USER MOD reduce.3.24.130724 H: found=0, std=0, add=978, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 976 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 5 MET CE :methyl 164:sc= -0.121 (180deg=-0.844) USER MOD Set 1.2: A 35 CYS SG : rot -90:sc= 0.36 USER MOD Set 1.3: A 69 ASN : amide:sc= 0.459 K(o=0.75,f=-0.46) USER MOD Set 1.4: A 73 TYR OH : rot 30:sc= 0.0553 USER MOD Set 2.1: A 43 HIS : no HD1:sc= 0.241 K(o=0.24,f=-4.8!) USER MOD Set 2.2: A 45 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 16 GLN : amide:sc= 2.2 K(o=5.6,f=-3.1) USER MOD Set 3.2: A 23 LYS NZ :NH3+ 180:sc= 1.78 (180deg=0.95) USER MOD Set 3.3: A 60 GLN : amide:sc= 1.63 K(o=5.6,f=-1.3) USER MOD Set 4.1: A 12 SER OG : rot 170:sc= 0.386 USER MOD Set 4.2: A 13 CYS SG : rot -64:sc= 0.335 USER MOD Set 5.1: A 11 ASN : amide:sc= 0.427 K(o=2.7,f=-4.3!) USER MOD Set 5.2: A 15 SER OG : rot -70:sc= 0.843 USER MOD Set 5.3: A 34 SER OG : rot -64:sc= 1.44 USER MOD Single : A 1 MET CE :methyl -158:sc= -0.0307 (180deg=-0.449) USER MOD Single : A 1 MET N :NH3+ 139:sc= 1.22 (180deg=0.685) USER MOD Single : A 2 LYS NZ :NH3+ -170:sc= 1.25 (180deg=1.12) USER MOD Single : A 3 LYS NZ :NH3+ -167:sc= 0.937 (180deg=0.688) USER MOD Single : A 8 CYS SG : rot 170:sc= 0.0641 USER MOD Single : A 9 LYS NZ :NH3+ 171:sc= 1.28 (180deg=1.24) USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 89:sc= 0.847 USER MOD Single : A 29 LYS NZ :NH3+ -171:sc= 0.925 (180deg=0.87) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot -64:sc= 0.637 USER MOD Single : A 49 MET CE :methyl 172:sc= -0.674 (180deg=-0.903) USER MOD Single : A 50 MET CE :methyl -140:sc= -0.236 (180deg=-3.24) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.22 USER MOD Single : A 62 SER OG : rot -90:sc= 0.28 USER MOD Single : A 67 ASN : amide:sc= 0.555 K(o=0.56,f=-0.19) USER MOD Single : A 78 SER OG : rot 110:sc= 0.28 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 THR OG1 : rot -37:sc= 0.217 USER MOD Single : A 93 GLN : amide:sc= 1.05 K(o=1,f=-0.19) USER MOD Single : A 100 GLN : amide:sc= 1.15 K(o=1.2,f=-0.34) USER MOD Single : A 107 GLN : amide:sc= 0.308 K(o=0.31,f=-0.7) USER MOD Single : A 108 SER OG : rot 180:sc= 0.068 USER MOD Single : A 114 THR OG1 : rot 78:sc= 1.18 USER MOD Single : A 118 GLN : amide:sc= 0.787 K(o=0.79,f=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= 0.982 K(o=0.98,f=-0.0039) USER MOD Single : A 129 LYS NZ :NH3+ -162:sc= 0.925 (180deg=0.757) USER MOD Single : A 131 SER OG : rot -160:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.044 0.002 1.367 1.00 0.00 N ATOM 2 CA MET A 1 2.443 0.159 -0.061 1.00 0.00 C ATOM 3 C MET A 1 2.410 1.628 -0.490 1.00 0.00 C ATOM 4 O MET A 1 1.360 2.263 -0.406 1.00 0.00 O ATOM 5 CB MET A 1 1.582 -0.712 -1.002 1.00 0.00 C ATOM 6 CG MET A 1 2.141 -0.733 -2.435 1.00 0.00 C ATOM 7 SD MET A 1 1.174 -1.788 -3.552 1.00 0.00 S ATOM 8 CE MET A 1 2.368 -1.983 -4.898 1.00 0.00 C ATOM 0 H1 MET A 1 1.431 -0.832 1.467 1.00 0.00 H new ATOM 0 H2 MET A 1 2.894 -0.121 1.953 1.00 0.00 H new ATOM 0 H3 MET A 1 1.528 0.850 1.678 1.00 0.00 H new ATOM 0 HA MET A 1 3.471 -0.194 -0.144 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.537 -1.730 -0.615 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.561 -0.331 -1.016 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.159 0.284 -2.828 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.172 -1.085 -2.413 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.843 -2.253 -5.814 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.902 -1.045 -5.049 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.079 -2.769 -4.643 1.00 0.00 H new ATOM 18 N LYS A 2 3.544 2.157 -0.973 1.00 0.00 N ATOM 19 CA LYS A 2 3.682 3.517 -1.556 1.00 0.00 C ATOM 20 C LYS A 2 4.404 3.481 -2.911 1.00 0.00 C ATOM 21 O LYS A 2 4.980 2.457 -3.276 1.00 0.00 O ATOM 22 CB LYS A 2 4.360 4.447 -0.522 1.00 0.00 C ATOM 23 CG LYS A 2 3.399 4.751 0.643 1.00 0.00 C ATOM 24 CD LYS A 2 3.989 5.696 1.701 1.00 0.00 C ATOM 25 CE LYS A 2 2.924 5.960 2.780 1.00 0.00 C ATOM 26 NZ LYS A 2 3.451 6.799 3.891 1.00 0.00 N ATOM 0 H LYS A 2 4.423 1.640 -0.973 1.00 0.00 H new ATOM 0 HA LYS A 2 2.695 3.926 -1.772 1.00 0.00 H new ATOM 0 HB2 LYS A 2 5.266 3.977 -0.140 1.00 0.00 H new ATOM 0 HB3 LYS A 2 4.662 5.377 -1.004 1.00 0.00 H new ATOM 0 HG2 LYS A 2 2.486 5.192 0.243 1.00 0.00 H new ATOM 0 HG3 LYS A 2 3.116 3.814 1.123 1.00 0.00 H new ATOM 0 HD2 LYS A 2 4.878 5.253 2.149 1.00 0.00 H new ATOM 0 HD3 LYS A 2 4.299 6.633 1.239 1.00 0.00 H new ATOM 0 HE2 LYS A 2 2.065 6.456 2.328 1.00 0.00 H new ATOM 0 HE3 LYS A 2 2.570 5.010 3.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 2.764 6.813 4.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 4.351 6.402 4.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 3.607 7.769 3.550 1.00 0.00 H new ATOM 40 N LYS A 3 4.352 4.574 -3.677 1.00 0.00 N ATOM 41 CA LYS A 3 4.942 4.685 -5.027 1.00 0.00 C ATOM 42 C LYS A 3 6.231 5.505 -5.002 1.00 0.00 C ATOM 43 O LYS A 3 6.297 6.531 -4.332 1.00 0.00 O ATOM 44 CB LYS A 3 3.930 5.236 -6.060 1.00 0.00 C ATOM 45 CG LYS A 3 2.694 4.336 -6.277 1.00 0.00 C ATOM 46 CD LYS A 3 1.531 4.490 -5.278 1.00 0.00 C ATOM 47 CE LYS A 3 0.952 5.907 -5.309 1.00 0.00 C ATOM 48 NZ LYS A 3 0.146 6.211 -4.095 1.00 0.00 N ATOM 0 H LYS A 3 3.889 5.431 -3.374 1.00 0.00 H new ATOM 0 HA LYS A 3 5.201 3.677 -5.351 1.00 0.00 H new ATOM 0 HB2 LYS A 3 3.596 6.221 -5.735 1.00 0.00 H new ATOM 0 HB3 LYS A 3 4.439 5.371 -7.014 1.00 0.00 H new ATOM 0 HG2 LYS A 3 2.308 4.527 -7.278 1.00 0.00 H new ATOM 0 HG3 LYS A 3 3.024 3.297 -6.255 1.00 0.00 H new ATOM 0 HD2 LYS A 3 0.748 3.770 -5.515 1.00 0.00 H new ATOM 0 HD3 LYS A 3 1.881 4.260 -4.272 1.00 0.00 H new ATOM 0 HE2 LYS A 3 1.765 6.628 -5.393 1.00 0.00 H new ATOM 0 HE3 LYS A 3 0.329 6.024 -6.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -0.402 7.081 -4.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.504 5.422 -3.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 0.780 6.343 -3.281 1.00 0.00 H new ATOM 62 N VAL A 4 7.234 5.069 -5.758 1.00 0.00 N ATOM 63 CA VAL A 4 8.549 5.735 -5.869 1.00 0.00 C ATOM 64 C VAL A 4 8.877 6.018 -7.338 1.00 0.00 C ATOM 65 O VAL A 4 8.597 5.198 -8.209 1.00 0.00 O ATOM 66 CB VAL A 4 9.682 4.951 -5.167 1.00 0.00 C ATOM 67 CG1 VAL A 4 10.972 5.775 -5.097 1.00 0.00 C ATOM 68 CG2 VAL A 4 9.312 4.507 -3.745 1.00 0.00 C ATOM 0 H VAL A 4 7.164 4.225 -6.327 1.00 0.00 H new ATOM 0 HA VAL A 4 8.479 6.685 -5.340 1.00 0.00 H new ATOM 0 HB VAL A 4 9.837 4.061 -5.777 1.00 0.00 H new ATOM 0 HG11 VAL A 4 11.748 5.195 -4.598 1.00 0.00 H new ATOM 0 HG12 VAL A 4 11.299 6.025 -6.106 1.00 0.00 H new ATOM 0 HG13 VAL A 4 10.788 6.692 -4.537 1.00 0.00 H new ATOM 0 HG21 VAL A 4 10.147 3.962 -3.305 1.00 0.00 H new ATOM 0 HG22 VAL A 4 9.090 5.384 -3.136 1.00 0.00 H new ATOM 0 HG23 VAL A 4 8.436 3.860 -3.782 1.00 0.00 H new ATOM 78 N MET A 5 9.487 7.167 -7.620 1.00 0.00 N ATOM 79 CA MET A 5 9.885 7.571 -8.973 1.00 0.00 C ATOM 80 C MET A 5 11.309 8.130 -8.967 1.00 0.00 C ATOM 81 O MET A 5 11.662 8.945 -8.118 1.00 0.00 O ATOM 82 CB MET A 5 8.849 8.551 -9.542 1.00 0.00 C ATOM 83 CG MET A 5 