USER MOD reduce.3.24.130724 H: found=0, std=0, add=795, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 791 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 51 SER OG : rot -118:sc= 0.157 USER MOD Set 1.2: A 54 SER OG : rot 180:sc= 0.154 USER MOD Set 2.1: A 44 TYR OH : rot 133:sc= 0.111 USER MOD Set 2.2: A 71 CYS SG : rot 180:sc= 0.108 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -178:sc= 0 (180deg=-0.00786) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=-0.0037) USER MOD Single : A 16 CYS SG : rot 180:sc= -0.152 USER MOD Single : A 18 SER OG : rot 100:sc= 0.559 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 22:sc= 0.608 USER MOD Single : A 28 SER OG : rot 180:sc= -0.88 USER MOD Single : A 38 CYS SG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 88:sc= 1.12 USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=-0.027) USER MOD Single : A 63 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 64 THR OG1 : rot 140:sc= -0.388 USER MOD Single : A 69 GLN : amide:sc= -0.236 K(o=-0.24,f=-2.9!) USER MOD Single : A 77 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 78:sc= 1.27 USER MOD Single : A 84 MET CE :methyl -171:sc= 0 (180deg=-0.157) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 20.563 22.501 15.722 1.00 0.00 N ATOM 2 CA MET A 1 19.917 21.766 16.796 1.00 0.00 C ATOM 3 C MET A 1 20.111 20.258 16.623 1.00 0.00 C ATOM 4 O MET A 1 20.520 19.570 17.557 1.00 0.00 O ATOM 5 CB MET A 1 18.421 22.090 16.809 1.00 0.00 C ATOM 6 CG MET A 1 18.118 23.244 17.766 1.00 0.00 C ATOM 7 SD MET A 1 17.285 22.628 19.220 1.00 0.00 S ATOM 8 CE MET A 1 18.655 22.571 20.362 1.00 0.00 C ATOM 0 H1 MET A 1 20.446 23.522 15.881 1.00 0.00 H new ATOM 0 H2 MET A 1 21.576 22.268 15.702 1.00 0.00 H new ATOM 0 H3 MET A 1 20.130 22.240 14.813 1.00 0.00 H new ATOM 0 HA MET A 1 20.371 22.066 17.740 1.00 0.00 H new ATOM 0 HB2 MET A 1 18.093 22.352 15.803 1.00 0.00 H new ATOM 0 HB3 MET A 1 17.857 21.207 17.108 1.00 0.00 H new ATOM 0 HG2 MET A 1 19.044 23.743 18.051 1.00 0.00 H new ATOM 0 HG3 MET A 1 17.496 23.987 17.267 1.00 0.00 H new ATOM 0 HE1 MET A 1 18.308 22.205 21.328 1.00 0.00 H new ATOM 0 HE2 MET A 1 19.423 21.902 19.975 1.00 0.00 H new ATOM 0 HE3 MET A 1 19.071 23.571 20.481 1.00 0.00 H new ATOM 18 N SER A 2 19.810 19.789 15.421 1.00 0.00 N ATOM 19 CA SER A 2 19.947 18.375 15.114 1.00 0.00 C ATOM 20 C SER A 2 19.512 18.109 13.671 1.00 0.00 C ATOM 21 O SER A 2 18.324 18.166 13.357 1.00 0.00 O ATOM 22 CB SER A 2 19.127 17.519 16.082 1.00 0.00 C ATOM 23 OG SER A 2 19.845 16.366 16.513 1.00 0.00 O ATOM 0 H SER A 2 19.472 20.363 14.648 1.00 0.00 H new ATOM 0 HA SER A 2 20.996 18.100 15.228 1.00 0.00 H new ATOM 0 HB2 SER A 2 18.848 18.118 16.949 1.00 0.00 H new ATOM 0 HB3 SER A 2 18.201 17.210 15.597 1.00 0.00 H new ATOM 0 HG SER A 2 19.289 15.846 17.131 1.00 0.00 H new ATOM 29 N ALA A 3 20.497 17.824 12.833 1.00 0.00 N ATOM 30 CA ALA A 3 20.231 17.549 11.431 1.00 0.00 C ATOM 31 C ALA A 3 21.491 16.976 10.780 1.00 0.00 C ATOM 32 O ALA A 3 21.475 15.858 10.266 1.00 0.00 O ATOM 33 CB ALA A 3 19.748 18.827 10.743 1.00 0.00 C ATOM 0 H ALA A 3 21.481 17.777 13.098 1.00 0.00 H new ATOM 0 HA ALA A 3 19.441 16.805 11.329 1.00 0.00 H new ATOM 0 HB1 ALA A 3 19.548 18.621 9.691 1.00 0.00 H new ATOM 0 HB2 ALA A 3 18.834 19.176 11.224 1.00 0.00 H new ATOM 0 HB3 ALA A 3 20.517 19.596 10.823 1.00 0.00 H new ATOM 39 N ASN A 4 22.553 17.767 10.823 1.00 0.00 N ATOM 40 CA ASN A 4 23.819 17.352 10.244 1.00 0.00 C ATOM 41 C ASN A 4 23.643 17.147 8.738 1.00 0.00 C ATOM 42 O ASN A 4 23.261 16.064 8.297 1.00 0.00 O ATOM 43 CB ASN A 4 24.295 16.030 10.849 1.00 0.00 C ATOM 44 CG ASN A 4 24.466 16.151 12.365 1.00 0.00 C ATOM 45 OD1 ASN A 4 23.554 15.911 13.139 1.00 0.00 O ATOM 46 ND2 ASN A 4 25.681 16.536 12.744 1.00 0.00 N ATOM 0 H ASN A 4 22.563 18.693 11.250 1.00 0.00 H new ATOM 0 HA ASN A 4 24.555 18.129 10.451 1.00 0.00 H new ATOM 0 HB2 ASN A 4 23.576 15.242 10.622 1.00 0.00 H new ATOM 0 HB3 ASN A 4 25.242 15.738 10.395 1.00 0.00 H new ATOM 0 HD21 ASN A 4 25.895 16.647 13.735 1.00 0.00 H new ATOM 0 HD22 ASN A 4 26.399 16.721 12.044 1.00 0.00 H new ATOM 53 N ARG A 5 23.931 18.203 7.991 1.00 0.00 N ATOM 54 CA ARG A 5 23.809 18.151 6.544 1.00 0.00 C ATOM 55 C ARG A 5 22.544 17.389 6.145 1.00 0.00 C ATOM 56 O ARG A 5 21.646 17.196 6.963 1.00 0.00 O ATOM 57 CB ARG A 5 25.026 17.473 5.913 1.00 0.00 C ATOM 58 CG ARG A 5 25.052 15.978 6.239 1.00 0.00 C ATOM 59 CD ARG A 5 25.792 15.716 7.552 1.00 0.00 C ATOM 60 NE ARG A 5 27.127 15.139 7.275 1.00 0.00 N ATOM 61 CZ ARG A 5 27.800 14.343 8.132 1.00 0.00 C ATOM 62 NH1 ARG A 5 27.269 14.022 9.330 1.00 0.00 N ATOM 63 NH2 ARG A 5 28.987 13.883 7.780 1.00 0.00 N ATOM 0 H ARG A 5 24.248 19.099 8.361 1.00 0.00 H new ATOM 0 HA ARG A 5 23.749 19.176 6.179 1.00 0.00 H new ATOM 0 HB2 ARG A 5 25.005 17.613 4.832 1.00 0.00 H new ATOM 0 HB3 ARG A 5 25.939 17.944 6.277 1.00 0.00 H new ATOM 0 HG2 ARG A 5 24.032 15.600 6.311 1.00 0.00 H new ATOM 0 HG3 ARG A 5 25.538 15.434 5.429 1.00 0.00 H new ATOM 0 HD2 ARG A 5 25.898 16.646 8.111 1.00 0.00 H new ATOM 0 HD3 ARG A 5 25.214 15.033 8.175 1.00 0.00 H new ATOM 0 HE ARG A 5 27.566 15.357 6.380 1.00 0.00 H new ATOM 0 HH11 ARG A 5 26.352 14.382 9.594 1.00 0.00 H new ATOM 0 HH12 ARG A 5 27.785 13.420 9.972 1.00 0.00 H new ATOM 0 HH21 ARG A 5 29.381 14.131 6.872 1.00 0.00 H new ATOM 0 HH22 ARG A 5 29.509 13.280 8.416 1.00 0.00 H new ATOM 77 N ARG A 6 22.514 16.975 4.887 1.00 0.00 N ATOM 78 CA ARG A 6 21.374 16.238 4.369 1.00 0.00 C ATOM 79 C ARG A 6 21.543 15.984 2.869 1.00 0.00 C ATOM 80 O ARG A 6 21.726 16.922 2.094 1.00 0.00 O ATOM 81 CB ARG A 6 20.070 17.001 4.606 1.00 0.00 C ATOM 82 CG ARG A 6 19.110 16.189 5.478 1.00 0.00 C ATOM 83 CD ARG A 6 17.782 16.926 5.665 1.00 0.00 C ATOM 84 NE ARG A 6 16.769 16.008 6.230 1.00 0.00 N ATOM 85 CZ ARG A 6 16.209 14.986 5.547 1.00 0.00 C ATOM 86 NH1 ARG A 6 16.560 14.744 4.266 1.00 0.00 N ATOM 87 NH2 ARG A 6 15.312 14.228 6.150 1.00 0.00 N ATOM 0 H ARG A 6 23.261 17.136 4.211 1.00 0.00 H new ATOM 0 HA ARG A 6 21.326 15.287 4.899 1.00 0.00 H new ATOM 0 HB2 ARG A 6 20.285 17.955 5.087 1.00 0.00 H new ATOM 0 HB3 ARG A 6 19.597 17.226 3.650 1.00 0.00 H new ATOM 0 HG2 ARG A 6 18.929 15.217 5.018 1.00 0.00 H new ATOM 0 HG3 ARG A 6 19.566 16.002 6.450 1.00 0.00 H new ATOM 0 HD2 ARG A 6 17.921 17.780 6.328 1.00 0.00 H new ATOM 0 HD3 ARG A 6 17.436 17.318 4.708 1.00 0.00 H new ATOM 0 HE ARG A 6 16.475 16.156 7.195 1.00 0.00 H new ATOM 0 HH11 ARG A 6 17.253 15.335 3.807 1.00 0.00 H new ATOM 0 HH12 ARG A 6 16.132 13.970 3.757 1.00 0.00 H new ATOM 0 HH21 ARG A 6 15.051 14.418 7.118 1.00 0.00 H new ATOM 0 HH22 ARG A 6 14.880 13.452 5.648 1.00 0.00 H new ATOM 101 N TRP A 7 21.475 14.712 2.505 1.00 0.00 N ATOM 102 CA TRP A 7 21.618 14.324 1.112 1.00 0.00 C ATOM 103 C TRP A 7 21.167 12.868 0.978 1.00 0.00 C ATOM 104 O TRP A 7 21.512 12.029 1.808 1.00 0.00 O ATOM 105 CB TRP A 7 23.049 14.554 0.623 1.00 0.00 C ATOM 106 CG TRP A 7 23.139 15.290 -0.715 1.00 0.00 C ATOM 107 CD1 TRP A 7 22.462 15.037 -1.844 1.00 0.00 C ATOM 108 CD2 TRP A 7 23.986 16.418 -1.021 1.00 0.00 C ATOM 109 NE1 TRP A 7 22.809 15.915 -2.850 1.00 0.00 N ATOM 110 CE2 TRP A 7 23.766 16.782 -2.333 1.00 0.00 C ATOM 111 CE3 TRP A 7 24.909 17.108 -0.214 1.00 0.00 C ATOM 112 CZ2 TRP A 7 24.429 17.846 -2.956 1.00 0.00 C ATOM 113 CZ3 TRP A 7 25.563 18.169 -0.851 1.00 0.00 C ATOM 114 CH2 TRP A 7 25.352 18.548 -2.172 1.00 0.00 C ATOM 0 H TRP A 7 21.323 13.937 3.150 1.00 0.00 H new ATOM 0 HA TRP A 7 20.989 14.943 0.473 1.00 0.00 H new ATOM 0 HB2 TRP A 7 23.592 15.124 1.377 1.00 0.00 H new ATOM 0 HB3 TRP A 7 23.550 13.590 0.530 1.00 0.00 H new ATOM 0 HD1 TRP A 7 21.736 14.245 -1.952 1.00 0.00 H new ATOM 0 HE1 TRP A 7 22.433 15.926 -3.798 1.00 0.00 H new ATOM 0 HE3 TRP A 7 25.098 16.840 0.815 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 24.239 18.111 -3.986 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 26.282 18.733 -0.276 1.00 0.00 H new ATOM 0 HH2 TRP A 7 25.898 19.380 -2.591 1.00 0.00 H new ATOM 125 N TRP A 8 20.402 12.614 -0.073 1.00 0.00 N ATOM 126 CA TRP A 8 19.900 11.274 -0.326 1.00 0.00 C ATOM 127 C TRP A 8 19.467 11.200 -1.792 1.00 0.00 C ATOM 128 O TRP A 8 19.025 12.196 -2.363 1.00 0.00 O ATOM 129 CB TRP A 8 18.775 10.916 0.648 1.00 0.00 C ATOM 130 CG TRP A 8 18.311 9.462 0.555 1.00 0.00 C ATOM 131 CD1 TRP A 8 17.163 8.993 0.046 1.00 0.00 C ATOM 132 CD2 TRP A 8 19.034 8.297 1.007 1.00 0.00 C ATOM 133 NE1 TRP A 8 17.094 7.618 0.136 1.00 0.00 N ATOM 134 CE2 TRP A 8 18.268 7.181 0.739 1.00 0.00 C ATOM 135 CE3 TRP A 8 20.294 8.191 1.621 1.00 0.00 C ATOM 136 CZ2 TRP A 8 18.675 5.879 1.051 1.00 0.00 C ATOM 137 CZ3 TRP A 8 20.687 6.882 1.927 1.00 0.00 C ATOM 138 CH2 TRP A 8 19.927 5.748 1.664 1.00 0.00 C ATOM 0 H TRP A 8 20.117 13.313 -0.759 1.00 0.00 H new ATOM 0 HA TRP A 8 20.680 10.532 -0.155 1.00 0.00 H new ATOM 0 HB2 TRP A 8 19.112 11.115 1.665 1.00 0.00 H new ATOM 0 HB3 TRP A 8 17.924 11.571 0.461 1.00 0.00 H new ATOM 0 HD1 TRP A 8 16.389 9.614 -0.381 1.00 0.00 H new ATOM 0 HE1 TRP A 8 16.323 7.030 -0.182 1.00 0.00 H new ATOM 0 HE3 TRP A 8 20.910 9.051 1.839 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 18.057 5.021 0.831 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 21.648 6.744 2.400 1.00 0.00 H new ATOM 0 HH2 TRP A 8 20.301 4.771 1.931 1.00 0.00 H new ATOM 149 N VAL A 9 19.609 10.011 -2.359 1.00 0.00 N ATOM 150 CA VAL A 9 19.238 9.794 -3.747 1.00 0.00 C ATOM 151 C VAL A 9 18.636 8.395 -3.897 1.00 0.00 C ATOM 152 O VAL A 9 19.359 7.425 -4.118 1.00 0.00 O ATOM 153 CB VAL A 9 20.448 10.025 -4.654 1.00 0.00 C ATOM 154 CG1 VAL A 9 20.123 9.661 -6.104 1.00 0.00 C ATOM 155 CG2 VAL A 9 20.944 11.469 -4.549 1.00 0.00 C ATOM 0 H VAL A 9 19.976 9.187 -1.882 1.00 0.00 H new ATOM 0 HA VAL A 9 18.476 10.510 -4.055 1.00 0.00 H new ATOM 0 HB VAL A 9 21.251 9.370 -4.316 1.00 0.00 H new ATOM 0 HG11 VAL A 9 21.000 9.834 -6.728 1.00 0.00 H new ATOM 0 HG12 VAL A 9 19.839 8.610 -6.161 1.00 0.00 H new ATOM 0 HG13 VAL A 9 19.298 10.279 -6.458 1.00 0.00 H new ATOM 0 HG21 VAL A 9 21.805 11.607 -5.204 1.00 0.00 H new ATOM 0 HG22 VAL A 9 20.148 12.150 -4.849 1.00 0.00 H new ATOM 0 HG23 VAL A 9 21.234 11.680 -3.520 1.00 0.00 H new ATOM 165 N PRO A 10 17.284 8.334 -3.768 1.00 0.00 N ATOM 166 CA PRO A 10 16.577 7.070 -3.887 1.00 0.00 C ATOM 167 C PRO A 10 16.492 6.625 -5.349 1.00 0.00 C ATOM 168 O PRO A 10 16.504 7.456 -6.256 1.00 0.00 O ATOM 169 CB PRO A 10 15.214 7.322 -3.263 1.00 0.00 C ATOM 170 CG PRO A 10 15.038 8.831 -3.239 1.00 0.00 C ATOM 171 CD PRO A 10 16.395 9.463 -3.507 1.00 0.00 C ATOM 0 HA PRO A 10 17.088 6.252 -3.379 1.00 0.00 H new ATOM 0 HB2 PRO A 10 14.424 6.846 -3.845 1.00 0.00 H new ATOM 0 HB3 PRO A 10 15.163 6.907 -2.256 1.00 0.00 H new ATOM 0 HG2 PRO A 10 14.316 9.143 -3.993 1.00 0.00 H new ATOM 0 HG3 PRO A 10 14.650 9.155 -2.273 1.00 0.00 H new ATOM 0 HD2 PRO A 10 16.355 10.141 -4.360 1.00 0.00 H new ATOM 0 HD3 PRO A 10 16.736 10.046 -2.652 1.00 0.00 H new ATOM 179 N PRO A 11 16.407 5.281 -5.536 1.00 0.00 N ATOM 180 CA PRO A 11 16.321 4.715 -6.872 1.00 0.00 C ATOM 181 C PRO A 11 14.926 4.921 -7.465 1.00 0.00 C ATOM 182 O PRO A 11 14.083 5.585 -6.863 1.00 0.00 O ATOM 183 CB PRO A 11 16.684 3.249 -6.702 1.00 0.00 C ATOM 184 CG PRO A 11 16.507 2.944 -5.224 1.00 0.00 C ATOM 185 CD PRO A 11 16.391 4.267 -4.485 1.00 0.00 C ATOM 0 HA PRO A 11 16.995 5.199 -7.579 1.00 0.00 H new ATOM 0 HB2 PRO A 11 16.041 2.614 -7.311 1.00 0.00 H new ATOM 0 HB3 PRO A 11 17.710 3.061 -7.019 1.00 0.00 H new ATOM 0 HG2 PRO A 11 15.615 2.338 -5.064 1.00 0.00 H