new ATOM 0 HA VAL A 137 10.089 -7.345 4.077 1.00 0.00 H new ATOM 0 HB VAL A 137 12.106 -7.442 2.488 1.00 0.00 H new ATOM 0 HG11 VAL A 137 13.683 -7.927 4.314 1.00 0.00 H new ATOM 0 HG12 VAL A 137 12.319 -6.926 4.867 1.00 0.00 H new ATOM 0 HG13 VAL A 137 12.363 -8.663 5.254 1.00 0.00 H new ATOM 0 HG21 VAL A 137 13.378 -9.549 2.476 1.00 0.00 H new ATOM 0 HG22 VAL A 137 12.045 -10.354 3.338 1.00 0.00 H new ATOM 0 HG23 VAL A 137 11.791 -9.729 1.691 1.00 0.00 H new ATOM 2209 N THR A 138 8.756 -7.085 1.999 1.00 0.00 N ATOM 2210 CA THR A 138 8.007 -6.862 0.767 1.00 0.00 C ATOM 2211 C THR A 138 8.006 -5.385 0.388 1.00 0.00 C ATOM 2212 O THR A 138 8.030 -4.511 1.254 1.00 0.00 O ATOM 2213 CB THR A 138 6.570 -7.363 0.923 1.00 0.00 C ATOM 2214 OG1 THR A 138 6.147 -7.264 2.271 1.00 0.00 O ATOM 2215 CG2 THR A 138 6.386 -8.800 0.488 1.00 0.00 C ATOM 0 H THR A 138 8.551 -6.420 2.744 1.00 0.00 H new ATOM 0 HA THR A 138 8.495 -7.421 -0.032 1.00 0.00 H new ATOM 0 HB THR A 138 5.971 -6.725 0.274 1.00 0.00 H new ATOM 0 HG1 THR A 138 5.225 -7.588 2.349 1.00 0.00 H new ATOM 0 HG21 THR A 138 5.345 -9.091 0.625 1.00 0.00 H new ATOM 0 HG22 THR A 138 6.655 -8.899 -0.564 1.00 0.00 H new ATOM 0 HG23 THR A 138 7.025 -9.447 1.089 1.00 0.00 H new ATOM 2223 N PHE A 139 7.977 -5.114 -0.913 1.00 0.00 N ATOM 2224 CA PHE A 139 7.971 -3.744 -1.409 1.00 0.00 C ATOM 2225 C PHE A 139 6.570 -3.330 -1.847 1.00 0.00 C ATOM 2226 O PHE A 139 5.947 -3.991 -2.677 1.00 0.00 O ATOM 2227 CB PHE A 139 8.947 -3.600 -2.579 1.00 0.00 C ATOM 2228 CG PHE A 139 9.425 -2.192 -2.793 1.00 0.00 C ATOM 2229 CD1 PHE A 139 8.562 -1.219 -3.272 1.00 0.00 C ATOM 2230 CD2 PHE A 139 10.737 -1.842 -2.516 1.00 0.00 C ATOM 2231 CE1 PHE A 139 8.999 0.078 -3.471 1.00 0.00 C ATOM 2232 CE2 PHE A 139 11.180 -0.547 -2.712 1.00 0.00 C ATOM 2233 CZ PHE A 139 10.310 0.414 -3.190 1.00 0.00 C ATOM 0 H PHE A 139 7.957 -5.826 -1.643 1.00 0.00 H new ATOM 0 HA PHE A 139 8.287 -3.088 -0.598 1.00 0.00 H new ATOM 0 HB2 PHE A 139 9.808 -4.245 -2.404 1.00 0.00 H new ATOM 0 HB3 PHE A 139 8.464 -3.953 -3.490 1.00 0.00 H new ATOM 0 HD1 PHE A 139 7.537 -1.477 -3.492 1.00 0.00 H new ATOM 0 HD2 PHE A 139 11.421 -2.589 -2.143 1.00 0.00 H new ATOM 0 HE1 PHE A 139 8.317 0.827 -3.845 1.00 0.00 H new ATOM 0 HE2 PHE A 139 12.205 -0.287 -2.492 1.00 0.00 H new ATOM 0 HZ PHE A 139 10.654 1.426 -3.344 1.00 0.00 H new ATOM 2243 N GLN A 140 6.080 -2.230 -1.282 1.00 0.00 N ATOM 2244 CA GLN A 140 4.752 -1.728 -1.614 1.00 0.00 C ATOM 2245 C GLN A 140 4.842 -0.498 -2.513 1.00 0.00 C ATOM 2246 O GLN A 140 5.700 0.363 -2.317 1.00 0.00 O ATOM 2247 CB GLN A 140 3.979 -1.387 -0.338 1.00 0.00 C ATOM 2248 CG GLN A 140 3.127 -2.532 0.182 1.00 0.00 C ATOM 2249 CD GLN A 140 1.972 -2.057 1.042 1.00 0.00 C ATOM 2250 OE1 GLN A 140 1.520 -0.918 0.920 1.00 0.00 O ATOM 2251 NE2 GLN A 140 1.489 -2.929 1.919 1.00 0.00 N ATOM 0 H GLN A 140 6.583 -1.670 -0.593 1.00 0.00 H new ATOM 0 HA GLN A 140 4.220 -2.511 -2.155 1.00 0.00 H new ATOM 0 HB2 GLN A 140 4.686 -1.091 0.437 1.00 0.00 H new ATOM 0 HB3 GLN A 140 3.338 -0.527 -0.531 1.00 0.00 H new ATOM 0 HG2 GLN A 140 2.737 -3.101 -0.661 1.00 0.00 H new