USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 990 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 125 ASN : amide:sc= 0.147 K(o=1.7,f=-2.1) USER MOD Set 1.2: A 129 LYS NZ :NH3+ -150:sc= 1.55 (180deg=1.18) USER MOD Set 2.1: A 16 GLN : amide:sc= 1.76 K(o=2,f=-5.6!) USER MOD Set 2.2: A 43 HIS : no HE2:sc= 0.191 K(o=2,f=-0.57) USER MOD Set 3.1: A 33 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 73 TYR OH : rot 30:sc= -0.033 USER MOD Set 4.1: A 11 ASN : amide:sc= 1.51 K(o=3.1,f=0.73) USER MOD Set 4.2: A 60 GLN : amide:sc= 1.63 K(o=3.1,f=-2.6) USER MOD Set 5.1: A 5 MET CE :methyl 175:sc= -0.315 (180deg=-0.464) USER MOD Set 5.2: A 35 SER OG : rot -135:sc= 0.544 USER MOD Single : A 1 MET CE :methyl 164:sc= 0 (180deg=-0.143) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -151:sc= 1.27 (180deg=1.24) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0.0408 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 150:sc= 0.159 USER MOD Single : A 17 MET CE :methyl -166:sc= -1.86 (180deg=-2.31) USER MOD Single : A 23 LYS NZ :NH3+ -163:sc= 2.4 (180deg=2.31) USER MOD Single : A 24 THR OG1 : rot -140:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 90:sc= 0.748 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 26:sc= 1.3 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -120:sc= -0.0509 (180deg=-1.09) USER MOD Single : A 58 SER OG : rot 180:sc= 0.0344 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.0999 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= 1.18 K(o=1.2,f=-0.91) USER MOD Single : A 69 ASN : amide:sc= 0.284 K(o=0.28,f=-7.7!) USER MOD Single : A 78 SER OG : rot -130:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0.0741 USER MOD Single : A 85 ASN : amide:sc=-0.00814 K(o=-0.0081,f=-1) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= 0.562 K(o=0.56,f=-1.1) USER MOD Single : A 100 GLN : amide:sc= 0.407 K(o=0.41,f=-6.1!) USER MOD Single : A 107 GLN : amide:sc= 1.21 K(o=1.2,f=-0.85) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 83:sc= 1.02 USER MOD Single : A 118 GLN : amide:sc= 0.177 K(o=0.18,f=-2.4!) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.231 -0.649 0.213 1.00 0.00 N ATOM 2 CA MET A 1 2.051 -0.542 -1.035 1.00 0.00 C ATOM 3 C MET A 1 2.248 -1.931 -1.667 1.00 0.00 C ATOM 4 O MET A 1 2.502 -2.898 -0.952 1.00 0.00 O ATOM 5 CB MET A 1 3.426 0.135 -0.762 1.00 0.00 C ATOM 6 CG MET A 1 3.674 1.402 -1.589 1.00 0.00 C ATOM 7 SD MET A 1 4.973 2.475 -0.919 1.00 0.00 S ATOM 8 CE MET A 1 5.320 3.474 -2.390 1.00 0.00 C ATOM 0 H1 MET A 1 1.106 0.296 0.629 1.00 0.00 H new ATOM 0 H2 MET A 1 0.300 -1.052 -0.017 1.00 0.00 H new ATOM 0 H3 MET A 1 1.716 -1.266 0.895 1.00 0.00 H new ATOM 0 HA MET A 1 1.507 0.091 -1.737 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.492 0.386 0.297 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.220 -0.583 -0.969 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.943 1.114 -2.605 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.745 1.969 -1.654 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.879 4.364 -2.102 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.908 2.889 -3.097 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.381 3.771 -2.858 1.00 0.00 H new ATOM 18 N LYS A 2 2.199 -2.046 -3.004 1.00 0.00 N ATOM 19 CA LYS A 2 2.549 -3.296 -3.702 1.00 0.00 C ATOM 20 C LYS A 2 4.069 -3.336 -3.742 1.00 0.00 C ATOM 21 O LYS A 2 4.659 -2.409 -4.292 1.00 0.00 O ATOM 22 CB LYS A 2 1.911 -3.374 -5.112 1.00 0.00 C ATOM 23 CG LYS A 2 0.437 -2.925 -5.137 1.00 0.00 C ATOM 24 CD LYS A 2 -0.140 -2.918 -6.561 1.00 0.00 C ATOM 25 CE LYS A 2 -1.352 -1.976 -6.680 1.00 0.00 C ATOM 26 NZ LYS A 2 -2.593 -2.528 -6.061 1.00 0.00 N ATOM 0 H LYS A 2 1.920 -1.287 -3.625 1.00 0.00 H new ATOM 0 HA LYS A 2 2.154 -4.167 -3.180 1.00 0.00 H new ATOM 0 HB2 LYS A 2 2.485 -2.752 -5.798 1.00 0.00 H new ATOM 0 HB3 LYS A 2 1.978 -4.398 -5.478 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -0.155 -3.591 -4.509 1.00 0.00 H new ATOM 0 HG3 LYS A 2 0.355 -1.926 -4.708 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.632 -2.608 -7.265 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -0.437 -3.930 -6.838 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -1.111 -1.024 -6.207 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -1.541 -1.770 -7.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -3.370 -1.847 -6.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -2.845 -3.423 -6.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.429 -2.700 -5.048 1.00 0.00 H new ATOM 40 N LYS A 3 4.723 -4.330 -3.141 1.00 0.00 N ATOM 41 CA LYS A 3 6.186 -4.401 -3.199 1.00 0.00 C ATOM 42 C LYS A 3 6.561 -5.124 -4.474 1.00 0.00 C ATOM 43 O LYS A 3 5.968 -6.163 -4.775 1.00 0.00 O ATOM 44 CB LYS A 3 6.811 -5.036 -1.959 1.00 0.00 C ATOM 45 CG LYS A 3 6.340 -4.358 -0.671 1.00 0.00 C ATOM 46 CD LYS A 3 7.100 -4.895 0.541 1.00 0.00 C ATOM 47 CE LYS A 3 6.557 -4.183 1.784 1.00 0.00 C ATOM 48 NZ LYS A 3 7.224 -4.662 3.023 1.00 0.00 N ATOM 0 H LYS A 3 4.276 -5.083 -2.618 1.00 0.00 H new ATOM 0 HA LYS A 3 6.594 -3.390 -3.210 1.00 0.00 H new ATOM 0 HB2 LYS A 3 6.556 -6.095 -1.926 1.00 0.00 H new ATOM 0 HB3 LYS A 3 7.897 -4.972 -2.027 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.487 -3.281 -0.748 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.271 -4.525 -0.538 1.00 0.00 H new ATOM 0 HD2 LYS A 3 6.967 -5.973 0.629 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.169 -4.714 0.433 1.00 0.00 H new ATOM 0 HE2 LYS A 3 6.705 -3.108 1.682 1.00 0.00 H new ATOM 0 HE3 LYS A 3 5.483 -4.351 1.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 6.569 -4.573 3.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.497 -5.659 2.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 8.073 -4.089 3.204 1.00 0.00 H new ATOM 62 N VAL A 4 7.529 -4.566 -5.189 1.00 0.00 N ATOM 63 CA VAL A 4 7.903 -4.941 -6.541 1.00 0.00 C ATOM 64 C VAL A 4 9.358 -5.398 -6.545 1.00 0.00 C ATOM 65 O VAL A 4 10.183 -4.851 -5.817 1.00 0.00 O ATOM 66 CB VAL A 4 7.724 -3.741 -7.498 1.00 0.00 C ATOM 67 CG1 VAL A 4 7.439 -4.185 -8.939 1.00 0.00 C ATOM 68 CG2 VAL A 4 6.630 -2.739 -7.111 1.00 0.00 C ATOM 0 H VAL A 4 8.100 -3.804 -4.822 1.00 0.00 H new ATOM 0 HA VAL A 4 7.261 -5.753 -6.883 1.00 0.00 H new ATOM 0 HB VAL A 4 8.686 -3.235 -7.415 1.00 0.00 H new ATOM 0 HG11 VAL A 4 7.321 -3.307 -9.574 1.00 0.00 H new ATOM 0 HG12 VAL A 4 8.270 -4.788 -9.305 1.00 0.00 H new ATOM 0 HG13 VAL A 4 6.523 -4.776 -8.963 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.591 -1.939 -7.850 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.667 -3.248 -7.076 1.00 0.00 H new ATOM 0 HG23 VAL A 4 6.853 -2.317 -6.131 1.00 0.00 H new ATOM 78 N MET A 5 9.678 -6.325 -7.438 1.00 0.00 N ATOM 79 CA MET A 5 11.029 -6.753 -7.778 1.00 0.00 C ATOM 80 C MET A 5 11.132 -6.864 -9.294 1.00 0.00 C ATOM 81 O MET A 5 10.168 -7.289 -9.927 1.00 0.00 O ATOM 82 CB MET A 5 11.340 -8.129 -7.183 1.00 0.00 C ATOM 83 CG MET A 5 11.323 -8.202 -5.657 1.00 0.00 C ATOM 84 SD MET A 5 12.723 -9.146 -4.999 1.00 0.00 S ATOM 85 CE MET A 5 12.521 -8.750 -3.251 1.00 0.00 C ATOM 0 H MET A 5 8.967 -6.824 -7.972 1.00 0.00 H new ATOM 0 HA MET A 5 11.734 -6.025 -7.377 1.00 0.00 H new ATOM 0 HB2 MET A 5 10.617 -8.846 -7.572 1.00 0.00 H new ATOM 0 HB3 MET A 5 12.323 -8.444 -7.534 1.00 0.00 H new ATOM 0 HG2 MET A 5 11.343 -7.192 -5.247 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.391 -8.661 -5.328 1.00 0.00 H new ATOM 0 HE1 MET A 5 13.245 -9.315 -2.664 1.00 0.00 H new ATOM 0 HE2 MET A 5 12.684 -7.683 -3.098 1.00 0.00 H new ATOM 0 HE3 MET A 5 11.512 -9.012 -2.933 1.00 0.00 H new ATOM 95 N PHE A 6 12.302 -6.575 -9.866 1.00 0.00 N ATOM 96 CA PHE A 6 12.634 -6.792 -11.268 1.00 0.00 C ATOM 97 C PHE A 6 13.996 -7.475 -11.254 1.00 0.00 C ATOM 98 O PHE A 6 15.019 -6.808 -11.129 1.00 0.00 O ATOM 99 CB PHE A 6 12.685 -5.453 -12.020 1.00 0.00 C ATOM 100 CG PHE A 6 11.382 -4.690 -12.085 1.00 0.00 C ATOM 101 CD1 PHE A 6 11.013 -3.861 -11.013 1.00 0.00 C ATOM 102 CD2 PHE A 6 10.555 -4.782 -13.217 1.00 0.00 C ATOM 103 CE1 PHE A 6 9.813 -3.138 -11.061 1.00 0.00 C ATOM 104 CE2 PHE A 6 9.367 -4.031 -13.278 1.00 0.00 C ATOM 105 CZ PHE A 6 8.989 -3.222 -12.195 1.00 0.00 C ATOM 0 H PHE A 6 13.074 -6.166 -9.339 1.00 0.00 H new ATOM 0 HA PHE A 6 11.890 -7.401 -11.781 1.00 0.00 H new ATOM 0 HB2 PHE A 6 13.433 -4.819 -11.545 1.00 0.00 H new ATOM 0 HB3 PHE A 6 13.026 -5.641 -13.038 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.656 -3.780 -10.149 1.00 0.00 H new ATOM 0 HD2 PHE A 6 10.830 -5.427 -14.038 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.522 -2.517 -10.227 1.00 0.00 H new ATOM 0 HE2 PHE A 6 8.745 -4.077 -14.160 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.065 -2.664 -12.234 1.00 0.00 H new ATOM 115 N VAL A 7 14.021 -8.803 -11.322 1.00 0.00 N ATOM 116 CA VAL A 7 15.237 -9.572 -11.083 1.00 0.00 C ATOM 117 C VAL A 7 15.431 -10.590 -12.206 1.00 0.00 C ATOM 118 O VAL A 7 14.502 -11.311 -12.560 1.00 0.00 O ATOM 119 CB VAL A 7 15.118 -10.194 -9.668 1.00 0.00 C ATOM 120 CG1 VAL A 7 16.165 -11.281 -9.379 1.00 0.00 C ATOM 121 CG2 VAL A 7 15.250 -9.117 -8.573 1.00 0.00 C ATOM 0 H VAL A 7 13.204 -9.373 -11.543 1.00 0.00 H new ATOM 0 HA VAL A 7 16.134 -8.953 -11.099 1.00 0.00 H new ATOM 0 HB VAL A 7 14.130 -10.654 -9.651 1.00 0.00 H new ATOM 0 HG11 VAL A 7 16.018 -11.669 -8.371 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.056 -12.092 -10.099 1.00 0.00 H new ATOM 0 HG13 VAL A 7 17.165 -10.854 -9.462 1.00 0.00 H new ATOM 0 HG21 VAL A 7 15.162 -9.583 -7.592 1.00 0.00 H new ATOM 0 HG22 VAL A 7 16.221 -8.629 -8.658 1.00 0.00 H new ATOM 0 HG23 VAL A 7 14.460 -8.376 -8.694 1.00 0.00 H new ATOM 131 N CYS A 8 16.631 -10.622 -12.786 1.00 0.00 N ATOM 132 CA CYS A 8 17.107 -11.653 -13.714 1.00 0.00 C ATOM 133 C CYS A 8 17.981 -12.630 -12.892 1.00 0.00 C ATOM 134 O CYS A 8 18.105 -12.472 -11.676 1.00 0.00 O ATOM 135 CB CYS A 8 17.827 -10.927 -14.871 1.00 0.00 C ATOM 136 SG CYS A 8 18.609 -11.911 -16.195 1.00 0.00 S ATOM 0 H CYS A 8 17.330 -9.899 -12.616 1.00 0.00 H new ATOM 0 HA CYS A 8 16.323 -12.254 -14.174 1.00 0.00 H new ATOM 0 HB2 CYS A 8 17.103 -10.262 -15.341 1.00 0.00 H new ATOM 0 HB3 CYS A 8 18.600 -10.297 -14.431 1.00 0.00 H new ATOM 141 N LYS A 9 18.587 -13.657 -13.514 1.00 0.00 N ATOM 142 CA LYS A 9 19.378 -14.680 -12.799 1.00 0.00 C ATOM 143 C LYS A 9 20.510 -14.039 -11.981 1.00 0.00 C ATOM 144 O LYS A 9 20.773 -14.454 -10.856 1.00 0.00 O ATOM 145 CB LYS A 9 19.900 -15.713 -13.821 1.00 0.00 C ATOM 146 CG LYS A 9 20.626 -16.900 -13.165 1.00 0.00 C ATOM 147 CD LYS A 9 21.067 -17.931 -14.215 1.00 0.00 C ATOM 148 CE LYS A 9 21.828 -19.087 -13.542 1.00 0.00 C ATOM 149 NZ LYS A 9 22.334 -20.078 -14.529 1.00 0.00 N ATOM 0 H LYS A 9 18.544 -13.803 -14.523 1.00 0.00 H new ATOM 0 HA LYS A 9 18.744 -15.197 -12.078 1.00 0.00 H new ATOM 0 HB2 LYS A 9 19.062 -16.088 -14.409 1.00 0.00 H new ATOM 0 HB3 LYS A 9 20.580 -15.217 -14.514 1.00 0.00 H new ATOM 0 HG2 LYS A 9 21.497 -16.539 -12.618 1.00 0.00 H new ATOM 0 HG3 LYS A 9 19.967 -17.376 -12.438 1.00 0.00 H new ATOM 0 HD2 LYS A 9 20.195 -18.319 -14.742 1.00 0.00 H new ATOM 0 HD3 LYS A 9 21.703 -17.453 -14.960 1.00 0.00 H new ATOM 0 HE2 LYS A 9 22.665 -18.685 -12.972 1.00 0.00 H new ATOM 0 HE3 LYS A 9 21.170 -19.588 -12.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 22.839 -20.838 -14.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 21.534 -20.482 -15.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 22.983 -19.608 -15.192 1.00 0.00 H new ATOM 163 N ARG A 10 21.155 -13.008 -12.534 1.00 0.00 N ATOM 164 CA ARG A 10 22.096 -12.133 -11.830 1.00 0.00 C ATOM 165 C ARG A 10 21.534 -10.717 -11.905 1.00 0.00 C ATOM 166 O ARG A 10 20.626 -10.452 -12.693 1.00 0.00 O ATOM 167 CB ARG A 10 23.499 -12.226 -12.471 1.00 0.00 C ATOM 168 CG ARG A 10 24.222 -13.538 -12.126 1.00 0.00 C ATOM 169 CD ARG A 10 25.576 -13.663 -12.839 1.00 0.00 C ATOM 170 NE ARG A 10 26.540 -12.613 -12.443 1.00 0.00 N ATOM 171 CZ ARG A 10 27.778 -12.460 -12.939 1.00 0.00 C ATOM 172 NH1 ARG A 10 28.256 -13.303 -13.853 1.00 0.00 N ATOM 173 NH2 ARG A 10 28.530 -11.450 -12.518 1.00 0.00 N ATOM 0 H ARG A 10 21.033 -12.752 -13.514 1.00 0.00 H new ATOM 0 HA ARG A 10 22.209 -12.432 -10.788 1.00 0.00 H new ATOM 0 HB2 ARG A 10 23.406 -12.141 -13.554 1.00 0.00 H new ATOM 0 HB3 ARG A 10 24.104 -11.383 -12.136 1.00 0.00 H new ATOM 0 HG2 ARG A 10 24.375 -13.593 -11.048 1.00 0.00 H new ATOM 0 HG3 ARG A 10 23.590 -14.382 -12.402 1.00 0.00 H new ATOM 0 HD2 ARG A 10 26.005 -14.642 -12.623 1.00 0.00 H new ATOM 0 HD3 ARG A 10 25.418 -13.615 -13.916 1.00 0.00 H new ATOM 0 HE ARG A 10 26.238 -11.948 -11.731 1.00 0.00 H new ATOM 0 HH11 ARG A 10 27.679 -14.076 -14.184 1.00 0.00 H new ATOM 0 HH12 ARG A 10 29.198 -13.175 -14.221 1.00 0.00 H new ATOM 0 HH21 ARG A 10 28.166 -10.798 -11.823 1.00 0.00 H new ATOM 0 HH22 ARG A 10 29.472 -11.326 -12.889 1.00 0.00 H new ATOM 187 N ASN A 11 22.105 -9.786 -11.133 1.00 0.00 N ATOM 188 CA ASN A 11 21.779 -8.367 -11.311 1.00 0.00 C ATOM 189 C ASN A 11 22.252 -7.867 -12.685 1.00 0.00 C ATOM 190 O ASN A 11 21.661 -6.943 -13.236 1.00 0.00 O ATOM 191 CB ASN A 11 22.405 -7.510 -10.202 1.00 0.00 C ATOM 192 CG ASN A 11 21.839 -6.096 -10.291 1.00 0.00 C ATOM 193 OD1 ASN A 11 20.675 -5.871 -9.977 1.00 0.00 O ATOM 194 ND2 ASN A 11 22.609 -5.130 -10.756 1.00 0.00 N ATOM 0 H ASN A 11 22.781 -9.983 -10.394 1.00 0.00 H new ATOM 0 HA ASN A 11 20.695 -8.270 -11.253 1.00 0.00 H new ATOM 0 HB2 ASN A 11 22.189 -7.942 -9.225 1.00 0.00 H new ATOM 0 HB3 ASN A 11 23.490 -7.489 -10.309 1.00 0.00 H new ATOM 0 HD21 ASN A 11 22.237 -4.186 -10.857 1.00 0.00 H new ATOM 0 HD22 ASN A 11 23.576 -5.328 -11.014 1.00 0.00 H new ATOM 201 N SER A 12 23.314 -8.475 -13.227 1.00 0.00 N ATOM 202 CA SER A 12 23.900 -8.146 -14.519 1.00 0.00 C ATOM 203 C SER A 12 22.845 -8.242 -15.629 1.00 0.00 C ATOM 204 O SER A 12 22.256 -9.307 -15.829 1.00 0.00 O ATOM 205 CB SER A 12 25.062 -9.110 -14.807 1.00 0.00 C ATOM 206 OG SER A 12 25.786 -9.379 -13.619 1.00 0.00 O ATOM 0 H SER A 12 23.802 -9.237 -12.756 1.00 0.00 H new ATOM 0 HA SER A 12 24.273 -7.122 -14.493 1.00 0.00 H new ATOM 0 HB2 SER A 12 24.676 -10.040 -15.224 1.00 0.00 H new ATOM 0 HB3 SER A 12 25.726 -8.676 -15.555 1.00 0.00 H new ATOM 0 HG SER A 12 26.522 -9.995 -13.817 1.00 0.00 H new ATOM 212 N SER A 13 22.681 -7.138 -16.365 1.00 0.00 N ATOM 213 CA SER A 13 21.762 -6.978 -17.491 1.00 0.00 C ATOM 214 C SER A 13 20.282 -7.058 -17.084 1.00 0.00 C ATOM 215 O SER A 13 19.908 -7.742 -16.136 1.00 0.00 O ATOM 216 CB SER A 13 22.127 -7.946 -18.629 1.00 0.00 C ATOM 217 OG SER A 13 23.524 -7.895 -18.908 