new ATOM 0 HG3 PRO A 11 17.354 2.370 -4.849 1.00 0.00 H new ATOM 0 HD2 PRO A 11 15.471 4.316 -3.902 1.00 0.00 H new ATOM 0 HD3 PRO A 11 17.218 4.405 -3.788 1.00 0.00 H new ATOM 193 N ASP A 12 14.725 4.340 -8.639 1.00 0.00 N ATOM 194 CA ASP A 12 13.447 4.451 -9.320 1.00 0.00 C ATOM 195 C ASP A 12 13.465 3.577 -10.576 1.00 0.00 C ATOM 196 O ASP A 12 13.981 3.987 -11.614 1.00 0.00 O ATOM 197 CB ASP A 12 13.176 5.893 -9.752 1.00 0.00 C ATOM 198 CG ASP A 12 11.947 6.541 -9.112 1.00 0.00 C ATOM 199 OD1 ASP A 12 11.178 5.882 -8.396 1.00 0.00 O ATOM 200 OD2 ASP A 12 11.790 7.793 -9.378 1.00 0.00 O ATOM 0 H ASP A 12 15.426 3.791 -9.136 1.00 0.00 H new ATOM 0 HA ASP A 12 12.668 4.129 -8.629 1.00 0.00 H new ATOM 0 HB2 ASP A 12 14.051 6.498 -9.515 1.00 0.00 H new ATOM 0 HB3 ASP A 12 13.057 5.915 -10.835 1.00 0.00 H new ATOM 205 N ASP A 13 12.896 2.388 -10.439 1.00 0.00 N ATOM 206 CA ASP A 13 12.840 1.453 -11.549 1.00 0.00 C ATOM 207 C ASP A 13 11.398 1.344 -12.047 1.00 0.00 C ATOM 208 O ASP A 13 10.476 1.844 -11.405 1.00 0.00 O ATOM 209 CB ASP A 13 13.298 0.058 -11.118 1.00 0.00 C ATOM 210 CG ASP A 13 14.045 -0.738 -12.190 1.00 0.00 C ATOM 211 OD1 ASP A 13 13.737 -0.642 -13.387 1.00 0.00 O ATOM 212 OD2 ASP A 13 14.993 -1.492 -11.747 1.00 0.00 O ATOM 0 H ASP A 13 12.470 2.051 -9.576 1.00 0.00 H new ATOM 0 HA ASP A 13 13.499 1.823 -12.334 1.00 0.00 H new ATOM 0 HB2 ASP A 13 13.943 0.158 -10.245 1.00 0.00 H new ATOM 0 HB3 ASP A 13 12.425 -0.514 -10.805 1.00 0.00 H new ATOM 217 N GLU A 14 11.247 0.688 -13.188 1.00 0.00 N ATOM 218 CA GLU A 14 9.932 0.507 -13.780 1.00 0.00 C ATOM 219 C GLU A 14 9.311 -0.806 -13.301 1.00 0.00 C ATOM 220 O GLU A 14 9.498 -1.850 -13.925 1.00 0.00 O ATOM 221 CB GLU A 14 10.008 0.553 -15.307 1.00 0.00 C ATOM 222 CG GLU A 14 8.884 1.415 -15.886 1.00 0.00 C ATOM 223 CD GLU A 14 9.451 2.589 -16.688 1.00 0.00 C ATOM 224 OE1 GLU A 14 10.376 3.269 -16.220 1.00 0.00 O ATOM 225 OE2 GLU A 14 8.897 2.783 -17.836 1.00 0.00 O ATOM 0 H GLU A 14 12.014 0.275 -13.719 1.00 0.00 H new ATOM 0 HA GLU A 14 9.292 1.328 -13.456 1.00 0.00 H new ATOM 0 HB2 GLU A 14 10.974 0.954 -15.615 1.00 0.00 H new ATOM 0 HB3 GLU A 14 9.940 -0.458 -15.709 1.00 0.00 H new ATOM 0 HG2 GLU A 14 8.247 0.806 -16.527 1.00 0.00 H new ATOM 0 HG3 GLU A 14 8.256 1.791 -15.078 1.00 0.00 H new ATOM 232 N ASP A 15 8.584 -0.712 -12.197 1.00 0.00 N ATOM 233 CA ASP A 15 7.933 -1.880 -11.627 1.00 0.00 C ATOM 234 C ASP A 15 6.893 -1.428 -10.600 1.00 0.00 C ATOM 235 O ASP A 15 6.860 -0.260 -10.218 1.00 0.00 O ATOM 236 CB ASP A 15 8.944 -2.779 -10.912 1.00 0.00 C ATOM 237 CG ASP A 15 9.193 -4.132 -11.582 1.00 0.00 C ATOM 238 OD1 ASP A 15 8.150 -4.883 -11.698 1.00 0.00 O ATOM 239 OD2 ASP A 15 10.325 -4.452 -11.973 1.00 0.00 O ATOM 0 H ASP A 15 8.431 0.155 -11.682 1.00 0.00 H new ATOM 0 HA ASP A 15 7.466 -2.437 -12.440 1.00 0.00 H new ATOM 0 HB2 ASP A 15 9.892 -2.247 -10.838 1.00 0.00 H new ATOM 0 HB3 ASP A 15 8.596 -2.953 -9.894 1.00 0.00 H new ATOM 244 N CYS A 16 6.069 -2.378 -10.184 1.00 0.00 N ATOM 245 CA CYS A 16 5.030 -2.093 -9.209 1.00 0.00 C ATOM 246 C CYS A 16 5.352 -2.860 -7.925 1.00 0.00 C ATOM 247 O CYS A 16 5.185 -2.334 -6.825 1.00 0.00 O ATOM 248 CB CYS A 16 3.640 -2.438 -9.746 1.00 0.00 C ATOM 249 SG CYS A 16 3.648 -4.119 -10.470 1.00 0.00 S ATOM 0 H CYS A 16 6.100 -3.346 -10.504 1.00 0.00 H new ATOM 0 HA CYS A 16 5.011 -1.024 -8.997 1.00 0.00 H new ATOM 0 HB2 CYS A 16 2.906 -2.383 -8.942 1.00 0.00 H new ATOM 0 HB3 CYS A 16 3.341 -1.710 -10.500 1.00 0.00 H new ATOM 0 HG CYS A 16 2.462 -4.403 -10.921 1.00 0.00 H new ATOM 255 N VAL A 17 5.809 -4.090 -8.107 1.00 0.00 N ATOM 256 CA VAL A 17 6.156 -4.935 -6.977 1.00 0.00 C ATOM 257 C VAL A 17 7.599 -5.419 -7.132 1.00 0.00 C ATOM 258 O VAL A 17 8.405 -5.283 -6.213 1.00 0.00 O ATOM 259 CB VAL A 17 5.150 -6.081 -6.852 1.00 0.00 C ATOM 260 CG1 VAL A 17 3.750 -5.551 -6.541 1.00 0.00 C ATOM 261 CG2 VAL A 17 5.142 -6.943 -8.116 1.00 0.00 C ATOM 0 H VAL A 17 5.947 -4.522 -9.021 1.00 0.00 H new ATOM 0 HA VAL A 17 6.101 -4.370 -6.046 1.00 0.00 H new ATOM 0 HB VAL A 17 5.462 -6.711 -6.019 1.00 0.00 H new ATOM 0 HG11 VAL A 17 3.055 -6.386 -6.457 1.00 0.00 H new ATOM 0 HG12 VAL A 17 3.770 -5.000 -5.601 1.00 0.00 H new ATOM 0 HG13 VAL A 17 3.426 -4.888 -7.343 1.00 0.00 H new ATOM 0 HG21 VAL A 17 4.419 -7.750 -8.001 1.00 0.00 H new ATOM 0 HG22 VAL A 17 4.867 -6.329 -8.974 1.00 0.00 H new ATOM 0 HG23 VAL A 17 6.134 -7.365 -8.275 1.00 0.00 H new ATOM 271 N SER A 18 7.880 -5.974 -8.302 1.00 0.00 N ATOM 272 CA SER A 18 9.212 -6.480 -8.589 1.00 0.00 C ATOM 273 C SER A 18 9.663 -7.428 -7.477 1.00 0.00 C ATOM 274 O SER A 18 8.961 -7.602 -6.481 1.00 0.00 O ATOM 275 CB SER A 18 10.213 -5.334 -8.748 1.00 0.00 C ATOM 276 OG SER A 18 11.334 -5.711 -9.544 1.00 0.00 O ATOM 0 H SER A 18 7.209 -6.084 -9.062 1.00 0.00 H new ATOM 0 HA SER A 18 9.174 -7.028 -9.531 1.00 0.00 H new ATOM 0 HB2 SER A 18 9.715 -4.479 -9.205 1.00 0.00 H new ATOM 0 HB3 SER A 18 10.558 -5.015 -7.765 1.00 0.00 H new ATOM 0 HG SER A 18 11.212 -5.380 -10.458 1.00 0.00 H new ATOM 282 N GLU A 19 10.831 -8.018 -7.683 1.00 0.00 N ATOM 283 CA GLU A 19 11.384 -8.945 -6.710 1.00 0.00 C ATOM 284 C GLU A 19 11.704 -8.215 -5.404 1.00 0.00 C ATOM 285 O GLU A 19 11.810 -8.839 -4.349 1.00 0.00 O ATOM 286 CB GLU A 19 12.626 -9.646 -7.264 1.00 0.00 C ATOM 287 CG GLU A 19 12.959 -10.897 -6.450 1.00 0.00 C ATOM 288 CD GLU A 19 14.147 -11.647 -7.057 1.00 0.00 C ATOM 289 OE1 GLU A 19 15.254 -11.094 -7.134 1.00 0.00 O ATOM 290 OE2 GLU A 19 13.889 -12.846 -7.455 1.00 0.00 O ATOM 0 H GLU A 19 11.410 -7.872 -8.510 1.00 0.00 H new ATOM 0 HA GLU A 19 10.637 -9.711 -6.502 1.00 0.00 H new ATOM 0 HB2 GLU A 19 12.459 -9.920 -8.306 1.00 0.00 H new ATOM 0 HB3 GLU A 19 13.473 -8.960 -7.246 1.00 0.00 H new ATOM 0 HG2 GLU A 19 13.189 -10.616 -5.422 1.00 0.00 H new ATOM 0 HG3 GLU A 19 12.090 -11.554 -6.414 1.00 0.00 H new ATOM 297 N LYS A 20 11.848 -6.903 -5.517 1.00 0.00 N ATOM 298 CA LYS A 20 12.153 -6.081 -4.358 1.00 0.00 C ATOM 299 C LYS A 20 11.003 -6.176 -3.353 1.00 0.00 C ATOM 300 O LYS A 20 11.199 -6.606 -2.218 1.00 0.00 O ATOM 301 CB LYS A 20 12.479 -4.649 -4.787 1.00 0.00 C ATOM 302 CG LYS A 20 13.383 -3.962 -3.762 1.00 0.00 C ATOM 303 CD LYS A 20 14.678 -3.473 -4.414 1.00 0.00 C ATOM 304 CE LYS A 20 15.781 -4.527 -4.300 1.00 0.00 C ATOM 305 NZ LYS A 20 17.056 -3.901 -3.884 1.00 0.00 N ATOM 0 H LYS A 20 11.759 -6.389 -6.393 1.00 0.00 H new ATOM 0 HA LYS A 20 13.047 -6.449 -3.855 1.00 0.00 H new ATOM 0 HB2 LYS A 20 12.970 -4.660 -5.760 1.00 0.00 H new ATOM 0 HB3 LYS A 20 11.556 -4.081 -4.902 1.00 0.00 H new ATOM 0 HG2 LYS A 20 12.856 -3.119 -3.314 1.00 0.00 H new ATOM 0 HG3 LYS A 20 13.617 -4.656 -2.955 1.00 0.00 H new ATOM 0 HD2 LYS A 20 14.497 -3.243 -5.464 1.00 0.00 H new ATOM 0 HD3 LYS A 20 15.003 -2.548 -3.937 1.00 0.00 H new ATOM 0 HE2 LYS A 20 15.490 -5.289 -3.577 1.00 0.00 H new ATOM 0 HE3 LYS A 20 15.912 -5.030 -5.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 17.794 -4.631 -3.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 17.340 -3.190 -4.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 16.932 -3.441 -2.959 1.00 0.00 H new ATOM 319 N LEU A 21 9.828 -5.767 -3.808 1.00 0.00 N ATOM 320 CA LEU A 21 8.646 -5.801 -2.964 1.00 0.00 C ATOM 321 C LEU A 21 8.333 -7.251 -2.588 1.00 0.00 C ATOM 322 O LEU A 21 8.119 -7.560 -1.417 1.00 0.00 O ATOM 323 CB LEU A 21 7.481 -5.077 -3.643 1.00 0.00 C ATOM 324 CG LEU A 21 6.356 -4.603 -2.720 1.00 0.00 C ATOM 325 CD1 LEU A 21 5.839 -3.228 -3.148 1.00 0.00 C ATOM 326 CD2 LEU A 21 5.234 -5.641 -2.646 1.00 0.00 C ATOM 0 H LEU A 21 9.669 -5.410 -4.750 1.00 0.00 H new ATOM 0 HA LEU A 21 8.828 -5.262 -2.034 1.00 0.00 H new ATOM 0 HB2 LEU A 21 7.877 -4.212 -4.174 1.00 0.00 H new ATOM 0 HB3 LEU A 21 7.053 -5.743 -4.393 1.00 0.00 H new ATOM 0 HG LEU A 21 6.761 -4.495 -1.714 1.00 0.00 H new ATOM 0 HD11 LEU A 21 5.040 -2.914 -2.476 1.00 0.00 H new ATOM 0 HD12 LEU A 21 6.653 -2.504 -3.107 1.00 0.00 H new ATOM 0 HD13 LEU A 21 5.455 -3.285 -4.167 1.00 0.00 H new ATOM 0 HD21 LEU A 21 4.447 -5.280 -1.984 1.00 0.00 H new ATOM 0 HD22 LEU A 21 4.823 -5.804 -3.642 1.00 0.00 H new ATOM 0 HD23 LEU A 21 5.631 -6.579 -2.259 1.00 0.00 H new ATOM 338 N LEU A 22 8.317 -8.101 -3.604 1.00 0.00 N ATOM 339 CA LEU A 22 8.035 -9.511 -3.396 1.00 0.00 C ATOM 340 C LEU A 22 8.862 -10.023 -2.216 1.00 0.00 C ATOM 341 O LEU A 22 8.311 -10.388 -1.178 1.00 0.00 O ATOM 342 CB LEU A 22 8.254 -10.299 -4.689 1.00 0.00 C ATOM 343 CG LEU A 22 7.065 -11.125 -5.181 1.00 0.00 C ATOM 344 CD1 LEU A 22 6.241 -10.344 -6.207 1.00 0.00 C ATOM 345 CD2 LEU A 22 7.525 -12.479 -5.726 1.00 0.00 C ATOM 0 H LEU A 22 8.495 -7.840 -4.574 1.00 0.00 H new ATOM 0 HA LEU A 22 6.986 -9.655 -3.137 1.00 0.00 H new ATOM 0 HB2 LEU A 22 8.534 -9.598 -5.475 1.00 0.00 H new ATOM 0 HB3 LEU A 22 9.101 -10.969 -4.543 1.00 0.00 H new ATOM 0 HG LEU A 22 6.414 -11.325 -4.330 1.00 0.00 H new ATOM 0 HD11 LEU A 22 5.402 -10.954 -6.540 1.00 0.00 H new ATOM 0 HD12 LEU A 22 5.865 -9.428 -5.751 1.00 0.00 H new ATOM 0 HD13 LEU A 22 6.869 -10.092 -7.062 1.00 0.00 H new ATOM 0 HD21 LEU A 22 6.660 -13.046 -6.069 1.00 0.00 H new ATOM 0 HD22 LEU A 22 8.210 -12.322 -6.559 1.00 0.00 H new ATOM 0 HD23 LEU A 22 8.034 -13.035 -4.938 1.00 0.00 H new ATOM 357 N ARG A 23 10.172 -10.035 -2.413 1.00 0.00 N ATOM 358 CA ARG A 23 11.081 -10.497 -1.378 1.00 0.00 C ATOM 359 C ARG A 23 10.781 -9.792 -0.054 1.00 0.00 C ATOM 360 O ARG A 23 10.837 -10.408 1.008 1.00 0.00 O ATOM 361 CB ARG A 23 12.538 -10.236 -1.768 1.00 0.00 C ATOM 362 CG ARG A 23 13.496 -10.799 -0.717 1.00 0.00 C ATOM 363 CD ARG A 23 14.928 -10.324 -0.969 1.00 0.00 C ATOM 364 NE ARG A 23 15.793 -10.692 0.174 1.00 0.00 N ATOM 365 CZ ARG A 23 17.124 -10.470 0.219 1.00 0.00 C ATOM 366 NH1 ARG A 23 17.755 -9.880 -0.818 1.00 0.00 N ATOM 367 NH2 ARG A 23 17.798 -10.839 1.292 1.00 0.00 N ATOM 0 H ARG A 23 10.626 -9.732 -3.275 1.00 0.00 H new ATOM 0 HA ARG A 23 10.934 -11.571 -1.263 1.00 0.00 H new ATOM 0 HB2 ARG A 23 12.746 -10.691 -2.736 1.00 0.00 H new ATOM 0 HB3 ARG A 23 12.702 -9.164 -1.878 1.00 0.00 H new ATOM 0 HG2 ARG A 23 13.175 -10.487 0.277 1.00 0.00 H new ATOM 0 HG3 ARG A 23 13.462 -11.888 -0.735 1.00 0.00 H new ATOM 0 HD2 ARG A 23 15.312 -10.772 -1.885 1.00 0.00 H new ATOM 0 HD3 ARG A 23 14.941 -9.244 -1.112 1.00 0.00 H new ATOM 0 HE ARG A 23 15.356 -11.142 0.979 1.00 0.00 H new ATOM 0 HH11 ARG A 23 17.226 -9.598 -1.643 1.00 0.00 H new ATOM 0 HH12 ARG A 23 18.761 -9.716 -0.776 1.00 0.00 H new ATOM 0 HH21 ARG A 23 17.313 -11.284 2.071 1.00 0.00 H new ATOM 0 HH22 ARG A 23 18.804 -10.679 1.342 1.00 0.00 H new ATOM 381 N LYS A 24 10.468 -8.509 -0.162 1.00 0.00 N ATOM 382 CA LYS A 24 10.158 -7.713 1.014 1.00 0.00 C ATOM 383 C LYS A 24 9.082 -8.424 1.837 1.00 0.00 C ATOM 384 O LYS A 24 9.265 -8.664 3.029 1.00 0.00 O ATOM 385 CB LYS A 24 9.780 -6.286 0.611 1.00 0.00 C ATOM 386 CG LYS A 24 10.857 -5.290 1.048 1.00 0.00 C ATOM 387 CD LYS A 24 10.296 -3.868 1.106 1.00 0.00 C ATOM 388 CE LYS A 24 10.747 -3.051 -0.107 1.00 0.00 C ATOM 389 NZ LYS A 24 11.696 -1.992 0.305 1.00 0.00 N ATOM 0 H LYS A 24 10.422 -8.001 -1.045 1.00 0.00 H new ATOM 0 HA LYS A 24 11.037 -7.618 1.651 1.00 0.00 H new ATOM 0 HB2 LYS A 24 9.647 -6.232 -0.470 1.00 0.00 H new ATOM 0 HB3 LYS A 24 8.826 -6.017 1.064 1.00 0.00 H new ATOM 0 HG2 LYS A 24 11.243 -5.573 2.027 1.00 0.00 H new ATOM 0 HG3 LYS A 24 11.695 -5.326 0.352 1.00 0.00 H new ATOM 0 HD2 LYS A 24 9.207 -3.904 1.140 1.00 0.00 H new ATOM 0 HD3 LYS A 24 10.628 -3.379 2.022 1.00 0.00 H new ATOM 0 HE2 LYS A 24 11.219 -3.706 -0.839 1.00 0.00 H new ATOM 0 HE3 LYS A 24 9.881 -2.602 -0.