9.286 9.285 -10.817 1.00 0.00 C ATOM 84 SD MET A 5 9.668 8.272 -12.272 1.00 0.00 S ATOM 85 CE MET A 5 8.229 8.634 -13.318 1.00 0.00 C ATOM 0 H MET A 5 9.724 7.856 -6.906 1.00 0.00 H new ATOM 0 HA MET A 5 9.903 6.705 -9.634 1.00 0.00 H new ATOM 0 HB2 MET A 5 7.930 8.004 -9.752 1.00 0.00 H new ATOM 0 HB3 MET A 5 8.612 9.291 -8.777 1.00 0.00 H new ATOM 0 HG2 MET A 5 8.496 9.984 -11.091 1.00 0.00 H new ATOM 0 HG3 MET A 5 10.168 9.879 -10.579 1.00 0.00 H new ATOM 0 HE1 MET A 5 8.438 8.327 -14.343 1.00 0.00 H new ATOM 0 HE2 MET A 5 7.362 8.089 -12.945 1.00 0.00 H new ATOM 0 HE3 MET A 5 8.022 9.704 -13.295 1.00 0.00 H new ATOM 95 N PHE A 6 12.114 7.696 -9.935 1.00 0.00 N ATOM 96 CA PHE A 6 13.544 8.029 -10.043 1.00 0.00 C ATOM 97 C PHE A 6 13.821 8.963 -11.232 1.00 0.00 C ATOM 98 O PHE A 6 13.594 8.568 -12.371 1.00 0.00 O ATOM 99 CB PHE A 6 14.357 6.725 -10.147 1.00 0.00 C ATOM 100 CG PHE A 6 14.031 5.698 -9.079 1.00 0.00 C ATOM 101 CD1 PHE A 6 14.532 5.834 -7.772 1.00 0.00 C ATOM 102 CD2 PHE A 6 13.190 4.616 -9.394 1.00 0.00 C ATOM 103 CE1 PHE A 6 14.148 4.925 -6.769 1.00 0.00 C ATOM 104 CE2 PHE A 6 12.806 3.711 -8.392 1.00 0.00 C ATOM 105 CZ PHE A 6 13.265 3.875 -7.075 1.00 0.00 C ATOM 0 H PHE A 6 11.788 7.088 -10.687 1.00 0.00 H new ATOM 0 HA PHE A 6 13.851 8.571 -9.148 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.184 6.280 -11.127 1.00 0.00 H new ATOM 0 HB3 PHE A 6 15.418 6.967 -10.090 1.00 0.00 H new ATOM 0 HD1 PHE A 6 15.213 6.638 -7.537 1.00 0.00 H new ATOM 0 HD2 PHE A 6 12.840 4.481 -10.407 1.00 0.00 H new ATOM 0 HE1 PHE A 6 14.531 5.034 -5.765 1.00 0.00 H new ATOM 0 HE2 PHE A 6 12.154 2.885 -8.635 1.00 0.00 H new ATOM 0 HZ PHE A 6 12.941 3.197 -6.300 1.00 0.00 H new ATOM 115 N VAL A 7 14.357 10.160 -10.979 1.00 0.00 N ATOM 116 CA VAL A 7 14.827 11.139 -11.979 1.00 0.00 C ATOM 117 C VAL A 7 16.334 11.014 -12.208 1.00 0.00 C ATOM 118 O VAL A 7 17.110 10.920 -11.266 1.00 0.00 O ATOM 119 CB VAL A 7 14.408 12.590 -11.594 1.00 0.00 C ATOM 120 CG1 VAL A 7 15.411 13.685 -11.990 1.00 0.00 C ATOM 121 CG2 VAL A 7 13.090 12.946 -12.293 1.00 0.00 C ATOM 0 H VAL A 7 14.484 10.495 -10.024 1.00 0.00 H new ATOM 0 HA VAL A 7 14.340 10.911 -12.927 1.00 0.00 H new ATOM 0 HB VAL A 7 14.338 12.575 -10.506 1.00 0.00 H new ATOM 0 HG11 VAL A 7 15.029 14.658 -11.679 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.367 13.497 -11.501 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.549 13.678 -13.071 1.00 0.00 H new ATOM 0 HG21 VAL A 7 12.798 13.961 -12.023 1.00 0.00 H new ATOM 0 HG22 VAL A 7 13.222 12.881 -13.373 1.00 0.00 H new ATOM 0 HG23 VAL A 7 12.312 12.249 -11.980 1.00 0.00 H new ATOM 131 N CYS A 8 16.766 11.095 -13.464 1.00 0.00 N ATOM 132 CA CYS A 8 18.171 11.216 -13.887 1.00 0.00 C ATOM 133 C CYS A 8 18.256 12.278 -15.004 1.00 0.00 C ATOM 134 O CYS A 8 17.226 12.765 -15.463 1.00 0.00 O ATOM 135 CB CYS A 8 18.636 9.792 -14.264 1.00 0.00 C ATOM 136 SG CYS A 8 20.292 9.696 -15.015 1.00 0.00 S ATOM 0 H CYS A 8 16.122 11.078 -14.255 1.00 0.00 H new ATOM 0 HA CYS A 8 18.851 11.575 -13.114 1.00 0.00 H new ATOM 0 HB2 CYS A 8 18.624 9.173 -13.367 1.00 0.00 H new ATOM 0 HB3 CYS A 8 17.914 9.362 -14.958 1.00 0.00 H new ATOM 0 HG CYS A 8 20.658 8.452 -15.100 1.00 0.00 H new ATOM 142 N LYS A 9 19.449 12.665 -15.469 1.00 0.00 N ATOM 143 CA LYS A 9 19.599 13.763 -16.461 1.00 0.00 C ATOM 144 C LYS A 9 19.024 13.384 -17.839 1.00 0.00 C ATOM 145 O LYS A 9 18.246 14.144 -18.393 1.00 0.00 O ATOM 146 CB LYS A 9 21.077 14.242 -16.484 1.00 0.00 C ATOM 147 CG LYS A 9 21.232 15.775 -16.454 1.00 0.00 C ATOM 148 CD LYS A 9 20.894 16.526 -17.757 1.00 0.00 C ATOM 149 CE LYS A 9 21.910 16.233 -18.878 1.00 0.00 C ATOM 150 NZ LYS A 9 21.747 17.165 -20.031 1.00 0.00 N ATOM 0 H LYS A 9 20.331 12.241 -15.181 1.00 0.00 H new ATOM 0 HA LYS A 9 18.996 14.618 -16.155 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.601 13.816 -15.629 1.00 0.00 H new ATOM 0 HB3 LYS A 9 21.561 13.854 -17.380 1.00 0.00 H new ATOM 0 HG2 LYS A 9 20.596 16.167 -15.660 1.00 0.00 H new ATOM 0 HG3 LYS A 9 22.262 16.009 -16.183 1.00 0.00 H new ATOM 0 HD2 LYS A 9 19.896 16.241 -18.090 1.00 0.00 H new ATOM 0 HD3 LYS A 9 20.871 17.598 -17.561 1.00 0.00 H new ATOM 0 HE2 LYS A 9 22.922 16.318 -18.482 1.00 0.00 H new ATOM 0 HE3 LYS A 9 21.787 15.206 -19.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 22.538 17.039 -20.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 20.851 16.961 -20.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 21.738 18.146 -19.686 1.00 0.00 H new ATOM 164 N ARG A 10 19.336 12.171 -18.329 1.00 0.00 N ATOM 165 CA ARG A 10 18.824 11.605 -19.616 1.00 0.00 C ATOM 166 C ARG A 10 18.136 10.226 -19.542 1.00 0.00 C ATOM 167 O ARG A 10 17.920 9.591 -20.567 1.00 0.00 O ATOM 168 CB ARG A 10 19.882 11.743 -20.739 1.00 0.00 C ATOM 169 CG ARG A 10 21.075 10.767 -20.736 1.00 0.00 C ATOM 170 CD ARG A 10 22.036 10.934 -19.561 1.00 0.00 C ATOM 171 NE ARG A 10 23.331 10.278 -19.825 1.00 0.00 N ATOM 172 CZ ARG A 10 24.339 10.181 -18.974 1.00 0.00 C ATOM 173 NH1 ARG A 10 24.280 10.671 -17.773 1.00 0.00 N ATOM 174 NH2 ARG A 10 25.434 9.585 -19.306 1.00 0.00 N ATOM 0 H ARG A 10 19.964 11.533 -17.840 1.00 0.00 H new ATOM 0 HA ARG A 10 17.973 12.231 -19.885 1.00 0.00 H new ATOM 0 HB2 ARG A 10 19.369 11.640 -21.695 1.00 0.00 H new ATOM 0 HB3 ARG A 10 20.280 12.757 -20.699 1.00 0.00 H new ATOM 0 HG2 ARG A 10 20.692 9.747 -20.731 1.00 0.00 H new ATOM 0 HG3 ARG A 10 21.632 10.894 -21.664 1.00 0.00 H new ATOM 0 HD2 ARG A 10 22.197 11.995 -19.369 1.00 0.00 H new ATOM 0 HD3 ARG A 10 21.589 10.511 -18.661 1.00 0.00 H new ATOM 0 HE ARG A 10 23.461 9.862 -20.747 1.00 0.00 H new ATOM 0 HH11 ARG A 10 23.436 11.150 -17.458 1.00 0.00 H new ATOM 0 HH12 ARG A 10 25.078 10.577 -17.144 1.00 0.00 H new ATOM 0 HH21 ARG A 10 25.532 9.180 -20.237 1.00 0.00 H new ATOM 0 HH22 ARG A 10 26.202 9.519 -18.638 1.00 0.00 H new ATOM 188 N ASN A 11 17.858 9.748 -18.322 1.00 0.00 N ATOM 189 CA ASN A 11 17.213 8.462 -17.949 1.00 0.00 C ATOM 190 C ASN A 11 17.745 7.206 -18.667 1.00 0.00 C ATOM 191 O ASN A 11 17.016 6.241 -18.879 1.00 0.00 O ATOM 192 CB ASN A 11 15.690 8.687 -17.951 1.00 0.00 C ATOM 193 CG ASN A 11 14.799 7.530 -17.493 1.00 0.00 C ATOM 194 OD1 ASN A 11 13.822 7.222 -18.147 1.00 0.00 O ATOM 195 ND2 ASN A 11 15.038 6.875 -16.376 1.00 0.00 N ATOM 0 H ASN A 11 18.095 10.291 -17.492 1.00 0.00 H new ATOM 0 HA ASN A 11 17.509 8.185 -16.937 1.00 0.00 H new ATOM 0 HB2 ASN A 11 15.477 9.546 -17.315 1.00 0.00 H new ATOM 0 HB3 ASN A 11 15.393 8.959 -18.964 1.00 0.00 H new ATOM 0 HD21 ASN A 11 14.410 6.129 -16.078 1.00 0.00 H new ATOM 0 HD22 ASN A 11 15.851 7.114 -15.809 1.00 0.00 H new ATOM 202 N SER A 12 19.040 7.215 -18.988 1.00 0.00 N ATOM 203 CA SER A 12 19.781 6.094 -19.578 1.00 0.00 C ATOM 204 C SER A 12 20.320 5.125 -18.526 1.00 0.00 C ATOM 205 O SER A 12 20.290 3.915 -18.723 1.00 0.00 O ATOM 206 CB SER A 12 20.946 6.692 -20.367 1.00 0.00 C ATOM 207 OG SER A 12 21.633 7.573 -19.483 1.00 0.00 O ATOM 0 H SER A 12 19.627 8.036 -18.839 1.00 0.00 H new ATOM 0 HA SER A 12 19.107 5.518 -20.213 1.00 0.00 H new ATOM 0 HB2 SER A 12 21.612 5.908 -20.726 