1.00 0.00 O ATOM 0 H SER A 13 23.215 -6.289 -16.180 1.00 0.00 H new ATOM 0 HA SER A 13 21.887 -5.963 -17.869 1.00 0.00 H new ATOM 0 HB2 SER A 13 21.843 -8.962 -18.354 1.00 0.00 H new ATOM 0 HB3 SER A 13 21.563 -7.690 -19.526 1.00 0.00 H new ATOM 0 HG SER A 13 23.736 -8.519 -19.633 1.00 0.00 H new ATOM 223 N ARG A 14 19.418 -6.352 -17.828 1.00 0.00 N ATOM 224 CA ARG A 14 17.952 -6.301 -17.692 1.00 0.00 C ATOM 225 C ARG A 14 17.522 -5.596 -16.398 1.00 0.00 C ATOM 226 O ARG A 14 16.843 -4.575 -16.455 1.00 0.00 O ATOM 227 CB ARG A 14 17.318 -7.710 -17.878 1.00 0.00 C ATOM 228 CG ARG A 14 17.843 -8.540 -19.078 1.00 0.00 C ATOM 229 CD ARG A 14 16.888 -8.644 -20.275 1.00 0.00 C ATOM 230 NE ARG A 14 15.977 -9.814 -20.175 1.00 0.00 N ATOM 231 CZ ARG A 14 15.836 -10.791 -21.089 1.00 0.00 C ATOM 232 NH1 ARG A 14 16.366 -10.692 -22.303 1.00 0.00 N ATOM 233 NH2 ARG A 14 15.133 -11.869 -20.785 1.00 0.00 N ATOM 0 H ARG A 14 19.745 -5.761 -18.592 1.00 0.00 H new ATOM 0 HA ARG A 14 17.558 -5.685 -18.500 1.00 0.00 H new ATOM 0 HB2 ARG A 14 17.482 -8.284 -16.966 1.00 0.00 H new ATOM 0 HB3 ARG A 14 16.240 -7.590 -17.989 1.00 0.00 H new ATOM 0 HG2 ARG A 14 18.780 -8.100 -19.420 1.00 0.00 H new ATOM 0 HG3 ARG A 14 18.072 -9.547 -18.729 1.00 0.00 H new ATOM 0 HD2 ARG A 14 16.296 -7.731 -20.344 1.00 0.00 H new ATOM 0 HD3 ARG A 14 17.469 -8.717 -21.194 1.00 0.00 H new ATOM 0 HE ARG A 14 15.404 -9.883 -19.334 1.00 0.00 H new ATOM 0 HH11 ARG A 14 16.896 -9.860 -22.562 1.00 0.00 H new ATOM 0 HH12 ARG A 14 16.243 -11.448 -22.976 1.00 0.00 H new ATOM 0 HH21 ARG A 14 14.703 -11.955 -19.864 1.00 0.00 H new ATOM 0 HH22 ARG A 14 15.021 -12.615 -21.472 1.00 0.00 H new ATOM 247 N SER A 15 17.949 -6.088 -15.238 1.00 0.00 N ATOM 248 CA SER A 15 17.557 -5.603 -13.916 1.00 0.00 C ATOM 249 C SER A 15 18.005 -4.160 -13.658 1.00 0.00 C ATOM 250 O SER A 15 17.456 -3.520 -12.767 1.00 0.00 O ATOM 251 CB SER A 15 18.095 -6.564 -12.845 1.00 0.00 C ATOM 252 OG SER A 15 17.985 -7.919 -13.274 1.00 0.00 O ATOM 0 H SER A 15 18.605 -6.868 -15.191 1.00 0.00 H new ATOM 0 HA SER A 15 16.468 -5.584 -13.869 1.00 0.00 H new ATOM 0 HB2 SER A 15 19.138 -6.330 -12.632 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.541 -6.427 -11.916 1.00 0.00 H new ATOM 0 HG SER A 15 18.705 -8.449 -12.873 1.00 0.00 H new ATOM 258 N GLN A 16 18.957 -3.619 -14.435 1.00 0.00 N ATOM 259 CA GLN A 16 19.391 -2.230 -14.302 1.00 0.00 C ATOM 260 C GLN A 16 18.248 -1.254 -14.584 1.00 0.00 C ATOM 261 O GLN A 16 17.819 -0.539 -13.686 1.00 0.00 O ATOM 262 CB GLN A 16 20.699 -1.969 -15.065 1.00 0.00 C ATOM 263 CG GLN A 16 20.737 -2.157 -16.596 1.00 0.00 C ATOM 264 CD GLN A 16 22.191 -2.216 -17.090 1.00 0.00 C ATOM 265 OE1 GLN A 16 23.113 -1.761 -16.419 1.00 0.00 O ATOM 266 NE2 GLN A 16 22.476 -2.830 -18.219 1.00 0.00 N ATOM 0 H GLN A 16 19.442 -4.135 -15.169 1.00 0.00 H new ATOM 0 HA GLN A 16 19.651 -2.038 -13.261 1.00 0.00 H new ATOM 0 HB2 GLN A 16 21.000 -0.943 -14.855 1.00 0.00 H new ATOM 0 HB3 GLN A 16 21.462 -2.619 -14.637 1.00 0.00 H new ATOM 0 HG2 GLN A 16 20.215 -3.074 -16.870 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.213 -1.335 -17.083 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.726 -3.216 -18.793 1.00 0.00 H new ATOM 0 HE22 GLN A 16 23.446 -2.920 -18.520 1.00 0.00 H new ATOM 275 N MET A 17 17.708 -1.243 -15.803 1.00 0.00 N ATOM 276 CA MET A 17 16.771 -0.202 -16.232 1.00 0.00 C ATOM 277 C MET A 17 15.360 -0.433 -15.686 1.00 0.00 C ATOM 278 O MET A 17 14.641 0.528 -15.431 1.00 0.00 O ATOM 279 CB MET A 17 16.815 -0.130 -17.765 1.00 0.00 C ATOM 280 CG MET A 17 15.895 0.917 -18.408 1.00 0.00 C ATOM 281 SD MET A 17 16.292 2.693 -18.336 1.00 0.00 S ATOM 282 CE MET A 17 16.127 3.221 -16.606 1.00 0.00 C ATOM 0 H MET A 17 17.904 -1.947 -16.515 1.00 0.00 H new ATOM 0 HA MET A 17 17.071 0.761 -15.819 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.840 0.077 -18.072 1.00 0.00 H new ATOM 0 HB3 MET A 17 16.554 -1.110 -18.164 1.00 0.00 H new ATOM 0 HG2 MET A 17 15.801 0.654 -19.462 1.00 0.00 H new ATOM 0 HG3 MET A 17 14.909 0.793 -17.960 1.00 0.00 H new ATOM 0 HE1 MET A 17 16.111 4.310 -16.558 1.00 0.00 H new ATOM 0 HE2 MET A 17 15.199 2.826 -16.192 1.00 0.00 H new ATOM 0 HE3 MET A 17 16.971 2.844 -16.029 1.00 0.00 H new ATOM 292 N ALA A 18 14.952 -1.691 -15.519 1.00 0.00 N ATOM 293 CA ALA A 18 13.564 -2.040 -15.189 1.00 0.00 C ATOM 294 C ALA A 18 13.142 -1.513 -13.813 1.00 0.00 C ATOM 295 O ALA A 18 12.169 -0.767 -13.717 1.00 0.00 O ATOM 296 CB ALA A 18 13.385 -3.555 -15.356 1.00 0.00 C ATOM 0 H ALA A 18 15.570 -2.497 -15.608 1.00 0.00 H new ATOM 0 HA ALA A 18 12.885 -1.542 -15.881 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.358 -3.829 -15.114 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.602 -3.836 -16.387 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.067 -4.078 -14.686 1.00 0.00 H new ATOM 302 N GLU A 19 13.922 -1.783 -12.761 1.00 0.00 N ATOM 303 CA GLU A 19 13.660 -1.179 -11.448 1.00 0.00 C ATOM 304 C GLU A 19 13.870 0.339 -11.512 1.00 0.00 C ATOM 305 O GLU A 19 13.136 1.095 -10.862 1.00 0.00 O ATOM 306 CB GLU A 19 14.519 -1.854 -10.367 1.00 0.00 C ATOM 307 CG GLU A 19 16.037 -1.674 -10.500 1.00 0.00 C ATOM 308 CD GLU A 19 16.640 -0.619 -9.553 1.00 0.00 C ATOM 309 OE1 GLU A 19 16.249 0.569 -9.606 1.00 0.00 O ATOM 310 OE2 GLU A 19 17.571 -0.981 -8.796 1.00 0.00 O ATOM 0 H GLU A 19 14.729 -2.406 -12.790 1.00 0.00 H new ATOM 0 HA GLU A 19 12.619 -1.345 -11.171 1.00 0.00 H new ATOM 0 HB2 GLU A 19 14.212 -1.469 -9.395 1.00 0.00 H new ATOM 0 HB3 GLU A 19 14.299 -2.921 -10.371 1.00 0.00 H new ATOM 0 HG2 GLU A 19 16.522 -2.632 -10.312 1.00 0.00 H new ATOM 0 HG3 GLU A 19 16.269 -1.396 -11.528 1.00 0.00 H new ATOM 317 N GLY A 20 14.804 0.762 -12.378 1.00 0.00 N ATOM 318 CA GLY A 20 15.112 2.145 -12.688 1.00 0.00 C ATOM 319 C GLY A 20 13.843 2.916 -12.996 1.00 0.00 C ATOM 320 O GLY A 20 13.564 3.884 -12.307 1.00 0.00 O ATOM 0 H GLY A 20 15.387 0.108 -12.900 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.629 2.606 -11.846 1.00 0.00 H new ATOM 0 HA3 GLY A 20 15.788 2.191 -13.542 1.00 0.00 H new ATOM 324 N PHE A 21 13.030 2.470 -13.956 1.00 0.00 N ATOM 325 CA PHE A 21 11.785 3.163 -14.271 1.00 0.00 C ATOM 326 C PHE A 21 10.700 2.963 -13.243 1.00 0.00 C ATOM 327 O PHE A 21 9.841 3.832 -13.113 1.00 0.00 O ATOM 328 CB PHE A 21 11.237 2.720 -15.623 1.00 0.00 C ATOM 329 CG PHE A 21 11.751 3.575 -16.736 1.00 0.00 C ATOM 330 CD1 PHE A 21 11.430 4.947 -16.771 1.00 0.00 C ATOM 331 CD2 PHE A 21 12.568 2.999 -17.716 1.00 0.00 C ATOM 332 CE1 PHE A 21 11.904 5.728 -17.840 1.00 0.00 C ATOM 333 CE2 PHE A 21 13.045 3.782 -18.769 1.00 0.00 C ATOM 334 CZ PHE A 21 12.700 5.145 -18.843 1.00 0.00 C ATOM 0 H PHE A 21 13.211 1.641 -14.522 1.00 0.00 H new ATOM 0 HA PHE A 21 12.051 4.220 -14.284 1.00 0.00 H new ATOM 0 HB2 PHE A 21 11.513 1.681 -15.805 1.00 0.00 H new ATOM 0 HB3 PHE A 21 10.148 2.762 -15.605 1.00 0.00 H new ATOM 0 HD1 PHE A 21 10.830 5.391 -15.990 1.00 0.00 H new ATOM 0 HD2 PHE A 21 12.828 1.952 -17.658 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.656 6.778 -17.891 1.00 0.00 H new ATOM 0 HE2 PHE A 21 13.678 3.343 -19.526 1.00 0.00 H new ATOM 0 HZ PHE A 21 13.047 5.744 -19.672 1.00 0.00 H new ATOM 344 N ALA A 22 10.668 1.830 -12.546 1.00 0.00 N ATOM 345 CA ALA A 22 9.514 1.534 -11.718 1.00 0.00 C ATOM 346 C ALA A 22 9.420 2.492 -10.535 1.00 0.00 C ATOM 347 O ALA A 22 8.311 2.858 -10.161 1.00 0.00 O ATOM 348 CB ALA A 22 9.559 0.070 -11.298 1.00 0.00 C ATOM 0 H ALA A 22 11.405 1.125 -12.539 1.00 0.00 H new ATOM 0 HA ALA A 22 8.601 1.688 -12.293 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.693 -0.157 -10.675 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.544 -0.564 -12.185 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.472 -0.118 -10.733 1.00 0.00 H new ATOM 354 N LYS A 23 10.545 2.981 -9.998 1.00 0.00 N ATOM 355 CA LYS A 23 10.485 4.039 -8.971 1.00 0.00 C ATOM 356 C LYS A 23 9.842 5.322 -9.521 1.00 0.00 C ATOM 357 O LYS A 23 9.145 6.013 -8.786 1.00 0.00 O ATOM 358 CB LYS A 23 11.887 4.311 -8.382 1.00 0.00 C ATOM 359 CG LYS A 23 12.790 5.074 -9.379 1.00 0.00 C ATOM 360 CD LYS A 23 14.311 4.925 -9.232 1.00 0.00 C ATOM 361 CE LYS A 23 14.744 3.448 -9.228 1.00 0.00 C ATOM 362 NZ LYS A 23 16.204 3.258 -9.029 1.00 0.00 N ATOM 0 H LYS A 23 11.486 2.674 -10.246 1.00 0.00 H new ATOM 0 HA LYS A 23 9.847 3.685 -8.161 1.00 0.00 H new ATOM 0 HB2 LYS A 23 11.789 4.890 -7.463 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.359 3.365 -8.114 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.519 4.756 -10.386 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.549 6.134 -9.304 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.808 5.447 -10.050 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.635 5.401 -8.306 1.00 0.00 H new ATOM 0 HE2 LYS A 23 14.207 2.922 -8.439 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.452 2.990 -10.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.471 2.295 -9.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 16.726 3.950 -9.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 16.438 3.395 -8.025 1.00 0.00 H new ATOM 376 N THR A 24 10.062 5.632 -10.801 1.00 0.00 N ATOM 377 CA THR A 24 9.608 6.837 -11.461 1.00 0.00 C ATOM 378 C THR A 24 8.114 6.736 -11.775 1.00 0.00 C ATOM 379 O THR A 24 7.319 7.574 -11.351 1.00 0.00 O ATOM 380 CB THR A 24 10.534 7.044 -12.671 1.00 0.00 C ATOM 381 OG1 THR A 24 11.797 7.477 -12.204 1.00 0.00 O ATOM 382 CG2 THR A 24 9.984 7.981 -13.731 1.00 0.00 C ATOM 0 H THR A 24 10.585 5.017 -11.424 1.00 0.00 H new ATOM 0 HA THR A 24 9.679 7.727 -10.836 1.00 0.00 H new ATOM 0 HB THR A 24 10.621 6.084 -13.180 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.148 8.168 -12.803 1.00 0.00 H new ATOM 0 HG21 THR A 24 10.702 8.069 -14.547 1.00 0.00 H new ATOM 0 HG22 THR A 24 9.044 7.584 -14.115 1.00 0.00 H new ATOM 0 HG23 THR A 24 9.810 8.964 -13.293 1.00 0.00 H new ATOM 390 N LEU A 25 7.731 5.681 -12.491 1.00 0.00 N ATOM 391 CA LEU A 25 6.369 5.495 -12.986 1.00 0.00 C ATOM 392 C LEU A 25 5.439 5.084 -11.842 1.00 0.00 C ATOM 393 O LEU A 25 4.272 5.471 -11.817 1.00 0.00 O ATOM 394 CB LEU A 25 6.381 4.419 -14.090 1.00 0.00 C ATOM 395 CG LEU A 25 7.212 4.769 -15.336 1.00 0.00 C ATOM 396 CD1 LEU A 25 7.352 3.513 -16.195 1.00 0.00 C ATOM 397 CD2 LEU A 25 6.599 5.908 -16.157 1.00 0.00 C ATOM 0 H LEU A 25 8.364 4.923 -12.746 1.00 0.00 H new ATOM 0 HA LEU A 25 5.998 6.433 -13.400 1.00 0.00 H new ATOM 0 HB2 LEU A 25 6.764 3.491 -13.666 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.354 4.228 -14.400 1.00 0.00 H new ATOM 0 HG LEU A 25 8.189 5.121 -15.005 1.00 0.00 H new ATOM 0 HD11 LEU A 25 7.939 3.744 -17.084 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.853 2.734 -15.621 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.363 3.164 -16.494 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.228 6.111 -17.024 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.602 5.620 -16.492 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.530 6.804 -15.541 1.00 0.00 H new ATOM 409 N GLY A 26 5.958 4.288 -10.901 1.00 0.00 N ATOM 410 CA GLY A 26 5.215 3.710 -9.789 1.00 0.00 C ATOM 411 C GLY A 26 5.269 4.558 -8.522 1.00 0.00 C ATOM 412 O GLY A 26 4.812 4.091 -7.478 1.00 0.00 O ATOM 0 H GLY A 26 6.943 4.022 -10.898 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.174 3.578 -10.086 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.612 2.719 -9.572 1.00 0.00 H new ATOM 416 N ALA A 27 5.845 5.766 -8.590 1.00 0.00 N ATOM 417 CA ALA A 27 6.068 6.654 -7.455 1.00 0.00 C ATOM 418 C ALA A 27 4.786 6.819 -6.630 1.00 0.00 C ATOM 419 O ALA A 27 3.737 7.183 -7.164 1.00 0.00 O ATOM 420 CB ALA A 27 6.548 8.022 -7.960 1.00 0.00 C ATOM 0 H ALA A 27 6.178 6.160 -9.470 1.00 0.00 H new ATOM 0 HA ALA A 27 6.831 6.214 -6.813 1.00 0.00 H new ATOM 0 HB1 ALA A 27 6.714 8.685 -7.111 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.479 7.899 -8.513 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.791 8.454 -8.615 1.00 0.00 H new ATOM 426 N GLY A 28 4.877 6.542 -5.324 1.00 0.00 N ATOM 427 CA GLY A 28 3.773 6.664 -4.374 1.00 0.00 C ATOM 428 C GLY A 28 2.741 5.530 -4.456 1.00 0.00 C ATOM 429 O GLY A 28 1.879 5.446 -3.581 1.00 0.00 O ATOM 0 H GLY A 28 5.743 6.219 -4.891 1.00 0.00 H new ATOM 0 HA2 GLY A 28 4.180 6.696 -3.364 1.00 0.00 H new ATOM 0 HA3 GLY A 28 3.266 7.614 -4.544 1.00 0.00 H new ATOM 433 N LYS A 29 2.820 4.638 -5.455 1.00 0.00 N ATOM 434 CA LYS A 29 1.881 3.523 -5.626 1.00 0.00 C ATOM 435 C LYS A 29 2.515 2.220 -5.161 1.00 0.00 C ATOM 436 O LYS A 29 1.910 1.477 -4.390 1.00 0.00 O ATOM 437 CB LYS A 29 1.408 3.416 -7.094 1.00 0.00 C ATOM 438 CG LYS A 29 0.744 4.710 -7.595 1.00 0.00 C ATOM 439 CD LYS A 29 0.279 4.570 -9.053 1.00 0.00 C ATOM 440 CE LYS A 29 -0.209 5.905 -9.644 1.00 0.00 C ATOM 441 NZ LYS A 29 -1.478 6.396 -9.039 1.00 0.00 N ATOM 0 H LYS A 29 3.544 4.672 -6.172 1.00 0.00 H new ATOM 0 HA LYS A 29 1.003 3.717 -5.009 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.260 3.179 -7.731 1.00 0.00 H new ATOM 0 HB3 LYS A 29 0.702 2.590 -7.186 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -0.109 4.953 -6.961 1.00 0.00 H new ATOM 0 HG3 LYS A 29 1.448 5.538 -7.513 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.100 4.186 -9.658 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -0.526 3.837 -9.106 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.566 6.659 -9.505 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.350 5.787 -10.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -1.748 7.297 -9.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -2.230 5.695 -9.