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 11.992 -1.447 -0.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 11.233 -1.357 0.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 12.530 -2.427 0.748 1.00 0.00 H new ATOM 403 N THR A 25 7.984 -8.742 1.167 1.00 0.00 N ATOM 404 CA THR A 25 6.878 -9.422 1.822 1.00 0.00 C ATOM 405 C THR A 25 6.128 -10.304 0.823 1.00 0.00 C ATOM 406 O THR A 25 5.662 -9.823 -0.209 1.00 0.00 O ATOM 407 CB THR A 25 5.994 -8.360 2.479 1.00 0.00 C ATOM 408 OG1 THR A 25 6.663 -8.058 3.700 1.00 0.00 O ATOM 409 CG2 THR A 25 4.641 -8.919 2.925 1.00 0.00 C ATOM 0 H THR A 25 7.836 -8.542 0.178 1.00 0.00 H new ATOM 0 HA THR A 25 7.233 -10.097 2.600 1.00 0.00 H new ATOM 0 HB THR A 25 5.836 -7.538 1.781 1.00 0.00 H new ATOM 0 HG1 THR A 25 7.607 -8.309 3.626 1.00 0.00 H new ATOM 0 HG21 THR A 25 4.053 -8.125 3.385 1.00 0.00 H new ATOM 0 HG22 THR A 25 4.107 -9.312 2.060 1.00 0.00 H new ATOM 0 HG23 THR A 25 4.798 -9.719 3.648 1.00 0.00 H new ATOM 417 N ARG A 26 6.034 -11.581 1.164 1.00 0.00 N ATOM 418 CA ARG A 26 5.348 -12.535 0.309 1.00 0.00 C ATOM 419 C ARG A 26 5.172 -13.869 1.038 1.00 0.00 C ATOM 420 O ARG A 26 5.689 -14.052 2.139 1.00 0.00 O ATOM 421 CB ARG A 26 6.124 -12.770 -0.988 1.00 0.00 C ATOM 422 CG ARG A 26 5.198 -13.275 -2.097 1.00 0.00 C ATOM 423 CD ARG A 26 5.467 -14.749 -2.406 1.00 0.00 C ATOM 424 NE ARG A 26 4.191 -15.498 -2.451 1.00 0.00 N ATOM 425 CZ ARG A 26 3.290 -15.398 -3.451 1.00 0.00 C ATOM 426 NH1 ARG A 26 3.517 -14.579 -4.499 1.00 0.00 N ATOM 427 NH2 ARG A 26 2.183 -16.114 -3.388 1.00 0.00 N ATOM 0 H ARG A 26 6.421 -11.977 2.020 1.00 0.00 H new ATOM 0 HA ARG A 26 4.371 -12.118 0.064 1.00 0.00 H new ATOM 0 HB2 ARG A 26 6.602 -11.843 -1.303 1.00 0.00 H new ATOM 0 HB3 ARG A 26 6.919 -13.496 -0.814 1.00 0.00 H new ATOM 0 HG2 ARG A 26 4.159 -13.147 -1.795 1.00 0.00 H new ATOM 0 HG3 ARG A 26 5.344 -12.678 -2.997 1.00 0.00 H new ATOM 0 HD2 ARG A 26 5.986 -14.840 -3.360 1.00 0.00 H new ATOM 0 HD3 ARG A 26 6.122 -15.175 -1.646 1.00 0.00 H new ATOM 0 HE ARG A 26 3.979 -16.129 -1.678 1.00 0.00 H new ATOM 0 HH11 ARG A 26 4.375 -14.029 -4.540 1.00 0.00 H new ATOM 0 HH12 ARG A 26 2.831 -14.510 -5.250 1.00 0.00 H new ATOM 0 HH21 ARG A 26 2.019 -16.731 -2.592 1.00 0.00 H new ATOM 0 HH22 ARG A 26 1.491 -16.051 -4.135 1.00 0.00 H new ATOM 441 N GLU A 27 4.439 -14.766 0.395 1.00 0.00 N ATOM 442 CA GLU A 27 4.188 -16.077 0.968 1.00 0.00 C ATOM 443 C GLU A 27 3.335 -15.950 2.232 1.00 0.00 C ATOM 444 O GLU A 27 3.135 -14.849 2.742 1.00 0.00 O ATOM 445 CB GLU A 27 5.500 -16.807 1.263 1.00 0.00 C ATOM 446 CG GLU A 27 5.744 -17.928 0.251 1.00 0.00 C ATOM 447 CD GLU A 27 6.928 -18.800 0.674 1.00 0.00 C ATOM 448 OE1 GLU A 27 8.090 -18.290 0.442 1.00 0.00 O ATOM 449 OE2 GLU A 27 6.728 -19.907 1.195 1.00 0.00 O ATOM 0 H GLU A 27 4.011 -14.610 -0.518 1.00 0.00 H new ATOM 0 HA GLU A 27 3.636 -16.671 0.239 1.00 0.00 H new ATOM 0 HB2 GLU A 27 6.328 -16.099 1.234 1.00 0.00 H new ATOM 0 HB3 GLU A 27 5.471 -17.222 2.271 1.00 0.00 H new ATOM 0 HG2 GLU A 27 4.849 -18.543 0.161 1.00 0.00 H new ATOM 0 HG3 GLU A 27 5.936 -17.499 -0.733 1.00 0.00 H new ATOM 456 N SER A 28 2.854 -17.092 2.700 1.00 0.00 N ATOM 457 CA SER A 28 2.027 -17.122 3.894 1.00 0.00 C ATOM 458 C SER A 28 0.620 -16.617 3.569 1.00 0.00 C ATOM 459 O SER A 28 0.375 -16.113 2.474 1.00 0.00 O ATOM 460 CB SER A 28 2.646 -16.284 5.015 1.00 0.00 C ATOM 461 OG SER A 28 2.824 -17.038 6.210 1.00 0.00 O ATOM 0 H SER A 28 3.021 -18.004 2.274 1.00 0.00 H new ATOM 0 HA SER A 28 1.965 -18.154 4.241 1.00 0.00 H new ATOM 0 HB2 SER A 28 3.609 -15.894 4.686 1.00 0.00 H new ATOM 0 HB3 SER A 28 2.007 -15.425 5.220 1.00 0.00 H new ATOM 0 HG SER A 28 3.223 -16.468 6.900 1.00 0.00 H new ATOM 467 N PRO A 29 -0.292 -16.773 4.566 1.00 0.00 N ATOM 468 CA PRO A 29 -1.668 -16.338 4.397 1.00 0.00 C ATOM 469 C PRO A 29 -1.777 -14.815 4.489 1.00 0.00 C ATOM 470 O PRO A 29 -0.921 -14.162 5.084 1.00 0.00 O ATOM 471 CB PRO A 29 -2.444 -17.056 5.489 1.00 0.00 C ATOM 472 CG PRO A 29 -1.411 -17.498 6.513 1.00 0.00 C ATOM 473 CD PRO A 29 -0.037 -17.365 5.877 1.00 0.00 C ATOM 0 HA PRO A 29 -2.069 -16.584 3.414 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -3.184 -16.396 5.941 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -2.985 -17.912 5.085 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -1.477 -16.884 7.411 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -1.592 -18.529 6.818 1.00 0.00 H new ATOM 0 HD2 PRO A 29 0.618 -16.733 6.477 1.00 0.00 H new ATOM 0 HD3 PRO A 29 0.453 -18.334 5.785 1.00 0.00 H new ATOM 481 N LEU A 30 -2.837 -14.292 3.890 1.00 0.00 N ATOM 482 CA LEU A 30 -3.069 -12.858 3.896 1.00 0.00 C ATOM 483 C LEU A 30 -4.105 -12.518 4.970 1.00 0.00 C ATOM 484 O LEU A 30 -4.202 -11.371 5.403 1.00 0.00 O ATOM 485 CB LEU A 30 -3.451 -12.371 2.497 1.00 0.00 C ATOM 486 CG LEU A 30 -3.354 -10.862 2.263 1.00 0.00 C ATOM 487 CD1 LEU A 30 -2.840 -10.557 0.855 1.00 0.00 C ATOM 488 CD2 LEU A 30 -4.693 -10.176 2.545 1.00 0.00 C ATOM 0 H LEU A 30 -3.545 -14.836 3.397 1.00 0.00 H new ATOM 0 HA LEU A 30 -2.154 -12.325 4.155 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -2.811 -12.873 1.772 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -4.474 -12.686 2.291 1.00 0.00 H new ATOM 0 HG LEU A 30 -2.628 -10.454 2.966 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -2.781 -9.478 0.715 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -1.850 -10.995 0.726 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -3.523 -10.981 0.119 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -4.597 -9.104 2.371 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -5.457 -10.584 1.883 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -4.980 -10.351 3.582 1.00 0.00 H new ATOM 500 N VAL A 31 -4.852 -13.536 5.369 1.00 0.00 N ATOM 501 CA VAL A 31 -5.877 -13.360 6.384 1.00 0.00 C ATOM 502 C VAL A 31 -5.291 -12.582 7.564 1.00 0.00 C ATOM 503 O VAL A 31 -5.888 -11.613 8.031 1.00 0.00 O ATOM 504 CB VAL A 31 -6.452 -14.719 6.789 1.00 0.00 C ATOM 505 CG1 VAL A 31 -6.689 -14.785 8.300 1.00 0.00 C ATOM 506 CG2 VAL A 31 -7.738 -15.022 6.019 1.00 0.00 C ATOM 0 H VAL A 31 -4.768 -14.486 5.008 1.00 0.00 H new ATOM 0 HA VAL A 31 -6.709 -12.776 5.990 1.00 0.00 H new ATOM 0 HB VAL A 31 -5.719 -15.483 6.530 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -7.098 -15.761 8.562 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -5.745 -14.635 8.823 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -7.393 -14.006 8.592 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -8.126 -15.993 6.326 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -8.479 -14.252 6.232 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -7.527 -15.037 4.950 1.00 0.00 H new ATOM 516 N PRO A 32 -4.100 -13.048 8.025 1.00 0.00 N ATOM 517 CA PRO A 32 -3.427 -12.407 9.142 1.00 0.00 C ATOM 518 C PRO A 32 -2.784 -11.087 8.710 1.00 0.00 C ATOM 519 O PRO A 32 -3.340 -10.016 8.944 1.00 0.00 O ATOM 520 CB PRO A 32 -2.414 -13.429 9.630 1.00 0.00 C ATOM 521 CG PRO A 32 -2.233 -14.416 8.488 1.00 0.00 C ATOM 522 CD PRO A 32 -3.364 -14.193 7.496 1.00 0.00 C ATOM 0 HA PRO A 32 -4.112 -12.131 9.944 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -1.469 -12.950 9.886 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -2.770 -13.933 10.529 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -1.267 -14.268 8.005 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -2.249 -15.440 8.862 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -2.980 -13.989 6.496 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -4.003 -15.073 7.419 1.00 0.00 H new ATOM 530 N ILE A 33 -1.620 -11.209 8.087 1.00 0.00 N ATOM 531 CA ILE A 33 -0.896 -10.039 7.621 1.00 0.00 C ATOM 532 C ILE A 33 -1.890 -9.012 7.074 1.00 0.00 C ATOM 533 O ILE A 33 -1.777 -7.821 7.359 1.00 0.00 O ATOM 534 CB ILE A 33 0.185 -10.443 6.616 1.00 0.00 C ATOM 535 CG1 ILE A 33 -0.431 -11.130 5.396 1.00 0.00 C ATOM 536 CG2 ILE A 33 1.256 -11.310 7.282 1.00 0.00 C ATOM 537 CD1 ILE A 33 0.632 -11.412 4.331 1.00 0.00 C ATOM 0 H ILE A 33 -1.161 -12.100 7.895 1.00 0.00 H new ATOM 0 HA ILE A 33 -0.369 -9.564 8.448 1.00 0.00 H new ATOM 0 HB ILE A 33 0.678 -9.538 6.262 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -0.903 -12.064 5.700 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -1.214 -10.499 4.975 1.00 0.00 H new ATOM 0 HG21 ILE A 33 2.012 -11.583 6.546 1.00 0.00 H new ATOM 0 HG22 ILE A 33 1.724 -10.752 8.093 1.00 0.00 H new ATOM 0 HG23 ILE A 33 0.796 -12.213 7.682 1.00 0.00 H new ATOM 0 HD11 ILE A 33 0.168 -11.901 3.474 1.00 0.00 H new ATOM 0 HD12 ILE A 33 1.085 -10.473 4.012 1.00 0.00 H new ATOM 0 HD13 ILE A 33 1.401 -12.063 4.748 1.00 0.00 H new ATOM 549 N GLY A 34 -2.841 -9.512 6.299 1.00 0.00 N ATOM 550 CA GLY A 34 -3.855 -8.653 5.710 1.00 0.00 C ATOM 551 C GLY A 34 -4.743 -8.034 6.791 1.00 0.00 C ATOM 552 O GLY A 34 -5.005 -6.832 6.770 1.00 0.00 O ATOM 0 H GLY A 34 -2.931 -10.501 6.065 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -3.376 -7.863 5.131 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -4.468 -9.230 5.017 1.00 0.00 H new ATOM 556 N LEU A 35 -5.183 -8.882 7.709 1.00 0.00 N ATOM 557 CA LEU A 35 -6.037 -8.432 8.795 1.00 0.00 C ATOM 558 C LEU A 35 -5.401 -7.214 9.467 1.00 0.00 C ATOM 559 O LEU A 35 -6.018 -6.153 9.550 1.00 0.00 O ATOM 560 CB LEU A 35 -6.328 -9.584 9.759 1.00 0.00 C ATOM 561 CG LEU A 35 -6.851 -9.186 11.141 1.00 0.00 C ATOM 562 CD1 LEU A 35 -8.339 -8.833 11.083 1.00 0.00 C ATOM 563 CD2 LEU A 35 -6.562 -10.278 12.172 1.00 0.00 C ATOM 0 H LEU A 35 -4.964 -9.878 7.723 1.00 0.00 H new ATOM 0 HA LEU A 35 -7.007 -8.115 8.411 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -7.058 -10.246 9.293 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -5.413 -10.161 9.891 1.00 0.00 H new ATOM 0 HG LEU A 35 -6.319 -8.291 11.462 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -8.686 -8.554 12.078 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -8.488 -7.998 10.399 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -8.904 -9.696 10.731 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -6.944 -9.970 13.145 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -7.050 -11.204 11.868 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -5.486 -10.440 12.239 1.00 0.00 H new ATOM 575 N GLY A 36 -4.174 -7.406 9.930 1.00 0.00 N ATOM 576 CA GLY A 36 -3.448 -6.336 10.592 1.00 0.00 C ATOM 577 C GLY A 36 -3.323 -5.113 9.682 1.00 0.00 C ATOM 578 O GLY A 36 -3.855 -4.047 9.991 1.00 0.00 O ATOM 0 H GLY A 36 -3.665 -8.287 9.860 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.962 -6.058 11.512 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -2.455 -6.686 10.875 1.00 0.00 H new ATOM 582 N GLY A 37 -2.617 -5.307 8.577 1.00 0.00 N ATOM 583 CA GLY A 37 -2.416 -4.233 7.619 1.00 0.00 C ATOM 584 C GLY A 37 -3.740 -3.545 7.281 1.00 0.00 C ATOM 585 O GLY A 37 -3.751 -2.398 6.835 1.00 0.00 O ATOM 0 H GLY A 37 -2.177 -6.192 8.324 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -1.717 -3.503 8.027 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -1.967 -4.632 6.709 1.00 0.00 H new ATOM 589 N CYS A 38 -4.823 -4.274 7.505 1.00 0.00 N ATOM 590 CA CYS A 38 -6.149 -3.748 7.230 1.00 0.00 C ATOM 591 C CYS A 38 -6.539 -2.804 8.369 1.00 0.00 C ATOM 592 O CYS A 38 -6.757 -1.614 8.148 1.00 0.00 O ATOM 593 CB CYS A 38 -7.174 -4.868 7.041 1.00 0.00 C ATOM 594 SG CYS A 38 -8.743 -4.179 6.397 1.00 0.00 S ATOM 0 H CYS A 38 -4.809 -5.225 7.874 1.00 0.00 H new ATOM 0 HA CYS A 38 -6.135 -3.195 6.291 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -6.785 -5.616 6.350 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -7.352 -5.373 7.990 1.00 0.00 H new ATOM 0 HG CYS A 38 -9.606 -5.139 6.238 1.00 0.00 H new ATOM 600 N LEU A 39 -6.614 -3.371 9.565 1.00 0.00 N ATOM 601 CA LEU A 39 -6.973 -2.595 10.739 1.00 0.00 C ATOM 602 C LEU A 39 -6.264 -1.241 10.687 1.00 0.00 C ATOM 603 O LEU A 39 -6.904 -0.196 10.799 1.00 0.00 O ATOM 604 CB LEU A 39 -6.687 -3.391 12.015 1.00 0.00 C ATOM 605 CG LEU A 39 -7.476 -2.973 13.257 1.00 0.00 C ATOM 606 CD1 LEU A 39 -7.175 -1.522 13.637 1.00 0.00 C ATOM 607 CD2 LEU A 39 -8.975 -3.215 13.061 1.00 0.00 C ATOM 0 H LEU A 39 -6.432 -4.358 9.745 1.00 0.00 H new ATOM 0 HA LEU A 39 -8.044 -2.393 10.750 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -6.891 -4.443 11.816 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -5.624 -3.309 12.240 1.00 0.00 H new ATOM 0 HG LEU A 39 -7.155 -3.597 14.091 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -7.749 -1.251 14.523 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -6.111 -1.414 13.847 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -7.450 -0.865 12.812 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -9.513 -2.910 13.958 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -9.329 -2.634 12.210 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -9.151 -4.274 12.875 1.00 0.00 H new ATOM 619 N VAL A 40 -4.951 -1.302 10.517 1.00 0.00 N ATOM 620 CA VAL A 40 -4.148 -0.093 10.449 1.00 0.00 C ATOM 621 C VAL A 40 -4.602 0.748 9.254 1.00 0.00 C ATOM 622 O VAL A 40 -4.933 1.923 9.408 1.00 0.00 O ATOM 623 CB VAL A 40 -2.662 -0.454 10.396 1.00 0.00 C ATOM 624 CG1 VAL A 40 -2.342 -1.276 9.145 1.00 0.00 C ATOM 625 CG2 VAL A 40 -1.790 0.801 10.465 1.00 0.00 C ATOM 0 H VAL A 40 -4.423 -2.170 10.424 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.290 0.511 11.345 1.00 0.00 H new ATOM 0 HB VAL A 40 -2.435 -1.068 11.268 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -1.280 -1.519 9.131 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -2.925 -2.197 9.156 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -2.593 -0.698 8.256 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -0.739 0.516 10.426 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -2.022 1.452 9.622 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -1.988 1.331 11.397 1.00 0.00 H new ATOM 635 N VAL A 41 -4.602 0.115 8.090 1.00 0.00 N ATOM 636 CA VAL A 41 -5.009 0.790 6.870 1.00 0.00 C ATOM 637 C VAL A 41 -6.282 1.596 7.139 1.00 0.00 C ATOM 638 O VAL A 41 -6.251 2.825 7.157 1.00 0.00 O ATOM 639 CB VAL A 41 -5.173 -0.226 5.739 1.00 0.00 C ATOM 640 CG1 VAL A 41 -6.214 0.247 4.722 1.00 0.00 C ATOM 641 CG2 VAL A 41 -3.832 -0.510 5.059 1.00 0.00 C ATOM 0 H VAL A 41 -4.326 -0.859 7.966 1.00 0.00 H new ATOM 0 HA VAL A 41 -4.241 1.493 6.548 1.00 0.00 H new ATOM 0 HB VAL A 41 -5.532 -1.158 6.176 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -6.311 -0.494 3.929 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -7.176 0.375 5.219 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -5.898 1.198 4.293 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.976 -1.236 4.259 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -3.432 0.415 4.643 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -3.131 -0.912 5.791 1.00 0.00 H new ATOM 651 N ALA A 42 -7.372 0.869 7.341 1.00 0.00 N ATOM 652 CA ALA A 42 -8.653 1.501 7.608 1.00 0.00 C ATOM 653 C ALA A 42 -8.462 2.616 8.638 1.00 0.00 C ATOM 654 O ALA A 42 -9.078 3.675 8.533 1.00 0.00 O ATOM 655 CB ALA A 42 -9.657 0.443 8.072 1.00 0.00 C ATOM 0 H ALA A 42 -7.394 -0.151 7.325 1.00 0.00 H new ATOM 0 HA ALA A 42 -9.054 1.955 6.702 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -10.618 0.917 8.272 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -9.779 -0.310 7.293 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -9.290 -0.033 8.982 1.00 0.00 H new ATOM 661 N ALA A 43 -7.606 2.339 9.611 1.00 0.00 N ATOM 662 CA ALA A 43 -7.327 3.306 10.659 1.00 0.00 C ATOM 663 C ALA A 43 -6.994 4.658 10.025 1.00 0.00 C ATOM 664 O ALA A 43 -7.700 5.641 10.244 1.00 0.00 O ATOM 665 CB ALA A 43 -6.195 2.783 11.547 1.00 0.00 C ATOM 0 H ALA A 43 -7.097 1.459 9.695 1.00 0.00 H new ATOM 0 HA ALA A 43 -8.202 3.447 11.294 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.985 3.508 12.333 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -6.493 1.836 11.997 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -5.300 2.632 10.944 1.00 0.00 H new ATOM 671 N TYR A 44 -5.918 4.663 9.252 1.00 0.00 N ATOM 672 CA TYR A 44 -5.482 5.878 8.584 1.00 0.00 C ATOM 673 C TYR A 44 -6.615 6.482 7.750 1.00 0.00 C ATOM 674 O TYR A 44 -6.846 7.689 7.793 1.00 0.00 O ATOM 675 CB TYR A 44 -4.344 5.462 7.651 1.00 0.00 C ATOM 676 CG TYR A 44 -4.114 6.422 6.482 1.00 0.00 C ATOM 677 CD1 TYR A 44 -3.872 7.759 6.725 1.00 0.00 C ATOM 678 CD2 TYR A 44 -4.149 5.952 5.186 1.00 0.00 C ATOM 679 CE1 TYR A 44 -3.656 8.663 5.625 1.00 0.00 C ATOM 680 CE2 TYR A 44 -3.933 6.856 4.086 1.00 0.00 C ATOM 681 CZ TYR A 44 -3.697 8.167 4.360 1.00 0.00 C ATOM 682 OH TYR A 44 -3.493 9.021 3.321 1.00 0.00 O ATOM 0 H TYR A 44 -5.335 3.845 9.073 1.00 0.00 H new ATOM 0 HA TYR A 44 -5.172 6.626 9.313 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -3.424 5.384 8.230 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -4.557 4.469 7.255 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -3.845 8.127 7.740 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -4.338 4.906 4.996 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -3.466 9.711 5.801 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -3.958 6.501 3.066 1.00 0.00 H new ATOM 0 HH TYR A 44 -2.859 8.622 2.689 1.00 0.00 H new ATOM 692 N ARG A 45 -7.290 5.613 7.012 1.00 0.00 N ATOM 693 CA ARG A 45 -8.392 6.045 6.170 1.00 0.00 C ATOM 694 C ARG A 45 -9.404 6.848 6.990 1.00 0.00 C ATOM 695 O ARG A 45 -9.549 8.054 6.795 1.00 0.00 O ATOM 696 CB ARG A 45 -9.100 4.848 5.531 1.00 0.00 C ATOM 697 CG ARG A 45 -8.723 4.712 4.055 1.00 0.00 C ATOM 698 CD ARG A 45 -8.356 3.267 3.713 1.00 0.00 C ATOM 699 NE ARG A 45 -8.729 2.967 2.313 1.00 0.00 N ATOM 700 CZ ARG A 45 -9.994 3.002 1.842 1.00 0.00 C ATOM 701 NH1 ARG A 45 -11.019 3.324 2.659 1.00 0.00 N ATOM 702 NH2 ARG A 45 -10.212 2.716 0.572 1.00 0.00 N ATOM 0 H ARG A 45 -7.095 4.612 6.980 1.00 0.00 H new ATOM 0 HA ARG A 45 -7.979 6.673 5.380 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -8.832 3.936 6.064 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -10.179 4.967 5.625 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -9.556 5.036 3.432 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -7.882 5.368 3.829 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -7.286 3.112 3.854 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -8.869 2.583 4.389 1.00 0.00 H new ATOM 0 HE ARG A 45 -7.984 2.718 1.663 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -10.841 3.543 3.639 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -11.972 3.348 2.296 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -9.431 2.473 -0.037 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -11.162 2.738 0.200 1.00 0.00 H new ATOM 716 N ILE A 46 -10.078 6.148 7.890 1.00 0.00 N ATOM 717 CA ILE A 46 -11.071 6.780 8.741 1.00 0.00 C ATOM 718 C ILE A 46 -10.518 8.108 9.263 1.00 0.00 C ATOM 719 O ILE A 46 -11.073 9.169 8.983 1.00 0.00 O ATOM 720 CB ILE A 46 -11.518 5.822 9.847 1.00 0.00 C ATOM 721 CG1 ILE A 46 -12.316 4.652 9.269 1.00 0.00 C ATOM 722 CG2 ILE A 46 -12.297 6.565 10.934 1.00 0.00 C ATOM 723 CD1 ILE A 46 -12.175 3.406 10.146 1.00 0.00 C ATOM 0 H ILE A 46 -9.956 5.148 8.048 1.00 0.00 H new ATOM 0 HA ILE A 46 -11.970 7.011 8.170 1.00 0.00 H new ATOM 0 HB ILE A 46 -10.628 5.404 10.317 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -13.367 4.928 9.190 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -11.967 4.432 8.260 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -12.603 5.861 11.708 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -11.663 7.335 11.374 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -13.181 7.029 10.496 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -12.752 2.589 9.713 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -11.125 3.118 10.203 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -12.547 3.622 11.147 1.00 0.00 H new ATOM 735 N TYR A 47 -9.431 8.005 10.014 1.00 0.00 N ATOM 736 CA TYR A 47 -8.797 9.184 10.578 1.00 0.00 C ATOM 737 C TYR A 47 -8.831 10.351 9.590 1.00 0.00 C ATOM 738 O TYR A 47 -9.389 11.406 9.888 1.00 0.00 O ATOM 739 CB TYR A 47 -7.341 8.795 10.840 1.00 0.00 C ATOM 740 CG TYR A 47 -6.979 8.699 12.324 1.00 0.00 C ATOM 741 CD1 TYR A 47 -7.107 9.806 13.138 1.00 0.00 C ATOM 742 CD2 TYR A 47 -6.526 7.505 12.848 1.00 0.00 C ATOM 743 CE1 TYR A 47 -6.767 9.715 14.535 1.00 0.00 C ATOM 744 CE2 TYR A 47 -6.186 7.415 14.244 1.00 0.00 C ATOM 745 CZ TYR A 47 -6.323 8.524 15.018 1.00 0.00 C ATOM 746 OH TYR A 47 -6.002 8.439 16.337 1.00 0.00 O ATOM 0 H TYR A 47 -8.974 7.123 10.245 1.00 0.00 H new ATOM 0 HA TYR A 47 -9.314 9.502 11.483 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.141 7.834 10.365 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -6.689 9.527 10.364 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -7.462 10.740 12.728 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -6.427 6.639 12.211 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -6.863 10.573 15.184 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -5.830 6.487 14.667 1.00 0.00 H new ATOM 0 HH TYR A 47 -5.701 7.529 16.542 1.00 0.00 H new ATOM 756 N ARG A 48 -8.227 10.122 8.433 1.00 0.00 N ATOM 757 CA ARG A 48 -8.181 11.141 7.398 1.00 0.00 C ATOM 758 C ARG A 48 -9.589 11.660 7.101 1.00 0.00 C ATOM 759 O ARG A 48 -9.847 12.859 7.199 1.00 0.00 O ATOM 760 CB ARG A 48 -7.565 10.592 6.110 1.00 0.00 C ATOM 761 CG ARG A 48 -6.760 11.670 5.383 1.00 0.00 C ATOM 762 CD ARG A 48 -7.633 12.422 4.377 1.00 0.00 C ATOM 763 NE ARG A 48 -6.834 12.789 3.187 1.00 0.00 N ATOM 764 CZ ARG A 48 -7.266 13.614 2.210 1.00 0.00 C ATOM 765 NH1 ARG A 48 -8.496 14.166 2.273 1.00 0.00 N ATOM 766 NH2 ARG A 48 -6.467 13.873 1.191 1.00 0.00 N ATOM 0 H ARG A 48 -7.765 9.246 8.189 1.00 0.00 H new ATOM 0 HA ARG A 48 -7.559 11.957 7.765 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -6.918 9.746 6.344 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -8.353 10.219 5.456 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -6.348 12.372 6.108 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -5.916 11.212 4.867 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -8.478 11.800 4.080 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -8.044 13.319 4.840 1.00 0.00 H new ATOM 0 HE ARG A 48 -5.898 12.394 3.099 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -9.107 13.961 3.063 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -8.814 14.788 1.530 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -5.539 13.452 1.151 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -6.778 14.494 0.444 1.00 0.00 H new ATOM 780 N LEU A 49 -10.464 10.732 6.743 1.00 0.00 N ATOM 781 CA LEU A 49 -11.840 11.080 6.431 1.00 0.00 C ATOM 782 C LEU A 49 -12.353 12.088 7.462 1.00 0.00 C ATOM 783 O LEU A 49 -12.829 13.163 7.101 1.00 0.00 O ATOM 784 CB LEU A 49 -12.700 9.820 6.322 1.00 0.00 C ATOM 785 CG LEU A 49 -14.198 10.047 6.106 1.00 0.00 C ATOM 786 CD1 LEU A 49 -14.740 9.126 5.011 1.00 0.00 C ATOM 787 CD2 LEU A 49 -14.970 9.893 7.418 1.00 