ATOM 0 HG3 GLN A 140 3.752 -3.210 0.763 1.00 0.00 H new ATOM 0 HE21 GLN A 140 1.894 -3.863 1.986 1.00 0.00 H new ATOM 0 HE22 GLN A 140 0.713 -2.665 2.526 1.00 0.00 H new ATOM 2260 N MET A 141 3.953 -0.423 -3.495 1.00 0.00 N ATOM 2261 CA MET A 141 3.931 0.701 -4.424 1.00 0.00 C ATOM 2262 C MET A 141 2.600 1.445 -4.347 1.00 0.00 C ATOM 2263 O MET A 141 1.545 0.877 -4.626 1.00 0.00 O ATOM 2264 CB MET A 141 4.173 0.214 -5.854 1.00 0.00 C ATOM 2265 CG MET A 141 5.480 -0.547 -6.024 1.00 0.00 C ATOM 2266 SD MET A 141 6.591 0.231 -7.213 1.00 0.00 S ATOM 2267 CE MET A 141 7.154 1.648 -6.274 1.00 0.00 C ATOM 0 H MET A 141 3.237 -1.128 -3.669 1.00 0.00 H new ATOM 0 HA MET A 141 4.729 1.388 -4.142 1.00 0.00 H new ATOM 0 HB2 MET A 141 3.346 -0.429 -6.155 1.00 0.00 H new ATOM 0 HB3 MET A 141 4.171 1.072 -6.527 1.00 0.00 H new ATOM 0 HG2 MET A 141 5.981 -0.620 -5.059 1.00 0.00 H new ATOM 0 HG3 MET A 141 5.263 -1.565 -6.348 1.00 0.00 H new ATOM 0 HE1 MET A 141 6.790 2.563 -6.742 1.00 0.00 H new ATOM 0 HE2 MET A 141 6.771 1.585 -5.255 1.00 0.00 H new ATOM 0 HE3 MET A 141 8.244 1.660 -6.252 1.00 0.00 H new ATOM 2277 N THR A 142 2.660 2.715 -3.965 1.00 0.00 N ATOM 2278 CA THR A 142 1.460 3.536 -3.850 1.00 0.00 C ATOM 2279 C THR A 142 1.337 4.492 -5.033 1.00 0.00 C ATOM 2280 O THR A 142 2.267 5.239 -5.339 1.00 0.00 O ATOM 2281 CB THR A 142 1.480 4.327 -2.541 1.00 0.00 C ATOM 2282 OG1 THR A 142 2.075 3.566 -1.504 1.00 0.00 O ATOM 2283 CG2 THR A 142 0.103 4.744 -2.073 1.00 0.00 C ATOM 0 H THR A 142 3.526 3.199 -3.730 1.00 0.00 H new ATOM 0 HA THR A 142 0.596 2.872 -3.852 1.00 0.00 H new ATOM 0 HB THR A 142 2.060 5.225 -2.755 1.00 0.00 H new ATOM 0 HG1 THR A 142 2.033 4.069 -0.664 1.00 0.00 H new ATOM 0 HG21 THR A 142 0.189 5.301 -1.140 1.00 0.00 H new ATOM 0 HG22 THR A 142 -0.363 5.374 -2.830 1.00 0.00 H new ATOM 0 HG23 THR A 142 -0.510 3.858 -1.911 1.00 0.00 H new ATOM 2291 N TYR A 143 0.183 4.463 -5.691 1.00 0.00 N ATOM 2292 CA TYR A 143 -0.063 5.328 -6.839 1.00 0.00 C ATOM 2293 C TYR A 143 -1.116 6.381 -6.510 1.00 0.00 C ATOM 2294 O TYR A 143 -2.255 6.052 -6.178 1.00 0.00 O ATOM 2295 CB TYR A 143 -0.515 4.498 -8.042 1.00 0.00 C ATOM 2296 CG TYR A 143 0.601 3.702 -8.683 1.00 0.00 C ATOM 2297 CD1 TYR A 143 1.263 2.706 -7.975 1.00 0.00 C ATOM 2298 CD2 TYR A 143 0.990 3.947 -9.993 1.00 0.00 C ATOM 2299 CE1 TYR A 143 2.283 1.977 -8.556 1.00 0.00 C ATOM 2300 CE2 TYR A 143 2.009 3.221 -10.582 1.00 0.00 C ATOM 2301 CZ TYR A 143 2.651 2.238 -9.859 1.00 0.00 C ATOM 2302 OH TYR A 143 3.666 1.513 -10.441 1.00 0.00 O ATOM 0 H TYR A 143 -0.596 3.850 -5.449 1.00 0.00 H new ATOM 0 HA TYR A 143 0.869 5.836 -7.086 1.00 0.00 H new ATOM 0 HB2 TYR A 143 -1.302 3.814 -7.726 1.00 0.00 H new ATOM 0 HB3 TYR A 143 -0.951 5.162 -8.788 1.00 0.00 H new ATOM 0 HD1 TYR A 143 0.976 2.499 -6.955 1.00 0.00 H new ATOM 0 HD2 TYR A 143 0.489 4.717 -10.561 1.00 0.00 H new ATOM 0 HE1 TYR A 143 2.789 1.207 -7.993 1.00 0.00 H new ATOM 0 HE2 TYR A 143 2.300 3.423 -11.602 1.00 0.00 H new ATOM 0 HH TYR A 143 3.801 1.820 -11.362 1.00 0.00 H new ATOM 2312 N ILE A 144 -0.728 7.649 -6.601 1.00 0.00 N ATOM 2313 CA ILE A 144 -1.639 