1.00 0.00 H new ATOM 0 HB3 SER A 12 20.584 7.229 -21.244 1.00 0.00 H new ATOM 0 HG SER A 12 22.477 7.855 -19.893 1.00 0.00 H new ATOM 213 N CYS A 13 20.817 5.676 -17.413 1.00 0.00 N ATOM 214 CA CYS A 13 21.570 4.997 -16.353 1.00 0.00 C ATOM 215 C CYS A 13 21.122 5.488 -14.961 1.00 0.00 C ATOM 216 O CYS A 13 20.277 6.378 -14.859 1.00 0.00 O ATOM 217 CB CYS A 13 23.073 5.215 -16.667 1.00 0.00 C ATOM 218 SG CYS A 13 23.497 6.985 -16.799 1.00 0.00 S ATOM 0 H CYS A 13 20.697 6.670 -17.216 1.00 0.00 H new ATOM 0 HA CYS A 13 21.378 3.924 -16.327 1.00 0.00 H new ATOM 0 HB2 CYS A 13 23.677 4.755 -15.884 1.00 0.00 H new ATOM 0 HB3 CYS A 13 23.325 4.712 -17.601 1.00 0.00 H new ATOM 0 HG CYS A 13 22.863 7.509 -17.806 1.00 0.00 H new ATOM 224 N ARG A 14 21.649 4.902 -13.876 1.00 0.00 N ATOM 225 CA ARG A 14 21.232 5.103 -12.457 1.00 0.00 C ATOM 226 C ARG A 14 19.746 4.836 -12.202 1.00 0.00 C ATOM 227 O ARG A 14 19.386 3.759 -11.765 1.00 0.00 O ATOM 228 CB ARG A 14 21.738 6.471 -11.927 1.00 0.00 C ATOM 229 CG ARG A 14 23.272 6.554 -11.876 1.00 0.00 C ATOM 230 CD ARG A 14 23.759 7.786 -11.094 1.00 0.00 C ATOM 231 NE ARG A 14 23.350 9.056 -11.739 1.00 0.00 N ATOM 232 CZ ARG A 14 23.926 9.673 -12.756 1.00 0.00 C ATOM 233 NH1 ARG A 14 25.049 9.279 -13.260 1.00 0.00 N ATOM 234 NH2 ARG A 14 23.365 10.718 -13.282 1.00 0.00 N ATOM 0 H ARG A 14 22.419 4.238 -13.955 1.00 0.00 H new ATOM 0 HA ARG A 14 21.723 4.333 -11.862 1.00 0.00 H new ATOM 0 HB2 ARG A 14 21.356 7.268 -12.565 1.00 0.00 H new ATOM 0 HB3 ARG A 14 21.335 6.641 -10.929 1.00 0.00 H new ATOM 0 HG2 ARG A 14 23.668 5.651 -11.412 1.00 0.00 H new ATOM 0 HG3 ARG A 14 23.667 6.590 -12.891 1.00 0.00 H new ATOM 0 HD2 ARG A 14 23.361 7.751 -10.080 1.00 0.00 H new ATOM 0 HD3 ARG A 14 24.845 7.756 -11.012 1.00 0.00 H new ATOM 0 HE ARG A 14 22.523 9.509 -11.351 1.00 0.00 H new ATOM 0 HH11 ARG A 14 25.524 8.464 -12.872 1.00 0.00 H new ATOM 0 HH12 ARG A 14 25.460 9.783 -14.045 1.00 0.00 H new ATOM 0 HH21 ARG A 14 22.480 11.063 -12.911 1.00 0.00 H new ATOM 0 HH22 ARG A 14 23.809 11.195 -14.067 1.00 0.00 H new ATOM 248 N SER A 15 18.879 5.780 -12.555 1.00 0.00 N ATOM 249 CA SER A 15 17.401 5.726 -12.418 1.00 0.00 C ATOM 250 C SER A 15 16.760 4.432 -12.940 1.00 0.00 C ATOM 251 O SER A 15 15.903 3.857 -12.275 1.00 0.00 O ATOM 252 CB SER A 15 16.818 6.937 -13.161 1.00 0.00 C ATOM 253 OG SER A 15 17.221 6.907 -14.532 1.00 0.00 O ATOM 0 H SER A 15 19.192 6.658 -12.969 1.00 0.00 H new ATOM 0 HA SER A 15 17.171 5.747 -11.353 1.00 0.00 H new ATOM 0 HB2 SER A 15 15.730 6.927 -13.092 1.00 0.00 H new ATOM 0 HB3 SER A 15 17.159 7.860 -12.693 1.00 0.00 H new ATOM 0 HG SER A 15 18.180 7.096 -14.595 1.00 0.00 H new ATOM 259 N GLN A 16 17.240 3.915 -14.075 1.00 0.00 N ATOM 260 CA GLN A 16 16.768 2.639 -14.655 1.00 0.00 C ATOM 261 C GLN A 16 17.155 1.434 -13.775 1.00 0.00 C ATOM 262 O GLN A 16 16.357 0.526 -13.567 1.00 0.00 O ATOM 263 CB GLN A 16 17.356 2.482 -16.073 1.00 0.00 C ATOM 264 CG GLN A 16 16.870 3.549 -17.075 1.00 0.00 C ATOM 265 CD GLN A 16 15.441 3.343 -17.582 1.00 0.00 C ATOM 266 OE1 GLN A 16 14.792 2.330 -17.369 1.00 0.00 O ATOM 267 NE2 GLN A 16 14.937 4.291 -18.332 1.00 0.00 N ATOM 0 H GLN A 16 17.971 4.367 -14.625 1.00 0.00 H new ATOM 0 HA GLN A 16 15.679 2.663 -14.705 1.00 0.00 H new ATOM 0 HB2 GLN A 16 18.443 2.525 -16.011 1.00 0.00 H new ATOM 0 HB3 GLN A 16 17.097 1.495 -16.455 1.00 0.00 H new ATOM 0 HG2 GLN A 16 16.936 4.529 -16.602 1.00 0.00 H new ATOM 0 HG3 GLN A 16 17.547 3.561 -17.930 1.00 0.00 H new ATOM 0 HE21 GLN A 16 15.475 5.139 -18.513 1.00 0.00 H new ATOM 0 HE22 GLN A 16 14.007 4.182 -18.735 1.00 0.00 H new ATOM 276 N MET A 17 18.364 1.455 -13.196 1.00 0.00 N ATOM 277 CA MET A 17 18.869 0.426 -12.261 1.00 0.00 C ATOM 278 C MET A 17 18.182 0.526 -10.891 1.00 0.00 C ATOM 279 O MET A 17 17.885 -0.494 -10.285 1.00 0.00 O ATOM 280 CB MET A 17 20.404 0.553 -12.147 1.00 0.00 C ATOM 281 CG MET A 17 21.119 0.319 -13.492 1.00 0.00 C ATOM 282 SD MET A 17 22.390 1.547 -13.901 1.00 0.00 S ATOM 283 CE MET A 17 23.746 0.990 -12.831 1.00 0.00 C ATOM 0 H MET A 17 19.037 2.203 -13.365 1.00 0.00 H new ATOM 0 HA MET A 17 18.628 -0.562 -12.652 1.00 0.00 H new ATOM 0 HB2 MET A 17 20.656 1.545 -11.773 1.00 0.00 H new ATOM 0 HB3 MET A 17 20.771 -0.166 -11.415 1.00 0.00 H new ATOM 0 HG2 MET A 17 21.580 -0.669 -13.476 1.00 0.00 H new ATOM 0 HG3 MET A 17 20.373 0.310 -14.287 1.00 0.00 H new ATOM 0 HE1 MET A 17 24.607 1.644 -12.965 1.00 0.00 H new ATOM 0 HE2 MET A 17 23.424 1.022 -11.790 1.00 0.00 H new ATOM 0 HE3 MET A 17 24.022 -0.031 -13.095 1.00 0.00 H new ATOM 293 N ALA A 18 17.828 1.738 -10.445 1.00 0.00 N ATOM 294 CA ALA A 18 17.014 1.964 -9.239 1.00 0.00 C ATOM 295 C ALA A 18 15.614 1.349 -9.381 1.00 0.00 C ATOM 296 O ALA A 18 15.171 0.616 -8.503 1.00 0.00 O ATOM 297 CB ALA A 18 16.959 3.473 -8.955 1.00 0.00 C ATOM 0 H ALA A 18 18.101 2.601 -10.916 1.00 0.00 H new ATOM 0 HA ALA A 18 17.476 1.463 -8.388 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.359 3.654 -8.063 1.00 0.00 H new ATOM 0 HB2 ALA A 18 17.969 3.850 -8.795 1.00 0.00 H new ATOM 0 HB3 ALA A 18 16.510 3.987 -9.805 1.00 0.00 H new ATOM 303 N GLU A 19 14.964 1.537 -10.535 1.00 0.00 N ATOM 304 CA GLU A 19 13.713 0.847 -10.883 1.00 0.00 C ATOM 305 C GLU A 19 13.892 -0.678 -10.919 1.00 0.00 C ATOM 306 O GLU A 19 13.061 -1.394 -10.366 1.00 0.00 O ATOM 307 CB GLU A 19 13.194 1.428 -12.208 1.00 0.00 C ATOM 308 CG GLU A 19 11.835 0.863 -12.640 1.00 0.00 C ATOM 309 CD GLU A 19 11.283 1.532 -13.920 1.00 0.00 C ATOM 310 OE1 GLU A 19 11.971 2.386 -14.527 1.00 0.00 O ATOM 311 OE2 GLU A 19 10.136 1.214 -14.310 1.00 0.00 O ATOM 0 H GLU A 19 15.292 2.176 -11.259 1.00 0.00 H new ATOM 0 HA GLU A 19 12.964 1.020 -10.111 1.00 0.00 H new ATOM 0 HB2 GLU A 19 13.113 2.511 -12.113 1.00 0.00 H new ATOM 0 HB3 GLU A 19 13.925 1.231 -12.992 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.931 -0.210 -12.809 1.00 0.00 H new ATOM 0 HG3 GLU A 19 11.118 0.995 -11.829 1.00 0.00 H new ATOM 318 N GLY A 20 15.006 -1.175 -11.466 1.00 0.00 N ATOM 319 CA GLY A 20 15.370 -2.600 -11.454 1.00 0.00 C ATOM 320 C GLY A 20 15.499 -3.208 -10.057 1.00 0.00 C ATOM 321 O GLY A 20 14.877 -4.233 -9.776 1.00 0.00 O ATOM 0 H GLY A 20 15.694 -0.589 -11.939 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.619 -3.159 -12.012 1.00 0.00 H new ATOM 0 HA3 GLY A 20 16.316 -2.725 -11.980 1.00 0.00 H new ATOM 325 N PHE A 21 16.244 -2.578 -9.143 1.00 0.00 N ATOM 326 CA PHE A 21 16.350 -3.065 -7.763 1.00 0.00 C ATOM 327 C PHE A 21 15.031 -2.930 -7.017 1.00 0.00 C ATOM 328 O PHE A 21 14.596 -3.874 -6.365 1.00 0.00 O ATOM 329 CB PHE A 21 17.486 -2.342 -7.025 1.00 0.00 C ATOM 330 CG PHE A 21 18.848 -2.819 -7.462 1.00 0.00 C ATOM 331 CD1 PHE A 21 19.207 -4.163 -7.252 1.00 0.00 C ATOM 332 CD2 PHE A 21 19.752 -1.942 -8.080 1.00 0.00 C ATOM 333 CE1 PHE A 21 20.460 -4.631 -7.664 1.00 0.00 C ATOM 334 CE2 PHE A 21 21.008 -2.412 -8.496 1.00 0.00 C ATOM 335 CZ PHE A 21 21.359 -3.758 -8.294 1.00 0.00 C ATOM 0 H PHE A 21 16.781 -1.732 -9.333 1.00 0.00 H new ATOM 0 HA PHE A 21 16.588 -4.128 -7.799 1.00 0.00 H new ATOM 0 HB2 PHE A 21 17.406 -1.269 -7.201 