0.00 C ATOM 0 H LEU A 49 -10.247 9.739 6.662 1.00 0.00 H new ATOM 0 HA LEU A 49 -11.899 11.563 5.456 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -12.322 9.216 5.497 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -12.569 9.235 7.232 1.00 0.00 H new ATOM 0 HG LEU A 49 -14.343 11.072 5.765 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -15.806 9.308 4.878 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -14.218 9.327 4.075 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -14.582 8.087 5.299 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -16.032 10.059 7.237 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -14.822 8.887 7.811 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -14.607 10.623 8.142 1.00 0.00 H new ATOM 799 N ARG A 50 -12.238 11.704 8.725 1.00 0.00 N ATOM 800 CA ARG A 50 -12.684 12.560 9.811 1.00 0.00 C ATOM 801 C ARG A 50 -11.707 13.722 10.006 1.00 0.00 C ATOM 802 O ARG A 50 -10.520 13.595 9.711 1.00 0.00 O ATOM 803 CB ARG A 50 -12.801 11.776 11.119 1.00 0.00 C ATOM 804 CG ARG A 50 -14.261 11.443 11.430 1.00 0.00 C ATOM 805 CD ARG A 50 -14.381 10.071 12.098 1.00 0.00 C ATOM 806 NE ARG A 50 -15.591 9.373 11.608 1.00 0.00 N ATOM 807 CZ ARG A 50 -16.119 8.276 12.190 1.00 0.00 C ATOM 808 NH1 ARG A 50 -15.548 7.742 13.291 1.00 0.00 N ATOM 809 NH2 ARG A 50 -17.203 7.734 11.668 1.00 0.00 N ATOM 0 H ARG A 50 -11.842 10.811 9.020 1.00 0.00 H new ATOM 0 HA ARG A 50 -13.667 12.948 9.545 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -12.221 10.856 11.048 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -12.375 12.359 11.936 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -14.681 12.208 12.084 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -14.845 11.455 10.509 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -13.495 9.474 11.883 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -14.432 10.188 13.181 1.00 0.00 H new ATOM 0 HE ARG A 50 -16.055 9.744 10.779 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -14.711 8.168 13.689 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -15.954 6.913 13.725 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -17.629 8.144 10.837 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -17.615 6.905 12.095 1.00 0.00 H new ATOM 823 N SER A 51 -12.244 14.827 10.503 1.00 0.00 N ATOM 824 CA SER A 51 -11.434 16.010 10.741 1.00 0.00 C ATOM 825 C SER A 51 -12.295 17.119 11.349 1.00 0.00 C ATOM 826 O SER A 51 -12.618 18.098 10.676 1.00 0.00 O ATOM 827 CB SER A 51 -10.776 16.496 9.449 1.00 0.00 C ATOM 828 OG SER A 51 -9.850 17.553 9.686 1.00 0.00 O ATOM 0 H SER A 51 -13.229 14.928 10.747 1.00 0.00 H new ATOM 0 HA SER A 51 -10.642 15.748 11.443 1.00 0.00 H new ATOM 0 HB2 SER A 51 -10.261 15.664 8.969 1.00 0.00 H new ATOM 0 HB3 SER A 51 -11.545 16.837 8.756 1.00 0.00 H new ATOM 0 HG SER A 51 -10.150 18.362 9.221 1.00 0.00 H new ATOM 834 N ARG A 52 -12.643 16.930 12.613 1.00 0.00 N ATOM 835 CA ARG A 52 -13.460 17.902 13.318 1.00 0.00 C ATOM 836 C ARG A 52 -12.785 19.275 13.301 1.00 0.00 C ATOM 837 O ARG A 52 -11.559 19.368 13.331 1.00 0.00 O ATOM 838 CB ARG A 52 -13.695 17.476 14.769 1.00 0.00 C ATOM 839 CG ARG A 52 -12.404 16.956 15.403 1.00 0.00 C ATOM 840 CD ARG A 52 -12.432 17.130 16.923 1.00 0.00 C ATOM 841 NE ARG A 52 -12.639 15.819 17.579 1.00 0.00 N ATOM 842 CZ ARG A 52 -12.840 15.659 18.904 1.00 0.00 C ATOM 843 NH1 ARG A 52 -12.862 16.729 19.728 1.00 0.00 N ATOM 844 NH2 ARG A 52 -13.013 14.441 19.383 1.00 0.00 N ATOM 0 H ARG A 52 -12.374 16.117 13.167 1.00 0.00 H new ATOM 0 HA ARG A 52 -14.421 17.959 12.807 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -14.072 18.322 15.344 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -14.460 16.700 14.805 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -12.272 15.903 15.156 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -11.550 17.490 14.988 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -11.496 17.573 17.264 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -13.230 17.817 17.204 1.00 0.00 H new ATOM 0 HE ARG A 52 -12.629 14.984 16.993 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -12.726 17.667 19.350 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -13.015 16.599 20.728 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -12.994 13.638 18.754 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -13.166 14.303 20.382 1.00 0.00 H new ATOM 858 N GLY A 53 -13.615 20.307 13.252 1.00 0.00 N ATOM 859 CA GLY A 53 -13.114 21.670 13.230 1.00 0.00 C ATOM 860 C GLY A 53 -12.354 21.954 11.933 1.00 0.00 C ATOM 861 O GLY A 53 -12.932 22.446 10.965 1.00 0.00 O ATOM 0 H GLY A 53 -14.631 20.226 13.227 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -13.945 22.368 13.329 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -12.457 21.833 14.084 1.00 0.00 H new ATOM 865 N SER A 54 -11.069 21.633 11.956 1.00 0.00 N ATOM 866 CA SER A 54 -10.223 21.847 10.794 1.00 0.00 C ATOM 867 C SER A 54 -10.102 23.344 10.504 1.00 0.00 C ATOM 868 O SER A 54 -11.004 24.117 10.824 1.00 0.00 O ATOM 869 CB SER A 54 -10.773 21.112 9.570 1.00 0.00 C ATOM 870 OG SER A 54 -9.741 20.470 8.824 1.00 0.00 O ATOM 0 H SER A 54 -10.593 21.226 12.761 1.00 0.00 H new ATOM 0 HA SER A 54 -9.234 21.444 11.012 1.00 0.00 H new ATOM 0 HB2 SER A 54 -11.504 20.370 9.891 1.00 0.00 H new ATOM 0 HB3 SER A 54 -11.298 21.819 8.928 1.00 0.00 H new ATOM 0 HG SER A 54 -10.133 20.011 8.052 1.00 0.00 H new ATOM 876 N THR A 55 -8.979 23.709 9.901 1.00 0.00 N ATOM 877 CA THR A 55 -8.729 25.100 9.564 1.00 0.00 C ATOM 878 C THR A 55 -8.737 25.291 8.047 1.00 0.00 C ATOM 879 O THR A 55 -9.473 26.127 7.526 1.00 0.00 O ATOM 880 CB THR A 55 -7.411 25.515 10.222 1.00 0.00 C ATOM 881 OG1 THR A 55 -7.748 25.688 11.596 1.00 0.00 O ATOM 882 CG2 THR A 55 -6.946 26.903 9.775 1.00 0.00 C ATOM 0 H THR A 55 -8.233 23.065 9.638 1.00 0.00 H new ATOM 0 HA THR A 55 -9.518 25.748 9.945 1.00 0.00 H new ATOM 0 HB THR A 55 -6.641 24.780 9.987 1.00 0.00 H new ATOM 0 HG1 THR A 55 -6.950 25.956 12.097 1.00 0.00 H new ATOM 0 HG21 THR A 55 -6.007 27.149 10.271 1.00 0.00 H new ATOM 0 HG22 THR A 55 -6.798 26.907 8.695 1.00 0.00 H new ATOM 0 HG23 THR A 55 -7.701 27.643 10.040 1.00 0.00 H new ATOM 890 N LYS A 56 -7.909 24.501 7.378 1.00 0.00 N ATOM 891 CA LYS A 56 -7.811 24.573 5.930 1.00 0.00 C ATOM 892 C LYS A 56 -7.737 23.156 5.358 1.00 0.00 C ATOM 893 O LYS A 56 -8.625 22.735 4.618 1.00 0.00 O ATOM 894 CB LYS A 56 -6.640 25.466 5.516 1.00 0.00 C ATOM 895 CG LYS A 56 -7.008 26.327 4.306 1.00 0.00 C ATOM 896 CD LYS A 56 -5.906 27.344 4.001 1.00 0.00 C ATOM 897 CE LYS A 56 -5.583 27.369 2.506 1.00 0.00 C ATOM 898 NZ LYS A 56 -4.216 27.890 2.280 1.00 0.00 N ATOM 0 H LYS A 56 -7.300 23.808 7.813 1.00 0.00 H new ATOM 0 HA LYS A 56 -8.702 25.041 5.510 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -6.355 26.107 6.350 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -5.774 24.849 5.278 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -7.170 25.689 3.437 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -7.946 26.848 4.498 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -6.221 28.336 4.325 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -5.008 27.094 4.567 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -5.669 26.364 2.093 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -6.307 27.992 1.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -4.013 27.900 1.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -4.146 28.857 2.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -3.527 27.279 2.764 1.00 0.00 H new ATOM 912 N MET A 57 -6.670 22.460 5.721 1.00 0.00 N ATOM 913 CA MET A 57 -6.469 21.100 5.253 1.00 0.00 C ATOM 914 C MET A 57 -6.510 20.107 6.417 1.00 0.00 C ATOM 915 O MET A 57 -6.986 18.984 6.263 1.00 0.00 O ATOM 916 CB MET A 57 -5.117 20.999 4.543 1.00 0.00 C ATOM 917 CG MET A 57 -3.970 20.939 5.554 1.00 0.00 C ATOM 918 SD MET A 57 -2.410 21.176 4.720 1.00 0.00 S ATOM 919 CE MET A 57 -1.709 22.466 5.736 1.00 0.00 C ATOM 0 H MET A 57 -5.935 22.813 6.334 1.00 0.00 H new ATOM 0 HA MET A 57 -7.273 20.852 4.560 1.00 0.00 H new ATOM 0 HB2 MET A 57 -5.098 20.109 3.913 1.00 0.00 H new ATOM 0 HB3 MET A 57 -4.982 21.858 3.885 1.00 0.00 H new ATOM 0 HG2 MET A 57 -4.105 21.707 6.316 1.00 0.00 H new ATOM 0 HG3 MET A 57 -3.976 19.977 6.066 1.00 0.00 H new ATOM 0 HE1 MET A 57 -0.725 22.737 5.353 1.00 0.00 H new ATOM 0 HE2 MET A 57 -2.360 23.340 5.715 1.00 0.00 H new ATOM 0 HE3 MET A 57 -1.613 22.110 6.762 1.00 0.00 H new ATOM 929 N SER A 58 -6.004 20.559 7.556 1.00 0.00 N ATOM 930 CA SER A 58 -5.977 19.725 8.745 1.00 0.00 C ATOM 931 C SER A 58 -5.543 20.554 9.956 1.00 0.00 C ATOM 932 O SER A 58 -4.897 21.589 9.804 1.00 0.00 O ATOM 933 CB SER A 58 -5.041 18.529 8.558 1.00 0.00 C ATOM 934 OG SER A 58 -3.707 18.936 8.263 1.00 0.00 O ATOM 0 H SER A 58 -5.610 21.492 7.680 1.00 0.00 H new ATOM 0 HA SER A 58 -6.983 19.342 8.916 1.00 0.00 H new ATOM 0 HB2 SER A 58 -5.043 17.922 9.463 1.00 0.00 H new ATOM 0 HB3 SER A 58 -5.415 17.899 7.751 1.00 0.00 H new ATOM 0 HG SER A 58 -3.214 19.072 9.099 1.00 0.00 H new ATOM 940 N ILE A 59 -5.917 20.067 11.130 1.00 0.00 N ATOM 941 CA ILE A 59 -5.575 20.750 12.366 1.00 0.00 C ATOM 942 C ILE A 59 -4.663 19.852 13.204 1.00 0.00 C ATOM 943 O ILE A 59 -3.645 20.308 13.724 1.00 0.00 O ATOM 944 CB ILE A 59 -6.841 21.197 13.099 1.00 0.00 C ATOM 945 CG1 ILE A 59 -6.493 21.958 14.380 1.00 0.00 C ATOM 946 CG2 ILE A 59 -7.765 20.009 13.372 1.00 0.00 C ATOM 947 CD1 ILE A 59 -7.050 23.383 14.340 1.00 0.00 C ATOM 0 H ILE A 59 -6.453 19.208 11.251 1.00 0.00 H new ATOM 0 HA ILE A 59 -5.018 21.663 12.156 1.00 0.00 H new ATOM 0 HB ILE A 59 -7.385 21.886 12.452 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -6.898 21.429 15.243 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -5.411 21.990 14.506 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -8.657 20.355 13.894 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -8.053 19.547 12.427 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -7.244 19.277 13.989 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -6.789 23.902 15.262 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -6.624 23.916 13.490 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -8.135 23.347 14.239 1.00 0.00 H new ATOM 959 N HIS A 60 -5.060 18.593 13.310 1.00 0.00 N ATOM 960 CA HIS A 60 -4.292 17.627 14.076 1.00 0.00 C ATOM 961 C HIS A 60 -2.978 17.327 13.353 1.00 0.00 C ATOM 962 O HIS A 60 -1.901 17.463 13.931 1.00 0.00 O ATOM 963 CB HIS A 60 -5.118 16.369 14.350 1.00 0.00 C ATOM 964 CG HIS A 60 -5.316 16.072 15.818 1.00 0.00 C ATOM 965 ND1 HIS A 60 -4.262 15.857 16.688 1.00 0.00 N ATOM 966 CD2 HIS A 60 -6.456 15.958 16.558 1.00 0.00 C ATOM 967 CE1 HIS A 60 -4.756 15.623 17.895 1.00 0.00 C ATOM 968 NE2 HIS A 60 -6.116 15.686 17.812 1.00 0.00 N ATOM 0 H HIS A 60 -5.905 18.219 12.878 1.00 0.00 H new ATOM 0 HA HIS A 60 -4.043 18.047 15.051 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -6.094 16.477 13.877 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -4.629 15.516 13.880 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -7.464 16.070 16.187 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -4.183 15.418 18.787 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -6.765 15.547 18.586 1.00 0.00 H new ATOM 976 N LEU A 61 -3.109 16.924 12.097 1.00 0.00 N ATOM 977 CA LEU A 61 -1.945 16.603 11.288 1.00 0.00 C ATOM 978 C LEU A 61 -1.317 17.898 10.771 1.00 0.00 C ATOM 979 O LEU A 61 -2.007 18.745 10.205 1.00 0.00 O ATOM 980 CB LEU A 