8.749 -6.312 1.00 0.00 C ATOM 2314 C ILE A 144 -2.476 9.107 -7.540 1.00 0.00 C ATOM 2315 O ILE A 144 -1.938 9.300 -8.629 1.00 0.00 O ATOM 2316 CB ILE A 144 -0.875 10.003 -5.843 1.00 0.00 C ATOM 2317 CG1 ILE A 144 0.093 9.647 -4.713 1.00 0.00 C ATOM 2318 CG2 ILE A 144 -1.851 11.081 -5.392 1.00 0.00 C ATOM 2319 CD1 ILE A 144 1.438 10.329 -4.834 1.00 0.00 C ATOM 0 H ILE A 144 0.211 7.939 -6.873 1.00 0.00 H new ATOM 0 HA ILE A 144 -2.297 8.413 -5.511 1.00 0.00 H new ATOM 0 HB ILE A 144 -0.297 10.391 -6.681 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -0.359 9.919 -3.759 1.00 0.00 H new ATOM 0 HG13 ILE A 144 0.242 8.567 -4.699 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -1.296 11.960 -5.064 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -2.503 11.352 -6.223 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -2.454 10.703 -4.566 1.00 0.00 H new ATOM 0 HD11 ILE A 144 2.073 10.031 -4.000 1.00 0.00 H new ATOM 0 HD12 ILE A 144 1.910 10.038 -5.772 1.00 0.00 H new ATOM 0 HD13 ILE A 144 1.301 11.410 -4.817 1.00 0.00 H new ATOM 2331 N PRO A 145 -3.810 9.201 -7.382 1.00 0.00 N ATOM 2332 CA PRO A 145 -4.711 9.539 -8.488 1.00 0.00 C ATOM 2333 C PRO A 145 -4.627 11.010 -8.875 1.00 0.00 C ATOM 2334 O PRO A 145 -4.757 11.893 -8.027 1.00 0.00 O ATOM 2335 CB PRO A 145 -6.094 9.211 -7.926 1.00 0.00 C ATOM 2336 CG PRO A 145 -5.954 9.393 -6.455 1.00 0.00 C ATOM 2337 CD PRO A 145 -4.543 8.988 -6.119 1.00 0.00 C ATOM 0 HA PRO A 145 -4.464 8.993 -9.399 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -6.856 9.873 -8.337 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -6.391 8.192 -8.173 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -6.141 10.428 -6.170 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -6.675 8.779 -5.915 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -4.134 9.594 -5.311 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -4.491 7.948 -5.796 1.00 0.00 H new ATOM 2345 N GLY A 146 -4.408 11.269 -10.159 1.00 0.00 N ATOM 2346 CA GLY A 146 -4.310 12.636 -10.635 1.00 0.00 C ATOM 2347 C GLY A 146 -4.330 12.727 -12.147 1.00 0.00 C ATOM 2348 O GLY A 146 -5.391 12.651 -12.767 1.00 0.00 O ATOM 0 H GLY A 146 -4.296 10.556 -10.880 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -5.136 13.219 -10.228 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -3.389 13.083 -10.260 1.00 0.00 H new ATOM 2352 N THR A 147 -3.153 12.892 -12.745 1.00 0.00 N ATOM 2353 CA THR A 147 -3.040 12.994 -14.195 1.00 0.00 C ATOM 2354 C THR A 147 -3.817 14.198 -14.717 1.00 0.00 C ATOM 2355 O THR A 147 -5.001 14.093 -15.038 1.00 0.00 O ATOM 2356 CB THR A 147 -3.551 11.714 -14.858 1.00 0.00 C ATOM 2357 OG1 THR A 147 -3.456 10.615 -13.970 1.00 0.00 O ATOM 2358 CG2 THR A 147 -2.797 11.352 -16.120 1.00 0.00 C ATOM 0 H THR A 147 -2.265 12.958 -12.247 1.00 0.00 H new ATOM 0 HA THR A 147 -1.988 13.128 -14.445 1.00 0.00 H new ATOM 0 HB THR A 147 -4.589 11.920 -15.120 1.00 0.00 H new ATOM 0 HG1 THR A 147 -3.789 9.807 -14.413 1.00 0.00 H new ATOM 0 HG21 THR A 147 -3.210 10.435 -16.540 1.00 0.00 H new ATOM 0 HG22 THR A 147 -2.894 12.159 -16.846 1.00 0.00 H new ATOM 0 