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -1.343 6.540 -8.018 1.00 0.00 H new ATOM 455 N ILE A 30 3.734 1.928 -5.630 1.00 0.00 N ATOM 456 CA ILE A 30 4.378 0.625 -5.460 1.00 0.00 C ATOM 457 C ILE A 30 5.849 0.805 -5.060 1.00 0.00 C ATOM 458 O ILE A 30 6.477 1.801 -5.417 1.00 0.00 O ATOM 459 CB ILE A 30 4.150 -0.226 -6.735 1.00 0.00 C ATOM 460 CG1 ILE A 30 4.859 0.347 -7.981 1.00 0.00 C ATOM 461 CG2 ILE A 30 2.642 -0.368 -7.025 1.00 0.00 C ATOM 462 CD1 ILE A 30 4.646 -0.479 -9.257 1.00 0.00 C ATOM 0 H ILE A 30 4.305 2.599 -6.144 1.00 0.00 H new ATOM 0 HA ILE A 30 3.928 0.069 -4.638 1.00 0.00 H new ATOM 0 HB ILE A 30 4.588 -1.203 -6.532 1.00 0.00 H new ATOM 0 HG12 ILE A 30 4.502 1.362 -8.154 1.00 0.00 H new ATOM 0 HG13 ILE A 30 5.928 0.415 -7.779 1.00 0.00 H new ATOM 0 HG21 ILE A 30 2.499 -0.968 -7.924 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.154 -0.856 -6.181 1.00 0.00 H new ATOM 0 HG23 ILE A 30 2.206 0.620 -7.175 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.176 -0.010 -10.086 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.029 -1.488 -9.105 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.581 -0.526 -9.487 1.00 0.00 H new ATOM 474 N ALA A 31 6.380 -0.144 -4.284 1.00 0.00 N ATOM 475 CA ALA A 31 7.676 -0.052 -3.618 1.00 0.00 C ATOM 476 C ALA A 31 8.652 -1.045 -4.244 1.00 0.00 C ATOM 477 O ALA A 31 8.538 -2.246 -4.022 1.00 0.00 O ATOM 478 CB ALA A 31 7.463 -0.353 -2.130 1.00 0.00 C ATOM 0 H ALA A 31 5.901 -1.025 -4.098 1.00 0.00 H new ATOM 0 HA ALA A 31 8.101 0.945 -3.732 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.417 -0.291 -1.606 1.00 0.00 H new ATOM 0 HB2 ALA A 31 6.769 0.374 -1.707 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.051 -1.356 -2.017 1.00 0.00 H new ATOM 484 N VAL A 32 9.586 -0.573 -5.059 1.00 0.00 N ATOM 485 CA VAL A 32 10.524 -1.423 -5.787 1.00 0.00 C ATOM 486 C VAL A 32 11.749 -1.709 -4.910 1.00 0.00 C ATOM 487 O VAL A 32 12.375 -0.777 -4.394 1.00 0.00 O ATOM 488 CB VAL A 32 10.923 -0.710 -7.092 1.00 0.00 C ATOM 489 CG1 VAL A 32 11.624 -1.689 -8.037 1.00 0.00 C ATOM 490 CG2 VAL A 32 9.729 -0.083 -7.835 1.00 0.00 C ATOM 0 H VAL A 32 9.717 0.423 -5.237 1.00 0.00 H new ATOM 0 HA VAL A 32 10.062 -2.378 -6.035 1.00 0.00 H new ATOM 0 HB VAL A 32 11.593 0.098 -6.799 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.901 -1.172 -8.956 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.521 -2.080 -7.556 1.00 0.00 H new ATOM 0 HG13 VAL A 32 10.950 -2.513 -8.273 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.081 0.403 -8.745 1.00 0.00 H new ATOM 0 HG22 VAL A 32 9.012 -0.862 -8.094 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.248 0.655 -7.193 1.00 0.00 H new ATOM 500 N THR A 33 12.133 -2.981 -4.838 1.00 0.00 N ATOM 501 CA THR A 33 13.362 -3.465 -4.250 1.00 0.00 C ATOM 502 C THR A 33 13.763 -4.653 -5.119 1.00 0.00 C ATOM 503 O THR A 33 13.064 -5.657 -5.113 1.00 0.00 O ATOM 504 CB THR A 33 13.100 -3.919 -2.803 1.00 0.00 C ATOM 505 OG1 THR A 33 12.395 -2.940 -2.046 1.00 0.00 O ATOM 506 CG2 THR A 33 14.401 -4.267 -2.063 1.00 0.00 C ATOM 0 H THR A 33 11.558 -3.736 -5.211 1.00 0.00 H new ATOM 0 HA THR A 33 14.142 -2.704 -4.213 1.00 0.00 H new ATOM 0 HB THR A 33 12.483 -4.813 -2.889 1.00 0.00 H new ATOM 0 HG1 THR A 33 12.250 -3.272 -1.136 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.168 -4.582 -1.046 1.00 0.00 H new ATOM 0 HG22 THR A 33 14.912 -5.076 -2.586 1.00 0.00 H new ATOM 0 HG23 THR A 33 15.048 -3.390 -2.032 1.00 0.00 H new ATOM 514 N SER A 34 14.837 -4.563 -5.902 1.00 0.00 N ATOM 515 CA SER A 34 15.262 -5.680 -6.746 1.00 0.00 C ATOM 516 C SER A 34 16.522 -6.289 -6.134 1.00 0.00 C ATOM 517 O SER A 34 17.645 -5.972 -6.525 1.00 0.00 O ATOM 518 CB SER A 34 15.369 -5.212 -8.197 1.00 0.00 C ATOM 519 OG SER A 34 14.075 -4.754 -8.571 1.00 0.00 O ATOM 0 H SER A 34 15.426 -3.733 -5.970 1.00 0.00 H new ATOM 0 HA SER A 34 14.533 -6.489 -6.780 1.00 0.00 H new ATOM 0 HB2 SER A 34 16.106 -4.414 -8.294 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.694 -6.027 -8.844 1.00 0.00 H new ATOM 0 HG SER A 34 13.994 -3.799 -8.365 1.00 0.00 H new ATOM 525 N SER A 35 16.305 -7.140 -5.129 1.00 0.00 N ATOM 526 CA SER A 35 17.348 -7.664 -4.255 1.00 0.00 C ATOM 527 C SER A 35 18.426 -8.478 -4.978 1.00 0.00 C ATOM 528 O SER A 35 19.613 -8.320 -4.687 1.00 0.00 O ATOM 529 CB SER A 35 16.674 -8.443 -3.125 1.00 0.00 C ATOM 530 OG SER A 35 15.557 -7.709 -2.647 1.00 0.00 O ATOM 0 H SER A 35 15.375 -7.490 -4.898 1.00 0.00 H new ATOM 0 HA SER A 35 17.907 -6.823 -3.845 1.00 0.00 H new ATOM 0 HB2 SER A 35 16.354 -9.421 -3.484 1.00 0.00 H new ATOM 0 HB3 SER A 35 17.383 -8.617 -2.315 1.00 0.00 H new ATOM 0 HG SER A 35 15.554 -7.719 -1.667 1.00 0.00 H new ATOM 536 N GLY A 36 18.031 -9.299 -5.958 1.00 0.00 N ATOM 537 CA GLY A 36 18.958 -10.075 -6.763 1.00 0.00 C ATOM 538 C GLY A 36 19.132 -11.449 -6.136 1.00 0.00 C ATOM 539 O GLY A 36 19.208 -11.589 -4.915 1.00 0.00 O ATOM 0 H GLY A 36 17.052 -9.439 -6.210 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.582 -10.171 -7.782 1.00 0.00 H new ATOM 0 HA3 GLY A 36 19.920 -9.566 -6.825 1.00 0.00 H new ATOM 543 N LEU A 37 19.148 -12.472 -6.988 1.00 0.00 N ATOM 544 CA LEU A 37 19.371 -13.857 -6.597 1.00 0.00 C ATOM 545 C LEU A 37 20.852 -14.045 -6.275 1.00 0.00 C ATOM 546 O LEU A 37 21.215 -14.782 -5.360 1.00 0.00 O ATOM 547 CB LEU A 37 18.900 -14.744 -7.751 1.00 0.00 C ATOM 548 CG LEU A 37 17.365 -14.850 -7.833 1.00 0.00 C ATOM 549 CD1 LEU A 37 16.954 -15.167 -9.272 1.00 0.00 C ATOM 550 CD2 LEU A 37 16.833 -15.953 -6.906 1.00 0.00 C ATOM 0 H LEU A 37 19.003 -12.356 -7.991 1.00 0.00 H new ATOM 0 HA LEU A 37 18.811 -14.130 -5.703 1.00 0.00 H new ATOM 0 HB2 LEU A 37 19.283 -14.345 -8.690 1.00 0.00 H new ATOM 0 HB3 LEU A 37 19.323 -15.742 -7.633 1.00 0.00 H new ATOM 0 HG LEU A 37 16.941 -13.897 -7.517 1.00 0.00 H new ATOM 0 HD11 LEU A 37 15.868 -15.242 -9.332 1.00 0.00 H new ATOM 0 HD12 LEU A 37 17.300 -14.372 -9.933 1.00 0.00 H new ATOM 0 HD13 LEU A 37 17.401 -16.113 -9.578 1.00 0.00 H new ATOM 0 HD21 LEU A 37 15.747 -16.003 -6.986 1.00 0.00 H new ATOM 0 HD22 LEU A 37 17.263 -16.911 -7.197 1.00 0.00 H new ATOM 0 HD23 LEU A 37 17.111 -15.728 -5.876 1.00 0.00 H new ATOM 562 N GLU A 38 21.689 -13.315 -7.011 1.00 0.00 N ATOM 563 CA GLU A 38 23.102 -13.102 -6.811 1.00 0.00 C ATOM 564 C GLU A 38 23.359 -11.652 -7.163 1.00 0.00 C ATOM 565 O GLU A 38 22.606 -11.060 -7.948 1.00 0.00 O ATOM 566 CB GLU A 38 23.946 -13.961 -7.744 1.00 0.00 C ATOM 567 CG GLU A 38 24.146 -15.352 -7.159 1.00 0.00 C ATOM 568 CD GLU A 38 25.083 -16.215 -8.027 1.00 0.00 C ATOM 569 OE1 GLU A 38 26.320 -16.184 -7.805 1.00 0.00 O ATOM 570 OE2 GLU A 38 24.592 -16.948 -8.919 1.00 0.00 O ATOM 0 H GLU A 38 21.353 -12.817 -7.835 1.00 0.00 H new ATOM 0 HA GLU A 38 23.368 -13.359 -5.786 1.00 0.00 H new ATOM 0 HB2 GLU A 38 23.460 -14.036 -8.717 1.00 0.00 H new ATOM 0 HB3 GLU A 38 24.914 -13.487 -7.907 1.00 0.00 H new ATOM 0 HG2 GLU A 38 24.559 -15.267 -6.154 1.00 0.00 H new ATOM 0 HG3 GLU A 38 23.180 -15.848 -7.065 1.00 0.00 H new ATOM 577 N SER A 39 24.439 -11.102 -6.622 1.00 0.00 N ATOM 578 CA SER A 39 24.750 -9.705 -6.786 1.00 0.00 C ATOM 579 C SER A 39 25.955 -9.468 -7.678 1.00 0.00 C ATOM 580 O SER A 39 26.866 -10.291 -7.814 1.00 0.00 O ATOM 581 CB SER A 39 24.823 -9.039 -5.419 1.00 0.00 C ATOM 582 OG SER A 39 25.765 -9.682 -4.567 1.00 0.00 O ATOM 0 H SER A 39 25.116 -11.618 -6.060 1.00 0.00 H new ATOM 0 HA SER A 39 23.942 -9.220 -7.333 1.00 0.00 H new ATOM 0 HB2 SER A 39 25.098 -7.991 -5.539 1.00 0.00 H new ATOM 0 HB3 SER A 39 23.838 -9.058 -4.952 1.00 0.00 H new ATOM 0 HG SER A 39 25.786 -9.226 -3.700 1.00 0.00 H new ATOM 588 N SER A 40 25.865 -8.333 -8.360 1.00 0.00 N ATOM 589 CA SER A 40 26.689 -7.846 -9.445 1.00 0.00 C ATOM 590 C SER A 40 26.232 -6.392 -9.626 1.00 0.00 C ATOM 591 O SER A 40 25.151 -6.021 -9.155 1.00 0.00 O ATOM 592 CB SER A 40 26.383 -8.700 -10.681 1.00 0.00 C ATOM 593 OG SER A 40 27.006 -9.974 -10.593 1.00 0.00 O ATOM 0 H SER A 40 25.130 -7.662 -8.137 1.00 0.00 H new ATOM 0 HA SER A 40 27.763 -7.900 -9.270 1.00 0.00 H new ATOM 0 HB2 SER A 40 25.305 -8.826 -10.781 1.00 0.00 H new ATOM 0 HB3 SER A 40 26.729 -8.184 -11.577 1.00 0.00 H new ATOM 0 HG SER A 40 27.148 -10.205 -9.651 1.00 0.00 H new ATOM 599 N ARG A 41 27.017 -5.548 -10.290 1.00 0.00 N ATOM 600 CA ARG A 41 26.723 -4.113 -10.376 1.00 0.00 C ATOM 601 C ARG A 41 25.897 -3.831 -11.634 1.00 0.00 C ATOM 602 O ARG A 41 25.148 -4.683 -12.112 1.00 0.00 O ATOM 603 CB ARG A 41 28.041 -3.317 -10.186 1.00 0.00 C ATOM 604 CG ARG A 41 27.934 -1.889 -9.602 1.00 0.00 C ATOM 605 CD ARG A 41 27.257 -1.787 -8.225 1.00 0.00 C ATOM 606 NE ARG A 41 27.115 -0.373 -7.822 1.00 0.00 N ATOM 607 CZ ARG A 41 27.937 0.340 -7.040 1.00 0.00 C ATOM 608 NH1 ARG A 41 29.043 -0.193 -6.527 1.00 0.00 N ATOM 609 NH2 ARG A 41 27.632 1.607 -6.788 1.00 0.00 N ATOM 0 H ARG A 41 27.866 -5.831 -10.780 1.00 0.00 H new ATOM 0 HA ARG A 41 26.080 -3.760 -9.570 1.00 0.00 H new ATOM 0 HB2 ARG A 41 28.694 -3.898 -9.536 1.00 0.00 H new ATOM 0 HB3 ARG A 41 28.535 -3.248 -11.155 1.00 0.00 H new ATOM 0 HG2 ARG A 41 28.937 -1.470 -9.526 1.00 0.00 H new ATOM 0 HG3 ARG A 41 27.381 -1.267 -10.306 1.00 0.00 H new ATOM 0 HD2 ARG A 41 26.276 -2.262 -8.259 1.00 0.00 H new ATOM 0 HD3 ARG A 41 27.846 -2.325 -7.483 1.00 0.00 H new ATOM 0 HE ARG A 41 26.296 0.118 -8.181 1.00 0.00 H new ATOM 0 HH11 ARG A 41 29.281 -1.165 -6.726 1.00 0.00 H new ATOM 0 HH12 ARG A 41 29.653 0.370 -5.934 1.00 0.00 H new ATOM 0 HH21 ARG A 41 26.788 2.017 -7.187 1.00 0.00 H new ATOM 0 HH22 ARG A 41 28.242 2.170 -6.196 1.00 0.00 H new ATOM 623 N VAL A 42 25.983 -2.596 -12.097 1.00 0.00 N ATOM 624 CA VAL A 42 25.183 -1.944 -13.129 1.00 0.00 C ATOM 625 C VAL A 42 26.165 -1.252 -14.092 1.00 0.00 C ATOM 626 O VAL A 42 27.308 -0.973 -13.714 1.00 0.00 O ATOM 627 CB VAL A 42 24.148 -1.040 -12.409 1.00 0.00 C ATOM 628 CG1 VAL A 42 24.694 -0.345 -11.144 1.00 0.00 C ATOM 629 CG2 VAL A 42 23.530 0.040 -13.303 1.00 0.00 C ATOM 0 H VAL A 42 26.685 -1.957 -11.724 1.00 0.00 H new ATOM 0 HA VAL A 42 24.590 -2.613 -13.753 1.00 0.00 H new ATOM 0 HB VAL A 42 23.376 -1.755 -12.124 1.00 0.00 H new ATOM 0 HG11 VAL A 42 23.910 0.268 -10.699 1.00 0.00 H new ATOM 0 HG12 VAL A 42 25.017 -1.098 -10.426 1.00 0.00 H new ATOM 0 HG13 VAL A 42 25.541 0.287 -11.413 1.00 0.00 H new ATOM 0 HG21 VAL A 42 22.818 0.628 -12.724 1.00 0.00 H new ATOM 0 HG22 VAL A 42 24.316 0.693 -13.682 1.00 0.00 H new ATOM 0 HG23 VAL A 42 23.015 -0.431 -14.140 1.00 0.00 H new ATOM 639 N HIS A 43 25.743 -1.004 -15.338 1.00 0.00 N ATOM 640 CA HIS A 43 26.661 -0.569 -16.398 1.00 0.00 C ATOM 641 C HIS A 43 26.868 0.953 -16.402 1.00 0.00 C ATOM 642 O HIS A 43 25.910 1.692 -16.179 1.00 0.00 O ATOM 643 CB HIS A 43 26.189 -1.128 -17.755 1.00 0.00 C ATOM 644 CG HIS A 43 26.265 -2.636 -17.809 1.00 0.00 C ATOM 645 ND1 HIS A 43 25.448 -3.527 -17.143 1.00 0.00 N ATOM 646 CD2 HIS A 43 27.212 -3.375 -18.466 1.00 0.00 C ATOM 647 CE1 HIS A 43 25.898 -4.771 -17.397 1.00 0.00 C ATOM 648 NE2 HIS A 43 26.982 -4.730 -18.190 1.00 0.00 N ATOM 0 H HIS A 43 24.772 -1.097 -15.637 1.00 0.00 H new ATOM 0 HA HIS A 43 27.650 -0.981 -16.198 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.163 -0.811 -17.939 1.00 0.00 H new ATOM 0 HB3 HIS A 43 26.801 -0.706 -18.552 1.00 0.00 H new ATOM 0 HD1 HIS A 43 24.645 -3.286 -16.561 1.00 0.00 H new ATOM 0 HD2 HIS A 43 28.001 -2.981 -19.090 1.00 0.00 H new ATOM 0 HE1 HIS A 43 25.449 -5.676 -17.016 1.00 0.00 H new ATOM 656 N PRO A 44 28.077 1.457 -16.722 1.00 0.00 N ATOM 657 CA PRO A 44 28.381 2.889 -16.671 1.00 0.00 C ATOM 658 C PRO A 44 27.564 3.681 -17.694 1.00 0.00 C ATOM 659 O PRO A 44 26.965 4.705 -17.359 1.00 0.00 O ATOM 660 CB PRO A 44 29.889 2.999 -16.935 1.00 0.00 C ATOM 661 CG PRO A 44 30.221 1.726 -17.715 1.00 0.00 C ATOM 662 CD PRO A 44 29.270 0.705 -17.098 1.00 0.00 C ATOM 0 HA PRO A 44 28.115 3.318 -15.705 1.00 0.00 H new ATOM 0 HB2 PRO A 44 30.130 3.893 -17.510 1.00 0.00 H new ATOM 0 HB3 PRO A 44 30.454 3.056 -16.005 1.00 0.00 H new ATOM 0 HG2 PRO A 44 30.048 1.848 -18.784 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.264 1.435 -17.592 1.00 0.00 H new ATOM 0 HD2 PRO A 44 29.028 -0.085 -17.809 1.00 0.00 H new ATOM 0 HD3 PRO A 44 29.720 0.225 -16.229 1.00 0.00 H new ATOM 670 N THR A 45 27.476 3.184 -18.929 1.00 0.00 N ATOM 671 CA THR A 45 26.718 3.847 -19.982 1.00 0.00 C ATOM 672 C THR A 45 25.219 3.759 -19.683 1.00 0.00 C ATOM 673 O THR A 45 24.488 4.688 -20.023 1.00 0.00 O ATOM 674 CB THR A 45 27.129 3.278 -21.345 1.00 0.00 C ATOM 675 OG1 THR A 45 28.545 3.164 -21.419 1.00 0.00 O ATOM 676 CG2 THR A 45 26.628 4.124 -22.520 1.00 0.00 C ATOM 0 H THR A 45 27.926 2.317 -19.222 1.00 0.00 H new ATOM 0 HA THR A 45 26.948 4.912 -20.017 1.00 0.00 H new ATOM 0 HB THR A 45 26.663 2.296 -21.427 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.799 2.798 -22.292 1.00 0.00 H new ATOM 0 HG21 THR A 45 26.950 3.671 -23.458 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.539 4.172 -22.495 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.038 5.131 -22.444 1.00 0.00 H new ATOM 684 N ALA A 46 24.757 2.720 -18.963 1.00 0.00 N ATOM 685 CA ALA A 46 23.380 2.691 -18.493 1.00 0.00 C ATOM 686 C ALA A 46 23.172 3.884 -17.596 1.00 0.00 C ATOM 687 O ALA A 46 22.291 4.687 -17.862 1.00 0.00 O ATOM 688 CB ALA A 46 23.030 1.406 -17.722 1.00 0.00 C ATOM 0 H ALA A 46 25.315 1.907 -18.703 1.00 0.00 H new ATOM 0 HA ALA A 46 22.726 2.717 -19.364 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.990 1.447 -17.399 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.175 0.542 -18.370 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.677 1.317 -16.850 1.00 0.00 H new ATOM 694 N ILE A 47 24.007 4.040 -16.576 1.00 0.00 N ATOM 695 CA ILE A 47 23.807 5.083 -15.581 1.00 0.00 C ATOM 696 C ILE A 47 23.789 6.437 -16.289 1.00 0.00 C ATOM 697 O ILE A 47 22.933 7.256 -15.979 1.00 0.00 O ATOM 698 CB ILE A 47 24.930 5.007 -14.517 1.00 0.00 C ATOM 699 CG1 ILE A 47 24.831 3.703 -13.695 1.00 0.00 C ATOM 700 CG2 ILE A 47 24.907 6.231 -13.585 1.00 0.00 C ATOM 701 CD1 ILE A 47 26.153 3.311 -13.022 1.00 0.00 C ATOM 0 H ILE A 47 24.829 3.457 -16.417 1.00 0.00 H new ATOM 0 HA ILE A 47 22.856 4.948 -15.066 1.00 0.00 H new ATOM 0 HB ILE A 47 25.881 5.007 -15.050 1.00 0.00 H new ATOM 0 HG12 ILE A 47 24.063 3.820 -12.931 1.00 0.00 H new ATOM 0 HG13 ILE A 47 24.509 2.892 -14.349 1.00 0.00 H new ATOM 0 HG21 ILE A 47 25.708 6.145 -12.851 1.00 0.00 H new ATOM 0 HG22 ILE A 47 25.049 7.138 -14.172 1.00 0.00 H new ATOM 0 HG23 ILE A 47 23.947 6.279 -13.071 1.00 0.00 H new ATOM 0 HD11 ILE A 47 26.015 2.387 -12.461 1.00 0.00 H new ATOM 0 HD12 ILE A 47 26.919 3.163 -13.783 1.00 0.00 H new ATOM 0 HD13 ILE A 47 26.465 4.105 -12.343 1.00 0.00 H new ATOM 713 N ALA A 48 24.656 6.650 -17.279 1.00 0.00 N ATOM 714 CA ALA A 48 24.691 7.902 -18.017 1.00 0.00 C ATOM 715 C ALA A 48 23.383 8.143 -18.784 1.00 0.00 C ATOM 716 O ALA A 48 22.792 9.211 -18.654 1.00 0.00 O ATOM 717 CB ALA A 48 25.901 7.926 -18.960 1.00 0.00 C ATOM 0 H ALA A 48 25.345 5.964 -17.586 1.00 0.00 H new ATOM 0 HA ALA A 48 24.794 8.716 -17.300 1.00 0.00 H new ATOM 0 HB1 ALA A 48 25.917 8.868 -19.508 1.00 0.00 H new ATOM 0 HB2 ALA A 48 26.818 7.829 -18.378 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.829 7.098 -19.665 1.00 0.00 H new ATOM 723 N MET A 49 22.895 7.157 -19.543 1.00 0.00 N ATOM 724 CA MET A 49 21.657 7.287 -20.320 1.00 0.00 C ATOM 725 C MET A 49 20.441 7.430 -19.393 1.00 0.00 C ATOM 726 O MET A 49 19.484 8.169 -19.648 1.00 0.00 O ATOM 727 CB MET A 49 21.504 6.037 -21.204 1.00 0.00 C ATOM 728 CG MET A 49 22.599 5.953 -22.274 1.00 0.00 C ATOM 