61 -2.318 15.615 10.181 1.00 0.00 C ATOM 981 CG LEU A 61 -2.999 14.323 10.636 1.00 0.00 C ATOM 982 CD1 LEU A 61 -3.583 13.562 9.445 1.00 0.00 C ATOM 983 CD2 LEU A 61 -2.040 13.457 11.455 1.00 0.00 C ATOM 0 H LEU A 61 -4.004 16.813 11.620 1.00 0.00 H new ATOM 0 HA LEU A 61 -1.189 16.100 11.890 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -2.978 16.121 9.477 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -1.412 15.352 9.636 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.831 14.587 11.288 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -4.061 12.648 9.796 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -4.320 14.186 8.940 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.784 13.309 8.748 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -2.549 12.545 11.766 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -1.173 13.199 10.847 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -1.714 14.009 12.336 1.00 0.00 H new ATOM 995 N ILE A 62 -0.014 18.012 10.983 1.00 0.00 N ATOM 996 CA ILE A 62 0.716 19.190 10.545 1.00 0.00 C ATOM 997 C ILE A 62 2.012 18.756 9.859 1.00 0.00 C ATOM 998 O ILE A 62 2.999 18.448 10.527 1.00 0.00 O ATOM 999 CB ILE A 62 0.931 20.153 11.715 1.00 0.00 C ATOM 1000 CG1 ILE A 62 -0.377 20.402 12.468 1.00 0.00 C ATOM 1001 CG2 ILE A 62 1.577 21.456 11.241 1.00 0.00 C ATOM 1002 CD1 ILE A 62 -1.309 21.309 11.662 1.00 0.00 C ATOM 0 H ILE A 62 0.555 17.308 11.452 1.00 0.00 H new ATOM 0 HA ILE A 62 0.136 19.745 9.808 1.00 0.00 H new ATOM 0 HB ILE A 62 1.623 19.688 12.417 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -0.872 19.452 12.668 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -0.163 20.860 13.434 1.00 0.00 H new ATOM 0 HG21 ILE A 62 1.719 22.122 12.092 1.00 0.00 H new ATOM 0 HG22 ILE A 62 2.543 21.238 10.786 1.00 0.00 H new ATOM 0 HG23 ILE A 62 0.930 21.937 10.507 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -2.232 21.470 12.220 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -0.820 22.267 11.484 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -1.540 20.837 10.707 1.00 0.00 H new ATOM 1014 N HIS A 63 1.969 18.744 8.535 1.00 0.00 N ATOM 1015 CA HIS A 63 3.128 18.353 7.752 1.00 0.00 C ATOM 1016 C HIS A 63 3.706 17.049 8.307 1.00 0.00 C ATOM 1017 O HIS A 63 4.904 16.960 8.570 1.00 0.00 O ATOM 1018 CB HIS A 63 4.157 19.484 7.702 1.00 0.00 C ATOM 1019 CG HIS A 63 4.824 19.648 6.357 1.00 0.00 C ATOM 1020 ND1 HIS A 63 5.687 18.704 5.827 1.00 0.00 N ATOM 1021 CD2 HIS A 63 4.746 20.655 5.440 1.00 0.00 C ATOM 1022 CE1 HIS A 63 6.103 19.134 4.645 1.00 0.00 C ATOM 1023 NE2 HIS A 63 5.519 20.344 4.407 1.00 0.00 N ATOM 0 H HIS A 63 1.149 18.999 7.985 1.00 0.00 H new ATOM 0 HA HIS A 63 2.829 18.167 6.721 1.00 0.00 H new ATOM 0 HB2 HIS A 63 3.666 20.420 7.969 1.00 0.00 H new ATOM 0 HB3 HIS A 63 4.922 19.299 8.456 1.00 0.00 H new ATOM 0 HD2 HIS A 63 4.155 21.554 5.538 1.00 0.00 H new ATOM 0 HE1 HIS A 63 6.785 18.617 3.986 1.00 0.00 H new ATOM 0 HE2 HIS A 63 5.654 20.915 3.573 1.00 0.00 H new ATOM 1031 N THR A 64 2.827 16.071 8.468 1.00 0.00 N ATOM 1032 CA THR A 64 3.235 14.777 8.986 1.00 0.00 C ATOM 1033 C THR A 64 3.773 13.895 7.858 1.00 0.00 C ATOM 1034 O THR A 64 3.310 13.983 6.721 1.00 0.00 O ATOM 1035 CB THR A 64 2.041 14.163 9.720 1.00 0.00 C ATOM 1036 OG1 THR A 64 2.488 12.860 10.082 1.00 0.00 O ATOM 1037 CG2 THR A 64 0.853 13.905 8.790 1.00 0.00 C ATOM 0 H THR A 64 1.834 16.149 8.249 1.00 0.00 H new ATOM 0 HA THR A 64 4.055 14.877 9.697 1.00 0.00 H new ATOM 0 HB THR A 64 1.732 14.825 10.529 1.00 0.00 H new ATOM 0 HG1 THR A 64 2.173 12.645 10.985 1.00 0.00 H new ATOM 0 HG21 THR A 64 0.033 13.469 9.360 1.00 0.00 H new ATOM 0 HG22 THR A 64 0.527 14.846 8.347 1.00 0.00 H new ATOM 0 HG23 THR A 64 1.152 13.216 8.000 1.00 0.00 H new ATOM 1045 N ARG A 65 4.744 13.064 8.209 1.00 0.00 N ATOM 1046 CA ARG A 65 5.349 12.168 7.240 1.00 0.00 C ATOM 1047 C ARG A 65 4.609 10.829 7.220 1.00 0.00 C ATOM 1048 O ARG A 65 4.423 10.234 6.160 1.00 0.00 O ATOM 1049 CB ARG A 65 6.824 11.922 7.564 1.00 0.00 C ATOM 1050 CG ARG A 65 6.975 11.094 8.841 1.00 0.00 C ATOM 1051 CD ARG A 65 8.393 11.207 9.404 1.00 0.00 C ATOM 1052 NE ARG A 65 8.375 10.993 10.869 1.00 0.00 N ATOM 1053 CZ ARG A 65 8.175 11.973 11.774 1.00 0.00 C ATOM 1054 NH1 ARG A 65 7.974 13.247 11.373 1.00 0.00 N ATOM 1055 NH2 ARG A 65 8.179 11.669 13.059 1.00 0.00 N ATOM 0 H ARG A 65 5.126 12.993 9.152 1.00 0.00 H new ATOM 0 HA ARG A 65 5.277 12.641 6.261 1.00 0.00 H new ATOM 0 HB2 ARG A 65 7.301 11.404 6.732 1.00 0.00 H new ATOM 0 HB3 ARG A 65 7.338 12.876 7.682 1.00 0.00 H new ATOM 0 HG2 ARG A 65 6.256 11.434 9.586 1.00 0.00 H new ATOM 0 HG3 ARG A 65 6.746 10.049 8.630 1.00 0.00 H new ATOM 0 HD2 ARG A 65 9.042 10.471 8.929 1.00 0.00 H new ATOM 0 HD3 ARG A 65 8.806 12.190 9.177 1.00 0.00 H new ATOM 0 HE ARG A 65 8.523 10.045 11.216 1.00 0.00 H new ATOM 0 HH11 ARG A 65 7.973 13.474 10.379 1.00 0.00 H new ATOM 0 HH12 ARG A 65 7.824 13.982 12.064 1.00 0.00 H new ATOM 0 HH21 ARG A 65 8.332 10.705 13.354 1.00 0.00 H new ATOM 0 HH22 ARG A 65 8.029 12.398 13.756 1.00 0.00 H new ATOM 1069 N VAL A 66 4.205 10.395 8.405 1.00 0.00 N ATOM 1070 CA VAL A 66 3.489 9.137 8.537 1.00 0.00 C ATOM 1071 C VAL A 66 2.298 9.131 7.577 1.00 0.00 C ATOM 1072 O VAL A 66 1.794 8.069 7.215 1.00 0.00 O ATOM 1073 CB VAL A 66 3.082 8.917 9.996 1.00 0.00 C ATOM 1074 CG1 VAL A 66 1.715 9.541 10.283 1.00 0.00 C ATOM 1075 CG2 VAL A 66 3.091 7.429 10.349 1.00 0.00 C ATOM 0 H VAL A 66 4.360 10.892 9.282 1.00 0.00 H new ATOM 0 HA VAL A 66 4.132 8.301 8.263 1.00 0.00 H new ATOM 0 HB VAL A 66 3.817 9.415 10.628 1.00 0.00 H new ATOM 0 HG11 VAL A 66 1.449 9.371 11.326 1.00 0.00 H new ATOM 0 HG12 VAL A 66 1.756 10.613 10.089 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.964 9.085 9.638 1.00 0.00 H new ATOM 0 HG21 VAL A 66 2.798 7.300 11.391 1.00 0.00 H new ATOM 0 HG22 VAL A 66 2.388 6.898 9.707 1.00 0.00 H new ATOM 0 HG23 VAL A 66 4.093 7.026 10.201 1.00 0.00 H new ATOM 1085 N ALA A 67 1.883 10.328 7.190 1.00 0.00 N ATOM 1086 CA ALA A 67 0.761 10.474 6.279 1.00 0.00 C ATOM 1087 C ALA A 67 1.197 10.063 4.871 1.00 0.00 C ATOM 1088 O ALA A 67 0.747 9.044 4.350 1.00 0.00 O ATOM 1089 CB ALA A 67 0.242 11.912 6.333 1.00 0.00 C ATOM 0 H ALA A 67 2.304 11.207 7.491 1.00 0.00 H new ATOM 0 HA ALA A 67 -0.060 9.821 6.574 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.600 12.021 5.649 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -0.082 12.144 7.347 1.00 0.00 H new ATOM 0 HB3 ALA A 67 1.038 12.597 6.041 1.00 0.00 H new ATOM 1095 N ALA A 68 2.068 10.879 4.294 1.00 0.00 N ATOM 1096 CA ALA A 68 2.569 10.614 2.957 1.00 0.00 C ATOM 1097 C ALA A 68 3.025 9.156 2.867 1.00 0.00 C ATOM 1098 O ALA A 68 2.871 8.516 1.828 1.00 0.00 O ATOM 1099 CB ALA A 68 3.694 11.597 2.629 1.00 0.00 C ATOM 0 H ALA A 68 2.439 11.724 4.729 1.00 0.00 H new ATOM 0 HA ALA A 68 1.782 10.760 2.217 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.070 11.398 1.625 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.312 12.617 2.678 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.503 11.478 3.350 1.00 0.00 H new ATOM 1105 N GLN A 69 3.576 8.673 3.971 1.00 0.00 N ATOM 1106 CA GLN A 69 4.055 7.302 4.030 1.00 0.00 C ATOM 1107 C GLN A 69 2.887 6.325 3.885 1.00 0.00 C ATOM 1108 O GLN A 69 2.830 5.558 2.925 1.00 0.00 O ATOM 1109 CB GLN A 69 4.825 7.046 5.327 1.00 0.00 C ATOM 1110 CG GLN A 69 5.944 6.026 5.108 1.00 0.00 C ATOM 1111 CD GLN A 69 7.183 6.692 4.504 1.00 0.00 C ATOM 1112 OE1 GLN A 69 7.104 7.488 3.582 1.00 0.00 O ATOM 1113 NE2 GLN A 69 8.327 6.324 5.073 1.00 0.00 N ATOM 0 H GLN A 69 3.701 9.206 4.831 1.00 0.00 H new ATOM 0 HA GLN A 69 4.743 7.142 3.200 1.00 0.00 H new ATOM 0 HB2 GLN A 69 5.247 7.981 5.694 1.00 0.00 H new ATOM 0 HB3 GLN A 69 4.141 6.682 6.094 1.00 0.00 H new ATOM 0 HG2 GLN A 69 6.205 5.558 6.057 1.00 0.00 H new ATOM 0 HG3 GLN A 69 5.594 5.233 4.447 1.00 0.00 H new ATOM 0 HE21 GLN A 69 8.322 5.653 5.841 1.00 0.00 H new ATOM 0 HE22 GLN A 69 9.210 6.713 4.741 1.00 0.00 H new ATOM 1122 N ALA A 70 1.983 6.385 4.852 1.00 0.00 N ATOM 1123 CA ALA A 70 0.819 5.514 4.843 1.00 0.00 C ATOM 1124 C ALA A 70 0.068 5.688 3.522 1.00 0.00 C ATOM 1125 O ALA A 70 -0.712 4.822 3.129 1.00 0.00 O ATOM 1126 CB ALA A 70 -0.058 5.823 6.058 1.00 0.00 C ATOM 0 H ALA A 70 2.033 7.023 5.647 1.00 0.00 H new ATOM 0 HA ALA A 70 1.120 4.469 4.915 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -0.931 5.170 6.052 1.00 0.00 H new ATOM 0 HB2 ALA A 70 0.513 5.656 6.971 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -0.382 6.863 6.018 1.00 0.00 H new ATOM 1132 N CYS A 71 0.329 6.813 2.873 1.00 0.00 N ATOM 1133 CA CYS A 71 -0.314 7.112 1.604 1.00 0.00 C ATOM 1134 C CYS A 71 0.274 6.184 0.539 1.00 0.00 C ATOM 1135 O CYS A 71 -0.411 5.289 0.044 1.00 0.00 O ATOM 1136 CB CYS A 71 -0.159 8.586 1.225 1.00 0.00 C ATOM 1137 SG CYS A 71 -1.683 9.184 0.407 1.00 0.00 S ATOM 0 H CYS A 71 0.977 7.529 3.202 1.00 0.00 H new ATOM 0 HA CYS A 71 -1.387 6.937 1.686 1.00 0.00 H new ATOM 0 HB2 CYS A 71 0.043 9.180 2.116 1.00 0.00 H new ATOM 0 HB3 CYS A 71 0.695 8.711 0.559 1.00 0.00 H new ATOM 0 HG CYS A 71 -1.543 10.437 0.091 1.00 0.00 H new ATOM 1143 N ALA A 72 1.535 6.428 0.217 1.00 0.00 N ATOM 1144 CA ALA A 72 2.222 5.626 -0.781 1.00 0.00 C ATOM 1145 C ALA A 72 2.157 4.151 -0.376 1.00 0.00 C ATOM 1146 O ALA A 72 1.657 3.319 -1.130 1.00 0.00 O ATOM 1147 CB ALA A 72 3.660 6.125 -0.936 1.00 0.00 C ATOM 0 H ALA A 72 2.100 7.170 0.630 1.00 0.00 H new ATOM 0 HA ALA A 72 1.737 5.723 -1.752 1.00 0.00 H new ATOM 0 HB1 ALA A 72 4.175 5.523 -1.685 1.00 0.00 H new ATOM 0 HB2 ALA A 72 3.651 7.168 -1.252 1.00 0.00 H new ATOM 0 HB3 ALA A 72 4.180 6.040 0.018 1.00 0.00 H new ATOM 1153 N VAL A 73 2.671 3.874 0.813 1.00 0.00 N ATOM 1154 CA VAL A 73 2.677 2.515 1.327 1.00 0.00 C ATOM 1155 C VAL A 73 1.261 1.940 1.254 1.00 0.00 C ATOM 1156 O VAL A 73 1.044 0.893 0.646 1.00 0.00 O ATOM 1157 CB VAL A 73 3.259 2.494 2.742 1.00 0.00 C ATOM 1158 CG1 VAL A 73 2.881 1.203 3.471 1.00 0.00 C ATOM 1159 CG2 VAL A 73 4.777 2.682 2.714 1.00 0.00 C ATOM 0 H VAL A 73 3.086 4.567 1.435 1.00 0.00 H new ATOM 0 HA VAL A 73 3.318 1.878 0.717 1.00 0.00 H new ATOM 0 HB VAL A 73 2.828 3.330 3.293 1.00 0.00 H new ATOM 0 HG11 VAL A 73 3.307 1.214 4.474 1.00 0.00 H new ATOM 0 HG12 VAL A 73 1.796 1.128 3.538 1.00 0.00 H new ATOM 0 HG13 VAL A 73 3.271 0.347 2.920 1.00 0.00 H new ATOM 0 HG21 VAL A 73 5.165 2.663 3.733 1.00 0.00 H new ATOM 0 HG22 VAL A 73 5.233 1.877 2.137 1.00 0.00 H new ATOM 0 HG23 VAL A 73 5.017 3.640 2.252 1.00 0.00 H new ATOM 1169 N GLY A 74 0.336 2.650 1.883 1.00 0.00 N ATOM 1170 CA GLY A 74 -1.053 2.223 1.897 1.00 0.00 C ATOM 1171 C GLY A 74 -1.571 1.995 0.475 1.00 0.00 C ATOM 1172 O GLY A 74 -2.495 1.210 0.266 1.00 0.00 O ATOM 0 H GLY A 74 0.521 3.518 2.386 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -1.149 1.304 2.475 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -1.664 2.977 2.394 1.00 0.00 H new ATOM 1176 N ALA A 75 -0.953 2.695 -0.465 1.00 0.00 N ATOM 1177 CA ALA A 75 -1.340 2.578 -1.861 1.00 0.00 C ATOM 1178 C ALA A 75 -0.904 1.212 -2.394 1.00 0.00 C ATOM 1179 O ALA A 75 -1.733 0.426 -2.849 1.00 0.00 O ATOM 1180 CB ALA A 75 -0.734 3.735 -2.657 1.00 0.00 C ATOM 0 H ALA A 75 -0.187 3.345 -0.288 1.00 0.00 H new ATOM 0 HA ALA A 75 -2.423 2.642 -1.966 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -1.024 3.648 -3.704 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -1.098 4.682 -2.257 1.00 0.00 H new ATOM 0 HB3 ALA A 75 0.353 3.702 -2.578 1.00 0.00 H new ATOM 1186 N ILE A 76 