1.00 0.00 H new ATOM 0 HB3 PHE A 21 17.376 -2.498 -5.952 1.00 0.00 H new ATOM 0 HD1 PHE A 21 18.513 -4.836 -6.771 1.00 0.00 H new ATOM 0 HD2 PHE A 21 19.482 -0.908 -8.235 1.00 0.00 H new ATOM 0 HE1 PHE A 21 20.734 -5.662 -7.497 1.00 0.00 H new ATOM 0 HE2 PHE A 21 21.705 -1.738 -8.972 1.00 0.00 H new ATOM 0 HZ PHE A 21 22.321 -4.120 -8.624 1.00 0.00 H new ATOM 345 N ALA A 22 14.352 -1.795 -7.150 1.00 0.00 N ATOM 346 CA ALA A 22 13.117 -1.538 -6.416 1.00 0.00 C ATOM 347 C ALA A 22 11.966 -2.456 -6.840 1.00 0.00 C ATOM 348 O ALA A 22 11.272 -2.969 -5.971 1.00 0.00 O ATOM 349 CB ALA A 22 12.790 -0.050 -6.552 1.00 0.00 C ATOM 0 H ALA A 22 14.639 -1.033 -7.764 1.00 0.00 H new ATOM 0 HA ALA A 22 13.261 -1.778 -5.362 1.00 0.00 H new ATOM 0 HB1 ALA A 22 11.869 0.171 -6.012 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.606 0.541 -6.136 1.00 0.00 H new ATOM 0 HB3 ALA A 22 12.661 0.199 -7.605 1.00 0.00 H new ATOM 355 N LYS A 23 11.801 -2.769 -8.131 1.00 0.00 N ATOM 356 CA LYS A 23 10.724 -3.683 -8.574 1.00 0.00 C ATOM 357 C LYS A 23 10.928 -5.129 -8.107 1.00 0.00 C ATOM 358 O LYS A 23 9.965 -5.866 -7.920 1.00 0.00 O ATOM 359 CB LYS A 23 10.524 -3.569 -10.092 1.00 0.00 C ATOM 360 CG LYS A 23 11.585 -4.271 -10.954 1.00 0.00 C ATOM 361 CD LYS A 23 11.360 -3.938 -12.437 1.00 0.00 C ATOM 362 CE LYS A 23 12.302 -4.768 -13.319 1.00 0.00 C ATOM 363 NZ LYS A 23 12.133 -4.436 -14.763 1.00 0.00 N ATOM 0 H LYS A 23 12.388 -2.411 -8.884 1.00 0.00 H new ATOM 0 HA LYS A 23 9.802 -3.365 -8.088 1.00 0.00 H new ATOM 0 HB2 LYS A 23 9.546 -3.980 -10.344 1.00 0.00 H new ATOM 0 HB3 LYS A 23 10.504 -2.513 -10.360 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.582 -3.954 -10.649 1.00 0.00 H new ATOM 0 HG3 LYS A 23 11.533 -5.349 -10.803 1.00 0.00 H new ATOM 0 HD2 LYS A 23 10.324 -4.140 -12.709 1.00 0.00 H new ATOM 0 HD3 LYS A 23 11.533 -2.875 -12.608 1.00 0.00 H new ATOM 0 HE2 LYS A 23 13.335 -4.587 -13.021 1.00 0.00 H new ATOM 0 HE3 LYS A 23 12.107 -5.829 -13.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 12.784 -5.015 -15.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 11.154 -4.633 -15.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 12.343 -3.429 -14.915 1.00 0.00 H new ATOM 377 N THR A 24 12.191 -5.499 -7.891 1.00 0.00 N ATOM 378 CA THR A 24 12.620 -6.824 -7.395 1.00 0.00 C ATOM 379 C THR A 24 12.569 -6.924 -5.860 1.00 0.00 C ATOM 380 O THR A 24 11.903 -7.802 -5.318 1.00 0.00 O ATOM 381 CB THR A 24 14.038 -7.152 -7.896 1.00 0.00 C ATOM 382 OG1 THR A 24 14.122 -6.963 -9.294 1.00 0.00 O ATOM 383 CG2 THR A 24 14.438 -8.602 -7.626 1.00 0.00 C ATOM 0 H THR A 24 12.976 -4.870 -8.060 1.00 0.00 H new ATOM 0 HA THR A 24 11.914 -7.554 -7.792 1.00 0.00 H new ATOM 0 HB THR A 24 14.706 -6.482 -7.354 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.377 -6.036 -9.484 1.00 0.00 H new ATOM 0 HG21 THR A 24 15.447 -8.777 -8.000 1.00 0.00 H new ATOM 0 HG22 THR A 24 14.411 -8.793 -6.553 1.00 0.00 H new ATOM 0 HG23 THR A 24 13.742 -9.272 -8.132 1.00 0.00 H new ATOM 391 N LEU A 25 13.255 -6.018 -5.146 1.00 0.00 N ATOM 392 CA LEU A 25 13.419 -6.034 -3.676 1.00 0.00 C ATOM 393 C LEU A 25 12.206 -5.437 -2.947 1.00 0.00 C ATOM 394 O LEU A 25 11.922 -5.781 -1.800 1.00 0.00 O ATOM 395 CB LEU A 25 14.710 -5.262 -3.302 1.00 0.00 C ATOM 396 CG LEU A 25 15.990 -5.758 -3.999 1.00 0.00 C ATOM 397 CD1 LEU A 25 17.156 -4.870 -3.584 1.00 0.00 C ATOM 398 CD2 LEU A 25 16.323 -7.205 -3.648 1.00 0.00 C ATOM 0 H LEU A 25 13.727 -5.228 -5.585 1.00 0.00 H new ATOM 0 HA LEU A 25 13.497 -7.073 -3.354 1.00 0.00 H new ATOM 0 HB2 LEU A 25 14.568 -4.209 -3.543 1.00 0.00 H new ATOM 0 HB3 LEU A 25 14.854 -5.326 -2.223 1.00 0.00 H new ATOM 0 HG LEU A 25 15.819 -5.709 -5.074 1.00 0.00 H new ATOM 0 HD11 LEU A 25 18.067 -5.214 -4.073 1.00 0.00 H new ATOM 0 HD12 LEU A 25 16.952 -3.841 -3.879 1.00 0.00 H new ATOM 0 HD13 LEU A 25 17.284 -4.919 -2.503 1.00 0.00 H new ATOM 0 HD21 LEU A 25 17.234 -7.505 -4.166 1.00 0.00 H new ATOM 0 HD22 LEU A 25 16.471 -7.293 -2.572 1.00 0.00 H new ATOM 0 HD23 LEU A 25 15.502 -7.852 -3.955 1.00 0.00 H new ATOM 410 N GLY A 26 11.489 -4.540 -3.625 1.00 0.00 N ATOM 411 CA GLY A 26 10.261 -3.890 -3.173 1.00 0.00 C ATOM 412 C GLY A 26 8.976 -4.501 -3.732 1.00 0.00 C ATOM 413 O GLY A 26 7.922 -3.909 -3.536 1.00 0.00 O ATOM 0 H GLY A 26 11.766 -4.231 -4.557 1.00 0.00 H new ATOM 0 HA2 GLY A 26 10.223 -3.930 -2.084 1.00 0.00 H new ATOM 0 HA3 GLY A 26 10.299 -2.837 -3.452 1.00 0.00 H new ATOM 417 N ALA A 27 9.025 -5.653 -4.410 1.00 0.00 N ATOM 418 CA ALA A 27 7.845 -6.313 -4.986 1.00 0.00 C ATOM 419 C ALA A 27 6.677 -6.436 -3.975 1.00 0.00 C ATOM 420 O ALA A 27 6.788 -7.122 -2.957 1.00 0.00 O ATOM 421 CB ALA A 27 8.265 -7.696 -5.509 1.00 0.00 C ATOM 0 H ALA A 27 9.894 -6.160 -4.577 1.00 0.00 H new ATOM 0 HA ALA A 27 7.470 -5.697 -5.804 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.400 -8.200 -5.940 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.034 -7.578 -6.272 1.00 0.00 H new ATOM 0 HB3 ALA A 27 8.659 -8.292 -4.686 1.00 0.00 H new ATOM 427 N GLY A 28 5.565 -5.733 -4.235 1.00 0.00 N ATOM 428 CA GLY A 28 4.371 -5.680 -3.371 1.00 0.00 C ATOM 429 C GLY A 28 4.479 -4.728 -2.166 1.00 0.00 C ATOM 430 O GLY A 28 3.459 -4.256 -1.659 1.00 0.00 O ATOM 0 H GLY A 28 5.466 -5.167 -5.078 1.00 0.00 H new ATOM 0 HA2 GLY A 28 3.516 -5.379 -3.977 1.00 0.00 H new ATOM 0 HA3 GLY A 28 4.163 -6.685 -3.003 1.00 0.00 H new ATOM 434 N LYS A 29 5.705 -4.378 -1.753 1.00 0.00 N ATOM 435 CA LYS A 29 6.003 -3.320 -0.767 1.00 0.00 C ATOM 436 C LYS A 29 5.825 -1.939 -1.398 1.00 0.00 C ATOM 437 O LYS A 29 5.309 -1.029 -0.759 1.00 0.00 O ATOM 438 CB LYS A 29 7.432 -3.522 -0.216 1.00 0.00 C ATOM 439 CG LYS A 29 7.544 -4.797 0.645 1.00 0.00 C ATOM 440 CD LYS A 29 8.869 -5.562 0.500 1.00 0.00 C ATOM 441 CE LYS A 29 10.078 -4.847 1.126 1.00 0.00 C ATOM 442 NZ LYS A 29 11.306 -5.696 1.036 1.00 0.00 N ATOM 0 H LYS A 29 6.546 -4.836 -2.105 1.00 0.00 H new ATOM 0 HA LYS A 29 5.304 -3.385 0.067 1.00 0.00 H new ATOM 0 HB2 LYS A 29 8.136 -3.582 -1.046 1.00 0.00 H new ATOM 0 HB3 LYS A 29 7.716 -2.655 0.381 1.00 0.00 H new ATOM 0 HG2 LYS A 29 7.412 -4.524 1.692 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.724 -5.467 0.385 1.00 0.00 H new ATOM 0 HD2 LYS A 29 8.762 -6.544 0.962 1.00 0.00 H new ATOM 0 HD3 LYS A 29 9.067 -5.728 -0.559 1.00 0.00 H new ATOM 0 HE2 LYS A 29 10.249 -3.899 0.616 1.00 0.00 H new ATOM 0 HE3 LYS A 29 9.868 -4.615 2.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 12.069 -5.264 1.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 11.100 -6.645 1.