729 SD MET A 49 22.472 7.214 -23.565 1.00 0.00 S ATOM 730 CE MET A 49 24.141 7.889 -23.388 1.00 0.00 C ATOM 0 H MET A 49 23.346 6.247 -19.636 1.00 0.00 H new ATOM 0 HA MET A 49 21.710 8.183 -20.939 1.00 0.00 H new ATOM 0 HB2 MET A 49 21.538 5.145 -20.579 1.00 0.00 H new ATOM 0 HB3 MET A 49 20.526 6.051 -21.686 1.00 0.00 H new ATOM 0 HG2 MET A 49 23.572 6.041 -21.790 1.00 0.00 H new ATOM 0 HG3 MET A 49 22.562 4.968 -22.739 1.00 0.00 H new ATOM 0 HE1 MET A 49 24.284 8.698 -24.104 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.273 8.272 -22.376 1.00 0.00 H new ATOM 0 HE3 MET A 49 24.873 7.104 -23.577 1.00 0.00 H new ATOM 740 N MET A 50 20.482 6.723 -18.276 1.00 0.00 N ATOM 741 CA MET A 50 19.365 6.636 -17.369 1.00 0.00 C ATOM 742 C MET A 50 19.336 7.931 -16.552 1.00 0.00 C ATOM 743 O MET A 50 18.257 8.452 -16.283 1.00 0.00 O ATOM 744 CB MET A 50 19.434 5.333 -16.556 1.00 0.00 C ATOM 745 CG MET A 50 19.444 4.016 -17.381 1.00 0.00 C ATOM 746 SD MET A 50 19.207 4.038 -19.194 1.00 0.00 S ATOM 747 CE MET A 50 19.448 2.280 -19.630 1.00 0.00 C ATOM 0 H MET A 50 21.300 6.192 -17.977 1.00 0.00 H new ATOM 0 HA MET A 50 18.408 6.566 -17.886 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.333 5.359 -15.940 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.582 5.306 -15.876 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.399 3.527 -17.190 1.00 0.00 H new ATOM 0 HG3 MET A 50 18.668 3.373 -16.965 1.00 0.00 H new ATOM 0 HE1 MET A 50 20.284 2.188 -20.323 1.00 0.00 H new ATOM 0 HE2 MET A 50 19.661 1.707 -18.727 1.00 0.00 H new ATOM 0 HE3 MET A 50 18.543 1.894 -20.100 1.00 0.00 H new ATOM 757 N GLU A 51 20.490 8.548 -16.294 1.00 0.00 N ATOM 758 CA GLU A 51 20.584 9.873 -15.720 1.00 0.00 C ATOM 759 C GLU A 51 20.164 10.926 -16.748 1.00 0.00 C ATOM 760 O GLU A 51 19.706 12.000 -16.352 1.00 0.00 O ATOM 761 CB GLU A 51 21.999 10.112 -15.169 1.00 0.00 C ATOM 762 CG GLU A 51 22.148 11.456 -14.450 1.00 0.00 C ATOM 763 CD GLU A 51 23.518 11.573 -13.756 1.00 0.00 C ATOM 764 OE1 GLU A 51 24.516 11.930 -14.429 1.00 0.00 O ATOM 765 OE2 GLU A 51 23.602 11.336 -12.525 1.00 0.00 O ATOM 0 H GLU A 51 21.398 8.125 -16.485 1.00 0.00 H new ATOM 0 HA GLU A 51 19.896 9.958 -14.879 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.254 9.308 -14.479 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.714 10.065 -15.990 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.031 12.269 -15.167 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.354 11.565 -13.712 1.00 0.00 H new ATOM 772 N GLU A 52 20.215 10.630 -18.054 1.00 0.00 N ATOM 773 CA GLU A 52 19.655 11.536 -19.052 1.00 0.00 C ATOM 774 C GLU A 52 18.126 11.579 -18.931 1.00 0.00 C ATOM 775 O GLU A 52 17.538 12.637 -19.167 1.00 0.00 O ATOM 776 CB GLU A 52 20.135 11.263 -20.489 1.00 0.00 C ATOM 777 CG GLU A 52 21.588 11.691 -20.731 1.00 0.00 C ATOM 778 CD GLU A 52 21.731 13.224 -20.821 1.00 0.00 C ATOM 779 OE1 GLU A 52 21.523 13.792 -21.920 1.00 0.00 O ATOM 780 OE2 GLU A 52 22.061 13.872 -19.798 1.00 0.00 O ATOM 0 H GLU A 52 20.633 9.781 -18.435 1.00 0.00 H new ATOM 0 HA GLU A 52 20.044 12.530 -18.831 1.00 0.00 H new ATOM 0 HB2 GLU A 52 20.036 10.199 -20.702 1.00 0.00 H new ATOM 0 HB3 GLU A 52 19.486 11.790 -21.188 1.00 0.00 H new ATOM 0 HG2 GLU A 52 22.216 11.315 -19.923 1.00 0.00 H new ATOM 0 HG3 GLU A 52 21.950 11.238 -21.654 1.00 0.00 H new ATOM 787 N VAL A 53 17.485 10.478 -18.502 1.00 0.00 N ATOM 788 CA VAL A 53 16.057 10.505 -18.129 1.00 0.00 C ATOM 789 C VAL A 53 15.878 10.852 -16.627 1.00 0.00 C ATOM 790 O VAL A 53 14.772 10.793 -16.089 1.00 0.00 O ATOM 791 CB VAL A 53 15.302 9.267 -18.664 1.00 0.00 C ATOM 792 CG1 VAL A 53 15.629 7.968 -17.921 1.00 0.00 C ATOM 793 CG2 VAL A 53 13.777 9.447 -18.722 1.00 0.00 C ATOM 0 H VAL A 53 17.928 9.564 -18.405 1.00 0.00 H new ATOM 0 HA VAL A 53 15.555 11.327 -18.639 1.00 0.00 H new ATOM 0 HB VAL A 53 15.675 9.177 -19.684 1.00 0.00 H new ATOM 0 HG11 VAL A 53 15.059 7.147 -18.356 1.00 0.00 H new ATOM 0 HG12 VAL A 53 16.695 7.757 -18.009 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.366 8.075 -16.869 1.00 0.00 H new ATOM 0 HG21 VAL A 53 13.318 8.537 -19.107 1.00 0.00 H new ATOM 0 HG22 VAL A 53 13.396 9.650 -17.721 1.00 0.00 H new ATOM 0 HG23 VAL A 53 13.534 10.282 -19.379 1.00 0.00 H new ATOM 803 N GLY A 54 16.952 11.271 -15.941 1.00 0.00 N ATOM 804 CA GLY A 54 16.928 11.757 -14.565 1.00 0.00 C ATOM 805 C GLY A 54 16.842 10.642 -13.518 1.00 0.00 C ATOM 806 O GLY A 54 16.494 10.921 -12.369 1.00 0.00 O ATOM 0 H GLY A 54 17.888 11.279 -16.347 1.00 0.00 H new ATOM 0 HA2 GLY A 54 17.826 12.346 -14.382 1.00 0.00 H new ATOM 0 HA3 GLY A 54 16.077 12.426 -14.440 1.00 0.00 H new ATOM 810 N ILE A 55 17.128 9.393 -13.897 1.00 0.00 N ATOM 811 CA ILE A 55 16.961 8.214 -13.051 1.00 0.00 C ATOM 812 C ILE A 55 18.311 7.760 -12.489 1.00 0.00 C ATOM 813 O ILE A 55 19.323 7.758 -13.194 1.00 0.00 O ATOM 814 CB ILE A 55 16.189 7.126 -13.825 1.00 0.00 C ATOM 815 CG1 ILE A 55 14.731 7.605 -14.017 1.00 0.00 C ATOM 816 CG2 ILE A 55 16.263 5.729 -13.175 1.00 0.00 C ATOM 817 CD1 ILE A 55 13.772 6.541 -14.545 1.00 0.00 C ATOM 0 H ILE A 55 17.491 9.171 -14.824 1.00 0.00 H new ATOM 0 HA ILE A 55 16.355 8.452 -12.177 1.00 0.00 H new ATOM 0 HB ILE A 55 16.668 6.993 -14.795 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.355 7.971 -13.062 1.00 0.00 H new ATOM 0 HG13 ILE A 55 14.729 8.450 -14.706 1.00 0.00 H new ATOM 0 HG21 ILE A 55 15.697 5.018 -13.776 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.303 5.409 -13.118 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.841 5.772 -12.171 1.00 0.00 H new ATOM 0 HD11 ILE A 55 12.775 6.969 -14.647 1.00 0.00 H new ATOM 0 HD12 ILE A 55 14.118 6.190 -15.517 1.00 0.00 H new ATOM 0 HD13 ILE A 55 13.738 5.704 -13.848 1.00 0.00 H new ATOM 829 N ASP A 56 18.304 7.324 -11.224 1.00 0.00 N ATOM 830 CA ASP A 56 19.429 6.654 -10.575 1.00 0.00 C ATOM 831 C ASP A 56 19.228 5.146 -10.706 1.00 0.00 C ATOM 832 O ASP A 56 18.111 4.658 -10.508 1.00 0.00 O ATOM 833 CB ASP A 56 19.516 7.056 -9.100 1.00 0.00 C ATOM 834 CG ASP A 56 20.662 6.313 -8.386 1.00 0.00 C ATOM 835 OD1 ASP A 56 20.440 5.184 -7.887 1.00 0.00 O ATOM 836 OD2 ASP A 56 21.784 6.865 -8.320 1.00 0.00 O ATOM 0 H ASP A 56 17.495 7.431 -10.612 1.00 0.00 H new ATOM 0 HA ASP A 56 20.363 6.949 -11.054 1.00 0.00 H new ATOM 0 HB2 ASP A 56 19.673 8.132 -9.022 1.00 0.00 H new ATOM 0 HB3 ASP A 56 18.571 6.835 -8.604 1.00 0.00 H new ATOM 841 N ILE A 57 20.292 4.407 -11.021 1.00 0.00 N ATOM 842 CA ILE A 57 20.327 2.938 -10.984 1.00 0.00 C ATOM 843 C ILE A 57 21.644 2.448 -10.383 1.00 0.00 C ATOM 844 O ILE A 57 21.669 1.405 -9.751 1.00 0.00 O ATOM 845 CB ILE A 57 20.073 2.313 -12.376 1.00 0.00 C ATOM 846 CG1 ILE A 57 20.841 3.039 -13.503 1.00 0.00 C ATOM 847 CG2 ILE A 57 18.565 2.264 -12.662 1.00 0.00 C ATOM 848 CD1 ILE A 57 20.926 2.233 -14.801 1.00 0.00 C ATOM 0 H ILE A 57 21.177 4.820 -11.317 1.00 0.00 H new ATOM 0 HA ILE A 57 19.512 2.606 -10.341 1.00 0.00 H new ATOM 0 HB ILE A 57 20.461 1.295 -12.357 1.00 0.00 H new ATOM 0 HG12 ILE A 57 20.354 3.992 -13.708 1.00 0.00 H new ATOM 0 HG13 ILE A 57 21.850 3.264 -13.158 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.395 1.823 -13.644 1.00 0.00 H new ATOM 0 HG22 ILE A 57 18.070 1.660 -11.902 1.00 0.00 H new ATOM 0 HG23 ILE A 57 18.158 3.275 -12.643 1.00 0.00 H new ATOM 0 HD11 ILE A 57 21.478 2.803 -15.548 1.00 0.00 H new ATOM 0 HD12 ILE A 57 21.440 1.291 -14.611 1.00 0.00 H new ATOM 0 HD13 ILE A 57 19.921 2.030 -15.170 1.00 0.00 H new ATOM 860 N SER A 58 22.725 3.201 -10.549 1.00 0.00 N ATOM 861 CA SER A 58 24.047 3.100 -9.930 1.00 0.00 C ATOM 862 C SER A 58 24.132 2.373 -8.572 1.00 0.00 C ATOM 863 O SER A 58 25.096 1.643 -8.337 1.00 0.00 O ATOM 864 CB SER A 58 24.555 4.548 -9.789 1.00 0.00 C ATOM 865 OG SER A 58 23.970 5.416 -10.759 1.00 0.00 O ATOM 0 H SER A 58 22.695 3.989 -11.195 1.00 0.00 H new ATOM 0 HA SER A 58 24.657 2.468 -10.575 1.00 0.00 H new ATOM 0 HB2 SER A 58 24.327 4.916 -8.789 1.00 0.00 H new ATOM 0 HB3 SER A 58 25.640 4.564 -9.895 1.00 0.00 H new ATOM 0 HG SER A 58 24.316 6.325 -10.636 1.00 0.00 H new ATOM 871 N GLY A 59 23.156 2.543 -7.682 1.00 0.00 N ATOM 872 CA GLY A 59 23.142 2.004 -6.321 1.00 0.00 C ATOM 873 C GLY A 59 22.334 0.711 -6.134 1.00 0.00 C ATOM 874 O GLY A 59 21.760 0.529 -5.061 1.00 0.00 O ATOM 0 H GLY A 59 22.318 3.083 -7.897 1.00 0.00 H new ATOM 0 HA2 GLY A 59 24.170 1.818 -6.011 1.00 0.00 H new ATOM 0 HA3 GLY A 59 22.740 2.764 -5.651 1.00 0.00 H new ATOM 878 N GLN A 60 22.235 -0.174 -7.142 1.00 0.00 N ATOM 879 CA GLN A 60 21.372 -1.368 -7.053 1.00 0.00 C ATOM 880 C GLN A 60 21.766 -2.337 -5.938 1.00 0.00 C ATOM 881 O GLN A 60 20.914 -3.072 -5.433 1.00 0.00 O ATOM 882 CB GLN A 60 21.405 -2.211 -8.340 1.00 0.00 C ATOM 883 CG GLN A 60 21.046 -1.430 -9.600 1.00 0.00 C ATOM 884 CD GLN A 60 20.413 -2.304 -10.667 1.00 0.00 C ATOM 885 OE1 GLN A 60 21.100 -2.893 -11.494 1.00 0.00 O ATOM 886 NE2 GLN A 60 19.100 -2.378 -10.675 1.00 0.00 N ATOM 0 H GLN A 60 22.739 -0.087 -8.024 1.00 0.00 H new ATOM 0 HA GLN A 60 20.387 -0.943 -6.862 1.00 0.00 H new ATOM 0 HB2 GLN A 60 22.402 -2.635 -8.459 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.713 -3.047 -8.233 1.00 0.00 H new ATOM 0 HG2 GLN A 60 20.359 -0.625 -9.341 1.00 0.00 H new ATOM 0 HG3 GLN A 60 21.945 -0.964 -10.003 1.00 0.00 H new ATOM 0 HE21 GLN A 60 18.557 -1.876 -9.973 1.00 0.00 H new ATOM 0 HE22 GLN A 60 18.625 -2.938 -11.383 1.00 0.00 H new ATOM 895 N THR A 61 23.058 -2.409 -5.627 1.00 0.00 N ATOM 896 CA THR A 61 23.607 -3.434 -4.762 1.00 0.00 C ATOM 897 C THR A 61 23.155 -3.213 -3.312 1.00 0.00 C ATOM 898 O THR A 61 23.401 -2.154 -2.726 1.00 0.00 O ATOM 899 CB THR A 61 25.136 -3.518 -4.960 1.00 0.00 C ATOM 900 OG1 THR A 61 25.695 -2.259 -5.322 1.00 0.00 O ATOM 901 CG2 THR A 61 25.459 -4.487 -6.103 1.00 0.00 C ATOM 0 H THR A 61 23.754 -1.749 -5.974 1.00 0.00 H new ATOM 0 HA THR A 61 23.217 -4.415 -5.032 1.00 0.00 H new ATOM 0 HB THR A 61 25.557 -3.851 -4.012 1.00 0.00 H new ATOM 0 HG1 THR A 61 26.664 -2.352 -5.437 1.00 0.00 H new ATOM 0 HG21 THR A 61 26.539 -4.543 -6.239 1.00 0.00 H new ATOM 0 HG22 THR A 61 25.072 -5.477 -5.861 1.00 0.00 H new ATOM 0 HG23 THR A 61 24.996 -4.131 -7.023 1.00 0.00 H new ATOM 909 N SER A 62 22.494 -4.231 -2.754 1.00 0.00 N ATOM 910 CA SER A 62 21.804 -4.231 -1.471 1.00 0.00 C ATOM 911 C SER A 62 21.827 -5.678 -0.934 1.00 0.00 C ATOM 912 O SER A 62 22.554 -6.531 -1.461 1.00 0.00 O ATOM 913 CB SER A 62 20.362 -3.732 -1.702 1.00 0.00 C ATOM 914 OG SER A 62 20.329 -2.370 -2.117 1.00 0.00 O ATOM 0 H SER A 62 22.425 -5.135 -3.222 1.00 0.00 H new ATOM 0 HA SER A 62 22.280 -3.575 -0.742 1.00 0.00 H new ATOM 0 HB2 SER A 62 19.880 -4.353 -2.457 1.00 0.00 H new ATOM 0 HB3 SER A 62 19.788 -3.845 -0.783 1.00 0.00 H new ATOM 0 HG SER A 62 19.399 -2.092 -2.254 1.00 0.00 H new ATOM 920 N ASP A 63 21.042 -5.966 0.108 1.00 0.00 N ATOM 921 CA ASP A 63 20.802 -7.326 0.602 1.00 0.00 C ATOM 922 C ASP A 63 20.364 -8.246 -0.551 1.00 0.00 C ATOM 923 O ASP A 63 19.599 -7.802 -1.414 1.00 0.00 O ATOM 924 CB ASP A 63 19.675 -7.330 1.644 1.00 0.00 C ATOM 925 CG ASP A 63 20.181 -7.035 3.061 1.00 0.00 C ATOM 926 OD1 ASP A 63 20.314 -5.842 3.422 1.00 0.00 O ATOM 927 OD2 ASP A 63 20.439 -7.999 3.821 1.00 0.00 O ATOM 0 H ASP A 63 20.548 -5.250 0.641 1.00 0.00 H new ATOM 0 HA ASP A 63 21.732 -7.681 1.045 1.00 0.00 H new ATOM 0 HB2 ASP A 63 18.927 -6.587 1.367 1.00 0.00 H new ATOM 0 HB3 ASP A 63 19.179 -8.301 1.634 1.00 0.00 H new ATOM 932 N PRO A 64 20.781 -9.525 -0.561 1.00 0.00 N ATOM 933 CA PRO A 64 20.300 -10.506 -1.524 1.00 0.00 C ATOM 934 C PRO A 64 18.841 -10.873 -1.227 1.00 0.00 C ATOM 935 O PRO A 64 18.366 -10.738 -0.095 1.00 0.00 O ATOM 936 CB PRO A 64 21.232 -11.712 -1.369 1.00 0.00 C ATOM 937 CG PRO A 64 21.606 -11.662 0.114 1.00 0.00 C ATOM 938 CD PRO A 64 21.681 -10.160 0.394 1.00 0.00 C ATOM 0 HA PRO A 64 20.314 -10.129 -2.546 1.00 0.00 H new ATOM 0 HB2 PRO A 64 20.733 -12.645 -1.629 1.00 0.00 H new ATOM 0 HB3 PRO A 64 22.109 -11.630 -2.011 1.00 0.00 H new ATOM 0 HG2 PRO A 64 20.858 -12.153 0.737 1.00 0.00 H new ATOM 0 HG3 PRO A 64 22.557 -12.158 0.308 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.381 -9.939 1.418 1.00 0.00 H new ATOM 0 HD3 PRO A 64 22.700 -9.792 0.274 1.00 0.00 H new ATOM 946 N ILE A 65 18.151 -11.434 -2.221 1.00 0.00 N ATOM 947 CA ILE A 65 16.746 -11.845 -2.112 1.00 0.00 C ATOM 948 C ILE A 65 16.535 -12.910 -1.029 1.00 0.00 C ATOM 949 O ILE A 65 15.425 -13.082 -0.532 1.00 0.00 O ATOM 950 CB ILE A 65 16.275 -12.316 -3.507 1.00 0.00 C ATOM 951 CG1 ILE A 65 14.747 -12.236 -3.665 1.00 0.00 C ATOM 952 CG2 ILE A 65 16.808 -13.711 -3.876 1.00 0.00 C ATOM 953 CD1 ILE A 65 14.277 -12.444 -5.110 1.00 0.00 C ATOM 0 H ILE A 65 18.556 -11.619 -3.139 1.00 0.00 H new ATOM 0 HA ILE A 65 16.139 -10.997 -1.793 1.00 0.00 H new ATOM 0 HB ILE A 65 16.711 -11.616 -4.220 1.00 0.00 H new ATOM 0 HG12 ILE A 65 14.282 -12.988 -3.027 1.00 0.00 H new ATOM 0 HG13 ILE A 65 14.402 -11.263 -3.314 1.00 0.00 H new ATOM 0 HG21 ILE A 65 16.445 -13.989 -4.865 1.00 0.00 H new ATOM 0 HG22 ILE A 65 17.898 -13.695 -3.881 1.00 0.00 H new ATOM 0 HG23 ILE A 65 16.459 -14.439 -3.144 1.00 0.00 H new ATOM 0 HD11 ILE A 65 13.190 -12.375 -5.152 1.00 0.00 H new ATOM 0 HD12 ILE A 65 14.714 -11.677 -5.749 1.00 0.00 H new ATOM 0 HD13 ILE A 65 14.592 -13.428 -5.457 1.00 0.00 H new ATOM 965 N GLU A 66 17.599 -13.616 -0.641 1.00 0.00 N ATOM 966 CA GLU A 66 17.565 -14.693 0.305 1.00 0.00 C ATOM 967 C GLU A 66 17.195 -14.170 1.705 1.00 0.00 C ATOM 968 O GLU A 66 16.582 -14.886 2.500 1.00 0.00 O ATOM 969 CB GLU A 66 18.973 -15.302 0.223 1.00 0.00 C ATOM 970 CG GLU A 66 19.254 -16.249 1.371 1.00 0.00 C ATOM 971 CD GLU A 66 20.558 -17.043 1.172 1.00 0.00 C ATOM 972 OE1 GLU A 66 21.652 -16.520 1.501 1.00 0.00 O ATOM 973 OE2 GLU A 66 20.497 -18.207 0.703 1.00 0.00 O ATOM 0 H GLU A 66 18.536 -13.433 -1.001 1.00 0.00 H new ATOM 0 HA GLU A 66 16.806 -15.446 0.092 1.00 0.00 H new ATOM 0 HB2 GLU A 66 19.082 -15.836 -0.721 1.00 0.00 H new ATOM 0 HB3 GLU A 66 19.714 -14.502 0.224 1.00 0.00 H new ATOM 0 HG2 GLU A 66 19.316 -15.682 2.300 1.00 0.00 H new ATOM 0 HG3 GLU A 66 18.421 -16.944 1.477 1.00 0.00 H new ATOM 980 N ASN A 67 17.534 -12.907 1.992 1.00 0.00 N ATOM 981 CA ASN A 67 17.245 -12.246 3.260 1.00 0.00 C ATOM 982 C ASN A 67 15.797 -11.729 3.335 1.00 0.00 C ATOM 983 O ASN A 67 15.404 -11.174 4.364 1.00 0.00 O ATOM 984 CB ASN A 67 18.273 -11.126 3.529 1.00 0.00 C ATOM 985 CG ASN A 67 19.654 -11.646 3.940 1.00 0.00 C ATOM 986 OD1 ASN A 67 19.878 -12.844 4.112 1.00 0.00 O ATOM 987 ND2 ASN A 67 20.623 -10.765 4.125 1.00 0.00 N ATOM 0 H ASN A 67 18.028 -12.307 1.331 1.00 0.00 H new ATOM 0 HA ASN A 67 17.339 -12.990 4.051 1.00 0.00 H new ATOM 0 HB2 ASN A 67 18.376 -10.516 2.632 1.00 0.00 H new ATOM 0 HB3 ASN A 67 17.891 -10.475 4.315 1.00 0.00 H new ATOM 0 HD21 ASN A 67 21.551 -11.079 4.409 1.00 0.00 H new ATOM 0 HD22 ASN A 67 20.442 -9.771 3.984 1.00 0.00 H new ATOM 994 N PHE A 68 15.004 -11.903 2.273 1.00 0.00 N ATOM 995 CA PHE A 68 13.605 -11.492 2.177 1.00 0.00 C ATOM 996 C PHE A 68 12.678 -12.710 2.149 1.00 0.00 C ATOM 997 O PHE A 68 13.136 -13.856 2.130 1.00 0.00 O ATOM 998 CB PHE A 68 13.411 -10.636 0.916 1.00 0.00 C ATOM 999 CG PHE A 68 14.059 -9.282 1.023 1.00 0.00 C ATOM 1000 CD1 PHE A 68 13.351 -8.236 1.635 1.00 0.00 C ATOM 1001 CD2 PHE A 68 15.368 -9.080 0.562 1.00 0.00 C ATOM 1002 CE1 PHE A 68 13.945 -6.966 1.755 1.00 0.00 C ATOM 1003 CE2 PHE A 68 15.963 -7.810 0.675 1.00 0.00 C ATOM 1004 CZ PHE A 68 15.248 -6.751 1.265 1.00 0.00 C ATOM 0 H PHE A 68 15.337 -12.354 1.421 1.00 0.00 H new ATOM 0 HA PHE A 68 13.349 -10.901 3.056 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.824 -11.164 0.057 1.00 0.00 H new ATOM 0 HB3 PHE A 68 12.345 -10.509 0.729 1.00 0.00 H new ATOM 0 HD1 PHE A 68 12.353 -8.405 2.013 1.00 0.00 H new ATOM 0 HD2 PHE A 68 15.918 -9.898 0.121 1.00 0.00 H new ATOM 0 HE1 PHE A 68 13.403 -6.157 2.222 1.00 0.00 H new ATOM 0 HE2 PHE A 68 16.966 -7.648 0.310 1.00 0.00 H new ATOM 0 HZ PHE A 68 15.699 -5.773 1.342 1.00 0.00 H new ATOM 1014 N ASN A 69 11.364 -12.452 2.121 1.00 0.00 N ATOM 1015 CA ASN A 69 10.349 -13.454 1.869 1.00 0.00 C ATOM 1016 C ASN A 69 9.444 -12.943 0.768 1.00 0.00 C ATOM 1017 O ASN A 69 8.997 -11.796 0.826 1.00 0.00 O ATOM 1018 CB ASN A 69 9.509 -13.758 3.117 1.00 0.00 C ATOM 1019 CG ASN A 69 8.648 -15.016 2.998 1.00 0.00 C ATOM 1020 OD1 ASN A 69 8.400 -15.528 1.909 1.00 0.00 O ATOM 1021 ND2 ASN A 69 8.142 -15.526 4.109 1.00 0.00 N ATOM 0 H ASN A 69 10.981 -11.520 2.277 1.00 0.00 H new ATOM 0 HA ASN A 69 10.844 -14.381 1.579 1.00 0.00 H new ATOM 0 HB2 ASN A 69 10.175 -13.866 3.973 1.00 0.00 H new ATOM 0 HB3 ASN A 69 8.862 -12.906 3.323 1.00 0.00 H new ATOM 0 HD21 ASN A 69 7.542 -16.350 4.065 1.00 0.00 H new ATOM 0 HD22 ASN A 69 8.352 -15.096 5.010 1.00 0.00 H new ATOM 1028 N ALA A 70 9.105 -13.794 -0.195 1.00 0.00 N ATOM 1029 CA ALA A 70 8.277 -13.375 -1.290 1.00 0.00 C ATOM 1030 C ALA A 70 6.852 -13.207 -0.803 1.00 0.00 C ATOM 1031 O ALA A 70 6.081 -12.471 -1.409 1.00 0.00 O ATOM 1032 CB ALA A 70 8.320 -14.402 -2.421 1.00 0.00 C ATOM 0 H ALA A 70 9.396 -14.771 -0.228 1.00 0.00 H new ATOM 0 HA ALA A 70 8.650 -12.425 -1.673 1.00 0.00 H new ATOM 0 HB1 ALA A 70 7.686 -14.066 -3.242 1.00 0.00 H new ATOM 0 HB2 ALA A 70 9.345 -14.510 -2.775 1.00 0.00 H new ATOM 0 HB3 ALA A 70 7.960 -15.363 -2.054 1.00 0.00 H new ATOM 1038 N ASP A 71 6.483 -13.902 0.276 1.00 0.00 N ATOM 1039 CA ASP A 71 5.126 -13.833 0.768 1.00 0.00 C ATOM 1040 C ASP A 71 4.799 -12.424 1.296 1.00 0.00 C ATOM 1041 O ASP A 71 3.630 -12.034 1.351 1.00 0.00 O ATOM 1042 CB ASP A 71 4.912 -14.882 1.862 1.00 0.00 C ATOM 1043 CG ASP A 71 3.465 -14.864 2.383 1.00 0.00 C ATOM 1044 OD1 ASP A 71 2.545 -15.276 1.635 1.00 0.00 O ATOM 1045 OD2 ASP A 71 3.247 -14.486 3.562 1.00 0.00 O ATOM 0 H ASP A 71 7.104 -14.508 0.812 1.00 0.00 H new ATOM 0 HA ASP A 71 4.449 -14.043 -0.060 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.147 -15.872 1.470 1.00 0.00 H new ATOM 0 HB3 ASP A 71 5.599 -14.695 2.687 1.00 0.00 H new ATOM 1050 N ASP A 72 5.829 -11.637 1.655 1.00 0.00 N ATOM 1051 CA ASP A 72 5.679 -10.245 2.053 1.00 0.00 C ATOM 1052 C ASP A 72 5.473 -9.330 0.839 1.00 0.00 C ATOM 1053 O ASP A 72 4.850 -8.271 0.945 1.00 0.00 O ATOM 1054 CB ASP A 72 6.915 -9.784 2.823 1.00 0.00 C ATOM 1055 CG ASP A 72 6.695 -8.381 3.416 1.00 0.00 C ATOM 1056 OD1 ASP A 72 5.832 -8.226 4.313 1.00 0.00 O ATOM 1057 OD2 ASP A 72 7.412 -7.428 3.026 1.00 0.00 O ATOM 0 H ASP A 72 6.795 -11.963 1.674 1.00 0.00 H new ATOM 0 HA ASP A 72 4.796 -10.179 2.689 1.00 0.00 H new ATOM 0 HB2 ASP A 72 7.136 -10.491 3.622 1.00 0.00 H new ATOM 0 HB3 ASP A 72 7.780 -9.772 2.159 1.00 0.00 H new ATOM 1062 N TYR A 73 6.009 -9.742 -0.313 1.00 0.00 N ATOM 1063 CA TYR A 73 5.941 -9.027 -1.576 1.00 0.00 C ATOM 1064 C TYR A 73 4.591 -9.246 -2.271 1.00 0.00 C ATOM 1065 O TYR A 73 3.787 -10.095 -1.861 1.00 0.00 O ATOM 1066 CB TYR A 73 7.153 -9.368 -2.467 1.00 0.00 C ATOM 1067 CG TYR A 73 8.382 -8.548 -2.113 1.00 0.00 C ATOM 1068 CD1 TYR A 73 9.007 -8.724 -0.866 1.00 0.00 C ATOM 1069 CD2 TYR A 73 8.850 -7.552 -2.994 1.00 0.00 C ATOM 1070 CE1 TYR A 73 10.046 -7.873 -0.462 1.00 0.00 C ATOM 1071 CE2 TYR A 73 9.899 -6.700 -2.600 1.00 0.00 C ATOM 1072 CZ TYR A 73 10.487 -6.842 -1.319 1.00 0.00 C ATOM 1073 OH TYR A 73 11.468 -5.986 -0.914 1.00 0.00 O ATOM 0 H TYR A 73 6.522 -10.620 -0.387 1.00 0.00 H new ATOM 0 HA TYR A 73 6.000 -7.957 -1.374 1.00 0.00 H new ATOM 0 HB2 TYR A 73 7.386 -10.428 -2.368 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.893 -9.195 -3.511 1.00 0.00 H new ATOM 0 HD1 TYR A 73 8.684 -9.522 -0.213 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.404 -7.443 -3.971 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.509 -8.007 0.505 1.00 0.00 H new ATOM 0 HE2 TYR A 73 10.256 -5.937 -3.275 1.00 0.00 H new ATOM 0 HH TYR A 73 12.068 -6.447 -0.292 1.00 0.00 H new ATOM 1083 N ASP A 74 4.322 -8.436 -3.304 1.00 0.00 N ATOM 1084 CA ASP A 74 3.103 -8.534 -4.106 1.00 0.00 C ATOM 1085 C ASP A 74 3.412 -8.883 -5.563 1.00 0.00 C ATOM 1086 O ASP A 74 2.691 -9.684 -6.166 1.00 0.00 O ATOM 1087 CB ASP A 74 2.318 -7.224 -4.038 1.00 0.00 C ATOM 1088 CG ASP A 74 1.017 -7.334 -4.852 1.00 0.00 C ATOM 1089 OD1 ASP A 74 0.014 -7.848 -4.302 1.00 0.00 O ATOM 1090 OD2 ASP A 74 0.985 -6.860 -6.011 1.00 0.00 O ATOM 0 H ASP A 74 4.950 -7.691 -3.605 1.00 0.00 H new ATOM 0 HA ASP A 74 2.498 -9.340 -3.690 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.086 -6.986 -3.000 1.00 0.00 H new ATOM 0 HB3 ASP A 74 2.928 -6.407 -4.424 1.00 0.00 H new ATOM 1095 N VAL A 75 4.483 -8.317 -6.132 1.00 0.00 N ATOM 1096 CA VAL A 75 4.787 -8.404 -7.548 1.00 0.00 C ATOM 1097 C VAL A 75 6.280 -8.649 -7.744 1.00 0.00 C ATOM 1098 O VAL A 75 7.126 -7.976 -7.155 1.00 0.00 O ATOM 1099 CB VAL A 75 4.252 -7.150 -8.279 1.00 0.00 C ATOM 1100 CG1 VAL A 75 4.280 -5.820 -7.503 1.00 0.00 C ATOM 1101 CG2 VAL A 75 4.893 -6.997 -9.669 1.00 0.00 C ATOM 0 H VAL A 75 5.169 -7.778 -5.604 1.00 0.00 H new ATOM 0 HA VAL A 75 4.279 -9.257 -7.998 1.00 0.00 H new ATOM 0 HB VAL A 75 3.187 -7.358 -8.378 1.00 0.00 H new ATOM 0 HG11 VAL A 75 3.878 -5.024 -8.130 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.675 -5.912 -6.601 1.00 0.00 H new ATOM 0 HG13 VAL A 75 5.307 -5.581 -7.228 1.00 0.00 H new ATOM 0 HG21 VAL A 75 4.496 -6.107 -10.157 1.00 0.00 H new ATOM 0 HG22 VAL A 75 5.974 -6.901 -9.563 1.00 0.00 H new ATOM 0 HG23 VAL A 75 4.664 -7.874 -10.274 1.00 0.00 H new ATOM 1111 N VAL A 76 6.622 -9.599 -8.609 1.00 0.00 N ATOM 1112 CA VAL A 76 7.998 -9.927 -8.932 1.00 0.00 C ATOM 1113 C VAL A 76 8.016 -10.202 -10.431 1.00 0.00 C ATOM 1114 O VAL A 76 7.240 -11.021 -10.928 1.00 0.00 O ATOM 1115 CB VAL A 76 8.434 -11.148 -8.106 1.00 0.00 C ATOM 1116 CG1 VAL A 76 9.807 -11.702 -8.527 1.00 0.00 C ATOM 1117 CG2 VAL A 76 8.457 -10.894 -6.582 1.00 0.00 C ATOM 0 H VAL A 76 5.939 -10.168 -9.109 1.00 0.00 H new ATOM 0 HA VAL A 76 8.697 -9.126 -8.693 1.00 0.00 H new ATOM 0 HB VAL A 76 7.664 -11.888 -8.323 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.058 -12.562 -7.907 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.771 -12.007 -9.573 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.566 -10.930 -8.400 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.774 -11.801 -6.067 1.00 0.00 H new ATOM 0 HG22 VAL A 76 9.154 -10.087 -6.358 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.459 -10.615 -6.244 1.00 0.00 H new ATOM 1127 N ILE A 77 8.887 -9.501 -11.148 1.00 0.00 N ATOM 1128 CA ILE A 77 9.182 -9.780 -12.538 1.00 0.00 C ATOM 1129 C ILE A 77 10.433 -10.643 -12.518 1.00 0.00 C ATOM 1130 O ILE A 77 11.457 -10.230 -11.959 1.00 0.00 O ATOM 1131 CB ILE A 77 9.424 -8.481 -13.330 1.00 0.00 C ATOM 1132 CG1 ILE A 77 8.471 -7.307 -13.003 1.00 0.00 C ATOM 1133 CG2 ILE A 77 9.475 -8.751 -14.843 1.00 0.00 C ATOM 1134 CD1 ILE A 77 6.966 -7.565 -13.009 1.00 0.00 C ATOM 0 H ILE A 77 9.413 -8.713 -10.770 1.00 0.00 H new ATOM 0 HA ILE A 77 8.349 -10.282 -13.030 1.00 0.00 H new ATOM 0 HB ILE A 77 10.401 -8.138 -12.989 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.738 -6.929 -12.016 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.673 -6.508 -13.716 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.647 -7.815 -15.374 1.00 0.00 H new ATOM 0 HG22 ILE A 77 10.286 -9.446 -15.061 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.529 -9.184 -15.167 1.00 0.00 H new ATOM 0 HD11 ILE A 77 6.438 -6.644 -12.761 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.659 -7.904 -13.998 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.725 -8.331 -12.272 1.00 0.00 H new ATOM 1146 N SER A 78 10.367 -11.806 -13.149 1.00 0.00 N ATOM 1147 CA SER A 78 11.524 -12.630 -13.402 1.00 0.00 C ATOM 1148 C SER A 78 11.978 -12.215 -14.790 1.00 0.00 C ATOM 1149 O SER A 78 11.478 -12.715 -15.789 1.00 0.00 O ATOM 1150 CB SER A 78 11.129 -14.103 -13.330 1.00 0.00 C ATOM 1151 OG SER A 78 10.631 -14.408 -12.032 1.00 0.00 O ATOM 0 H SER A 78 9.496 -12.202 -13.501 1.00 0.00 H new ATOM 0 HA SER A 78 12.325 -12.503 -12.674 1.00 0.00 H new ATOM 0 HB2 SER A 78 10.370 -14.322 -14.081 1.00 0.00 H new ATOM 0 HB3 SER A 78 11.991 -14.731 -13.555 1.00 0.00 H new ATOM 0 HG SER A 78 11.082 -15.207 -11.688 1.00 0.00 H new ATOM 1157 N LEU A 79 12.886 -11.240 -14.865 1.00 0.00 N ATOM 1158 CA LEU A 79 13.309 -10.638 -16.133 1.00 0.00 C ATOM 1159 C LEU A 79 13.993 -11.637 -17.062 1.00 0.00 C ATOM 1160 O LEU A 79 14.225 -11.293 -18.219 1.00 0.00 O ATOM 1161 CB LEU A 79 14.275 -9.473 -15.858 1.00 0.00 C ATOM 1162 CG LEU A 79 13.577 -8.160 -15.498 1.00 0.00 C ATOM 1163 CD1 LEU A 79 14.645 -7.214 -14.963 1.00 0.00 C ATOM 1164 CD2 LEU A 79 12.900 -7.506 -16.705 1.00 0.00 C ATOM 0 H LEU A 79 13.350 -10.844 -14.047 1.00 0.00 H new ATOM 0 HA LEU A 79 12.406 -10.285 -16.632 1.00 0.00 H new ATOM 0 HB2 LEU A 79 14.943 -9.753 -15.044 1.00 0.00 H new ATOM 0 HB3 LEU A 79 14.896 -9.313 -16.739 1.00 0.00 H new ATOM 0 HG LEU A 79 12.798 -8.367 -14.765 1.00 0.00 H new ATOM 0 HD11 LEU A 79 14.186 -6.262 -14.694 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.112 -7.654 -14.082 1.00 0.00 H new ATOM 0 HD13 LEU A 79 15.401 -7.048 -15.730 1.00 0.00 H new ATOM 0 HD21 LEU A 79 12.420 -6.578 -16.394 1.00 0.00 H new ATOM 0 HD22 LEU A 79 13.647 -7.290 -17.469 1.00 0.00 H new ATOM 0 HD23 LEU A 79 12.150 -8.184 -17.113 1.00 0.00 H new ATOM 1176 N CYS A 80 14.367 -12.820 -16.575 1.00 0.00 N ATOM 1177 CA CYS A 80 14.916 -13.889 -17.378 1.00 0.00 C ATOM 1178 C CYS A 80 14.364 -15.196 -16.804 1.00 0.00 C ATOM 1179 O CYS A 80 14.529 -15.436 -15.603 1.00 0.00 O ATOM 1180 CB CYS A 80 16.451 -13.844 -17.274 1.00 0.00 C ATOM 1181 SG CYS A 80 17.204 -12.227 -17.639 1.00 0.00 S ATOM 0 H CYS A 80 14.291 -13.058 -15.586 1.00 0.00 H new ATOM 0 HA CYS A 80 14.645 -13.799 -18.430 1.00 0.00 H new ATOM 0 HB2 CYS A 80 16.740 -14.143 -16.266 1.00 0.00 H new ATOM 0 HB3 CYS A 80 16.868 -14.584 -17.958 1.00 0.00 H new ATOM 1186 N GLY A 81 13.748 -16.036 -17.642 1.00 0.00 N ATOM 1187 CA GLY A 81 13.222 -17.339 -17.240 1.00 0.00 C ATOM 1188 C GLY A 81 12.184 -17.223 -16.117 1.00 0.00 C ATOM 1189 O GLY A 81 11.452 -16.232 -16.025 1.00 0.00 O ATOM 0 H GLY A 81 13.600 -15.825 -18.629 1.00 0.00 H new ATOM 0 HA2 GLY A 81 12.769 -17.828 -18.102 1.00 0.00 H new ATOM 0 HA3 GLY A 81 14.044 -17.974 -16.909 1.00 0.00 H new ATOM 1193 N SER A 82 12.124 -18.247 -15.260 1.00 0.00 N ATOM 1194 CA SER A 82 11.265 -18.280 -14.082 1.00 0.00 C ATOM 1195 C SER A 82 12.046 -18.899 -12.922 1.00 0.00 C ATOM 1196 O SER A 82 12.601 -18.175 -12.098 1.00 0.00 O ATOM 1197 CB SER A 82 9.943 -18.995 -14.420 1.00 0.00 C ATOM 1198 OG SER A 82 10.179 -20.232 -15.089 1.00 0.00 O ATOM 0 H SER A 82 12.685 -19.092 -15.372 1.00 0.00 H new ATOM 0 HA SER A 82 10.979 -17.278 -13.764 1.00 0.00 H new ATOM 0 HB2 SER A 82 9.381 -19.176 -13.504 1.00 0.00 H new ATOM 0 HB3 SER A 82 9.329 -18.350 -15.049 1.00 0.00 H new ATOM 0 HG SER A 82 9.323 -20.664 -15.289 1.00 0.00 H new ATOM 1204 N GLY A 83 12.163 -20.228 -12.887 1.00 0.00 N ATOM 1205 CA GLY A 83 12.842 -20.993 -11.843 1.00 0.00 C ATOM 1206 C GLY A 83 14.358 -20.983 -12.018 1.00 0.00 C ATOM 1207 O GLY A 83 14.973 -22.048 -12.078 1.00 0.00 O ATOM 0 H GLY A 83 11.771 -20.824 -13.616 1.00 0.00 H new ATOM 0 HA2 GLY A 83 12.587 -20.579 -10.867 1.00 0.00 H new ATOM 0 HA3 GLY A 83 12.483 -22.022 -11.856 1.00 0.00 H new ATOM 1211 N VAL A 84 14.972 -19.803 -12.134 1.00 0.00 N ATOM 1212 CA VAL A 84 16.397 -19.625 -12.432 1.00 0.00 C ATOM 1213 C VAL A 84 17.249 -19.793 -11.156 1.00 0.00 C ATOM 1214 O VAL A 84 17.940 -18.870 -10.728 1.00 0.00 O ATOM 1215 CB VAL A 84 16.627 -18.317 -13.230 1.00 0.00 C ATOM 1216 CG1 VAL A 84 16.049 -18.455 -14.646 1.00 0.00 C ATOM 1217 CG2 VAL A 84 16.024 -17.053 -12.589 1.00 0.00 C ATOM 0 H VAL A 84 14.477 -18.918 -12.020 1.00 0.00 H new ATOM 0 HA VAL A 84 16.746 -20.416 -13.095 1.00 0.00 H new ATOM 0 HB VAL A 84 17.709 -18.183 -13.241 1.00 0.00 H new ATOM 0 HG11 VAL A 84 16.216 -17.530 -15.199 1.00 0.00 H new ATOM 0 HG12 VAL A 84 16.541 -19.280 -15.161 1.00 0.00 H new ATOM 0 HG13 VAL A 84 14.979 -18.653 -14.584 1.00 0.00 H new ATOM 0 HG21 VAL A 84 16.236 -16.189 -13.219 1.00 0.00 H new ATOM 0 HG22 VAL A 84 14.945 -17.174 -12.490 1.00 0.00 H new ATOM 0 HG23 VAL A 84 16.463 -16.900 -11.603 1.00 0.00 H new ATOM 1227 N ASN A 85 17.179 -20.986 -10.547 1.00 0.00 N ATOM 1228 CA ASN A 85 17.772 -21.327 -9.242 1.00 0.00 C ATOM 1229 C ASN A 85 17.236 -20.345 -8.197 1.00 0.00 C ATOM 1230 O ASN A 85 17.966 -19.556 -7.595 1.00 0.00 O ATOM 1231 CB ASN A 85 19.308 -21.423 -9.300 1.00 0.00 C ATOM 1232 CG ASN A 85 19.903 -21.907 -7.972 1.00 0.00 C ATOM 1233 OD1 ASN A 85 19.221 -22.493 -7.130 1.00 0.00 O ATOM 1234 ND2 ASN A 85 21.196 -21.706 -7.763 1.00 0.00 N ATOM 0 H ASN A 85 16.687 -21.774 -10.967 1.00 0.00 H new ATOM 0 HA ASN A 85 17.469 -22.331 -8.944 1.00 0.00 H new ATOM 0 HB2 ASN A 85 19.599 -22.106 -10.098 1.00 0.00 H new ATOM 0 HB3 ASN A 85 19.723 -20.446 -9.549 1.00 0.00 H new ATOM 0 HD21 ASN A 85 21.631 -22.037 -6.902 1.00 0.00 H new ATOM 0 HD22 ASN A 85 21.756 -21.220 -8.463 1.00 0.00 H new ATOM 1241 N LEU A 86 15.909 -20.367 -8.066 1.00 0.00 N ATOM 1242 CA LEU A 86 15.101 -19.405 -7.330 1.00 0.00 C ATOM 1243 C LEU A 86 14.036 -20.169 -6.514 1.00 0.00 C ATOM 1244 O LEU A 86 13.509 -21.163 -7.022 1.00 0.00 O ATOM 1245 CB LEU A 86 14.537 -18.425 -8.391 1.00 0.00 C ATOM 1246 CG LEU A 86 13.229 -17.697 -8.043 1.00 0.00 C ATOM 1247 CD1 LEU A 86 13.159 -16.353 -8.775 1.00 0.00 C ATOM 1248 CD2 LEU A 86 12.019 -18.513 -8.515 1.00 0.00 C ATOM 0 H LEU A 86 15.342 -21.098 -8.496 1.00 0.00 H new ATOM 0 HA LEU A 86 15.656 -18.823 -6.594 1.00 0.00 H new ATOM 0 HB2 LEU A 86 15.299 -17.673 -8.596 1.00 0.00 H new ATOM 0 HB3 LEU A 86 14.380 -18.980 -9.316 1.00 0.00 H new ATOM 0 HG LEU A 86 13.211 -17.560 -6.962 1.00 0.00 H new ATOM 0 HD11 LEU A 86 12.228 -15.848 -8.520 1.00 0.00 H new ATOM 0 HD12 LEU A 86 14.003 -15.731 -8.476 1.00 0.00 H new ATOM 0 HD13 LEU A 86 13.197 -16.522 -9.851 1.00 0.00 H new ATOM 0 HD21 LEU A 86 11.101 -17.983 -8.261 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.071 -18.650 -9.595 1.00 0.00 H new ATOM 0 HD23 LEU A 86 12.023 -19.487 -8.025 1.00 0.00 H new ATOM 1260 N PRO A 87 13.689 -19.731 -5.287 1.00 0.00 N ATOM 1261 CA PRO A 87 12.584 -20.317 -4.524 1.00 0.00 C ATOM 1262 C PRO A 87 11.225 -20.032 -5.195 1.00 0.00 C ATOM 1263 O PRO A 87 10.995 -18.898 -5.623 1.00 0.00 O ATOM 1264 CB PRO A 87 12.673 -19.736 -3.108 1.00 0.00 C ATOM 1265 CG PRO A 87 14.113 -19.229 -3.011 1.00 0.00 C ATOM 1266 CD PRO A 87 14.451 -18.823 -4.443 1.00 0.00 C ATOM 0 HA PRO A 87 12.662 -21.404 -4.488 1.00 0.00 H new ATOM 0 HB2 PRO A 87 11.954 -18.930 -2.961 1.00 0.00 H new ATOM 0 HB3 PRO A 87 12.463 -20.492 -2.351 1.00 0.00 H new ATOM 0 HG2 PRO A 87 14.195 -18.385 -2.326 1.00 0.00 H new ATOM 0 HG3 PRO A 87 14.787 -20.004 -2.645 1.00 0.00 H new ATOM 0 HD2 PRO A 87 14.177 -17.785 -4.633 1.00 0.00 H new ATOM 0 HD3 PRO A 87 15.520 -18.911 -4.635 1.00 0.00 H new ATOM 1274 N PRO A 88 10.303 -21.009 -5.290 1.00 0.00 N ATOM 1275 CA PRO A 88 9.094 -20.879 -6.098 1.00 0.00 C ATOM 1276 C PRO A 88 8.134 -19.783 -5.643 1.00 0.00 C ATOM 1277 O PRO A 88 7.434 -19.229 -6.491 1.00 0.00 O ATOM 1278 CB PRO A 88 8.438 -22.264 -6.090 1.00 0.00 C ATOM 1279 CG PRO A 88 8.970 -22.909 -4.810 1.00 0.00 C ATOM 1280 CD PRO A 88 10.383 -22.340 -4.710 1.00 0.00 C ATOM 0 HA PRO A 88 9.363 -20.556 -7.104 1.00 0.00 H new ATOM 0 HB2 PRO A 88 7.350 -22.192 -6.080 1.00 0.00 H new ATOM 0 HB3 PRO A 88 8.711 -22.842 -6.973 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.365 -22.646 -3.942 1.00 0.00 H new ATOM 0 HG3 PRO A 88 8.975 -23.997 -4.877 1.00 0.00 H new ATOM 0 HD2 PRO A 88 10.717 -22.298 -3.673 1.00 0.00 H new ATOM 0 HD3 PRO A 88 11.097 -22.962 -5.250 1.00 0.00 H new ATOM 1288 N GLU A 89 8.123 -19.388 -4.367 1.00 0.00 N ATOM 1289 CA GLU A 89 7.271 -18.307 -3.876 1.00 0.00 C ATOM 1290 C GLU A 89 7.517 -16.985 -4.624 1.00 0.00 C ATOM 1291 O GLU A 89 6.633 -16.124 -4.653 1.00 0.00 O ATOM 1292 CB GLU A 89 7.416 -18.132 -2.352 1.00 0.00 C ATOM 1293 CG GLU A 89 8.843 -17.884 -1.827 1.00 0.00 C ATOM 1294 CD GLU A 89 9.522 -19.179 -1.332 1.00 0.00 C ATOM 1295 OE1 GLU A 89 9.582 -20.172 -2.094 1.00 0.00 O ATOM 1296 OE2 GLU A 89 10.001 -19.208 -0.171 1.00 0.00 O ATOM 0 H GLU A 89 8.707 -19.811 -3.646 1.00 0.00 H new ATOM 0 HA GLU A 89 6.240 -18.594 -4.082 1.00 0.00 H new ATOM 0 HB2 GLU A 89 6.787 -17.297 -2.042 1.00 0.00 H new ATOM 0 HB3 GLU A 89 7.023 -19.025 -1.866 1.00 0.00 H new ATOM 0 HG2 GLU A 89 9.447 -17.441 -2.619 1.00 0.00 H new ATOM 0 HG3 GLU A 89 8.807 -17.162 -1.012 1.00 0.00 H new ATOM 1303 N TRP A 90 8.675 -16.827 -5.276 1.00 0.00 N ATOM 1304 CA TRP A 90 8.995 -15.627 -6.038 1.00 0.00 C ATOM 1305 C TRP A 90 8.329 -15.610 -7.419 1.00 0.00 C ATOM 1306 O TRP A 90 8.111 -14.527 -7.956 1.00 0.00 O ATOM 1307 CB TRP A 90 10.521 -15.490 -6.124 1.00 0.00 C ATOM 1308 CG TRP A 90 11.194 -15.197 -4.815 1.00 0.00 C ATOM 1309 CD1 TRP A 90 11.874 -16.071 -4.045 1.00 0.00 C ATOM 1310 CD2 TRP A 90 11.196 -13.949 -4.064 1.00 0.00 C ATOM 1311 NE1 TRP A 90 12.272 -15.459 -2.869 1.00 0.00 N ATOM 1312 CE2 TRP A 90 11.840 -14.151 -2.810 1.00 0.00 C ATOM 1313 CE3 TRP A 90 10.661 -12.675 -4.310 1.00 0.00 C ATOM 1314 CZ2 TRP A 90 11.916 -13.141 -1.838 1.00 0.00 C ATOM 1315 CZ3 TRP A 90 10.706 -11.658 -3.344 1.00 0.00 C ATOM 1316 CH2 TRP A 90 11.336 -11.887 -2.109 1.00 0.00 C ATOM 0 H TRP A 90 9.413 -17.531 -5.287 1.00 0.00 H new ATOM 0 HA TRP A 90 8.587 -14.760 -5.518 1.00 0.00 H new ATOM 0 HB2 TRP A 90 10.934 -16.413 -6.532 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.763 -14.694 -6.829 1.00 0.00 H new ATOM 0 HD1 TRP A 90 12.078 -17.098 -4.308 1.00 0.00 H new ATOM 0 HE1 TRP A 90 12.816 -15.918 -2.138 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.203 -12.472 -5.267 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 12.412 -13.323 -0.896 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 10.256 -10.698 -3.550 1.00 0.00 H new ATOM 0 HH2 TRP A 90 11.375 -11.102 -1.368 1.00 0.00 H new ATOM 1327 N VAL A 91 7.967 -16.768 -7.982 1.00 0.00 N ATOM 1328 CA VAL A 91 7.331 -16.892 -9.287 1.00 0.00 C ATOM 1329 C VAL A 91 5.836 -17.200 -9.197 1.00 0.00 C ATOM 1330 O VAL A 91 5.146 -17.105 -10.206 1.00 0.00 O ATOM 1331 CB VAL A 91 8.095 -17.892 -10.175 1.00 0.00 C ATOM 1332 CG1 VAL A 91 9.403 -17.269 -10.665 1.00 0.00 C ATOM 1333 CG2 VAL A 91 8.384 -19.243 -9.503 1.00 0.00 C ATOM 0 H VAL A 91 8.115 -17.668 -7.525 1.00 0.00 H new ATOM 0 HA VAL A 91 7.389 -15.916 -9.769 1.00 0.00 H new ATOM 0 HB VAL A 91 7.433 -18.106 -11.014 1.00 0.00 H new ATOM 0 HG11 VAL A 91 9.935 -17.985 -11.292 1.00 0.00 H new ATOM 0 HG12 VAL A 91 9.184 -16.372 -11.244 1.00 0.00 H new ATOM 0 HG13 VAL A 91 10.024 -17.005 -9.809 1.00 0.00 H new ATOM 0 HG21 VAL A 91 8.924 -19.886 -10.197 1.00 0.00 H new ATOM 0 HG22 VAL A 91 8.989 -19.083 -8.610 1.00 0.00 H new ATOM 0 HG23 VAL A 91 7.444 -19.719 -9.224 1.00 0.00 H new ATOM 1343 N THR A 92 5.306 -17.499 -8.008 1.00 0.00 N ATOM 1344 CA THR A 92 3.865 -17.650 -7.779 1.00 0.00 C ATOM 1345 C THR A 92 3.345 -16.498 -6.893 1.00 0.00 C ATOM 1346 O THR A 92 2.604 -16.675 -5.923 1.00 0.00 O ATOM 1347 CB THR A 92 3.586 -19.111 -7.348 1.00 0.00 C ATOM 1348 OG1 THR A 92 2.212 -19.461 -7.418 1.00 0.00 O ATOM 1349 CG2 THR A 92 4.131 -19.433 -5.951 1.00 0.00 C ATOM 0 H THR A 92 5.869 -17.644 -7.170 1.00 0.00 H new ATOM 0 HA THR A 92 3.263 -17.528 -8.680 1.00 0.00 H new ATOM 0 HB THR A 92 4.125 -19.718 -8.075 1.00 0.00 H new ATOM 0 HG1 THR A 92 2.097 -20.393 -7.136 1.00 0.00 H new ATOM 0 HG21 THR A 92 3.906 -20.470 -5.703 1.00 0.00 H new ATOM 0 HG22 THR A 92 5.211 -19.283 -5.938 1.00 0.00 H new ATOM 0 HG23 THR A 92 3.664 -18.775 -5.218 1.00 0.00 H new ATOM 1357 N GLN A 93 3.774 -15.279 -7.237 1.00 0.00 N ATOM 1358 CA GLN A 93 3.263 -14.032 -6.691 1.00 0.00 C ATOM 1359 C GLN A 93 1.865 -13.747 -7.267 1.00 0.00 C ATOM 1360 O GLN A 93 1.377 -14.488 -8.127 1.00 0.00 O ATOM 1361 CB GLN A 93 4.273 -12.925 -7.030 1.00 0.00 C ATOM 1362 CG GLN A 93 5.573 -13.075 -6.233 1.00 0.00 C ATOM 1363 CD GLN A 93 5.399 -12.675 -4.769 1.00 0.00 C ATOM 1364 OE1 GLN A 93 5.272 -11.494 -4.471 1.00 0.00 O ATOM 1365 NE2 GLN A 93 5.371 -13.626 -3.848 1.00 0.00 N ATOM 0 H GLN A 93 4.512 -15.136 -7.927 1.00 0.00 H new ATOM 0 HA GLN A 93 3.151 -14.086 -5.608 1.00 0.00 H new ATOM 0 HB2 GLN A 93 4.496 -12.951 -8.097 1.00 0.00 H new ATOM 0 HB3 GLN A 93 3.829 -11.952 -6.821 1.00 0.00 H new ATOM 0 HG2 GLN A 93 5.914 -14.109 -6.288 1.00 0.00 H new ATOM 0 HG3 GLN A 93 6.349 -12.459 -6.687 1.00 0.00 H new ATOM 0 HE21 GLN A 93 5.479 -14.603 -4.120 1.00 0.00 H new ATOM 0 HE22 GLN A 93 5.241 -13.382 -2.866 1.00 0.00 H new ATOM 1374 N GLU A 94 1.224 -12.659 -6.827 1.00 0.00 N ATOM 1375 CA GLU A 94 -0.116 -12.296 -7.302 1.00 0.00 C ATOM 1376 C GLU A 94 -0.098 -11.935 -8.797 1.00 0.00 C ATOM 1377 O GLU A 94 -1.125 -12.030 -9.474 1.00 0.00 O ATOM 1378 CB GLU A 94 -0.688 -11.138 -6.464 1.00 0.00 C ATOM 1379 CG GLU A 94 -0.938 -11.508 -4.992 1.00 0.00 C ATOM 1380 CD GLU A 94 -1.980 -12.633 -4.842 1.00 0.00 C ATOM 1381 OE1 GLU A 94 -3.199 -12.360 -4.983 1.00 0.00 O ATOM 1382 OE2 GLU A 94 -1.597 -13.796 -4.565 1.00 0.00 O ATOM 0 H GLU A 94 1.613 -12.012 -6.141 1.00 0.00 H new ATOM 0 HA GLU A 94 -0.765 -13.163 -7.180 1.00 0.00 H new ATOM 0 HB2 GLU A 94 0.002 -10.295 -6.506 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -1.625 -10.806 -6.911 1.00 0.00 H new ATOM 0 HG2 GLU A 94 0.000 -11.821 -4.534 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.279 -10.625 -4.450 1.00 0.00 H new ATOM 1389 N ILE A 95 1.076 -11.564 -9.316 1.00 0.00 N ATOM 1390 CA ILE A 95 1.372 -11.381 -10.726 1.00 0.00 C ATOM 1391 C ILE A 95 2.779 -11.943 -10.950 1.00 0.00 C ATOM 1392 O ILE A 95 3.702 -11.623 -10.196 1.00 0.00 O ATOM 1393 CB ILE A 95 1.222 -9.890 -11.134 1.00 0.00 C ATOM 1394 CG1 ILE A 95 1.827 -9.643 -12.538 1.00 0.00 C ATOM 1395 CG2 ILE A 95 1.836 -8.944 -10.087 1.00 0.00 C ATOM 1396 CD1 ILE A 95 1.496 -8.277 -13.155 1.00 0.00 C ATOM 0 H ILE A 95 1.885 -11.375 -8.725 1.00 0.00 H new ATOM 0 HA ILE A 95 0.668 -11.913 -11.366 1.00 0.00 H new ATOM 0 HB ILE A 95 0.156 -9.667 -11.178 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.910 -9.743 -12.473 1.00 0.00 H new ATOM 0 HG13 ILE A 95 1.475 -10.424 -13.212 1.00 0.00 H new ATOM 0 HG21 ILE A 95 1.709 -7.911 -10.411 1.00 0.00 H new ATOM 0 HG22 ILE A 95 1.336 -9.087 -9.129 1.00 0.00 H new ATOM 0 HG23 ILE A 95 2.898 -9.162 -9.978 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.964 -8.198 -14.136 1.00 0.00 H new ATOM 0 HD12 ILE A 95 0.416 -8.177 -13.259 1.00 0.00 H new ATOM 0 HD13 ILE A 95 1.874 -7.485 -12.509 1.00 0.00 H new ATOM 1408 N PHE A 96 2.930 -12.781 -11.976 1.00 0.00 N ATOM 1409 CA PHE A 96 4.214 -13.247 -12.485 1.00 0.00 C ATOM 1410 C PHE A 96 4.405 -12.573 -13.855 1.00 0.00 C ATOM 1411 O PHE A 96 3.458 -12.532 -14.647 1.00 0.00 O ATOM 1412 CB PHE A 96 4.241 -14.777 -12.591 1.00 0.00 C ATOM 1413 CG PHE A 96 5.366 -15.302 -13.467 1.00 0.00 C ATOM 1414 CD1 PHE A 96 6.690 -15.314 -12.992 1.00 0.00 C ATOM 1415 CD2 PHE A 96 5.095 -15.714 -14.788 1.00 0.00 C ATOM 1416 CE1 PHE A 96 7.737 -15.723 -13.839 1.00 0.00 C ATOM 1417 CE2 PHE A 96 6.144 -16.113 -15.634 1.00 0.00 C ATOM 1418 CZ PHE A 96 7.467 -16.107 -15.163 1.00 0.00 C ATOM 0 H PHE A 96 2.136 -13.164 -12.489 1.00 0.00 H new ATOM 0 HA PHE A 96 5.029 -12.983 -11.812 1.00 0.00 H new ATOM 0 HB2 PHE A 96 4.340 -15.201 -11.592 1.00 0.00 H new ATOM 0 HB3 PHE A 96 3.288 -15.123 -12.991 1.00 0.00 H new ATOM 0 HD1 PHE A 96 6.903 -15.010 -11.978 1.00 0.00 H new ATOM 0 HD2 PHE A 96 4.078 -15.723 -15.151 1.00 0.00 H new ATOM 0 HE1 PHE A 96 8.752 -15.742 -13.470 1.00 0.00 H new ATOM 0 HE2 PHE A 96 5.933 -16.424 -16.646 1.00 0.00 H new ATOM 0 HZ PHE A 96 8.276 -16.397 -15.818 1.00 0.00 H new ATOM 1428 N GLU A 97 5.602 -12.064 -14.143 1.00 0.00 N ATOM 1429 CA GLU A 97 5.961 -11.473 -15.432 1.00 0.00 C ATOM 1430 C GLU A 97 7.402 -11.854 -15.766 1.00 0.00 C ATOM 1431 O GLU A 97 8.169 -12.262 -14.889 1.00 0.00 O ATOM 1432 CB GLU A 97 5.820 -9.947 -15.399 1.00 0.00 C ATOM 1433 CG GLU A 97 4.393 -9.382 -15.419 1.00 0.00 C ATOM 1434 CD GLU A 97 3.707 -9.411 -16.802 1.00 0.00 C ATOM 1435 OE1 GLU A 97 3.999 -10.294 -17.644 1.00 0.00 O ATOM 1436 OE2 GLU A 97 2.848 -8.527 -17.049 1.00 0.00 O ATOM 0 H GLU A 97 6.368 -12.051 -13.470 1.00 0.00 H new ATOM 0 HA GLU A 97 5.284 -11.855 -16.196 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.318 -9.579 -14.502 1.00 0.00 H new ATOM 0 HB3 GLU A 97 6.359 -9.538 -16.253 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.783 -9.947 -14.714 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.420 -8.352 -15.063 1.00 0.00 H new ATOM 1443 N ASP A 98 7.750 -11.705 -17.041 1.00 0.00 N ATOM 1444 CA ASP A 98 8.976 -12.178 -17.679 1.00 0.00 C ATOM 1445 C ASP A 98 8.959 -11.659 -19.112 1.00 0.00 C ATOM 1446 O ASP A 98 7.950 -11.822 -19.807 1.00 0.00 O ATOM 1447 CB ASP A 98 9.056 -13.715 -17.719 1.00 0.00 C ATOM 1448 CG ASP A 98 10.058 -14.220 -18.783 1.00 0.00 C ATOM 1449 OD1 ASP A 98 11.223 -13.756 -18.836 1.00 0.00 O ATOM 1450 OD2 ASP A 98 9.666 -15.093 -19.597 1.00 0.00 O ATOM 0 H ASP A 98 7.143 -11.218 -17.700 1.00 0.00 H new ATOM 0 HA ASP A 98 9.834 -11.819 -17.110 1.00 0.00 H new ATOM 0 HB2 ASP A 98 9.352 -14.087 -16.738 1.00 0.00 H new ATOM 0 HB3 ASP A 98 8.068 -14.123 -17.930 1.00 0.00 H new ATOM 1455 N TRP A 99 10.051 -11.027 -19.546 1.00 0.00 N ATOM 1456 CA TRP A 99 10.106 -10.332 -20.829 1.00 0.00 C ATOM 1457 C TRP A 99 11.483 -10.500 -21.455 1.00 0.00 C ATOM 1458 O TRP A 99 12.492 -10.353 -20.766 1.00 0.00 O ATOM 1459 CB TRP A 99 9.803 -8.838 -20.630 1.00 0.00 C ATOM 1460 CG TRP A 99 8.465 -8.497 -20.042 1.00 0.00 C ATOM 1461 CD1 TRP A 99 7.252 -8.904 -20.481 1.00 0.00 C ATOM 1462 CD2 TRP A 99 8.191 -7.695 -18.858 1.00 0.00 C ATOM 1463 NE1 TRP A 99 6.265 -8.443 -19.631 1.00 0.00 N ATOM 1464 CE2 TRP A 99 6.785 -7.670 -18.623 1.00 0.00 C ATOM 1465 CE3 TRP A 99 9.006 -7.003 -17.943 1.00 0.00 C ATOM 1466 CZ2 TRP A 99 6.213 -6.988 -17.542 1.00 0.00 C ATOM 1467 CZ3 TRP A 99 8.442 -6.355 -16.833 1.00 0.00 C ATOM 1468 CH2 TRP A 99 7.055 -6.336 -16.633 1.00 0.00 C ATOM 0 H TRP A 99 10.921 -10.984 -19.016 1.00 0.00 H new ATOM 0 HA TRP A 99 9.358 -10.762 -21.495 1.00 0.00 H new ATOM 0 HB2 TRP A 99 10.575 -8.416 -19.987 1.00 0.00 H new ATOM 0 HB3 TRP A 99 9.887 -8.341 -21.597 1.00 0.00 H new ATOM 0 HD1 TRP A 99 7.080 -9.501 -21.365 1.00 0.00 H new ATOM 0 HE1 TRP A 99 5.272 -8.651 -19.739 1.00 0.00 H new ATOM 0 HE3 TRP A 99 10.075 -6.970 -18.096 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 5.141 -6.965 -17.412 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 9.088 -5.863 -16.121 1.00 0.00 H new ATOM 0 HH2 TRP A 99 6.637 -5.820 -15.781 1.00 0.00 H new ATOM 1479 N GLN A 100 11.539 -10.694 -22.776 1.00 0.00 N ATOM 1480 CA GLN A 100 12.787 -10.698 -23.538 1.00 0.00 C ATOM 1481 C GLN A 100 13.161 -9.255 -23.899 1.00 0.00 C ATOM 1482 O GLN A 100 13.236 -8.880 -25.071 1.00 0.00 O ATOM 1483 CB GLN A 100 12.697 -11.650 -24.747 1.00 0.00 C ATOM 1484 CG GLN A 100 12.423 -13.128 -24.399 1.00 0.00 C ATOM 1485 CD GLN A 100 13.552 -13.857 -23.653 1.00 0.00 C ATOM 1486 OE1 GLN A 100 14.517 -13.269 -23.164 1.00 0.00 O ATOM 1487 NE2 GLN A 100 13.452 -15.171 -23.529 1.00 0.00 N ATOM 0 H GLN A 100 10.711 -10.854 -23.350 1.00 0.00 H new ATOM 0 HA GLN A 100 13.601 -11.095 -22.931 1.00 0.00 H new ATOM 0 HB2 GLN A 100 11.907 -11.297 -25.410 1.00 0.00 H new ATOM 0 HB3 GLN A 100 13.631 -11.592 -25.306 1.00 0.00 H new ATOM 0 HG2 GLN A 100 11.520 -13.178 -23.791 1.00 0.00 H new ATOM 0 HG3 GLN A 100 12.216 -13.667 -25.323 1.00 0.00 H new ATOM 0 HE21 GLN A 100 12.654 -15.662 -23.933 1.00 0.00 H new ATOM 0 HE22 GLN A 100 14.173 -15.692 -23.030 1.00 0.00 H new ATOM 1496 N LEU A 101 13.347 -8.429 -22.865 1.00 0.00 N ATOM 1497 CA LEU A 101 