0.397 0.972 -2.321 1.00 0.00 N ATOM 1187 CA ILE A 76 0.953 -0.286 -2.791 1.00 0.00 C ATOM 1188 C ILE A 76 0.312 -1.442 -2.020 1.00 0.00 C ATOM 1189 O ILE A 76 0.188 -2.548 -2.544 1.00 0.00 O ATOM 1190 CB ILE A 76 2.480 -0.262 -2.704 1.00 0.00 C ATOM 1191 CG1 ILE A 76 2.944 0.042 -1.278 1.00 0.00 C ATOM 1192 CG2 ILE A 76 3.072 0.717 -3.720 1.00 0.00 C ATOM 1193 CD1 ILE A 76 4.436 -0.253 -1.112 1.00 0.00 C ATOM 0 H ILE A 76 1.082 1.627 -1.944 1.00 0.00 H new ATOM 0 HA ILE A 76 0.718 -0.436 -3.845 1.00 0.00 H new ATOM 0 HB ILE A 76 2.852 -1.255 -2.959 1.00 0.00 H new ATOM 0 HG12 ILE A 76 2.748 1.088 -1.043 1.00 0.00 H new ATOM 0 HG13 ILE A 76 2.370 -0.556 -0.570 1.00 0.00 H new ATOM 0 HG21 ILE A 76 4.159 0.715 -3.637 1.00 0.00 H new ATOM 0 HG22 ILE A 76 2.784 0.415 -4.727 1.00 0.00 H new ATOM 0 HG23 ILE A 76 2.695 1.720 -3.521 1.00 0.00 H new ATOM 0 HD11 ILE A 76 4.740 -0.028 -0.090 1.00 0.00 H new ATOM 0 HD12 ILE A 76 4.625 -1.306 -1.324 1.00 0.00 H new ATOM 0 HD13 ILE A 76 5.008 0.364 -1.804 1.00 0.00 H new ATOM 1205 N MET A 77 -0.079 -1.146 -0.789 1.00 0.00 N ATOM 1206 CA MET A 77 -0.704 -2.146 0.058 1.00 0.00 C ATOM 1207 C MET A 77 -2.129 -2.449 -0.411 1.00 0.00 C ATOM 1208 O MET A 77 -2.513 -3.612 -0.529 1.00 0.00 O ATOM 1209 CB MET A 77 -0.738 -1.643 1.503 1.00 0.00 C ATOM 1210 CG MET A 77 -0.345 -2.753 2.480 1.00 0.00 C ATOM 1211 SD MET A 77 -1.133 -2.485 4.058 1.00 0.00 S ATOM 1212 CE MET A 77 0.255 -1.869 4.997 1.00 0.00 C ATOM 0 H MET A 77 0.025 -0.227 -0.358 1.00 0.00 H new ATOM 0 HA MET A 77 -0.119 -3.063 -0.003 1.00 0.00 H new ATOM 0 HB2 MET A 77 -0.058 -0.799 1.614 1.00 0.00 H new ATOM 0 HB3 MET A 77 -1.738 -1.280 1.742 1.00 0.00 H new ATOM 0 HG2 MET A 77 -0.638 -3.723 2.078 1.00 0.00 H new ATOM 0 HG3 MET A 77 0.738 -2.773 2.604 1.00 0.00 H new ATOM 0 HE1 MET A 77 -0.064 -1.649 6.016 1.00 0.00 H new ATOM 0 HE2 MET A 77 1.043 -2.622 5.018 1.00 0.00 H new ATOM 0 HE3 MET A 77 0.634 -0.959 4.531 1.00 0.00 H new ATOM 1222 N LEU A 78 -2.873 -1.383 -0.665 1.00 0.00 N ATOM 1223 CA LEU A 78 -4.247 -1.520 -1.118 1.00 0.00 C ATOM 1224 C LEU A 78 -4.263 -2.217 -2.480 1.00 0.00 C ATOM 1225 O LEU A 78 -5.096 -3.087 -2.727 1.00 0.00 O ATOM 1226 CB LEU A 78 -4.951 -0.162 -1.114 1.00 0.00 C ATOM 1227 CG LEU A 78 -6.462 -0.190 -0.877 1.00 0.00 C ATOM 1228 CD1 LEU A 78 -6.874 0.860 0.156 1.00 0.00 C ATOM 1229 CD2 LEU A 78 -7.227 -0.031 -2.193 1.00 0.00 C ATOM 0 H LEU A 78 -2.551 -0.420 -0.566 1.00 0.00 H new ATOM 0 HA LEU A 78 -4.814 -2.148 -0.431 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -4.494 0.459 -0.344 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -4.762 0.325 -2.070 1.00 0.00 H new ATOM 0 HG LEU A 78 -6.726 -1.165 -0.468 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -7.953 0.819 0.306 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -6.368 0.659 1.101 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -6.595 1.851 -0.201 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -8.299 -0.054 -1.996 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -6.964 0.921 -2.654 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -6.964 -0.846 -2.867 1.00 0.00 H new ATOM 1241 N GLY A 79 -3.331 -1.808 -3.329 1.00 0.00 N ATOM 1242 CA GLY A 79 -3.228 -2.382 -4.660 1.00 0.00 C ATOM 1243 C GLY A 79 -2.956 -3.886 -4.589 1.00 0.00 C ATOM 1244 O GLY A 79 -3.726 -4.685 -5.120 1.00 0.00 O ATOM 0 H GLY A 79 -2.641 -1.086 -3.121 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.151 -2.201 -5.210 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -2.427 -1.890 -5.211 1.00 0.00 H new ATOM 1248 N ALA A 80 -1.859 -4.226 -3.929 1.00 0.00 N ATOM 1249 CA ALA A 80 -1.476 -5.620 -3.781 1.00 0.00 C ATOM 1250 C ALA A 80 -2.609 -6.385 -3.093 1.00 0.00 C ATOM 1251 O ALA A 80 -2.893 -7.529 -3.445 1.00 0.00 O ATOM 1252 CB ALA A 80 -0.159 -5.709 -3.008 1.00 0.00 C ATOM 0 H ALA A 80 -1.223 -3.560 -3.490 1.00 0.00 H new ATOM 0 HA ALA A 80 -1.313 -6.079 -4.756 1.00 0.00 H new ATOM 0 HB1 ALA A 80 0.128 -6.755 -2.897 1.00 0.00 H new ATOM 0 HB2 ALA A 80 0.619 -5.175 -3.553 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -0.285 -5.261 -2.022 1.00 0.00 H new ATOM 1258 N VAL A 81 -3.225 -5.723 -2.125 1.00 0.00 N ATOM 1259 CA VAL A 81 -4.319 -6.327 -1.384 1.00 0.00 C ATOM 1260 C VAL A 81 -5.434 -6.716 -2.358 1.00 0.00 C ATOM 1261 O VAL A 81 -5.706 -7.899 -2.554 1.00 0.00 O ATOM 1262 CB VAL A 81 -4.792 -5.376 -0.282 1.00 0.00 C ATOM 1263 CG1 VAL A 81 -6.241 -5.673 0.112 1.00 0.00 C ATOM 1264 CG2 VAL A 81 -3.867 -5.444 0.934 1.00 0.00 C ATOM 0 H VAL A 81 -2.987 -4.774 -1.837 1.00 0.00 H new ATOM 0 HA VAL A 81 -3.988 -7.239 -0.887 1.00 0.00 H new ATOM 0 HB VAL A 81 -4.753 -4.360 -0.675 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -6.553 -4.984 0.897 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -6.887 -5.550 -0.757 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -6.316 -6.697 0.478 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -4.225 -4.759 1.702 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -3.859 -6.460 1.329 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -2.856 -5.162 0.639 1.00 0.00 H new ATOM 1274 N TYR A 82 -6.049 -5.697 -2.941 1.00 0.00 N ATOM 1275 CA TYR A 82 -7.128 -5.918 -3.888 1.00 0.00 C ATOM 1276 C TYR A 82 -6.706 -6.903 -4.980 1.00 0.00 C ATOM 1277 O TYR A 82 -7.510 -7.718 -5.430 1.00 0.00 O ATOM 1278 CB TYR A 82 -7.412 -4.557 -4.528 1.00 0.00 C ATOM 1279 CG TYR A 82 -8.847 -4.395 -5.035 1.00 0.00 C ATOM 1280 CD1 TYR A 82 -9.363 -5.296 -5.944 1.00 0.00 C ATOM 1281 CD2 TYR A 82 -9.624 -3.348 -4.584 1.00 0.00 C ATOM 1282 CE1 TYR A 82 -10.713 -5.144 -6.421 1.00 0.00 C ATOM 1283 CE2 TYR A 82 -10.974 -3.196 -5.061 1.00 0.00 C ATOM 1284 CZ TYR A 82 -11.452 -4.101 -5.956 1.00 0.00 C ATOM 1285 OH TYR A 82 -12.727 -3.957 -6.407 1.00 0.00 O ATOM 0 H TYR A 82 -5.820 -4.717 -2.776 1.00 0.00 H new ATOM 0 HA TYR A 82 -8.001 -6.335 -3.385 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -7.205 -3.774 -3.799 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -6.724 -4.408 -5.360 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -8.754 -6.115 -6.298 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -9.220 -2.642 -3.873 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -11.129 -5.842 -7.132 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -11.593 -2.381 -4.716 1.00 0.00 H new ATOM 0 HH TYR A 82 -13.135 -3.170 -5.989 1.00 0.00 H new ATOM 1295 N THR A 83 -5.446 -6.796 -5.375 1.00 0.00 N ATOM 1296 CA THR A 83 -4.907 -7.667 -6.405 1.00 0.00 C ATOM 1297 C THR A 83 -5.113 -9.134 -6.024 1.00 0.00 C ATOM 1298 O THR A 83 -5.743 -9.889 -6.763 1.00 0.00 O ATOM 1299 CB THR A 83 -3.439 -7.295 -6.619 1.00 0.00 C ATOM 1300 OG1 THR A 83 -3.493 -6.074 -7.351 1.00 0.00 O ATOM 1301 CG2 THR A 83 -2.721 -8.263 -7.562 1.00 0.00 C ATOM 0 H THR A 83 -4.782 -6.118 -5.000 1.00 0.00 H new ATOM 0 HA THR A 83 -5.432 -7.533 -7.351 1.00 0.00 H new ATOM 0 HB THR A 83 -2.926 -7.277 -5.658 1.00 0.00 H new ATOM 0 HG1 THR A 83 -3.699 -5.336 -6.741 1.00 0.00 H new ATOM 0 HG21 THR A 83 -1.683 -7.953 -7.680 1.00 0.00 H new ATOM 0 HG22 THR A 83 -2.755 -9.269 -7.145 1.00 0.00 H new ATOM 0 HG23 THR A 83 -3.214 -8.257 -8.534 1.00 0.00 H new ATOM 1309 N MET A 84 -4.569 -9.495 -4.870 1.00 0.00 N ATOM 1310 CA MET A 84 -4.686 -10.858 -4.382 1.00 0.00 C ATOM 1311 C MET A 84 -6.132 -11.184 -4.005 1.00 0.00 C ATOM 1312 O MET A 84 -6.773 -12.015 -4.646 1.00 0.00 O ATOM 1313 CB MET A 84 -3.785 -11.041 -3.158 1.00 0.00 C ATOM 1314 CG MET A 84 -2.337 -11.305 -3.578 1.00 0.00 C ATOM 1315 SD MET A 84 -1.233 -10.246 -2.659 1.00 0.00 S ATOM 1316 CE MET A 84 -0.316 -9.513 -4.004 1.00 0.00 C ATOM 0 H MET A 84 -4.046 -8.867 -4.260 1.00 0.00 H new ATOM 0 HA MET A 84 -4.377 -11.536 -5.177 1.00 0.00 H new ATOM 0 HB2 MET A 84 -3.829 -10.149 -2.533 1.00 0.00 H new ATOM 0 HB3 MET A 84 -4.150 -11.872 -2.554 1.00 0.00 H new ATOM 0 HG2 MET A 84 -2.083 -12.350 -3.401 1.00 0.00 H new ATOM 0 HG3 MET A 84 -2.221 -11.125 -4.647 1.00 0.00 H new ATOM 0 HE1 MET A 84 0.524 -8.945 -3.605 1.00 0.00 H new ATOM 0 HE2 MET A 84 0.057 -10.299 -4.661 1.00 0.00 H new ATOM 0 HE3 MET A 84 -0.968 -8.847 -4.569 1.00 0.00 H new ATOM 1326 N TYR A 85 -6.604 -10.513 -2.965 1.00 0.00 N ATOM 1327 CA TYR A 85 -7.963 -10.720 -2.494 1.00 0.00 C ATOM 1328 C TYR A 85 -8.924 -10.930 -3.667 1.00 0.00 C ATOM 1329 O TYR A 85 -9.682 -11.898 -3.688 1.00 0.00 O ATOM 1330 CB TYR A 85 -8.354 -9.440 -1.754 1.00 0.00 C ATOM 1331 CG TYR A 85 -9.558 -9.601 -0.824 1.00 0.00 C ATOM 1332 CD1 TYR A 85 -9.472 -10.425 0.280 1.00 0.00 C ATOM 1333 CD2 TYR A 85 -10.730 -8.923 -1.089 1.00 0.00 C ATOM 1334 CE1 TYR A 85 -10.605 -10.577 1.155 1.00 0.00 C ATOM 1335 CE2 TYR A 85 -11.864 -9.075 -0.214 1.00 0.00 C ATOM 1336 CZ TYR A 85 -11.745 -9.894 0.865 1.00 0.00 C ATOM 1337 OH TYR A 85 -12.816 -10.038 1.692 1.00 0.00 O ATOM 0 H TYR A 85 -6.069 -9.825 -2.435 1.00 0.00 H new ATOM 0 HA TYR A 85 -8.017 -11.603 -1.858 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -7.501 -9.095 -1.170 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -8.575 -8.663 -2.486 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -8.555 -10.956 0.487 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -10.797 -8.278 -1.953 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -10.551 -11.219 2.022 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -12.787 -8.551 -0.410 1.00 0.00 H new ATOM 0 HH TYR A 85 -13.559 -9.491 1.363 1.00 0.00 H new ATOM 1347 N SER A 86 -8.859 -10.007 -4.615 1.00 0.00 N ATOM 1348 CA SER A 86 -9.714 -10.078 -5.788 1.00 0.00 C ATOM 1349 C SER A 86 -9.311 -11.272 -6.657 1.00 0.00 C ATOM 1350 O SER A 86 -10.164 -12.049 -7.083 1.00 0.00 O ATOM 1351 CB SER A 86 -9.643 -8.783 -6.600 1.00 0.00 C ATOM 1352 OG SER A 86 -10.683 -8.705 -7.572 1.00 0.00 O ATOM 0 H SER A 86 -8.228 -9.206 -4.595 1.00 0.00 H new ATOM 0 HA SER A 86 -10.743 -10.210 -5.454 1.00 0.00 H new ATOM 0 HB2 SER A 86 -9.711 -7.929 -5.927 1.00 0.00 H new ATOM 0 HB3 SER A 86 -8.676 -8.720 -7.098 1.00 0.00 H new ATOM 0 HG SER A 86 -10.604 -7.864 -8.068 1.00 0.00 H new ATOM 1358 N ASP A 87 -8.012 -11.380 -6.893 1.00 0.00 N ATOM 1359 CA ASP A 87 -7.486 -12.466 -7.703 1.00 0.00 C ATOM 1360 C ASP A 87 -8.226 -13.759 -7.356 1.00 0.00 C ATOM 1361 O ASP A 87 -8.608 -14.518 -8.245 1.00 0.00 O ATOM 1362 CB ASP A 87 -5.997 -12.685 -7.430 1.00 0.00 C ATOM 1363 CG ASP A 87 -5.069 -12.348 -8.600 1.00 0.00 C ATOM 1364 OD1 ASP A 87 -5.303 -11.384 -9.343 1.00 0.00 O ATOM 1365 OD2 ASP A 87 -4.056 -13.134 -8.735 1.00 0.00 O ATOM 0 H ASP A 87 -7.308 -10.733 -6.538 1.00 0.00 H new ATOM 0 HA ASP A 87 -7.625 -12.203 -8.752 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.708 -12.080 -6.570 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -5.843 -13.728 -7.152 1.00 0.00 H new ATOM 1370 N TYR A 88 -8.405 -13.971 -6.060 1.00 0.00 N ATOM 1371 CA TYR A 88 -9.092 -15.160 -5.584 1.00 0.00 C ATOM 1372 C TYR A 88 -10.257 -15.526 -6.506 1.00 0.00 C ATOM 1373 O TYR A 88 -10.331 -16.649 -7.003 1.00 0.00 O ATOM 1374 CB TYR A 88 -9.643 -14.804 -4.202 1.00 0.00 C ATOM 1375 CG TYR A 88 -10.369 -15.957 -3.506 1.00 0.00 C ATOM 1376 CD1 TYR A 88 -9.659 -16.852 -2.731 1.00 0.00 C ATOM 1377 CD2 TYR A 88 -11.733 -16.101 -3.653 1.00 0.00 C ATOM 1378 CE1 TYR A 88 -10.343 -17.937 -2.076 1.00 0.00 C ATOM 1379 CE2 TYR A 88 -12.417 -17.186 -2.998 1.00 0.00 C ATOM 1380 CZ TYR A 88 -11.688 -18.050 -2.241 1.00 0.00 C ATOM 1381 OH TYR A 88 -12.334 -19.075 -1.623 1.00 0.00 O ATOM 0 H TYR A 88 -8.086 -13.340 -5.325 1.00 0.00 H new ATOM 0 HA TYR A 88 -8.412 -16.011 -5.556 