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 11.605 -5.770 0.043 1.00 0.00 H new ATOM 456 N ILE A 30 6.205 -1.787 -2.670 1.00 0.00 N ATOM 457 CA ILE A 30 6.076 -0.554 -3.461 1.00 0.00 C ATOM 458 C ILE A 30 5.737 -0.812 -4.939 1.00 0.00 C ATOM 459 O ILE A 30 5.749 -1.949 -5.408 1.00 0.00 O ATOM 460 CB ILE A 30 7.368 0.309 -3.341 1.00 0.00 C ATOM 461 CG1 ILE A 30 8.705 -0.355 -3.743 1.00 0.00 C ATOM 462 CG2 ILE A 30 7.570 0.806 -1.905 1.00 0.00 C ATOM 463 CD1 ILE A 30 8.810 -0.864 -5.183 1.00 0.00 C ATOM 0 H ILE A 30 6.628 -2.549 -3.200 1.00 0.00 H new ATOM 0 HA ILE A 30 5.232 -0.006 -3.042 1.00 0.00 H new ATOM 0 HB ILE A 30 7.167 1.101 -4.062 1.00 0.00 H new ATOM 0 HG12 ILE A 30 9.507 0.364 -3.576 1.00 0.00 H new ATOM 0 HG13 ILE A 30 8.885 -1.194 -3.071 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.479 1.405 -1.852 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.716 1.415 -1.607 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.659 -0.048 -1.233 1.00 0.00 H new ATOM 0 HD11 ILE A 30 9.793 -1.308 -5.341 1.00 0.00 H new ATOM 0 HD12 ILE A 30 8.040 -1.615 -5.361 1.00 0.00 H new ATOM 0 HD13 ILE A 30 8.672 -0.032 -5.874 1.00 0.00 H new ATOM 475 N ALA A 31 5.449 0.271 -5.664 1.00 0.00 N ATOM 476 CA ALA A 31 5.340 0.312 -7.130 1.00 0.00 C ATOM 477 C ALA A 31 6.288 1.414 -7.649 1.00 0.00 C ATOM 478 O ALA A 31 6.453 2.440 -6.984 1.00 0.00 O ATOM 479 CB ALA A 31 3.881 0.495 -7.562 1.00 0.00 C ATOM 0 H ALA A 31 5.278 1.180 -5.233 1.00 0.00 H new ATOM 0 HA ALA A 31 5.650 -0.634 -7.575 1.00 0.00 H new ATOM 0 HB1 ALA A 31 3.824 0.523 -8.650 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.284 -0.337 -7.189 1.00 0.00 H new ATOM 0 HB3 ALA A 31 3.496 1.430 -7.155 1.00 0.00 H new ATOM 485 N VAL A 32 6.953 1.206 -8.790 1.00 0.00 N ATOM 486 CA VAL A 32 8.044 2.071 -9.256 1.00 0.00 C ATOM 487 C VAL A 32 8.027 2.410 -10.743 1.00 0.00 C ATOM 488 O VAL A 32 7.543 1.645 -11.578 1.00 0.00 O ATOM 489 CB VAL A 32 9.400 1.451 -8.900 1.00 0.00 C ATOM 490 CG1 VAL A 32 9.820 1.969 -7.531 1.00 0.00 C ATOM 491 CG2 VAL A 32 9.471 -0.080 -8.949 1.00 0.00 C ATOM 0 H VAL A 32 6.749 0.430 -9.420 1.00 0.00 H new ATOM 0 HA VAL A 32 7.884 3.015 -8.735 1.00 0.00 H new ATOM 0 HB VAL A 32 10.093 1.763 -9.682 1.00 0.00 H new ATOM 0 HG11 VAL A 32 10.784 1.539 -7.259 1.00 0.00 H new ATOM 0 HG12 VAL A 32 9.904 3.055 -7.563 1.00 0.00 H new ATOM 0 HG13 VAL A 32 9.074 1.684 -6.790 1.00 0.00 H new ATOM 0 HG21 VAL A 32 10.475 -0.406 -8.679 1.00 0.00 H new ATOM 0 HG22 VAL A 32 8.752 -0.500 -8.246 1.00 0.00 H new ATOM 0 HG23 VAL A 32 9.236 -0.423 -9.957 1.00 0.00 H new ATOM 501 N THR A 33 8.635 3.560 -11.045 1.00 0.00 N ATOM 502 CA THR A 33 8.841 4.109 -12.394 1.00 0.00 C ATOM 503 C THR A 33 10.169 4.884 -12.428 1.00 0.00 C ATOM 504 O THR A 33 10.632 5.355 -11.386 1.00 0.00 O ATOM 505 CB THR A 33 7.676 5.058 -12.757 1.00 0.00 C ATOM 506 OG1 THR A 33 6.412 4.517 -12.415 1.00 0.00 O ATOM 507 CG2 THR A 33 7.589 5.395 -14.247 1.00 0.00 C ATOM 0 H THR A 33 9.018 4.167 -10.320 1.00 0.00 H new ATOM 0 HA THR A 33 8.874 3.294 -13.117 1.00 0.00 H new ATOM 0 HB THR A 33 7.902 5.955 -12.181 1.00 0.00 H new ATOM 0 HG1 THR A 33 5.707 5.152 -12.661 1.00 0.00 H new ATOM 0 HG21 THR A 33 6.747 6.065 -14.420 1.00 0.00 H new ATOM 0 HG22 THR A 33 8.511 5.882 -14.564 1.00 0.00 H new ATOM 0 HG23 THR A 33 7.447 4.478 -14.820 1.00 0.00 H new ATOM 515 N SER A 34 10.809 5.040 -13.587 1.00 0.00 N ATOM 516 CA SER A 34 11.951 5.949 -13.767 1.00 0.00 C ATOM 517 C SER A 34 11.735 6.902 -14.949 1.00 0.00 C ATOM 518 O SER A 34 11.031 6.587 -15.910 1.00 0.00 O ATOM 519 CB SER A 34 13.289 5.212 -13.872 1.00 0.00 C ATOM 520 OG SER A 34 13.419 4.497 -15.079 1.00 0.00 O ATOM 0 H SER A 34 10.551 4.537 -14.436 1.00 0.00 H new ATOM 0 HA SER A 34 12.006 6.553 -12.861 1.00 0.00 H new ATOM 0 HB2 SER A 34 14.104 5.932 -13.790 1.00 0.00 H new ATOM 0 HB3 SER A 34 13.387 4.523 -13.033 1.00 0.00 H new ATOM 0 HG SER A 34 12.740 3.791 -15.116 1.00 0.00 H new ATOM 526 N CYS A 35 12.329 8.091 -14.845 1.00 0.00 N ATOM 527 CA CYS A 35 12.256 9.159 -15.834 1.00 0.00 C ATOM 528 C CYS A 35 13.501 10.054 -15.753 1.00 0.00 C ATOM 529 O CYS A 35 14.428 9.803 -14.981 1.00 0.00 O ATOM 530 CB CYS A 35 10.960 9.952 -15.624 1.00 0.00 C ATOM 531 SG CYS A 35 11.004 10.984 -14.141 1.00 0.00 S ATOM 0 H CYS A 35 12.896 8.343 -14.036 1.00 0.00 H new ATOM 0 HA CYS A 35 12.238 8.735 -16.838 1.00 0.00 H new ATOM 0 HB2 CYS A 35 10.780 10.582 -16.495 1.00 0.00 H new ATOM 0 HB3 CYS A 35 10.122 9.258 -15.554 1.00 0.00 H new ATOM 0 HG CYS A 35 10.553 10.307 -13.127 1.00 0.00 H new ATOM 537 N GLY A 36 13.560 11.109 -16.557 1.00 0.00 N ATOM 538 CA GLY A 36 14.588 12.141 -16.417 1.00 0.00 C ATOM 539 C GLY A 36 14.122 13.487 -16.923 1.00 0.00 C ATOM 540 O GLY A 36 13.115 13.559 -17.614 1.00 0.00 O ATOM 0 H GLY A 36 12.903 11.275 -17.320 1.00 0.00 H new ATOM 0 HA2 GLY A 36 14.872 12.228 -15.368 1.00 0.00 H new ATOM 0 HA3 GLY A 36 15.480 11.838 -16.965 1.00 0.00 H new ATOM 544 N LEU A 37 14.841 14.569 -16.629 1.00 0.00 N ATOM 545 CA LEU A 37 14.492 15.879 -17.221 1.00 0.00 C ATOM 546 C LEU A 37 14.664 15.902 -18.756 1.00 0.00 C ATOM 547 O LEU A 37 14.119 16.772 -19.436 1.00 0.00 O ATOM 548 CB LEU A 37 15.162 17.062 -16.511 1.00 0.00 C ATOM 549 CG LEU A 37 16.675 16.922 -16.257 1.00 0.00 C ATOM 550 CD1 LEU A 37 17.369 18.283 -16.320 1.00 0.00 C ATOM 551 CD2 LEU A 37 16.925 16.349 -14.859 1.00 0.00 C ATOM 0 H LEU A 37 15.647 14.578 -16.004 1.00 0.00 H new ATOM 0 HA LEU A 37 13.425 16.014 -17.043 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.994 17.960 -17.105 1.00 0.00 H new ATOM 0 HB3 LEU A 37 14.665 17.216 -15.553 1.00 0.00 H new ATOM 0 HG LEU A 37 17.073 16.261 -17.027 1.00 0.00 H new ATOM 0 HD11 LEU A 37 18.436 18.156 -16.137 1.00 0.00 H new ATOM 0 HD12 LEU A 37 17.219 18.722 -17.306 1.00 0.00 H new ATOM 0 HD13 LEU A 37 16.947 18.942 -15.561 1.00 0.00 H new ATOM 0 HD21 LEU A 37 17.998 16.255 -14.691 1.00 0.00 H new ATOM 0 HD22 LEU A 37 16.498 17.016 -14.111 1.00 0.00 H new ATOM 0 HD23 LEU A 37 16.458 15.368 -14.779 1.00 0.00 H new ATOM 563 N GLU A 38 15.368 14.902 -19.283 1.00 0.00 N ATOM 564 CA GLU A 38 15.496 14.560 -20.702 1.00 0.00 C ATOM 565 C GLU A 38 15.449 13.026 -20.860 1.00 0.00 C ATOM 566 O GLU A 38 15.583 12.278 -19.886 1.00 0.00 O ATOM 567 CB GLU A 38 16.803 15.118 -21.304 1.00 0.00 C ATOM 568 CG GLU A 38 16.942 16.641 -21.188 1.00 0.00 C ATOM 569 CD GLU A 38 18.205 17.134 -21.920 1.00 0.00 C ATOM 570 OE1 GLU A 38 19.302 17.142 -21.308 1.00 0.00 O ATOM 571 OE2 GLU A 38 18.110 17.521 -23.111 1.00 0.00 O ATOM 0 H GLU A 38 15.901 14.265 -18.691 1.00 0.00 H new ATOM 0 HA GLU A 38 14.666 15.014 -21.244 1.00 0.00 H new ATOM 0 HB2 GLU A 38 17.651 14.647 -20.806 1.00 0.00 H new ATOM 0 HB3 GLU A 38 16.855 14.838 -22.356 1.00 0.00 H new ATOM 0 HG2 GLU A 38 16.060 17.124 -21.609 1.00 0.00 H new ATOM 0 HG3 GLU A 38 16.991 16.927 -20.137 1.00 0.00 H new ATOM 578 N SER A 39 15.300 12.553 -22.096 1.00 0.00 N ATOM 579 CA SER A 39 15.441 11.145 -22.490 1.00 0.00 C ATOM 580 C SER A 39 16.543 10.989 -23.550 1.00 0.00 C ATOM 581 O SER A 39 16.830 11.919 -24.314 1.00 0.00 O ATOM 582 CB SER A 39 14.100 10.585 -22.990 1.00 0.00 C ATOM 583 OG SER A 39 13.567 11.389 -24.036 1.00 0.00 O ATOM 0 H SER A 39 15.069 13.159 -22.883 1.00 0.00 H new ATOM 0 HA SER A 39 15.736 10.567 -21.614 1.00 0.00 H new ATOM 0 HB2 SER A 39 14.239 9.564 -23.346 1.00 0.00 H new ATOM 0 HB3 SER A 39 13.390 10.540 -22.164 1.00 0.00 H new ATOM 0 HG SER A 39 12.715 11.011 -24.338 1.00 0.00 H new ATOM 589 N SER A 40 17.172 9.813 -23.598 1.00 0.00 N ATOM 590 CA SER A 40 18.160 9.444 -24.625 1.00 0.00 C ATOM 591 C SER A 40 17.920 8.026 -25.166 1.00 0.00 C ATOM 592 O