HG23 THR A 147 -1.744 11.201 -15.884 1.00 0.00 H new ATOM 2366 N TYR A 148 -3.144 15.341 -14.800 1.00 0.00 N ATOM 2367 CA TYR A 148 -3.772 16.565 -15.283 1.00 0.00 C ATOM 2368 C TYR A 148 -2.789 17.393 -16.104 1.00 0.00 C ATOM 2369 O TYR A 148 -3.046 17.706 -17.267 1.00 0.00 O ATOM 2370 CB TYR A 148 -4.299 17.390 -14.107 1.00 0.00 C ATOM 2371 CG TYR A 148 -5.673 17.973 -14.344 1.00 0.00 C ATOM 2372 CD1 TYR A 148 -6.726 17.169 -14.764 1.00 0.00 C ATOM 2373 CD2 TYR A 148 -5.919 19.326 -14.149 1.00 0.00 C ATOM 2374 CE1 TYR A 148 -7.985 17.699 -14.982 1.00 0.00 C ATOM 2375 CE2 TYR A 148 -7.174 19.862 -14.364 1.00 0.00 C ATOM 2376 CZ TYR A 148 -8.203 19.045 -14.781 1.00 0.00 C ATOM 2377 OH TYR A 148 -9.454 19.575 -14.997 1.00 0.00 O ATOM 0 H TYR A 148 -2.163 15.445 -14.539 1.00 0.00 H new ATOM 0 HA TYR A 148 -4.608 16.288 -15.925 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -4.329 16.761 -13.217 1.00 0.00 H new ATOM 0 HB3 TYR A 148 -3.600 18.201 -13.901 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -6.559 16.114 -14.923 1.00 0.00 H new ATOM 0 HD2 TYR A 148 -5.115 19.970 -13.824 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -8.793 17.061 -15.308 1.00 0.00 H new ATOM 0 HE2 TYR A 148 -7.348 20.916 -14.206 1.00 0.00 H new ATOM 0 HH TYR A 148 -9.439 20.537 -14.809 1.00 0.00 H new ATOM 2387 N ASN A 149 -1.664 17.745 -15.491 1.00 0.00 N ATOM 2388 CA ASN A 149 -0.642 18.538 -16.166 1.00 0.00 C ATOM 2389 C ASN A 149 0.716 18.362 -15.493 1.00 0.00 C ATOM 2390 O ASN A 149 1.729 18.154 -16.161 1.00 0.00 O ATOM 2391 CB ASN A 149 -1.034 20.016 -16.171 1.00 0.00 C ATOM 2392 CG ASN A 149 -1.264 20.558 -14.773 1.00 0.00 C ATOM 2393 OD1 ASN A 149 -0.316 20.820 -14.033 1.00 0.00 O ATOM 2394 ND2 ASN A 149 -2.529 20.728 -14.405 1.00 0.00 N ATOM 0 H ASN A 149 -1.436 17.494 -14.529 1.00 0.00 H new ATOM 0 HA ASN A 149 -0.566 18.186 -17.195 1.00 0.00 H new ATOM 0 HB2 ASN A 149 -0.250 20.595 -16.658 1.00 0.00 H new ATOM 0 HB3 ASN A 149 -1.940 20.147 -16.762 1.00 0.00 H new ATOM 0 HD21 ASN A 149 -2.746 21.089 -13.476 1.00 0.00 H new ATOM 0 HD22 ASN A 149 -3.284 20.497 -15.051 1.00 0.00 H new ATOM 2401 N ASN A 150 0.729 18.447 -14.167 1.00 0.00 N ATOM 2402 CA ASN A 150 1.962 18.298 -13.404 1.00 0.00 C ATOM 2403 C ASN A 150 1.674 17.772 -12.001 1.00 0.00 C ATOM 2404 O ASN A 150 0.521 17.707 -11.576 1.00 0.00 O ATOM 2405 CB ASN A 150 2.699 19.636 -13.318 1.00 0.00 C ATOM 2406 CG ASN A 150 4.205 19.471 -13.361 1.00 0.00 C ATOM 2407 OD1 ASN A 150 4.727 18.617 -14.078 1.00 0.00 O ATOM 2408 ND2 ASN A 150 4.912 20.291 -12.593 1.00 0.00 N ATOM 0 H ASN A 150 -0.101 18.618 -13.599 1.00 0.00 H new ATOM 0 HA ASN A 150 2.594 17.576 -13.921 1.00 0.00 H new ATOM 0 HB2 ASN A 150 2.383 20.275 -14.142 1.00 0.00 H new ATOM 0 HB3 ASN A 150 2.418 20.144 -12.395 1.00 0.00 H new ATOM 0 HD21 ASN A 150 5.930 20.228 -12.581 1.00 0.00 H new ATOM 0 HD22 ASN A 150 4.437 20.984 -12.014 1.00 0.00 H new ATOM 2415 N GLY A 151 2.731 17.398 -11.288 1.00 0.00 N ATOM 2416 CA GLY A 151 2.572 16.882 -9.941 1.00 0.00 C ATOM 2417 C GLY A 151 2.433 15.372 -9.911 1.00 0.00 C ATOM 2418 O GLY A 151 1.729 14.823 -9.062 