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -8.821 -14.471 -3.569 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -10.329 -13.963 -4.301 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -8.591 -16.739 -2.616 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -12.288 -15.400 -4.259 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -9.800 -18.645 -1.467 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -13.484 -17.311 -3.105 1.00 0.00 H new ATOM 0 HH TYR A 88 -13.291 -19.030 -1.829 1.00 0.00 H new ATOM 1391 N VAL A 89 -11.138 -14.557 -6.707 1.00 0.00 N ATOM 1392 CA VAL A 89 -12.296 -14.763 -7.560 1.00 0.00 C ATOM 1393 C VAL A 89 -11.876 -14.622 -9.024 1.00 0.00 C ATOM 1394 O VAL A 89 -11.071 -13.756 -9.362 1.00 0.00 O ATOM 1395 CB VAL A 89 -13.416 -13.799 -7.163 1.00 0.00 C ATOM 1396 CG1 VAL A 89 -13.071 -12.363 -7.563 1.00 0.00 C ATOM 1397 CG2 VAL A 89 -14.752 -14.232 -7.771 1.00 0.00 C ATOM 0 H VAL A 89 -11.073 -13.627 -6.294 1.00 0.00 H new ATOM 0 HA VAL A 89 -12.692 -15.770 -7.431 1.00 0.00 H new ATOM 0 HB VAL A 89 -13.516 -13.829 -6.078 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -13.884 -11.698 -7.269 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -12.153 -12.057 -7.062 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -12.931 -12.310 -8.643 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -15.531 -13.530 -7.474 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -14.670 -14.244 -8.858 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -15.007 -15.230 -7.415 1.00 0.00 H new ATOM 1407 N LYS A 90 -12.441 -15.486 -9.854 1.00 0.00 N ATOM 1408 CA LYS A 90 -12.136 -15.469 -11.275 1.00 0.00 C ATOM 1409 C LYS A 90 -13.441 -15.438 -12.072 1.00 0.00 C ATOM 1410 O LYS A 90 -13.857 -14.383 -12.550 1.00 0.00 O ATOM 1411 CB LYS A 90 -11.220 -16.639 -11.640 1.00 0.00 C ATOM 1412 CG LYS A 90 -9.841 -16.139 -12.075 1.00 0.00 C ATOM 1413 CD LYS A 90 -8.874 -17.308 -12.280 1.00 0.00 C ATOM 1414 CE LYS A 90 -7.574 -17.085 -11.505 1.00 0.00 C ATOM 1415 NZ LYS A 90 -6.668 -18.244 -11.670 1.00 0.00 N ATOM 0 H LYS A 90 -13.109 -16.203 -9.570 1.00 0.00 H new ATOM 0 HA LYS A 90 -11.582 -14.567 -11.535 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -11.116 -17.305 -10.784 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -11.670 -17.221 -12.444 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -9.932 -15.570 -13.001 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -9.442 -15.460 -11.322 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -9.343 -18.235 -11.951 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -8.654 -17.421 -13.342 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -7.083 -16.179 -11.859 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -7.795 -16.936 -10.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -5.790 -18.077 -11.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -7.133 -19.102 -11.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -6.443 -18.368 -12.678 1.00 0.00 H new ATOM 1429 N ARG A 91 -14.053 -16.607 -12.192 1.00 0.00 N ATOM 1430 CA ARG A 91 -15.302 -16.727 -12.923 1.00 0.00 C ATOM 1431 C ARG A 91 -16.103 -17.926 -12.412 1.00 0.00 C ATOM 1432 O ARG A 91 -16.756 -18.619 -13.191 1.00 0.00 O ATOM 1433 CB ARG A 91 -15.049 -16.894 -14.423 1.00 0.00 C ATOM 1434 CG ARG A 91 -14.008 -17.984 -14.686 1.00 0.00 C ATOM 1435 CD ARG A 91 -13.084 -17.593 -15.841 1.00 0.00 C ATOM 1436 NE ARG A 91 -12.250 -18.750 -16.236 1.00 0.00 N ATOM 1437 CZ ARG A 91 -12.686 -19.769 -17.006 1.00 0.00 C ATOM 1438 NH1 ARG A 91 -13.953 -19.784 -17.471 1.00 0.00 N ATOM 1439 NH2 ARG A 91 -11.854 -20.752 -17.297 1.00 0.00 N ATOM 0 H ARG A 91 -13.706 -17.480 -11.795 1.00 0.00 H new ATOM 0 HA ARG A 91 -15.870 -15.811 -12.762 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -15.982 -17.148 -14.927 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -14.706 -15.949 -14.845 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -13.418 -18.153 -13.785 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -14.510 -18.923 -14.919 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -13.675 -17.253 -16.691 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -12.447 -16.760 -15.542 1.00 0.00 H new ATOM 0 HE ARG A 91 -11.285 -18.779 -15.906 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -14.590 -19.021 -17.241 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -14.274 -20.558 -18.052 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -10.898 -20.733 -16.941 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -12.167 -21.530 -17.878 1.00 0.00 H new ATOM 1453 N MET A 92 -16.028 -18.135 -11.106 1.00 0.00 N ATOM 1454 CA MET A 92 -16.738 -19.238 -10.481 1.00 0.00 C ATOM 1455 C MET A 92 -17.049 -18.930 -9.015 1.00 0.00 C ATOM 1456 O MET A 92 -16.478 -18.007 -8.436 1.00 0.00 O ATOM 1457 CB MET A 92 -15.887 -20.507 -10.567 1.00 0.00 C ATOM 1458 CG MET A 92 -16.666 -21.646 -11.228 1.00 0.00 C ATOM 1459 SD MET A 92 -16.787 -23.032 -10.109 1.00 0.00 S ATOM 1460 CE MET A 92 -15.615 -24.144 -10.867 1.00 0.00 C ATOM 0 H MET A 92 -15.486 -17.558 -10.463 1.00 0.00 H new ATOM 0 HA MET A 92 -17.680 -19.385 -11.009 1.00 0.00 H new ATOM 0 HB2 MET A 92 -14.980 -20.303 -11.137 1.00 0.00 H new ATOM 0 HB3 MET A 92 -15.574 -20.808 -9.567 1.00 0.00 H new ATOM 0 HG2 MET A 92 -17.663 -21.303 -11.505 1.00 0.00 H new ATOM 0 HG3 MET A 92 -16.168 -21.953 -12.148 1.00 0.00 H new ATOM 0 HE1 MET A 92 -15.565 -25.068 -10.291 1.00 0.00 H new ATOM 0 HE2 MET A 92 -15.932 -24.368 -11.886 1.00 0.00 H new ATOM 0 HE3 MET A 92 -14.631 -23.676 -10.888 1.00 0.00 H new ATOM 1470 N ALA A 93 -17.954 -19.721 -8.457 1.00 0.00 N ATOM 1471 CA ALA A 93 -18.348 -19.544 -7.070 1.00 0.00 C ATOM 1472 C ALA A 93 -19.350 -18.392 -6.972 1.00 0.00 C ATOM 1473 O ALA A 93 -19.091 -17.394 -6.301 1.00 0.00 O ATOM 1474 CB ALA A 93 -17.104 -19.309 -6.211 1.00 0.00 C ATOM 0 H ALA A 93 -18.425 -20.486 -8.940 1.00 0.00 H new ATOM 0 HA ALA A 93 -18.839 -20.441 -6.693 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -17.400 -19.176 -5.170 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -16.438 -20.168 -6.292 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -16.586 -18.415 -6.558 1.00 0.00 H new ATOM 1480 N GLN A 94 -20.475 -18.569 -7.650 1.00 0.00 N ATOM 1481 CA GLN A 94 -21.517 -17.556 -7.648 1.00 0.00 C ATOM 1482 C GLN A 94 -20.970 -16.230 -8.181 1.00 0.00 C ATOM 1483 O GLN A 94 -20.812 -15.272 -7.426 1.00 0.00 O ATOM 1484 CB GLN A 94 -22.109 -17.382 -6.248 1.00 0.00 C ATOM 1485 CG GLN A 94 -23.608 -17.083 -6.319 1.00 0.00 C ATOM 1486 CD GLN A 94 -24.320 -17.545 -5.047 1.00 0.00 C ATOM 1487 OE1 GLN A 94 -24.120 -17.017 -3.965 1.00 0.00 O ATOM 1488 NE2 GLN A 94 -25.162 -18.557 -5.235 1.00 0.00 N ATOM 0 H GLN A 94 -20.687 -19.399 -8.204 1.00 0.00 H new ATOM 0 HA GLN A 94 -22.319 -17.886 -8.308 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -21.943 -18.287 -5.664 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -21.597 -16.570 -5.731 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -23.763 -16.013 -6.458 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -24.042 -17.583 -7.185 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -25.283 -18.953 -6.167 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -25.687 -18.937 -4.447 1.00 0.00 H new ATOM 1497 N ASP A 95 -20.697 -16.218 -9.477 1.00 0.00 N ATOM 1498 CA ASP A 95 -20.171 -15.025 -10.119 1.00 0.00 C ATOM 1499 C ASP A 95 -20.744 -14.919 -11.534 1.00 0.00 C ATOM 1500 O ASP A 95 -21.336 -13.903 -11.893 1.00 0.00 O ATOM 1501 CB ASP A 95 -18.646 -15.086 -10.230 1.00 0.00 C ATOM 1502 CG ASP A 95 -17.929 -13.752 -10.015 1.00 0.00 C ATOM 1503 OD1 ASP A 95 -18.369 -12.911 -9.216 1.00 0.00 O ATOM 1504 OD2 ASP A 95 -16.860 -13.588 -10.718 1.00 0.00 O ATOM 0 H ASP A 95 -20.830 -17.015 -10.100 1.00 0.00 H new ATOM 0 HA ASP A 95 -20.454 -14.163 -9.514 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -18.272 -15.804 -9.500 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -18.383 -15.468 -11.217 1.00 0.00 H new ATOM 1509 N ALA A 96 -20.547 -15.983 -12.299 1.00 0.00 N ATOM 1510 CA ALA A 96 -21.036 -16.022 -13.667 1.00 0.00 C ATOM 1511 C ALA A 96 -22.457 -15.456 -13.712 1.00 0.00 C ATOM 1512 O ALA A 96 -23.405 -16.113 -13.285 1.00 0.00 O ATOM 1513 CB ALA A 96 -20.963 -17.456 -14.195 1.00 0.00 C ATOM 0 H ALA A 96 -20.056 -16.824 -11.998 1.00 0.00 H new ATOM 0 HA ALA A 96 -20.414 -15.404 -14.315 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -21.330 -17.485 -15.221 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -19.929 -17.801 -14.169 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -21.578 -18.105 -13.571 1.00 0.00 H new ATOM 1519 N GLY A 97 -22.560 -14.242 -14.232 1.00 0.00 N ATOM 1520 CA GLY A 97 -23.849 -13.579 -14.338 1.00 0.00 C ATOM 1521 C GLY A 97 -24.536 -13.926 -15.661 1.00 0.00 C ATOM 1522 O GLY A 97 -24.234 -14.950 -16.272 1.00 0.00 O ATOM 0 H GLY A 97 -21.771 -13.700 -14.585 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -24.485 -13.877 -13.505 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -23.714 -12.500 -14.266 1.00 0.00 H new ATOM 1526 N GLU A 98 -25.447 -13.052 -16.064 1.00 0.00 N ATOM 1527 CA GLU A 98 -26.179 -13.253 -17.303 1.00 0.00 C ATOM 1528 C GLU A 98 -25.208 -13.414 -18.474 1.00 0.00 C ATOM 1529 O GLU A 98 -24.228 -12.677 -18.578 1.00 0.00 O ATOM 1530 CB GLU A 98 -27.156 -12.102 -17.555 1.00 0.00 C ATOM 1531 CG GLU A 98 -28.605 -12.568 -17.399 1.00 0.00 C ATOM 1532 CD GLU A 98 -29.580 -11.409 -17.612 1.00 0.00 C ATOM 1533 OE1 GLU A 98 -29.426 -10.412 -16.809 1.00 0.00 O ATOM 1534 OE2 GLU A 98 -30.436 -11.476 -18.507 1.00 0.00 O ATOM 0 H GLU A 98 -25.695 -12.204 -15.555 1.00 0.00 H new ATOM 0 HA GLU A 98 -26.763 -14.169 -17.213 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -26.954 -11.290 -16.857 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -27.004 -11.705 -18.559 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -28.815 -13.361 -18.117 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -28.750 -12.991 -16.405 1.00 0.00 H new ATOM 1541 N LYS A 99 -25.513 -14.382 -19.325 1.00 0.00 N ATOM 1542 CA LYS A 99 -24.678 -14.649 -20.484 1.00 0.00 C ATOM 1543 C LYS A 99 -23.229 -14.838 -20.032 1.00 0.00 C ATOM 1544 O LYS A 99 -22.637 -15.892 -20.257 1.00 0.00 O ATOM 1545 CB LYS A 99 -24.856 -13.553 -21.537 1.00 0.00 C ATOM 1546 CG LYS A 99 -25.273 -14.148 -22.883 1.00 0.00 C ATOM 1547 CD LYS A 99 -26.776 -13.980 -23.116 1.00 0.00 C ATOM 1548 CE LYS A 99 -27.105 -13.997 -24.609 1.00 0.00 C ATOM 1549 NZ LYS A 99 -27.937 -12.827 -24.970 1.00 0.00 N ATOM 0 H LYS A 99 -26.326 -14.991 -19.235 1.00 0.00 H new ATOM 0 HA LYS A 99 -24.984 -15.576 -20.968 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -25.609 -12.840 -21.201 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -23.924 -13.000 -21.653 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -24.720 -13.661 -23.687 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -25.013 -15.206 -22.913 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -27.317 -14.780 -22.612 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -27.113 -13.041 -22.677 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -26.183 -13.988 -25.191 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -27.632 -14.917 -24.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -28.151 -12.854 -25.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -28.825 -12.852 -24.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -27.420 -11.952 -24.748 1.00 0.00 H new TER 1563 LYS A 99