13.859 -7.069 -22.998 1.00 0.00 C ATOM 1498 C LEU A 101 15.294 -7.147 -23.519 1.00 0.00 C ATOM 1499 O LEU A 101 16.054 -8.005 -23.070 1.00 0.00 O ATOM 1500 CB LEU A 101 13.814 -6.357 -21.623 1.00 0.00 C ATOM 1501 CG LEU A 101 12.458 -5.721 -21.278 1.00 0.00 C ATOM 1502 CD1 LEU A 101 12.402 -5.394 -19.779 1.00 0.00 C ATOM 1503 CD2 LEU A 101 12.167 -4.529 -22.194 1.00 0.00 C ATOM 0 H LEU A 101 13.142 -8.693 -21.901 1.00 0.00 H new ATOM 0 HA LEU A 101 13.248 -6.497 -23.696 1.00 0.00 H new ATOM 0 HB2 LEU A 101 14.071 -7.077 -20.847 1.00 0.00 H new ATOM 0 HB3 LEU A 101 14.580 -5.582 -21.604 1.00 0.00 H new ATOM 0 HG LEU A 101 11.652 -6.431 -21.467 1.00 0.00 H new ATOM 0 HD11 LEU A 101 11.439 -4.943 -19.541 1.00 0.00 H new ATOM 0 HD12 LEU A 101 12.527 -6.310 -19.202 1.00 0.00 H new ATOM 0 HD13 LEU A 101 13.201 -4.696 -19.529 1.00 0.00 H new ATOM 0 HD21 LEU A 101 11.202 -4.095 -21.931 1.00 0.00 H new ATOM 0 HD22 LEU A 101 12.948 -3.778 -22.073 1.00 0.00 H new ATOM 0 HD23 LEU A 101 12.144 -4.864 -23.231 1.00 0.00 H new ATOM 1515 N GLU A 102 15.687 -6.277 -24.448 1.00 0.00 N ATOM 1516 CA GLU A 102 17.087 -6.145 -24.806 1.00 0.00 C ATOM 1517 C GLU A 102 17.830 -5.527 -23.618 1.00 0.00 C ATOM 1518 O GLU A 102 17.224 -4.895 -22.746 1.00 0.00 O ATOM 1519 CB GLU A 102 17.256 -5.295 -26.079 1.00 0.00 C ATOM 1520 CG GLU A 102 17.183 -6.126 -27.360 1.00 0.00 C ATOM 1521 CD GLU A 102 18.351 -7.130 -27.469 1.00 0.00 C ATOM 1522 OE1 GLU A 102 19.530 -6.698 -27.493 1.00 0.00 O ATOM 1523 OE2 GLU A 102 18.092 -8.357 -27.524 1.00 0.00 O ATOM 0 H GLU A 102 15.056 -5.660 -24.960 1.00 0.00 H new ATOM 0 HA GLU A 102 17.507 -7.126 -25.028 1.00 0.00 H new ATOM 0 HB2 GLU A 102 16.482 -4.528 -26.104 1.00 0.00 H new ATOM 0 HB3 GLU A 102 18.215 -4.778 -26.041 1.00 0.00 H new ATOM 0 HG2 GLU A 102 16.237 -6.667 -27.387 1.00 0.00 H new ATOM 0 HG3 GLU A 102 17.195 -5.461 -28.224 1.00 0.00 H new ATOM 1530 N ASP A 103 19.153 -5.678 -23.593 1.00 0.00 N ATOM 1531 CA ASP A 103 20.032 -4.979 -22.676 1.00 0.00 C ATOM 1532 C ASP A 103 21.170 -4.382 -23.502 1.00 0.00 C ATOM 1533 O ASP A 103 21.715 -5.080 -24.360 1.00 0.00 O ATOM 1534 CB ASP A 103 20.556 -5.883 -21.565 1.00 0.00 C ATOM 1535 CG ASP A 103 21.368 -5.030 -20.589 1.00 0.00 C ATOM 1536 OD1 ASP A 103 22.543 -4.722 -20.874 1.00 0.00 O ATOM 1537 OD2 ASP A 103 20.784 -4.621 -19.558 1.00 0.00 O ATOM 0 H ASP A 103 19.648 -6.305 -24.227 1.00 0.00 H new ATOM 0 HA ASP A 103 19.477 -4.192 -22.165 1.00 0.00 H new ATOM 0 HB2 ASP A 103 19.727 -6.366 -21.047 1.00 0.00 H new ATOM 0 HB3 ASP A 103 21.177 -6.676 -21.983 1.00 0.00 H new ATOM 1542 N PRO A 104 21.507 -3.095 -23.328 1.00 0.00 N ATOM 1543 CA PRO A 104 22.425 -2.408 -24.223 1.00 0.00 C ATOM 1544 C PRO A 104 23.919 -2.713 -23.975 1.00 0.00 C ATOM 1545 O PRO A 104 24.749 -2.227 -24.747 1.00 0.00 O ATOM 1546 CB PRO A 104 22.082 -0.940 -24.026 1.00 0.00 C ATOM 1547 CG PRO A 104 21.687 -0.856 -22.553 1.00 0.00 C ATOM 1548 CD PRO A 104 20.908 -2.154 -22.393 1.00 0.00 C ATOM 0 HA PRO A 104 22.300 -2.744 -25.252 1.00 0.00 H new ATOM 0 HB2 PRO A 104 22.933 -0.296 -24.250 1.00 0.00 H new ATOM 0 HB3 PRO A 104 21.266 -0.628 -24.678 1.00 0.00 H new ATOM 0 HG2 PRO A 104 22.554 -0.811 -21.894 1.00 0.00 H new ATOM 0 HG3 PRO A 104 21.077 0.021 -22.338 1.00 0.00 H new ATOM 0 HD2 PRO A 104 20.972 -2.525 -21.370 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.851 -2.005 -22.612 1.00 0.00 H new ATOM 1556 N ASP A 105 24.282 -3.492 -22.947 1.00 0.00 N ATOM 1557 CA ASP A 105 25.676 -3.862 -22.686 1.00 0.00 C ATOM 1558 C ASP A 105 26.341 -4.433 -23.948 1.00 0.00 C ATOM 1559 O ASP A 105 25.808 -5.350 -24.583 1.00 0.00 O ATOM 1560 CB ASP A 105 25.781 -4.903 -21.571 1.00 0.00 C ATOM 1561 CG ASP A 105 27.223 -5.451 -21.490 1.00 0.00 C ATOM 1562 OD1 ASP A 105 28.184 -4.647 -21.398 1.00 0.00 O ATOM 1563 OD2 ASP A 105 27.405 -6.692 -21.574 1.00 0.00 O ATOM 0 H ASP A 105 23.619 -3.881 -22.276 1.00 0.00 H new ATOM 0 HA ASP A 105 26.188 -2.950 -22.378 1.00 0.00 H new ATOM 0 HB2 ASP A 105 25.500 -4.456 -20.618 1.00 0.00 H new ATOM 0 HB3 ASP A 105 25.083 -5.719 -21.758 1.00 0.00 H new ATOM 1568 N GLY A 106 27.517 -3.902 -24.296 1.00 0.00 N ATOM 1569 CA GLY A 106 28.357 -4.440 -25.360 1.00 0.00 C ATOM 1570 C GLY A 106 27.820 -4.183 -26.773 1.00 0.00 C ATOM 1571 O GLY A 106 28.342 -4.773 -27.723 1.00 0.00 O ATOM 0 H GLY A 106 27.912 -3.079 -23.841 1.00 0.00 H new ATOM 0 HA2 GLY A 106 29.353 -4.005 -25.277 1.00 0.00 H new ATOM 0 HA3 GLY A 106 28.465 -5.515 -25.214 1.00 0.00 H new ATOM 1575 N GLN A 107 26.800 -3.328 -26.935 1.00 0.00 N ATOM 1576 CA GLN A 107 26.258 -2.945 -28.237 1.00 0.00 C ATOM 1577 C GLN A 107 25.990 -1.428 -28.308 1.00 0.00 C ATOM 1578 O GLN A 107 26.403 -0.670 -27.427 1.00 0.00 O ATOM 1579 CB GLN A 107 25.082 -3.863 -28.620 1.00 0.00 C ATOM 1580 CG GLN A 107 23.876 -3.801 -27.680 1.00 0.00 C ATOM 1581 CD GLN A 107 22.804 -4.830 -28.083 1.00 0.00 C ATOM 1582 OE1 GLN A 107 22.617 -5.140 -29.260 1.00 0.00 O ATOM 1583 NE2 GLN A 107 22.060 -5.387 -27.137 1.00 0.00 N ATOM 0 H GLN A 107 26.325 -2.880 -26.152 1.00 0.00 H new ATOM 0 HA GLN A 107 27.000 -3.110 -29.018 1.00 0.00 H new ATOM 0 HB2 GLN A 107 24.752 -3.604 -29.626 1.00 0.00 H new ATOM 0 HB3 GLN A 107 25.441 -4.891 -28.657 1.00 0.00 H new ATOM 0 HG2 GLN A 107 24.199 -3.990 -26.656 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.448 -2.799 -27.699 1.00 0.00 H new ATOM 0 HE21 GLN A 107 22.207 -5.137 -26.159 1.00 0.00 H new ATOM 0 HE22 GLN A 107 21.341 -6.066 -27.387 1.00 0.00 H new ATOM 1592 N SER A 108 25.326 -0.986 -29.378 1.00 0.00 N ATOM 1593 CA SER A 108 25.209 0.420 -29.746 1.00 0.00 C ATOM 1594 C SER A 108 24.374 1.327 -28.834 1.00 0.00 C ATOM 1595 O SER A 108 23.430 0.894 -28.174 1.00 0.00 O ATOM 1596 CB SER A 108 24.731 0.514 -31.210 1.00 0.00 C ATOM 1597 OG SER A 108 25.363 -0.474 -32.018 1.00 0.00 O ATOM 0 H SER A 108 24.846 -1.612 -30.024 1.00 0.00 H new ATOM 0 HA SER A 108 26.213 0.824 -29.614 1.00 0.00 H new ATOM 0 HB2 SER A 108 23.649 0.386 -31.252 1.00 0.00 H new ATOM 0 HB3 SER A 108 24.950 1.506 -31.605 1.00 0.00 H new ATOM 0 HG SER A 108 25.043 -0.396 -32.941 1.00 0.00 H new ATOM 1603 N LEU A 109 24.649 2.639 -28.925 1.00 0.00 N ATOM 1604 CA LEU A 109 23.886 3.741 -28.334 1.00 0.00 C ATOM 1605 C LEU A 109 22.420 3.687 -28.745 1.00 0.00 C ATOM 1606 O LEU A 109 21.541 3.990 -27.945 1.00 0.00 O ATOM 1607 CB LEU A 109 24.533 5.049 -28.819 1.00 0.00 C ATOM 1608 CG LEU A 109 23.904 6.336 -28.255 1.00 0.00 C ATOM 1609 CD1 LEU A 109 24.006 6.386 -26.728 1.00 0.00 C ATOM 1610 CD2 LEU A 109 24.630 7.540 -28.861 1.00 0.00 C ATOM 0 H LEU A 109 25.460 2.974 -29.445 1.00 0.00 H new ATOM 0 HA LEU A 109 23.909 3.672 -27.246 1.00 0.00 H new ATOM 0 HB2 LEU A 109 25.590 5.033 -28.554 1.00 0.00 H new ATOM 0 HB3 LEU A 109 24.477 5.082 -29.907 1.00 0.00 H new ATOM 0 HG LEU A 109 22.846 6.355 -28.517 1.00 0.00 H new ATOM 0 HD11 LEU A 109 23.552 7.307 -26.363 1.00 0.00 H new ATOM 0 HD12 LEU A 109 23.484 5.530 -26.300 1.00 0.00 H new ATOM 0 HD13 LEU A 109 25.055 6.356 -26.432 1.00 0.00 H new ATOM 0 HD21 LEU A 109 24.196 8.461 -28.471 1.00 0.00 H new ATOM 0 HD22 LEU A 109 25.687 7.498 -28.598 1.00 0.00 H new ATOM 0 HD23 LEU A 109 24.525 7.520 -29.946 1.00 0.00 H new ATOM 1622 N GLU A 110 22.139 3.239 -29.966 1.00 0.00 N ATOM 1623 CA GLU A 110 20.771 3.096 -30.440 1.00 0.00 C ATOM 1624 C GLU A 110 20.024 2.037 -29.630 1.00 0.00 C ATOM 1625 O GLU A 110 18.821 2.162 -29.415 1.00 0.00 O ATOM 1626 CB GLU A 110 20.790 2.827 -31.953 1.00 0.00 C ATOM 1627 CG GLU A 110 19.444 3.125 -32.631 1.00 0.00 C ATOM 1628 CD GLU A 110 18.959 4.588 -32.482 1.00 0.00 C ATOM 1629 OE1 GLU A 110 19.779 5.509 -32.236 1.00 0.00 O ATOM 1630 OE2 GLU A 110 17.735 4.825 -32.620 1.00 0.00 O ATOM 0 H GLU A 110 22.848 2.968 -30.647 1.00 0.00 H new ATOM 0 HA GLU A 110 20.214 4.020 -30.286 1.00 0.00 H new ATOM 0 HB2 GLU A 110 21.567 3.436 -32.415 1.00 0.00 H new ATOM 0 HB3 GLU A 110 21.056 1.785 -32.128 1.00 0.00 H new ATOM 0 HG2 GLU A 110 19.526 2.889 -33.692 1.00 0.00 H new ATOM 0 HG3 GLU A 110 18.687 2.461 -32.215 1.00 0.00 H new ATOM 1637 N VAL A 111 20.723 1.030 -29.101 1.00 0.00 N ATOM 1638 CA VAL A 111 20.121 0.029 -28.237 1.00 0.00 C ATOM 1639 C VAL A 111 19.904 0.601 -26.839 1.00 0.00 C ATOM 1640 O VAL A 111 18.858 0.332 -26.268 1.00 0.00 O ATOM 1641 CB VAL A 111 20.914 -1.286 -28.229 1.00 0.00 C ATOM 1642 CG1 VAL A 111 20.036 -2.399 -27.632 1.00 0.00 C ATOM 1643 CG2 VAL A 111 21.345 -1.703 -29.648 1.00 0.00 C ATOM 0 H VAL A 111 21.720 0.891 -29.263 1.00 0.00 H new ATOM 0 HA VAL A 111 19.142 -0.228 -28.642 1.00 0.00 H new ATOM 0 HB VAL A 111 21.812 -1.133 -27.630 1.00 0.00 H new ATOM 0 HG11 VAL A 111 20.593 -3.336 -27.623 1.00 0.00 H new ATOM 0 HG12 VAL A 111 19.756 -2.134 -26.613 1.00 0.00 H new ATOM 0 HG13 VAL A 111 19.137 -2.517 -28.237 1.00 0.00 H new ATOM 0 HG21 VAL A 111 21.903 -2.638 -29.599 1.00 0.00 H new ATOM 0 HG22 VAL A 111 20.461 -1.841 -30.271 1.00 0.00 H new ATOM 0 HG23 VAL A 111 21.976 -0.926 -30.080 1.00 0.00 H new ATOM 1653 N PHE A 112 20.797 1.441 -26.296 1.00 0.00 N ATOM 1654 CA PHE A 112 20.510 2.170 -25.048 1.00 0.00 C ATOM 1655 C PHE A 112 19.221 2.984 -25.211 1.00 0.00 C ATOM 1656 O PHE A 112 18.300 2.857 -24.403 1.00 0.00 O ATOM 1657 CB PHE A 112 21.676 3.095 -24.651 1.00 0.00 C ATOM 1658 CG PHE A 112 22.882 2.406 -24.034 1.00 0.00 C ATOM 1659 CD1 PHE A 112 22.923 2.170 -22.646 1.00 0.00 C ATOM 1660 CD2 PHE A 112 23.954 1.975 -24.839 1.00 0.00 C ATOM 1661 CE1 PHE A 112 23.995 1.449 -22.084 1.00 0.00 C ATOM 1662 CE2 PHE A 112 25.035 1.278 -24.274 1.00 0.00 C ATOM 1663 CZ PHE A 112 25.043 0.990 -22.899 1.00 0.00 C ATOM 0 H PHE A 112 21.716 1.633 -26.695 1.00 0.00 H new ATOM 0 HA PHE A 112 20.383 1.439 -24.250 1.00 0.00 H new ATOM 0 HB2 PHE A 112 22.004 3.637 -25.538 1.00 0.00 H new ATOM 0 HB3 PHE A 112 21.303 3.837 -23.944 1.00 0.00 H new ATOM 0 HD1 PHE A 112 22.132 2.542 -22.012 1.00 0.00 H new ATOM 0 HD2 PHE A 112 23.945 2.182 -25.899 1.00 0.00 H new ATOM 0 HE1 PHE A 112 24.011 1.248 -21.023 1.00 0.00 H new ATOM 0 HE2 PHE A 112 25.860 0.964 -24.897 1.00 0.00 H new ATOM 0 HZ PHE A 112 25.852 0.418 -22.470 1.00 0.00 H new ATOM 1673 N ARG A 113 19.119 3.750 -26.303 1.00 0.00 N ATOM 1674 CA ARG A 113 17.935 4.558 -26.618 1.00 0.00 C ATOM 1675 C ARG A 113 16.689 3.671 -26.735 1.00 0.00 C ATOM 1676 O ARG A 113 15.652 3.996 -26.162 1.00 0.00 O ATOM 1677 CB ARG A 113 18.182 5.325 -27.931 1.00 0.00 C ATOM 1678 CG ARG A 113 19.224 6.452 -27.810 1.00 0.00 C ATOM 1679 CD ARG A 113 19.818 6.759 -29.188 1.00 0.00 C ATOM 1680 NE ARG A 113 20.567 8.027 -29.228 1.00 0.00 N ATOM 1681 CZ ARG A 113 21.133 8.536 -30.333 1.00 0.00 C ATOM 1682 NH1 ARG A 113 21.059 7.893 -31.499 1.00 0.00 N ATOM 1683 NH2 ARG A 113 21.782 9.698 -30.266 1.00 0.00 N ATOM 0 H ARG A 113 19.861 3.827 -26.998 1.00 0.00 H new ATOM 0 HA ARG A 113 17.760 5.270 -25.812 1.00 0.00 H new ATOM 0 HB2 ARG A 113 18.511 4.621 -28.695 1.00 0.00 H new ATOM 0 HB3 ARG A 113 17.239 5.751 -28.274 1.00 0.00 H new ATOM 0 HG2 ARG A 113 18.759 7.347 -27.397 1.00 0.00 H new ATOM 0 HG3 ARG A 113 20.015 6.156 -27.121 1.00 0.00 H new ATOM 0 HD2 ARG A 113 20.480 5.944 -29.481 1.00 0.00 H new ATOM 0 HD3 ARG A 113 19.014 6.796 -29.923 1.00 0.00 H new ATOM 0 HE ARG A 113 20.662 8.552 -28.359 1.00 0.00 H new ATOM 0 HH11 ARG A 113 20.567 7.002 -31.559 1.00 0.00 H new ATOM 0 HH12 ARG A 113 21.494 8.293 -32.330 1.00 0.00 H new ATOM 0 HH21 ARG A 113 21.847 10.196 -29.378 1.00 0.00 H new ATOM 0 HH22 ARG A 113 22.214 10.090 -31.103 1.00 0.00 H new ATOM 1697 N THR A 114 16.795 2.527 -27.413 1.00 0.00 N ATOM 1698 CA THR A 114 15.710 1.593 -27.607 1.00 0.00 C ATOM 1699 C THR A 114 15.292 0.990 -26.268 1.00 0.00 C ATOM 1700 O THR A 114 14.106 0.990 -25.958 1.00 0.00 O ATOM 1701 CB THR A 114 16.205 0.538 -28.610 1.00 0.00 C ATOM 1702 OG1 THR A 114 16.321 1.095 -29.909 1.00 0.00 O ATOM 1703 CG2 THR A 114 15.317 -0.693 -28.663 1.00 0.00 C ATOM 0 H THR A 114 17.666 2.226 -27.850 1.00 0.00 H new ATOM 0 HA THR A 114 14.819 2.077 -28.007 1.00 0.00 H new ATOM 0 HB THR A 114 17.185 0.219 -28.255 1.00 0.00 H new ATOM 0 HG1 THR A 114 17.180 1.560 -29.990 1.00 0.00 H new ATOM 0 HG21 THR A 114 15.719 -1.400 -29.389 1.00 0.00 H new ATOM 0 HG22 THR A 114 15.285 -1.161 -27.679 1.00 0.00 H new ATOM 0 HG23 THR A 114 14.309 -0.402 -28.959 1.00 0.00 H new ATOM 1711 N VAL A 115 16.223 0.493 -25.455 1.00 0.00 N ATOM 1712 CA VAL A 115 15.898 -0.246 -24.243 1.00 0.00 C ATOM 1713 C VAL A 115 15.256 0.695 -23.236 1.00 0.00 C ATOM 1714 O VAL A 115 14.298 0.305 -22.579 1.00 0.00 O ATOM 1715 CB VAL A 115 17.143 -0.999 -23.727 1.00 0.00 C ATOM 1716 CG1 VAL A 115 16.919 -1.620 -22.342 1.00 0.00 C ATOM 1717 CG2 VAL A 115 17.469 -2.138 -24.705 1.00 0.00 C ATOM 0 H VAL A 115 17.224 0.593 -25.621 1.00 0.00 H new ATOM 0 HA VAL A 115 15.160 -1.022 -24.443 1.00 0.00 H new ATOM 0 HB VAL A 115 17.956 -0.276 -23.652 1.00 0.00 H new ATOM 0 HG11 VAL A 115 17.824 -2.138 -22.025 1.00 0.00 H new ATOM 0 HG12 VAL A 115 16.680 -0.834 -21.625 1.00 0.00 H new ATOM 0 HG13 VAL A 115 16.093 -2.330 -22.391 1.00 0.00 H new ATOM 0 HG21 VAL A 115 18.347 -2.679 -24.353 1.00 0.00 H new ATOM 0 HG22 VAL A 115 16.621 -2.821 -24.764 1.00 0.00 H new ATOM 0 HG23 VAL A 115 17.670 -1.723 -25.693 1.00 0.00 H new ATOM 1727 N ARG A 116 15.691 1.952 -23.177 1.00 0.00 N ATOM 1728 CA ARG A 116 15.039 2.951 -22.340 1.00 0.00 C ATOM 1729 C ARG A 116 13.560 3.086 -22.745 1.00 0.00 C ATOM 1730 O ARG A 116 12.700 3.104 -21.871 1.00 0.00 O ATOM 1731 CB ARG A 116 15.881 4.245 -22.410 1.00 0.00 C ATOM 1732 CG ARG A 116 15.402 5.314 -21.419 1.00 0.00 C ATOM 1733 CD ARG A 116 16.464 6.379 -21.094 1.00 0.00 C ATOM 1734 NE ARG A 116 17.072 7.033 -22.273 1.00 0.00 N ATOM 1735 CZ ARG A 116 16.524 7.951 -23.086 1.00 0.00 C ATOM 1736 NH1 ARG A 116 15.257 8.333 -22.942 1.00 0.00 N ATOM 1737 NH2 ARG A 116 17.253 8.488 -24.059 1.00 0.00 N ATOM 0 H ARG A 116 16.494 2.301 -23.701 1.00 0.00 H new ATOM 0 HA ARG A 116 15.002 2.666 -21.289 1.00 0.00 H new ATOM 0 HB2 ARG A 116 16.925 4.007 -22.205 1.00 0.00 H new ATOM 0 HB3 ARG A 116 15.838 4.648 -23.422 1.00 0.00 H new ATOM 0 HG2 ARG A 116 14.520 5.807 -21.828 1.00 0.00 H new ATOM 0 HG3 ARG A 116 15.094 4.827 -20.494 1.00 0.00 H new ATOM 0 HD2 ARG A 116 16.009 7.145 -20.466 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.256 5.914 -20.506 1.00 0.00 H new ATOM 0 HE ARG A 116 18.027 6.752 -22.497 1.00 0.00 H new ATOM 0 HH11 ARG A 116 14.683 7.927 -22.203 1.00 0.00 H new ATOM 0 HH12 ARG A 116 14.860 9.032 -23.570 1.00 0.00 H new ATOM 0 HH21 ARG A 116 18.224 8.203 -24.186 1.00 0.00 H new ATOM 0 HH22 ARG A 116 16.841 9.186 -24.679 1.00 0.00 H new ATOM 