1.00 0.00 O ATOM 0 H GLY A 151 3.695 17.443 -11.619 1.00 0.00 H new ATOM 0 HA2 GLY A 151 3.431 17.177 -9.339 1.00 0.00 H new ATOM 0 HA3 GLY A 151 1.692 17.334 -9.484 1.00 0.00 H new ATOM 2422 N ASN A 152 3.105 14.699 -10.840 1.00 0.00 N ATOM 2423 CA ASN A 152 3.053 13.244 -10.918 1.00 0.00 C ATOM 2424 C ASN A 152 4.232 12.618 -10.179 1.00 0.00 C ATOM 2425 O ASN A 152 5.359 12.615 -10.677 1.00 0.00 O ATOM 2426 CB ASN A 152 3.053 12.791 -12.379 1.00 0.00 C ATOM 2427 CG ASN A 152 2.309 11.485 -12.579 1.00 0.00 C ATOM 2428 OD1 ASN A 152 2.908 10.460 -12.902 1.00 0.00 O ATOM 2429 ND2 ASN A 152 0.995 11.517 -12.385 1.00 0.00 N ATOM 0 H ASN A 152 3.692 15.138 -11.549 1.00 0.00 H new ATOM 0 HA ASN A 152 2.131 12.911 -10.442 1.00 0.00 H new ATOM 0 HB2 ASN A 152 2.596 13.564 -12.996 1.00 0.00 H new ATOM 0 HB3 ASN A 152 4.082 12.676 -12.721 1.00 0.00 H new ATOM 0 HD21 ASN A 152 0.441 10.669 -12.503 1.00 0.00 H new ATOM 0 HD22 ASN A 152 0.540 12.390 -12.118 1.00 0.00 H new ATOM 2436 N VAL A 153 3.964 12.088 -8.991 1.00 0.00 N ATOM 2437 CA VAL A 153 5.003 11.459 -8.184 1.00 0.00 C ATOM 2438 C VAL A 153 4.536 10.111 -7.642 1.00 0.00 C ATOM 2439 O VAL A 153 3.350 9.916 -7.373 1.00 0.00 O ATOM 2440 CB VAL A 153 5.423 12.361 -7.006 1.00 0.00 C ATOM 2441 CG1 VAL A 153 4.236 12.642 -6.096 1.00 0.00 C ATOM 2442 CG2 VAL A 153 6.566 11.729 -6.225 1.00 0.00 C ATOM 0 H VAL A 153 3.037 12.081 -8.566 1.00 0.00 H new ATOM 0 HA VAL A 153 5.863 11.306 -8.836 1.00 0.00 H new ATOM 0 HB VAL A 153 5.774 13.311 -7.410 1.00 0.00 H new ATOM 0 HG11 VAL A 153 4.553 13.280 -5.271 1.00 0.00 H new ATOM 0 HG12 VAL A 153 3.453 13.145 -6.664 1.00 0.00 H new ATOM 0 HG13 VAL A 153 3.850 11.702 -5.701 1.00 0.00 H new ATOM 0 HG21 VAL A 153 6.847 12.382 -5.398 1.00 0.00 H new ATOM 0 HG22 VAL A 153 6.248 10.763 -5.833 1.00 0.00 H new ATOM 0 HG23 VAL A 153 7.423 11.589 -6.884 1.00 0.00 H new ATOM 2452 N TYR A 154 5.476 9.185 -7.484 1.00 0.00 N ATOM 2453 CA TYR A 154 5.162 7.856 -6.973 1.00 0.00 C ATOM 2454 C TYR A 154 5.669 7.688 -5.544 1.00 0.00 C ATOM 2455 O TYR A 154 6.840 7.935 -5.257 1.00 0.00 O ATOM 2456 CB TYR A 154 5.778 6.782 -7.873 1.00 0.00 C ATOM 2457 CG TYR A 154 5.560 7.031 -9.349 1.00 0.00 C ATOM 2458 CD1 TYR A 154 6.470 7.779 -10.088 1.00 0.00 C ATOM 2459 CD2 TYR A 154 4.448 6.517 -10.003 1.00 0.00 C ATOM 2460 CE1 TYR A 154 6.275 8.009 -11.436 1.00 0.00 C ATOM 2461 CE2 TYR A 154 4.247 6.741 -11.352 1.00 0.00 C ATOM 2462 CZ TYR A 154 5.164 7.487 -12.063 1.00 0.00 C ATOM 2463 OH TYR A 154 4.966 7.713 -13.407 1.00 0.00 O ATOM 0 H TYR A 154 6.462 9.331 -7.703 1.00 0.00 H new ATOM 0 HA TYR A 154 4.078 7.742 -6.971 1.00 0.00 H new ATOM 0 HB2 TYR A 154 6.849 6.726 -7.677 1.00 0.00 H new ATOM 0 HB3 TYR A 154 5.354 5.813 -7.610 1.00 0.00 H new ATOM 0 HD1 TYR A 154 7.343 8.187 -9.600 1.00 0.00 H new ATOM 0 HD2 TYR A 154 3.729 5.933 -9.449 1.00 0.00 H new ATOM 0 HE1 TYR A 154 6.989 8.595 -11.996 1.00 0.00 H new ATOM 0 HE2 TYR A 154 3.377 6.334 -11.846 1.00 0.00 H new ATOM 0 HH TYR A 154 4.137 7.275 -13.694 1.00 0.00 H new ATOM 2473 N PHE A 155 4.778 7.266 -4.652 1.00 0.00 N ATOM 2474 CA PHE A 155 5.136 7.065 -3.253 1.00 0.00 C ATOM 2475 C PHE A 155 5.245 5.579 -2.928 1.00 0.00 C ATOM 2476 O PHE A 155 4.280 4.829 -3.073 1.00 0.00 O ATOM 2477 CB PHE A 155 4.100 7.727 -2.340 1.00 0.00 C ATOM 2478 CG PHE A 155 4.578 9.010 -1.722 1.00 0.00 C ATOM 2479 CD1 PHE A 155 4.724 10.153 -2.491 1.00 0.00 C ATOM 2480 CD2 PHE A 155 4.882 9.072 -0.371 1.00 0.00 C ATOM 2481 CE1 PHE A 155 5.164 11.335 -1.925 1.00 0.00 C ATOM 2482 CE2 PHE A 155 5.321 10.250 0.201 1.00 0.00 C ATOM 2483 CZ PHE A 155 5.463 11.383 -0.577 1.00 0.00 C ATOM 0 H PHE A 155 3.804 7.057 -4.873 1.00 0.00 H new ATOM 0 HA PHE A 155 6.108 7.527 -3.081 1.00 0.00 H new ATOM 0 HB2 PHE A 155 3.195 7.925 -2.914 1.00 0.00 H new ATOM 0 HB3 PHE A 155 3.828 7.030 -1.547 1.00 0.00 H new ATOM 0 HD1 PHE A 155 4.491 10.120 -3.545 1.00 0.00 H new ATOM 0 HD2 PHE A 155 4.774 8.189 0.241 1.00 0.00 H new ATOM 0 HE1 PHE A 155 5.274 12.219 -2.535 1.00 0.00 H new ATOM 0 HE2 PHE A 155 5.553 10.286 1.255 1.00 0.00 H new ATOM 0 HZ PHE A 155 5.807 12.305 -0.132 1.00 0.00 H new ATOM 2493 N ALA A 156 6.427 5.161 -2.488 1.00 0.00 N ATOM 2494 CA ALA A 156 6.665 3.764 -2.142 1.00 0.00 C ATOM 2495 C ALA A 156 6.943 3.608 -0.652 1.00 0.00 C ATOM 2496 O ALA A 156 7.395 4.545 0.007 1.00 0.00 O ATOM 2497 CB ALA A 156 7.821 3.208 -2.959 1.00 0.00 C ATOM 0 H ALA A 156 7.236 5.770 -2.362 1.00 0.00 H new ATOM 0 HA ALA A 156 5.764 3.198 -2.377 1.00 0.00 H new ATOM 0 HB1 ALA A 156 7.988 2.165 -2.691 1.00 0.00 H new ATOM 0 HB2 ALA A 156 7.582 3.276 -4.020 1.00 0.00 H new ATOM 0 HB3 ALA A 156 8.723 3.784 -2.752 1.00 0.00 H new ATOM 2503 N TRP A 157 6.672 2.418 -0.125 1.00 0.00 N ATOM 2504 CA TRP A 157 6.894 2.139 1.289 1.00 0.00 C ATOM 2505 C TRP A 157 7.272 0.677 1.501 1.00 0.00 C ATOM 2506 O TRP A 157 6.698 -0.219 0.880 1.00 0.00 O ATOM 2507 CB TRP A 157 5.642 2.478 2.100 1.00 0.00 C ATOM 2508 CG TRP A 157 5.366 3.948 2.179 1.00 0.00 C ATOM 2509 CD1 TRP A 157 6.250 4.933 2.515 1.00 0.00 C ATOM 2510 CD2 TRP A 157 4.118 4.602 1.918 1.00 0.00 C ATOM 2511 NE1 TRP A 157 5.629 6.157 2.478 1.00 0.00 N ATOM 2512 CE2 TRP A 157 4.320 5.981 2.114 1.00 0.00 C ATOM 2513 CE3 TRP A 157 2.850 4.154 1.536 1.00 0.00 C ATOM 2514 CZ2 TRP A 157 3.302 6.915 1.942 1.00 0.00 C ATOM 2515 CZ3 TRP A 157 1.840 5.083 1.365 1.00 0.00 C ATOM 2516 CH2 TRP A 157 2.071 6.449 1.567 1.00 0.00 C ATOM 0 H TRP A 157 6.298 1.632 -0.656 1.00 0.00 H new ATOM 0 HA TRP A 157 7.720 2.762 1.632 1.00 0.00 H new ATOM 0 HB2 TRP A 157 4.782 1.978 1.654 1.00 0.00 H new ATOM 0 HB3 TRP A 157 5.753 2.082 3.109 1.00 0.00 H new ATOM 0 HD1 TRP A 157 7.287 4.773 2.772 1.00 0.00 H new ATOM 0 HE1 TRP A 157 6.071 7.052 2.688 1.00 0.00 H new ATOM 0 HE3 TRP A 157 2.663 3.102 1.377 1.00 0.00 H new ATOM 0 HZ2 TRP A 157 3.477 7.969 2.099 1.00 0.00 H new ATOM 0 HZ3 TRP A 157 0.856 4.749 1.071 1.00 0.00 H new ATOM 0 HH2 TRP A 157 1.261 7.149 1.424 1.00 0.00 H new ATOM 2527 N MET A 158 8.240 0.442 2.380 1.00 0.00 N ATOM 2528 CA MET A 158 8.694 -0.912 2.673 1.00 0.00 C ATOM 2529 C MET A 158 7.909 -1.509 3.836 1.00 0.00 C ATOM 2530 O MET A 158 7.538 -0.804 4.775 1.00 0.00 O ATOM 2531 CB MET A 158 10.190 -0.912 2.995 1.00 0.00 C