SER A 40 17.258 7.850 -26.190 1.00 0.00 O ATOM 593 CB SER A 40 19.585 9.657 -24.096 1.00 0.00 C ATOM 594 OG SER A 40 19.784 8.901 -22.910 1.00 0.00 O ATOM 0 H SER A 40 17.009 9.074 -22.914 1.00 0.00 H new ATOM 0 HA SER A 40 18.035 10.106 -25.482 1.00 0.00 H new ATOM 0 HB2 SER A 40 20.310 9.358 -24.853 1.00 0.00 H new ATOM 0 HB3 SER A 40 19.752 10.715 -23.894 1.00 0.00 H new ATOM 0 HG SER A 40 19.191 9.236 -22.205 1.00 0.00 H new ATOM 600 N ARG A 41 18.446 7.016 -24.462 1.00 0.00 N ATOM 601 CA ARG A 41 18.299 5.569 -24.694 1.00 0.00 C ATOM 602 C ARG A 41 18.604 4.826 -23.401 1.00 0.00 C ATOM 603 O ARG A 41 19.474 5.269 -22.657 1.00 0.00 O ATOM 604 CB ARG A 41 19.228 5.117 -25.850 1.00 0.00 C ATOM 605 CG ARG A 41 20.741 4.962 -25.566 1.00 0.00 C ATOM 606 CD ARG A 41 21.489 6.219 -25.088 1.00 0.00 C ATOM 607 NE ARG A 41 22.945 5.948 -24.998 1.00 0.00 N ATOM 608 CZ ARG A 41 23.812 6.388 -24.098 1.00 0.00 C ATOM 609 NH1 ARG A 41 23.498 7.231 -23.158 1.00 0.00 N ATOM 610 NH2 ARG A 41 25.047 5.977 -24.120 1.00 0.00 N ATOM 0 H ARG A 41 19.033 7.202 -23.649 1.00 0.00 H new ATOM 0 HA ARG A 41 17.276 5.338 -24.991 1.00 0.00 H new ATOM 0 HB2 ARG A 41 18.860 4.158 -26.215 1.00 0.00 H new ATOM 0 HB3 ARG A 41 19.116 5.833 -26.664 1.00 0.00 H new ATOM 0 HG2 ARG A 41 20.867 4.184 -24.813 1.00 0.00 H new ATOM 0 HG3 ARG A 41 21.223 4.605 -26.476 1.00 0.00 H new ATOM 0 HD2 ARG A 41 21.307 7.043 -25.778 1.00 0.00 H new ATOM 0 HD3 ARG A 41 21.109 6.529 -24.115 1.00 0.00 H new ATOM 0 HE ARG A 41 23.329 5.344 -25.724 1.00 0.00 H new ATOM 0 HH11 ARG A 41 22.544 7.586 -23.089 1.00 0.00 H new ATOM 0 HH12 ARG A 41 24.206 7.537 -22.490 1.00 0.00 H new ATOM 0 HH21 ARG A 41 25.351 5.313 -24.832 1.00 0.00 H new ATOM 0 HH22 ARG A 41 25.711 6.319 -23.425 1.00 0.00 H new ATOM 624 N VAL A 42 17.950 3.700 -23.118 1.00 0.00 N ATOM 625 CA VAL A 42 18.384 2.853 -21.995 1.00 0.00 C ATOM 626 C VAL A 42 19.808 2.350 -22.255 1.00 0.00 C ATOM 627 O VAL A 42 20.119 1.917 -23.366 1.00 0.00 O ATOM 628 CB VAL A 42 17.372 1.725 -21.700 1.00 0.00 C ATOM 629 CG1 VAL A 42 17.837 0.300 -21.973 1.00 0.00 C ATOM 630 CG2 VAL A 42 16.984 1.832 -20.228 1.00 0.00 C ATOM 0 H VAL A 42 17.139 3.355 -23.632 1.00 0.00 H new ATOM 0 HA VAL A 42 18.410 3.448 -21.082 1.00 0.00 H new ATOM 0 HB VAL A 42 16.547 1.882 -22.394 1.00 0.00 H new ATOM 0 HG11 VAL A 42 17.037 -0.398 -21.726 1.00 0.00 H new ATOM 0 HG12 VAL A 42 18.095 0.197 -23.027 1.00 0.00 H new ATOM 0 HG13 VAL A 42 18.712 0.079 -21.362 1.00 0.00 H new ATOM 0 HG21 VAL A 42 16.268 1.048 -19.983 1.00 0.00 H new ATOM 0 HG22 VAL A 42 17.873 1.718 -19.608 1.00 0.00 H new ATOM 0 HG23 VAL A 42 16.534 2.807 -20.040 1.00 0.00 H new ATOM 640 N HIS A 43 20.690 2.447 -21.256 1.00 0.00 N ATOM 641 CA HIS A 43 22.107 2.132 -21.459 1.00 0.00 C ATOM 642 C HIS A 43 22.323 0.615 -21.562 1.00 0.00 C ATOM 643 O HIS A 43 21.882 -0.112 -20.672 1.00 0.00 O ATOM 644 CB HIS A 43 22.950 2.758 -20.345 1.00 0.00 C ATOM 645 CG HIS A 43 24.391 2.806 -20.736 1.00 0.00 C ATOM 646 ND1 HIS A 43 25.260 1.717 -20.781 1.00 0.00 N ATOM 647 CD2 HIS A 43 25.006 3.897 -21.261 1.00 0.00 C ATOM 648 CE1 HIS A 43 26.402 2.197 -21.309 1.00 0.00 C ATOM 649 NE2 HIS A 43 26.266 3.495 -21.622 1.00 0.00 N ATOM 0 H HIS A 43 20.451 2.738 -20.308 1.00 0.00 H new ATOM 0 HA HIS A 43 22.433 2.563 -22.405 1.00 0.00 H new ATOM 0 HB2 HIS A 43 22.592 3.766 -20.134 1.00 0.00 H new ATOM 0 HB3 HIS A 43 22.836 2.180 -19.428 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.586 4.886 -21.372 1.00 0.00 H new ATOM 0 HE1 HIS A 43 27.301 1.618 -21.460 1.00 0.00 H new ATOM 0 HE2 HIS A 43 26.979 4.082 -22.055 1.00 0.00 H new ATOM 657 N PRO A 44 22.999 0.095 -22.601 1.00 0.00 N ATOM 658 CA PRO A 44 23.046 -1.345 -22.820 1.00 0.00 C ATOM 659 C PRO A 44 23.945 -2.063 -21.800 1.00 0.00 C ATOM 660 O PRO A 44 23.698 -3.222 -21.460 1.00 0.00 O ATOM 661 CB PRO A 44 23.534 -1.504 -24.263 1.00 0.00 C ATOM 662 CG PRO A 44 24.415 -0.273 -24.479 1.00 0.00 C ATOM 663 CD PRO A 44 23.679 0.803 -23.679 1.00 0.00 C ATOM 0 HA PRO A 44 22.072 -1.812 -22.676 1.00 0.00 H new ATOM 0 HB2 PRO A 44 24.096 -2.428 -24.397 1.00 0.00 H new ATOM 0 HB3 PRO A 44 22.703 -1.531 -24.967 1.00 0.00 H new ATOM 0 HG2 PRO A 44 25.429 -0.430 -24.111 1.00 0.00 H new ATOM 0 HG3 PRO A 44 24.495 -0.011 -25.534 1.00 0.00 H new ATOM 0 HD2 PRO A 44 24.375 1.543 -23.284 1.00 0.00 H new ATOM 0 HD3 PRO A 44 22.967 1.339 -24.306 1.00 0.00 H new ATOM 671 N THR A 45 24.944 -1.370 -21.239 1.00 0.00 N ATOM 672 CA THR A 45 25.807 -1.920 -20.180 1.00 0.00 C ATOM 673 C THR A 45 25.096 -1.926 -18.826 1.00 0.00 C ATOM 674 O THR A 45 25.325 -2.831 -18.028 1.00 0.00 O ATOM 675 CB THR A 45 27.153 -1.183 -20.122 1.00 0.00 C ATOM 676 OG1 THR A 45 27.743 -1.176 -21.409 1.00 0.00 O ATOM 677 CG2 THR A 45 28.146 -1.865 -19.178 1.00 0.00 C ATOM 0 H THR A 45 25.178 -0.413 -21.504 1.00 0.00 H new ATOM 0 HA THR A 45 26.020 -2.959 -20.430 1.00 0.00 H new ATOM 0 HB THR A 45 26.946 -0.176 -19.761 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.601 -0.704 -21.373 1.00 0.00 H new ATOM 0 HG21 THR A 45 29.083 -1.307 -19.171 1.00 0.00 H new ATOM 0 HG22 THR A 45 27.731 -1.891 -18.170 1.00 0.00 H new ATOM 0 HG23 THR A 45 28.333 -2.883 -19.520 1.00 0.00 H new ATOM 685 N ALA A 46 24.144 -1.016 -18.580 1.00 0.00 N ATOM 686 CA ALA A 46 23.286 -1.079 -17.392 1.00 0.00 C ATOM 687 C ALA A 46 22.525 -2.409 -17.309 1.00 0.00 C ATOM 688 O ALA A 46 22.557 -3.076 -16.281 1.00 0.00 O ATOM 689 CB ALA A 46 22.287 0.086 -17.430 1.00 0.00 C ATOM 0 H ALA A 46 23.949 -0.224 -19.192 1.00 0.00 H new ATOM 0 HA ALA A 46 23.921 -1.006 -16.509 1.00 0.00 H new ATOM 0 HB1 ALA A 46 21.646 0.045 -16.549 1.00 0.00 H new ATOM 0 HB2 ALA A 46 22.830 1.031 -17.439 1.00 0.00 H new ATOM 0 HB3 ALA A 46 21.674 0.011 -18.328 1.00 0.00 H new ATOM 695 N ILE A 47 21.907 -2.834 -18.412 1.00 0.00 N ATOM 696 CA ILE A 47 21.221 -4.133 -18.510 1.00 0.00 C ATOM 697 C ILE A 47 22.191 -5.271 -18.177 1.00 0.00 C ATOM 698 O ILE A 47 21.882 -6.102 -17.327 1.00 0.00 O ATOM 699 CB ILE A 47 20.629 -4.284 -19.926 1.00 0.00 C ATOM 700 CG1 ILE A 47 19.459 -3.299 -20.149 1.00 0.00 C ATOM 701 CG2 ILE A 47 20.144 -5.710 -20.221 1.00 0.00 C ATOM 702 CD1 ILE A 47 19.507 -2.672 -21.538 1.00 0.00 C ATOM 0 H ILE A 47 21.865 -2.286 -19.271 1.00 0.00 H new ATOM 0 HA ILE A 47 20.406 -4.180 -17.788 1.00 0.00 H new ATOM 0 HB ILE A 47 21.443 -4.055 -20.613 1.00 0.00 H new ATOM 0 HG12 ILE A 47 18.512 -3.823 -20.019 1.00 0.00 H new ATOM 0 HG13 ILE A 47 19.495 -2.514 -19.394 1.00 0.00 H new ATOM 0 HG21 ILE A 47 19.738 -5.754 -21.232 1.00 0.00 H new ATOM 0 HG22 ILE A 47 20.980 -6.404 -20.135 1.00 0.00 H new ATOM 0 HG23 ILE A 47 19.369 -5.986 -19.506 1.00 0.00 H new ATOM 0 HD11 ILE A 47 18.668 -1.986 -21.657 1.00 0.00 H new ATOM 0 HD12 ILE A 47 20.443 -2.126 -21.659 1.00 0.00 H new ATOM 0 HD13 ILE A 47 19.444 -3.455 -22.293 1.00 0.00 H new ATOM 714 N ALA A 48 23.395 -5.256 -18.753 1.00 0.00 N ATOM 715 CA ALA A 48 24.411 -6.281 -18.490 1.00 0.00 C ATOM 716 C ALA A 48 24.825 -6.343 -17.006 1.00 0.00 C ATOM 717 O ALA A 48 25.012 -7.424 -16.448 1.00 0.00 O ATOM 718 CB ALA A 48 25.624 -5.984 -19.374 1.00 0.00 