1751 N GLY A 117 13.249 3.050 -24.042 1.00 0.00 N ATOM 1752 CA GLY A 117 11.876 3.015 -24.547 1.00 0.00 C ATOM 1753 C GLY A 117 11.153 1.709 -24.196 1.00 0.00 C ATOM 1754 O GLY A 117 10.082 1.748 -23.587 1.00 0.00 O ATOM 0 H GLY A 117 13.953 3.044 -24.780 1.00 0.00 H new ATOM 0 HA2 GLY A 117 11.319 3.857 -24.135 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.887 3.140 -25.630 1.00 0.00 H new ATOM 1758 N GLN A 118 11.743 0.553 -24.532 1.00 0.00 N ATOM 1759 CA GLN A 118 11.132 -0.768 -24.333 1.00 0.00 C ATOM 1760 C GLN A 118 10.735 -0.944 -22.872 1.00 0.00 C ATOM 1761 O GLN A 118 9.630 -1.372 -22.540 1.00 0.00 O ATOM 1762 CB GLN A 118 12.103 -1.914 -24.676 1.00 0.00 C ATOM 1763 CG GLN A 118 12.492 -2.047 -26.150 1.00 0.00 C ATOM 1764 CD GLN A 118 13.165 -3.391 -26.452 1.00 0.00 C ATOM 1765 OE1 GLN A 118 13.822 -4.000 -25.607 1.00 0.00 O ATOM 1766 NE2 GLN A 118 13.013 -3.879 -27.671 1.00 0.00 N ATOM 0 H GLN A 118 12.670 0.509 -24.955 1.00 0.00 H new ATOM 0 HA GLN A 118 10.267 -0.812 -24.994 1.00 0.00 H new ATOM 0 HB2 GLN A 118 13.013 -1.779 -24.092 1.00 0.00 H new ATOM 0 HB3 GLN A 118 11.653 -2.853 -24.354 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.602 -1.941 -26.770 1.00 0.00 H new ATOM 0 HG3 GLN A 118 13.167 -1.235 -26.420 1.00 0.00 H new ATOM 0 HE21 GLN A 118 12.466 -3.365 -28.362 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.442 -4.770 -27.921 1.00 0.00 H new ATOM 1775 N VAL A 119 11.671 -0.627 -21.988 1.00 0.00 N ATOM 1776 CA VAL A 119 11.529 -0.901 -20.571 1.00 0.00 C ATOM 1777 C VAL A 119 10.544 0.084 -19.951 1.00 0.00 C ATOM 1778 O VAL A 119 9.731 -0.354 -19.140 1.00 0.00 O ATOM 1779 CB VAL A 119 12.913 -0.912 -19.909 1.00 0.00 C ATOM 1780 CG1 VAL A 119 12.793 -1.157 -18.408 1.00 0.00 C ATOM 1781 CG2 VAL A 119 13.781 -2.040 -20.478 1.00 0.00 C ATOM 0 H VAL A 119 12.550 -0.172 -22.237 1.00 0.00 H new ATOM 0 HA VAL A 119 11.105 -1.891 -20.405 1.00 0.00 H new ATOM 0 HB VAL A 119 13.366 0.060 -20.107 1.00 0.00 H new ATOM 0 HG11 VAL A 119 13.786 -1.161 -17.959 1.00 0.00 H new ATOM 0 HG12 VAL A 119 12.194 -0.366 -17.957 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.313 -2.120 -18.234 1.00 0.00 H new ATOM 0 HG21 VAL A 119 14.757 -2.028 -19.993 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.297 -2.999 -20.295 1.00 0.00 H new ATOM 0 HG23 VAL A 119 13.907 -1.896 -21.551 1.00 0.00 H new ATOM 1791 N LYS A 120 10.516 1.358 -20.366 1.00 0.00 N ATOM 1792 CA LYS A 120 9.469 2.264 -19.904 1.00 0.00 C ATOM 1793 C LYS A 120 8.115 1.646 -20.227 1.00 0.00 C ATOM 1794 O LYS A 120 7.260 1.584 -19.354 1.00 0.00 O ATOM 1795 CB LYS A 120 9.584 3.621 -20.612 1.00 0.00 C ATOM 1796 CG LYS A 120 8.567 4.637 -20.065 1.00 0.00 C ATOM 1797 CD LYS A 120 8.638 5.954 -20.856 1.00 0.00 C ATOM 1798 CE LYS A 120 7.586 6.944 -20.331 1.00 0.00 C ATOM 1799 NZ LYS A 120 7.568 8.212 -21.110 1.00 0.00 N ATOM 0 H LYS A 120 11.193 1.773 -21.007 1.00 0.00 H new ATOM 0 HA LYS A 120 9.574 2.418 -18.830 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.593 4.013 -20.486 1.00 0.00 H new ATOM 0 HB3 LYS A 120 9.425 3.488 -21.682 1.00 0.00 H new ATOM 0 HG2 LYS A 120 7.561 4.222 -20.128 1.00 0.00 H new ATOM 0 HG3 LYS A 120 8.767 4.828 -19.011 1.00 0.00 H new ATOM 0 HD2 LYS A 120 9.634 6.388 -20.766 1.00 0.00 H new ATOM 0 HD3 LYS A 120 8.469 5.760 -21.915 1.00 0.00 H new ATOM 0 HE2 LYS A 120 6.601 6.480 -20.373 1.00 0.00 H new ATOM 0 HE3 LYS A 120 7.790 7.166 -19.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 6.844 8.849 -20.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 8.500 8.670 -21.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 7.348 8.005 -22.105 1.00 0.00 H new ATOM 1813 N GLU A 121 7.938 1.145 -21.448 1.00 0.00 N ATOM 1814 CA GLU A 121 6.661 0.627 -21.899 1.00 0.00 C ATOM 1815 C GLU A 121 6.268 -0.640 -21.120 1.00 0.00 C ATOM 1816 O GLU A 121 5.125 -0.745 -20.669 1.00 0.00 O ATOM 1817 CB GLU A 121 6.759 0.415 -23.413 1.00 0.00 C ATOM 1818 CG GLU A 121 5.444 -0.099 -24.009 1.00 0.00 C ATOM 1819 CD GLU A 121 5.514 -0.178 -25.543 1.00 0.00 C ATOM 1820 OE1 GLU A 121 5.992 -1.205 -26.085 1.00 0.00 O ATOM 1821 OE2 GLU A 121 5.076 0.785 -26.221 1.00 0.00 O ATOM 0 H GLU A 121 8.679 1.090 -22.147 1.00 0.00 H new ATOM 0 HA GLU A 121 5.856 1.334 -21.699 1.00 0.00 H new ATOM 0 HB2 GLU A 121 7.031 1.355 -23.893 1.00 0.00 H new ATOM 0 HB3 GLU A 121 7.557 -0.296 -23.628 1.00 0.00 H new ATOM 0 HG2 GLU A 121 5.220 -1.085 -23.603 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.627 0.560 -23.714 1.00 0.00 H new ATOM 1828 N ARG A 122 7.201 -1.573 -20.880 1.00 0.00 N ATOM 1829 CA ARG A 122 6.920 -2.770 -20.072 1.00 0.00 C ATOM 1830 C ARG A 122 6.548 -2.390 -18.643 1.00 0.00 C ATOM 1831 O ARG A 122 5.571 -2.905 -18.100 1.00 0.00 O ATOM 1832 CB ARG A 122 8.122 -3.739 -20.061 1.00 0.00 C ATOM 1833 CG ARG A 122 8.433 -4.427 -21.402 1.00 0.00 C ATOM 1834 CD ARG A 122 7.308 -5.345 -21.888 1.00 0.00 C ATOM 1835 NE ARG A 122 7.701 -6.053 -23.123 1.00 0.00 N ATOM 1836 CZ ARG A 122 6.980 -6.989 -23.760 1.00 0.00 C ATOM 1837 NH1 ARG A 122 5.809 -7.393 -23.272 1.00 0.00 N ATOM 1838 NH2 ARG A 122 7.436 -7.516 -24.891 1.00 0.00 N ATOM 0 H ARG A 122 8.156 -1.522 -21.234 1.00 0.00 H new ATOM 0 HA ARG A 122 6.073 -3.278 -20.533 1.00 0.00 H new ATOM 0 HB2 ARG A 122 9.007 -3.188 -19.742 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.938 -4.509 -19.312 1.00 0.00 H new ATOM 0 HG2 ARG A 122 8.622 -3.665 -22.158 1.00 0.00 H new ATOM 0 HG3 ARG A 122 9.349 -5.009 -21.300 1.00 0.00 H new ATOM 0 HD2 ARG A 122 7.063 -6.069 -21.111 1.00 0.00 H new ATOM 0 HD3 ARG A 122 6.408 -4.758 -22.071 1.00 0.00 H new ATOM 0 HE ARG A 122 8.604 -5.808 -23.530 1.00 0.00 H new ATOM 0 HH11 ARG A 122 5.451 -6.991 -22.406 1.00 0.00 H new ATOM 0 HH12 ARG A 122 5.270 -8.105 -23.764 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.331 -7.209 -25.272 1.00 0.00 H new ATOM 0 HH22 ARG A 122 6.891 -8.228 -25.378 1.00 0.00 H new ATOM 1852 N VAL A 123 7.301 -1.479 -18.035 1.00 0.00 N ATOM 1853 CA VAL A 123 7.078 -1.081 -16.652 1.00 0.00 C ATOM 1854 C VAL A 123 5.757 -0.295 -16.558 1.00 0.00 C ATOM 1855 O VAL A 123 4.995 -0.515 -15.619 1.00 0.00 O ATOM 1856 CB VAL A 123 8.324 -0.358 -16.124 1.00 0.00 C ATOM 1857 CG1 VAL A 123 8.151 0.129 -14.684 1.00 0.00 C ATOM 1858 CG2 VAL A 123 9.578 -1.255 -16.126 1.00 0.00 C ATOM 0 H VAL A 123 8.079 -0.998 -18.486 1.00 0.00 H new ATOM 0 HA VAL A 123 6.948 -1.939 -15.992 1.00 0.00 H new ATOM 0 HB VAL A 123 8.452 0.483 -16.806 1.00 0.00 H new ATOM 0 HG11 VAL A 123 9.061 0.634 -14.359 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.313 0.824 -14.633 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.956 -0.723 -14.033 1.00 0.00 H new ATOM 0 HG21 VAL A 123 10.429 -0.692 -15.743 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.404 -2.125 -15.493 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.789 -1.583 -17.144 1.00 0.00 H new ATOM 1868 N GLU A 124 5.422 0.544 -17.544 1.00 0.00 N ATOM 1869 CA GLU A 124 4.138 1.228 -17.616 1.00 0.00 C ATOM 1870 C GLU A 124 3.004 0.209 -17.676 1.00 0.00 C ATOM 1871 O GLU A 124 2.025 0.352 -16.950 1.00 0.00 O ATOM 1872 CB GLU A 124 4.056 2.181 -18.827 1.00 0.00 C ATOM 1873 CG GLU A 124 4.634 3.577 -18.572 1.00 0.00 C ATOM 1874 CD GLU A 124 4.223 4.559 -19.683 1.00 0.00 C ATOM 1875 OE1 GLU A 124 4.739 4.453 -20.820 1.00 0.00 O ATOM 1876 OE2 GLU A 124 3.382 5.451 -19.419 1.00 0.00 O ATOM 0 H GLU A 124 6.045 0.766 -18.320 1.00 0.00 H new ATOM 0 HA GLU A 124 4.039 1.833 -16.715 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.585 1.729 -19.666 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.012 2.282 -19.125 1.00 0.00 H new ATOM 0 HG2 GLU A 124 4.286 3.948 -17.608 1.00 0.00 H new ATOM 0 HG3 GLU A 124 5.721 3.519 -18.517 1.00 0.00 H new ATOM 1883 N ASN A 125 3.142 -0.831 -18.496 1.00 0.00 N ATOM 1884 CA ASN A 125 2.114 -1.857 -18.667 1.00 0.00 C ATOM 1885 C ASN A 125 1.891 -2.656 -17.375 1.00 0.00 C ATOM 1886 O ASN A 125 0.748 -2.899 -16.989 1.00 0.00 O ATOM 1887 CB ASN A 125 2.496 -2.781 -19.834 1.00 0.00 C ATOM 1888 CG ASN A 125 1.412 -3.816 -20.102 1.00 0.00 C ATOM 1889 OD1 ASN A 125 1.547 -4.980 -19.736 1.00 0.00 O ATOM 1890 ND2 ASN A 125 0.313 -3.427 -20.732 1.00 0.00 N ATOM 0 H ASN A 125 3.975 -0.987 -19.064 1.00 0.00 H new ATOM 0 HA ASN A 125 1.170 -1.365 -18.900 1.00 0.00 H new ATOM 0 HB2 ASN A 125 2.662 -2.186 -20.732 1.00 0.00 H new ATOM 0 HB3 ASN A 125 3.435 -3.286 -19.608 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -0.433 -4.098 -20.918 1.00 0.00 H new ATOM 0 HD22 ASN A 125 0.213 -2.457 -21.031 1.00 0.00 H new ATOM 1897 N LEU A 126 2.973 -3.018 -16.678 1.00 0.00 N ATOM 1898 CA LEU A 126 2.982 -3.669 -15.372 1.00 0.00 C ATOM 1899 C LEU A 126 2.251 -2.818 -14.339 1.00 0.00 C ATOM 1900 O LEU A 126 1.377 -3.320 -13.638 1.00 0.00 O ATOM 1901 CB LEU A 126 4.453 -3.908 -15.011 1.00 0.00 C ATOM 1902 CG LEU A 126 4.773 -4.618 -13.688 1.00 0.00 C ATOM 1903 CD1 LEU A 126 4.984 -3.650 -12.518 1.00 0.00 C ATOM 1904 CD2 LEU A 126 3.780 -5.717 -13.326 1.00 0.00 C ATOM 0 H LEU A 126 3.915 -2.854 -17.033 1.00 0.00 H new ATOM 0 HA LEU A 126 2.451 -4.620 -15.392 1.00 0.00 H new ATOM 0 HB2 LEU A 126 4.903 -4.488 -15.817 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.953 -2.940 -14.998 1.00 0.00 H new ATOM 0 HG LEU A 126 5.728 -5.111 -13.871 1.00 0.00 H new ATOM 0 HD11 LEU A 126 5.206 -4.216 -11.613 1.00 0.00 H new ATOM 0 HD12 LEU A 126 5.816 -2.983 -12.743 1.00 0.00 H new ATOM 0 HD13 LEU A 126 4.079 -3.062 -12.365 1.00 0.00 H new ATOM 0 HD21 LEU A 126 4.071 -6.173 -12.380 1.00 0.00 H new ATOM 0 HD22 LEU A 126 2.782 -5.289 -13.231 1.00 0.00 H new ATOM 0 HD23 LEU A 126 3.776 -6.476 -14.108 1.00 0.00 H new ATOM 1916 N ILE A 127 2.555 -1.526 -14.262 1.00 0.00 N ATOM 1917 CA ILE A 127 1.918 -0.617 -13.323 1.00 0.00 C ATOM 1918 C ILE A 127 0.445 -0.481 -13.698 1.00 0.00 C ATOM 1919 O ILE A 127 -0.414 -0.632 -12.836 1.00 0.00 O ATOM 1920 CB ILE A 127 2.691 0.713 -13.386 1.00 0.00 C ATOM 1921 CG1 ILE A 127 4.050 0.500 -12.695 1.00 0.00 C ATOM 1922 CG2 ILE A 127 1.920 1.860 -12.719 1.00 0.00 C ATOM 1923 CD1 ILE A 127 5.053 1.602 -12.993 1.00 0.00 C ATOM 0 H ILE A 127 3.255 -1.080 -14.855 1.00 0.00 H new ATOM 0 HA ILE A 127 1.946 -0.978 -12.295 1.00 0.00 H new ATOM 0 HB ILE A 127 2.828 1.000 -14.428 1.00 0.00 H new ATOM 0 HG12 ILE A 127 3.897 0.439 -11.618 1.00 0.00 H new ATOM 0 HG13 ILE A 127 4.466 -0.456 -13.013 1.00 0.00 H new ATOM 0 HG21 ILE A 127 2.503 2.778 -12.787 1.00 0.00 H new ATOM 0 HG22 ILE A 127 0.964 1.998 -13.225 1.00 0.00 H new ATOM 0 HG23 ILE A 127 1.744 1.619 -11.671 1.00 0.00 H new ATOM 0 HD11 ILE A 127 5.989 1.391 -12.476 1.00 0.00 H new ATOM 0 HD12 ILE A 127 5.234 1.649 -14.067 1.00 0.00 H new ATOM 0 HD13 ILE A 127 4.656 2.558 -12.650 1.00 0.00 H new ATOM 1935 N ALA A 128 0.142 -0.251 -14.978 1.00 0.00 N ATOM 1936 CA ALA A 128 -1.217 -0.037 -15.447 1.00 0.00 C ATOM 1937 C ALA A 128 -2.134 -1.225 -15.125 1.00 0.00 C ATOM 1938 O ALA A 128 -3.332 -1.013 -14.915 1.00 0.00 O ATOM 1939 CB ALA A 128 -1.204 0.238 -16.956 1.00 0.00 C ATOM 0 H ALA A 128 0.842 -0.209 -15.718 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.620 0.828 -14.921 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -2.224 0.398 -17.305 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.607 1.127 -17.159 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.772 -0.616 -17.478 1.00 0.00 H new ATOM 1945 N LYS A 129 -1.609 -2.462 -15.086 1.00 0.00 N ATOM 1946 CA LYS A 129 -2.412 -3.621 -14.713 1.00 0.00 C ATOM 1947 C LYS A 129 -2.550 -3.773 -13.202 1.00 0.00 C ATOM 1948 O LYS A 129 -3.649 -4.117 -12.756 1.00 0.00 O ATOM 1949 CB LYS A 129 -1.993 -4.901 -15.459 1.00 0.00 C ATOM 1950 CG LYS A 129 -0.608 -5.444 -15.088 1.00 0.00 C ATOM 1951 CD LYS A 129 -0.153 -6.632 -15.947 1.00 0.00 C ATOM 1952 CE LYS A 129 0.021 -6.244 -17.421 1.00 0.00 C ATOM 1953 NZ LYS A 129 0.651 -7.327 -18.218 1.00 0.00 N ATOM 0 H LYS A 129 -0.637 -2.676 -15.308 1.00 0.00 H new ATOM 0 HA LYS A 129 -3.428 -3.432 -15.061 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -2.734 -5.676 -15.264 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -2.013 -4.702 -16.531 1.00 0.00 H new ATOM 0 HG2 LYS A 129 0.123 -4.641 -15.181 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -0.617 -5.748 -14.041 1.00 0.00 H new ATOM 0 HD2 LYS A 129 0.790 -7.018 -15.560 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -0.884 -7.437 -15.868 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -0.952 -6.001 -17.848 1.00 0.00 H new ATOM 0 HE3 LYS A 129 0.632 -5.344 -17.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 1.198 -6.911 -18.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 1.285 -7.883 -17.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -0.088 -7.948 -18.606 1.00 0.00 H new ATOM 1967 N ILE A 130 -1.501 -3.526 -12.407 1.00 0.00 N ATOM 1968 CA ILE A 130 -1.588 -3.748 -10.970 1.00 0.00 C ATOM 1969 C ILE A 130 -2.257 -2.599 -10.208 1.00 0.00 C ATOM 1970 O ILE A 130 -2.974 -2.857 -9.237 1.00 0.00 O ATOM 1971 CB ILE A 130 -0.233 -4.147 -10.371 1.00 0.00 C ATOM 1972 CG1 ILE A 130 0.776 -2.984 -10.363 1.00 0.00 C ATOM 1973 CG2 ILE A 130 0.296 -5.417 -11.063 1.00 0.00 C ATOM 1974 CD1 ILE A 130 2.176 -3.380 -9.899 1.00 0.00 C ATOM 0 H ILE A 130 -0.599 -3.178 -12.733 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.258 -4.598 -10.839 1.00 0.00 H new ATOM 0 HB ILE A 130 -0.379 -4.388 -9.318 1.00 0.00 H new ATOM 0 HG12 ILE A 130 0.842 -2.567 -11.368 1.00 0.00 H new ATOM 0 HG13 ILE A 130 0.399 -2.194 -9.714 1.00 0.00 H new ATOM 0 HG21 ILE A 130 1.258 -5.693 -10.631 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.413 -6.232 -10.919 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.418 -5.226 -12.129 1.00 0.00 H new ATOM 0 HD11 ILE A 130 2.827 -2.506 -9.922 1.00 0.00 H new ATOM 0 HD12 ILE A 130 2.126 -3.769 -8.882 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.575 -4.148 -10.562 1.00 0.00 H new ATOM 1986 N SER A 131 -2.012 -1.355 -10.612 1.00 0.00 N ATOM 1987 CA SER A 131 -2.382 -0.151 -9.903 1.00 0.00 C ATOM 1988 C SER A 131 -3.690 0.399 -10.467 1.00 0.00 C ATOM 1989 O SER A 131 -3.718 0.840 -11.640 1.00 0.00 O ATOM 1990 CB SER A 131 -1.227 0.846 -9.960 1.00 0.00 C ATOM 1991 OG SER A 131 -0.111 0.302 -9.260 1.00 0.00 O ATOM 1992 OXT SER A 131 -4.708 0.365 -9.739 1.00 0.00 O ATOM 0 H SER A 131 -1.526 -1.159 -11.487 1.00 0.00 H new ATOM 0 HA SER A 131 -2.565 -0.363 -8.849 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.958 1.052 -10.996 1.00 0.00 H new ATOM 0 HB3 SER A 131 -1.526 1.795 -9.514 1.00 0.00 H new ATOM 0 HG SER A 131 0.636 0.935 -9.293 1.00 0.00 H new TER 1998 SER A 131