ATOM 2532 CG MET A 158 11.071 -1.194 1.790 1.00 0.00 C ATOM 2533 SD MET A 158 12.649 -1.940 2.243 1.00 0.00 S ATOM 2534 CE MET A 158 13.417 -2.109 0.633 1.00 0.00 C ATOM 0 H MET A 158 8.725 1.172 2.902 1.00 0.00 H new ATOM 0 HA MET A 158 8.521 -1.527 1.790 1.00 0.00 H new ATOM 0 HB2 MET A 158 10.463 0.056 3.415 1.00 0.00 H new ATOM 0 HB3 MET A 158 10.388 -1.660 3.763 1.00 0.00 H new ATOM 0 HG2 MET A 158 10.543 -1.858 1.106 1.00 0.00 H new ATOM 0 HG3 MET A 158 11.254 -0.263 1.253 1.00 0.00 H new ATOM 0 HE1 MET A 158 14.404 -2.558 0.746 1.00 0.00 H new ATOM 0 HE2 MET A 158 12.799 -2.746 0.000 1.00 0.00 H new ATOM 0 HE3 MET A 158 13.516 -1.126 0.172 1.00 0.00 H new ATOM 2544 N ARG A 159 7.661 -2.813 3.768 1.00 0.00 N ATOM 2545 CA ARG A 159 6.920 -3.507 4.816 1.00 0.00 C ATOM 2546 C ARG A 159 7.773 -4.598 5.455 1.00 0.00 C ATOM 2547 O ARG A 159 8.450 -5.357 4.761 1.00 0.00 O ATOM 2548 CB ARG A 159 5.635 -4.113 4.243 1.00 0.00 C ATOM 2549 CG ARG A 159 4.383 -3.323 4.588 1.00 0.00 C ATOM 2550 CD ARG A 159 3.616 -3.967 5.732 1.00 0.00 C ATOM 2551 NE ARG A 159 2.581 -4.880 5.250 1.00 0.00 N ATOM 2552 CZ ARG A 159 1.396 -4.481 4.793 1.00 0.00 C ATOM 2553 NH1 ARG A 159 1.092 -3.190 4.753 1.00 0.00 N ATOM 2554 NH2 ARG A 159 0.513 -5.376 4.373 1.00 0.00 N ATOM 0 H ARG A 159 7.962 -3.411 2.998 1.00 0.00 H new ATOM 0 HA ARG A 159 6.659 -2.781 5.586 1.00 0.00 H new ATOM 0 HB2 ARG A 159 5.726 -4.178 3.159 1.00 0.00 H new ATOM 0 HB3 ARG A 159 5.526 -5.132 4.616 1.00 0.00 H new ATOM 0 HG2 ARG A 159 4.658 -2.304 4.861 1.00 0.00 H new ATOM 0 HG3 ARG A 159 3.740 -3.256 3.710 1.00 0.00 H new ATOM 0 HD2 ARG A 159 4.310 -4.511 6.373 1.00 0.00 H new ATOM 0 HD3 ARG A 159 3.158 -3.190 6.344 1.00 0.00 H new ATOM 0 HE ARG A 159 2.778 -5.881 5.265 1.00 0.00 H new ATOM 0 HH11 ARG A 159 1.768 -2.497 5.074 1.00 0.00 H new ATOM 0 HH12 ARG A 159 0.182 -2.891 4.402 1.00 0.00 H new ATOM 0 HH21 ARG A 159 0.742 -6.370 4.400 1.00 0.00 H new ATOM 0 HH22 ARG A 159 -0.395 -5.071 4.023 1.00 0.00 H new ATOM 2568 N PHE A 160 7.736 -4.669 6.782 1.00 0.00 N ATOM 2569 CA PHE A 160 8.505 -5.668 7.516 1.00 0.00 C ATOM 2570 C PHE A 160 7.603 -6.469 8.449 1.00 0.00 C ATOM 2571 O PHE A 160 6.662 -5.932 9.033 1.00 0.00 O ATOM 2572 CB PHE A 160 9.620 -4.994 8.319 1.00 0.00 C ATOM 2573 CG PHE A 160 10.878 -4.775 7.529 1.00 0.00 C ATOM 2574 CD1 PHE A 160 10.910 -3.858 6.491 1.00 0.00 C ATOM 2575 CD2 PHE A 160 12.030 -5.486 7.827 1.00 0.00 C ATOM 2576 CE1 PHE A 160 12.067 -3.654 5.764 1.00 0.00 C ATOM 2577 CE2 PHE A 160 13.190 -5.286 7.102 1.00 0.00 C ATOM 2578 CZ PHE A 160 13.209 -4.369 6.069 1.00 0.00 C ATOM 0 H PHE A 160 7.182 -4.047 7.371 1.00 0.00 H new ATOM 0 HA PHE A 160 8.950 -6.352 6.794 1.00 0.00 H new ATOM 0 HB2 PHE A 160 9.261 -4.034 8.689 1.00 0.00 H new ATOM 0 HB3 PHE A 160 9.850 -5.606 9.191 1.00 0.00 H new ATOM 0 HD1 PHE A 160 10.020 -3.296 6.247 1.00 0.00 H new ATOM 0 HD2 PHE A 160 12.021 -6.204 8.634 1.00 0.00 H new ATOM 0 HE1 PHE A 160 12.079 -2.936 4.958 1.00 0.00 H new ATOM 0 HE2 PHE A 160 14.081 -5.847 7.343 1.00 0.00 H new ATOM 0 HZ PHE A 160 14.114 -4.211 5.501 1.00 0.00 H new ATOM 2588 N GLN A 161 7.897 -7.759 8.584 1.00 0.00 N ATOM 2589 CA GLN A 161 7.113 -8.635 9.447 1.00 0.00 C ATOM 2590 C GLN A 161 8.009 -9.359 10.447 1.00 0.00 C ATOM 2591 O GLN A 161 8.856 -10.166 10.066 1.00 0.00 O ATOM 2592 CB GLN A 161 6.338 -9.653 8.606 1.00 0.00 C ATOM 2593 CG GLN A 161 4.911 -9.227 8.300 1.00 0.00 C ATOM 2594 CD GLN A 161 4.287 -10.044 7.184 1.00 0.00 C ATOM 2595 OE1 GLN A 161 4.004 -11.230 7.351 1.00 0.00 O ATOM 2596 NE2 GLN A 161 4.070 -9.410 6.038 1.00 0.00 N ATOM 0 H GLN A 161 8.672 -8.220 8.107 1.00 0.00 H new ATOM 0 HA GLN A 161 6.406 -8.019 10.002 1.00 0.00 H new ATOM 0 HB2 GLN A 161 6.869 -9.817 7.668 1.00 0.00 H new ATOM 0 HB3 GLN A 161 6.319 -10.607 9.132 1.00 0.00 H new ATOM 0 HG2 GLN A 161 4.305 -9.326 9.201 1.00 0.00 H new ATOM 0 HG3 GLN A 161 4.901 -8.173 8.023 1.00 0.00 H new ATOM 0 HE21 GLN A 161 4.321 -8.426 5.944 1.00 0.00 H new ATOM 0 HE22 GLN A 161 3.653 -9.907 5.251 1.00 0.00 H new ATOM 2605 N PHE A 162 7.815 -9.064 11.728 1.00 0.00 N ATOM 2606 CA PHE A 162 8.605 -9.688 12.784 1.00 0.00 C ATOM 2607 C PHE A 162 7.719 -10.092 13.959 1.00 0.00 C ATOM 2608 O PHE A 162 6.498 -9.963 13.901 1.00 0.00 O ATOM 2609 CB PHE A 162 9.701 -8.733 13.261 1.00 0.00 C ATOM 2610 CG PHE A 162 9.170 -7.467 13.870 1.00 0.00 C ATOM 2611 CD1 PHE A 162 8.678 -6.450 13.069 1.00 0.00 C ATOM 2612 CD2 PHE A 162 9.165 -7.294 15.245 1.00 0.00 C ATOM 2613 CE1 PHE A 162 8.190 -5.284 13.626 1.00 0.00 C ATOM 2614 CE2 PHE A 162 8.678 -6.129 15.809 1.00 0.00 C ATOM 2615 CZ PHE A 162 8.190 -5.123 14.998 1.00 0.00 C ATOM 0 H PHE A 162 7.118 -8.397 12.060 1.00 0.00 H new ATOM 0 HA PHE A 162 9.068 -10.586 12.376 1.00 0.00 H new ATOM 0 HB2 PHE A 162 10.325 -9.245 13.994 1.00 0.00 H new ATOM 0 HB3 PHE A 162 10.343 -8.479 12.418 1.00 0.00 H new ATOM 0 HD1 PHE A 162 8.676 -6.570 11.996 1.00 0.00 H new ATOM 0 HD2 PHE A 162 9.546 -8.078 15.883 1.00 0.00 H new ATOM 0 HE1 PHE A 162 7.809 -4.499 12.990 1.00 0.00 H new ATOM 0 HE2 PHE A 162 8.679 -6.006 16.882 1.00 0.00 H new ATOM 0 HZ PHE A 162 7.809 -4.212 15.436 1.00 0.00 H new ATOM 2625 N LEU A 163 8.346 -10.581 15.024 1.00 0.00 N ATOM 2626 CA LEU A 163 7.615 -11.003 16.214 1.00 0.00 C ATOM 2627 C LEU A 163 8.048 -10.195 17.433 1.00 0.00 C ATOM 2628 O LEU A 163 9.198 -9.767 17.531 1.00 0.00 O ATOM 2629 CB LEU A 163 7.836 -12.496 16.470 1.00 0.00 C ATOM 2630 CG LEU A 163 6.802 -13.423 15.827 1.00 0.00 C ATOM 2631 CD1 LEU A 163 7.296 -14.861 15.838 1.00 0.00 C ATOM 2632 CD2 LEU A 163 5.467 -13.310 16.546 1.00 0.00 C ATOM 0 H LEU A 163 9.358 -10.695 15.088 1.00 0.00 H new ATOM 0 HA LEU A 163 6.554 -10.824 16.042 1.00 0.00 H new ATOM 0 HB2 LEU A 163 8.825 -12.770 16.103 1.00 0.00 H new ATOM 0 HB3 LEU A 163 7.837 -12.668 17.546 1.00 0.00 H new ATOM 0 HG LEU A 163 6.661 -13.117 14.790 1.00 0.00 H new ATOM 0 HD11 LEU A 163 6.548 -15.506 15.377 1.00 0.00 H new ATOM 0 HD12 LEU A 163 8.229 -14.930 15.278 1.00 0.00 H new ATOM 0 HD13 LEU A 163 7.466 -15.180 16.867 1.00 0.00 H new ATOM 0 HD21 LEU A 163 4.743 -13.976 16.076 1.00 0.00 H new ATOM 0 HD22 LEU A 163 5.592 -13.590 17.592 1.00 0.00 H new ATOM 0 HD23 LEU A 163 5.107 -12.283 16.486 1.00 0.00 H new