C ATOM 0 H ALA A 48 23.694 -4.537 -19.412 1.00 0.00 H new ATOM 0 HA ALA A 48 23.989 -7.258 -18.725 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.395 -6.733 -19.197 1.00 0.00 H new ATOM 0 HB2 ALA A 48 25.326 -6.011 -20.422 1.00 0.00 H new ATOM 0 HB3 ALA A 48 26.016 -4.996 -19.134 1.00 0.00 H new ATOM 724 N MET A 49 24.926 -5.180 -16.353 1.00 0.00 N ATOM 725 CA MET A 49 25.323 -5.053 -14.948 1.00 0.00 C ATOM 726 C MET A 49 24.180 -5.404 -13.991 1.00 0.00 C ATOM 727 O MET A 49 24.448 -5.880 -12.892 1.00 0.00 O ATOM 728 CB MET A 49 25.895 -3.650 -14.702 1.00 0.00 C ATOM 729 CG MET A 49 27.118 -3.367 -15.586 1.00 0.00 C ATOM 730 SD MET A 49 28.726 -3.751 -14.848 1.00 0.00 S ATOM 731 CE MET A 49 28.962 -5.461 -15.371 1.00 0.00 C ATOM 0 H MET A 49 24.730 -4.283 -16.796 1.00 0.00 H new ATOM 0 HA MET A 49 26.107 -5.780 -14.737 1.00 0.00 H new ATOM 0 HB2 MET A 49 25.125 -2.904 -14.899 1.00 0.00 H new ATOM 0 HB3 MET A 49 26.174 -3.551 -13.653 1.00 0.00 H new ATOM 0 HG2 MET A 49 27.017 -3.939 -16.509 1.00 0.00 H new ATOM 0 HG3 MET A 49 27.108 -2.312 -15.862 1.00 0.00 H new ATOM 0 HE1 MET A 49 29.970 -5.785 -15.112 1.00 0.00 H new ATOM 0 HE2 MET A 49 28.235 -6.099 -14.868 1.00 0.00 H new ATOM 0 HE3 MET A 49 28.823 -5.534 -16.450 1.00 0.00 H new ATOM 741 N MET A 50 22.920 -5.242 -14.403 1.00 0.00 N ATOM 742 CA MET A 50 21.756 -5.749 -13.663 1.00 0.00 C ATOM 743 C MET A 50 21.570 -7.262 -13.873 1.00 0.00 C ATOM 744 O MET A 50 21.144 -7.959 -12.951 1.00 0.00 O ATOM 745 CB MET A 50 20.497 -4.967 -14.072 1.00 0.00 C ATOM 746 CG MET A 50 20.549 -3.482 -13.673 1.00 0.00 C ATOM 747 SD MET A 50 20.856 -3.113 -11.922 1.00 0.00 S ATOM 748 CE MET A 50 19.523 -4.067 -11.159 1.00 0.00 C ATOM 0 H MET A 50 22.675 -4.753 -15.264 1.00 0.00 H new ATOM 0 HA MET A 50 21.930 -5.597 -12.598 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.365 -5.042 -15.151 1.00 0.00 H new ATOM 0 HB3 MET A 50 19.624 -5.430 -13.612 1.00 0.00 H new ATOM 0 HG2 MET A 50 21.328 -2.999 -14.263 1.00 0.00 H new ATOM 0 HG3 MET A 50 19.603 -3.021 -13.956 1.00 0.00 H new ATOM 0 HE1 MET A 50 19.094 -3.498 -10.334 1.00 0.00 H new ATOM 0 HE2 MET A 50 18.750 -4.270 -11.900 1.00 0.00 H new ATOM 0 HE3 MET A 50 19.920 -5.009 -10.782 1.00 0.00 H new ATOM 758 N GLU A 51 21.969 -7.811 -15.024 1.00 0.00 N ATOM 759 CA GLU A 51 21.916 -9.260 -15.264 1.00 0.00 C ATOM 760 C GLU A 51 22.918 -10.049 -14.396 1.00 0.00 C ATOM 761 O GLU A 51 22.656 -11.215 -14.097 1.00 0.00 O ATOM 762 CB GLU A 51 22.127 -9.585 -16.754 1.00 0.00 C ATOM 763 CG GLU A 51 20.876 -9.337 -17.607 1.00 0.00 C ATOM 764 CD GLU A 51 21.117 -9.806 -19.056 1.00 0.00 C ATOM 765 OE1 GLU A 51 21.893 -9.159 -19.802 1.00 0.00 O ATOM 766 OE2 GLU A 51 20.536 -10.844 -19.461 1.00 0.00 O ATOM 0 H GLU A 51 22.334 -7.272 -15.809 1.00 0.00 H new ATOM 0 HA GLU A 51 20.916 -9.580 -14.970 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.948 -8.980 -17.139 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.426 -10.628 -16.853 1.00 0.00 H new ATOM 0 HG2 GLU A 51 20.026 -9.870 -17.181 1.00 0.00 H new ATOM 0 HG3 GLU A 51 20.625 -8.276 -17.597 1.00 0.00 H new ATOM 773 N GLU A 52 24.012 -9.436 -13.906 1.00 0.00 N ATOM 774 CA GLU A 52 24.934 -10.112 -12.962 1.00 0.00 C ATOM 775 C GLU A 52 24.250 -10.518 -11.641 1.00 0.00 C ATOM 776 O GLU A 52 24.641 -11.497 -11.003 1.00 0.00 O ATOM 777 CB GLU A 52 26.126 -9.221 -12.587 1.00 0.00 C ATOM 778 CG GLU A 52 26.917 -8.670 -13.772 1.00 0.00 C ATOM 779 CD GLU A 52 28.348 -8.314 -13.350 1.00 0.00 C ATOM 780 OE1 GLU A 52 28.527 -7.394 -12.517 1.00 0.00 O ATOM 781 OE2 GLU A 52 29.310 -8.931 -13.861 1.00 0.00 O ATOM 0 H GLU A 52 24.281 -8.481 -14.143 1.00 0.00 H new ATOM 0 HA GLU A 52 25.266 -11.002 -13.496 1.00 0.00 H new ATOM 0 HB2 GLU A 52 25.762 -8.384 -11.992 1.00 0.00 H new ATOM 0 HB3 GLU A 52 26.803 -9.793 -11.952 1.00 0.00 H new ATOM 0 HG2 GLU A 52 26.942 -9.408 -14.574 1.00 0.00 H new ATOM 0 HG3 GLU A 52 26.419 -7.785 -14.168 1.00 0.00 H new ATOM 788 N VAL A 53 23.220 -9.757 -11.252 1.00 0.00 N ATOM 789 CA VAL A 53 22.391 -9.956 -10.053 1.00 0.00 C ATOM 790 C VAL A 53 21.011 -10.557 -10.407 1.00 0.00 C ATOM 791 O VAL A 53 20.120 -10.672 -9.564 1.00 0.00 O ATOM 792 CB VAL A 53 22.401 -8.656 -9.212 1.00 0.00 C ATOM 793 CG1 VAL A 53 21.883 -7.427 -9.970 1.00 0.00 C ATOM 794 CG2 VAL A 53 21.687 -8.748 -7.859 1.00 0.00 C ATOM 0 H VAL A 53 22.926 -8.943 -11.792 1.00 0.00 H new ATOM 0 HA VAL A 53 22.812 -10.721 -9.400 1.00 0.00 H new ATOM 0 HB VAL A 53 23.464 -8.527 -9.009 1.00 0.00 H new ATOM 0 HG11 VAL A 53 21.920 -6.555 -9.317 1.00 0.00 H new ATOM 0 HG12 VAL A 53 22.506 -7.251 -10.847 1.00 0.00 H new ATOM 0 HG13 VAL A 53 20.854 -7.601 -10.285 1.00 0.00 H new ATOM 0 HG21 VAL A 53 21.750 -7.787 -7.348 1.00 0.00 H new ATOM 0 HG22 VAL A 53 20.640 -9.007 -8.017 1.00 0.00 H new ATOM 0 HG23 VAL A 53 22.162 -9.516 -7.248 1.00 0.00 H new ATOM 804 N GLY A 54 20.834 -10.998 -11.662 1.00 0.00 N ATOM 805 CA GLY A 54 19.637 -11.698 -12.144 1.00 0.00 C ATOM 806 C GLY A 54 18.400 -10.810 -12.346 1.00 0.00 C ATOM 807 O GLY A 54 17.280 -11.322 -12.394 1.00 0.00 O ATOM 0 H GLY A 54 21.540 -10.873 -12.388 1.00 0.00 H new ATOM 0 HA2 GLY A 54 19.875 -12.183 -13.091 1.00 0.00 H new ATOM 0 HA3 GLY A 54 19.387 -12.487 -11.435 1.00 0.00 H new ATOM 811 N ILE A 55 18.582 -9.487 -12.450 1.00 0.00 N ATOM 812 CA ILE A 55 17.503 -8.495 -12.602 1.00 0.00 C ATOM 813 C ILE A 55 17.435 -8.014 -14.057 1.00 0.00 C ATOM 814 O ILE A 55 18.443 -7.641 -14.651 1.00 0.00 O ATOM 815 CB ILE A 55 17.694 -7.344 -11.590 1.00 0.00 C ATOM 816 CG1 ILE A 55 17.583 -7.886 -10.144 1.00 0.00 C ATOM 817 CG2 ILE A 55 16.668 -6.219 -11.820 1.00 0.00 C ATOM 818 CD1 ILE A 55 17.778 -6.839 -9.041 1.00 0.00 C ATOM 0 H ILE A 55 19.509 -9.063 -12.430 1.00 0.00 H new ATOM 0 HA ILE A 55 16.540 -8.953 -12.376 1.00 0.00 H new ATOM 0 HB ILE A 55 18.688 -6.923 -11.739 1.00 0.00 H new ATOM 0 HG12 ILE A 55 16.602 -8.345 -10.019 1.00 0.00 H new ATOM 0 HG13 ILE A 55 18.323 -8.675 -10.010 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.830 -5.425 -11.091 1.00 0.00 H new ATOM 0 HG22 ILE A 55 16.787 -5.818 -12.827 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.660 -6.617 -11.705 1.00 0.00 H new ATOM 0 HD11 ILE A 55 17.682 -7.316 -8.066 1.00 0.00 H new ATOM 0 HD12 ILE A 55 18.769 -6.395 -9.132 1.00 0.00 H new ATOM 0 HD13 ILE A 55 17.022 -6.061 -9.140 1.00 0.00 H new ATOM 830 N ASP A 56 16.231 -7.995 -14.628 1.00 0.00 N ATOM 831 CA ASP A 56 15.987 -7.571 -16.011 1.00 0.00 C ATOM 832 C ASP A 56 15.492 -6.119 -16.076 1.00 0.00 C ATOM 833 O ASP A 56 14.485 -5.766 -15.460 1.00 0.00 O ATOM 834 CB ASP A 56 14.997 -8.551 -16.660 1.00 0.00 C ATOM 835 CG ASP A 56 14.804 -8.295 -18.167 1.00 0.00 C ATOM 836 OD1 ASP A 56 14.323 -7.201 -18.546 1.00 0.00 O ATOM 837 OD2 ASP A 56 15.135 -9.198 -18.973 1.00 0.00 O ATOM 0 H ASP A 56 15.383 -8.278 -14.137 1.00 0.00 H new ATOM 0 HA ASP A 56 16.923 -7.593 -16.570 1.00 0.00 H new ATOM 0 HB2 ASP A 56 15.353 -9.571 -16.512 1.00 0.00 H new ATOM 0 HB3 ASP A 56 14.033 -8.473 -16.157 1.00 0.00 H new ATOM 842 N ILE A 57 16.183 -5.273 -16.845 1.00 0.00 N ATOM 843 CA ILE A 57 15.727 -3.914 -17.199 1.00 0.00 C ATOM 844 C ILE A 57 15.706 -3.699 -18.729 1.00 0.00 C ATOM 845 O ILE A 57 15.796 -2.571 -19.206 1.00 0.00 O ATOM 846 CB ILE A 57 16.487 -2.812 -16.423 1.00 0.00 C ATOM 847 CG1 ILE A 57 17.999 -2.820 -16.716 1.00 0.00 C ATOM 848 CG2 ILE A 57 16.245 -2.896 -14.904 1.00 0.00 C ATOM 849 CD1 ILE A 57 18.610 -1.422 -16.585 1.00 0.00 C ATOM 0 H ILE A 57 17.089 -5.511 -17.248 1.00 0.00 H new ATOM 0 HA ILE A 57 14.691 -3.823 -16.871 1.00 0.00 H new ATOM 0 HB ILE A 57 16.079 -1.868 -16.783 1.00 0.00 H new ATOM 0 HG12 ILE A 57 18.499 -3.501 -16.028 1.00 0.00 H new ATOM 0 HG13 ILE A 57 18.172 -3.200 -17.723 1.00 0.00 H new ATOM 0 HG21 ILE A 57 16.799 -2.102 -14.403 1.00 0.00 H new ATOM 0 HG22 ILE A 57 15.181 -2.781 -14.698 1.00 0.00 H new ATOM 0 HG23 ILE A 57 16.584 -3.864 -14.535 1.00 0.00 H new ATOM 0 HD11 ILE A 57 19.678 -1.470 -16.799 1.00 0.00 H new ATOM 0 HD12 ILE A 57 18.128 -0.747 -17.292 1.00 0.00 H new ATOM 0 HD13 ILE A 57 18.460 -1.053 -15.570 1.00 0.00 H new ATOM 861 N SER A 58 15.573 -4.776 -19.510 1.00 0.00 N ATOM 862 CA SER A 58 15.502 -4.738 -20.983 1.00 0.00 C ATOM 863 C SER A 58 14.123 -4.295 -21.493 1.00 0.00 C ATOM 864 O SER A 58 14.019 -3.675 -22.550 1.00 0.00 O ATOM 865 CB SER A 58 15.820 -6.123 -21.559 1.00 0.00 C ATOM 866 OG SER A 58 17.087 -6.573 -21.109 1.00 0.00 O ATOM 0 H SER A 58 15.510 -5.721 -19.132 1.00 0.00 H new ATOM 0 HA SER A 58 16.237 -4.005 -21.316 1.00 0.00 H new ATOM 0 HB2 SER A 58 15.049 -6.833 -21.260 1.00 0.00 H new ATOM 0 HB3 SER A 58 15.809 -6.081 -22.648 1.00 0.00 H new ATOM 0 HG SER A 58 17.272 -7.459 -21.485 1.00 0.00 H new ATOM 872 N GLY A 59 13.062 -4.577 -20.723 1.00 0.00 N ATOM 873 CA GLY A 59 11.667 -4.214 -21.024 1.00 0.00 C ATOM 874 C GLY A 59 11.276 -2.767 -20.684 1.00 0.00 C ATOM 875 O GLY A 59 10.085 -2.447 -20.669 1.00 0.00 O ATOM 0 H GLY A 59 13.154 -5.082 -19.842 1.00 0.00 H new ATOM 0 HA2 GLY A 59 11.486 -4.382 -22.086 1.00 0.00 H new ATOM 0 HA3 GLY A 59 11.008 -4.889 -20.478 1.00 0.00 H new ATOM 879 N GLN A 60 12.246 -1.900 -20.375 1.00 0.00 N ATOM 880 CA GLN A 60 12.062 -0.486 -20.022 1.00 0.00 C ATOM 881 C GLN A 60 13.082 0.380 -20.785 1.00 0.00 C ATOM 882 O GLN A 60 14.151 -0.100 -21.165 1.00 0.00 O ATOM 883 CB GLN A 60 12.135 -0.314 -18.485 1.00 0.00 C ATOM 884 CG GLN A 60 13.392 -0.931 -17.845 1.00 0.00 C ATOM 885 CD GLN A 60 13.399 -0.868 -16.324 1.00 0.00 C ATOM 886 OE1 GLN A 60 12.988 -1.799 -15.640 1.00 0.00 O ATOM 887 NE2 GLN A 60 13.913 0.189 -15.743 1.00 0.00 N ATOM 0 H GLN A 60 13.228 -2.177 -20.363 1.00 0.00 H new ATOM 0 HA GLN A 60 11.073 -0.143 -20.327 1.00 0.00 H new ATOM 0 HB2 GLN A 60 12.103 0.749 -18.247 1.00 0.00 H new ATOM 0 HB3 GLN A 60 11.251 -0.768 -18.036 1.00 0.00 H new ATOM 0 HG2 GLN A 60 13.474 -1.972 -18.157 1.00 0.00 H new ATOM 0 HG3 GLN A 60 14.273 -0.414 -18.225 1.00 0.00 H new ATOM 0 HE21 GLN A 60 14.256 0.966 -16.308 1.00 0.00 H new ATOM 0 HE22 GLN A 60 13.970 0.235 -14.726 1.00 0.00 H new ATOM 896 N THR A 61 12.763 1.653 -21.034 1.00 0.00 N ATOM 897 CA THR A 61 13.637 2.598 -21.736 1.00 0.00 C ATOM 898 C THR A 61 13.434 4.012 -21.199 1.00 0.00 C ATOM 899 O THR A 61 12.741 4.208 -20.197 1.00 0.00 O ATOM 900 CB THR A 61 13.499 2.487 -23.264 1.00 0.00 C ATOM 901 OG1 THR A 61 14.586 3.165 -23.870 1.00 0.00 O ATOM 902 CG2 THR A 61 12.195 3.057 -23.824 1.00 0.00 C ATOM 0 H THR A 61 11.874 2.064 -20.748 1.00 0.00 H new ATOM 0 HA THR A 61 14.674 2.332 -21.530 1.00 0.00 H new ATOM 0 HB THR A 61 13.494 1.422 -23.494 1.00 0.00 H new ATOM 0 HG1 THR A 61 14.510 3.100 -24.845 1.00 0.00 H new ATOM 0 HG21 THR A 61 12.181 2.937 -24.907 1.00 0.00 H new ATOM 0 HG22 THR A 61 11.349 2.525 -23.389 1.00 0.00 H new ATOM 0 HG23 THR A 61 12.124 4.116 -23.575 1.00 0.00 H new ATOM 910 N SER A 62 14.110 4.989 -21.797 1.00 0.00 N ATOM 911 CA SER A 62 14.181 6.339 -21.252 1.00 0.00 C ATOM 912 C SER A 62 12.993 7.233 -21.628 1.00 0.00 C ATOM 913 O SER A 62 12.591 7.308 -22.791 1.00 0.00 O ATOM 914 CB SER A 62 15.542 6.960 -21.530 1.00 0.00 C ATOM 915 OG SER A 62 15.673 7.459 -22.847 1.00 0.00 O ATOM 0 H SER A 62 14.622 4.867 -22.671 1.00 0.00 H new ATOM 0 HA SER A 62 14.085 6.251 -20.170 1.00 0.00 H new ATOM 0 HB2 SER A 62 15.714 7.772 -20.823 1.00 0.00 H new ATOM 0 HB3 SER A 62 16.317 6.214 -21.353 1.00 0.00 H new ATOM 0 HG SER A 62 16.023 6.754 -23.431 1.00 0.00 H new ATOM 921 N ASP A 63 12.441 7.919 -20.625 1.00 0.00 N ATOM 922 CA ASP A 63 11.256 8.791 -20.762 1.00 0.00 C ATOM 923 C ASP A 63 11.344 10.107 -19.947 1.00 0.00 C ATOM 924 O ASP A 63 11.929 10.121 -18.859 1.00 0.00 O ATOM 925 CB ASP A 63 9.984 8.015 -20.387 1.00 0.00 C ATOM 926 CG ASP A 63 9.560 7.030 -21.489 1.00 0.00 C ATOM 927 OD1 ASP A 63 9.060 7.490 -22.545 1.00 0.00 O ATOM 928 OD2 ASP A 63 9.682 5.796 -21.294 1.00 0.00 O ATOM 0 H ASP A 63 12.807 7.888 -19.673 1.00 0.00 H new ATOM 0 HA ASP A 63 11.219 9.090 -21.809 1.00 0.00 H new ATOM 0 HB2 ASP A 63 10.154 7.469 -19.459 1.00 0.00 H new ATOM 0 HB3 ASP A 63 9.173 8.719 -20.199 1.00 0.00 H new ATOM 933 N PRO A 64 10.758 11.220 -20.439 1.00 0.00 N ATOM 934 CA PRO A 64 10.937 12.553 -19.862 1.00 0.00 C ATOM 935 C PRO A 64 9.944 12.896 -18.731 1.00 0.00 C ATOM 936 O PRO A 64 8.764 12.544 -18.776 1.00 0.00 O ATOM 937 CB PRO A 64 10.809 13.516 -21.047 1.00 0.00 C ATOM 938 CG PRO A 64 9.768 12.823 -21.924 1.00 0.00 C ATOM 939 CD PRO A 64 10.099 11.341 -21.738 1.00 0.00 C ATOM 0 HA PRO A 64 11.905 12.622 -19.366 1.00 0.00 H new ATOM 0 HB2 PRO A 64 10.480 14.506 -20.732 1.00 0.00 H new ATOM 0 HB3 PRO A 64 11.757 13.646 -21.568 1.00 0.00 H new ATOM 0 HG2 PRO A 64 8.752 13.054 -21.604 1.00 0.00 H new ATOM 0 HG3 PRO A 64 9.851 13.128 -22.967 1.00 0.00 H new ATOM 0 HD2 PRO A 64 9.194 10.735 -21.771 1.00 0.00 H new ATOM 0 HD3 PRO A 64 10.750 10.986 -22.537 1.00 0.00 H new ATOM 947 N ILE A 65 10.405 13.674 -17.749 1.00 0.00 N ATOM 948 CA ILE A 65 9.688 14.112 -16.540 1.00 0.00 C ATOM 949 C ILE A 65 8.388 14.859 -16.873 1.00 0.00 C ATOM 950 O ILE A 65 7.365 14.670 -16.225 1.00 0.00 O ATOM 951 CB ILE A 65 10.666 14.973 -15.695 1.00 0.00 C ATOM 952 CG1 ILE A 65 10.188 15.077 -14.245 1.00 0.00 C ATOM 953 CG2 ILE A 65 10.923 16.382 -16.270 1.00 0.00 C ATOM 954 CD1 ILE A 65 11.137 15.870 -13.345 1.00 0.00 C ATOM 0 H ILE A 65 11.356 14.043 -17.776 1.00 0.00 H new ATOM 0 HA ILE A 65 9.372 13.243 -15.963 1.00 0.00 H new ATOM 0 HB ILE A 65 11.621 14.448 -15.733 1.00 0.00 H new ATOM 0 HG12 ILE A 65 9.205 15.548 -14.228 1.00 0.00 H new ATOM 0 HG13 ILE A 65 10.068 14.073 -13.838 1.00 0.00 H new ATOM 0 HG21 ILE A 65 11.616 16.919 -15.622 1.00 0.00 H new ATOM 0 HG22 ILE A 65 11.353 16.295 -17.268 1.00 0.00 H new ATOM 0 HG23 ILE A 65 9.982 16.929 -16.327 1.00 0.00 H new ATOM 0 HD11 ILE A 65 10.735 15.903 -12.332 1.00 0.00 H new ATOM 0 HD12 ILE A 65 12.114 15.388 -13.332 1.00 0.00 H new ATOM 0 HD13 ILE A 65 11.239 16.885 -13.728 1.00 0.00 H new ATOM 966 N GLU A 66 8.406 15.640 -17.954 1.00 0.00 N ATOM 967 CA GLU A 66 7.278 16.472 -18.403 1.00 0.00 C ATOM 968 C GLU A 66 6.070 15.683 -18.954 1.00 0.00 C ATOM 969 O GLU A 66 4.990 16.261 -19.105 1.00 0.00 O ATOM 970 CB GLU A 66 7.781 17.548 -19.386 1.00 0.00 C ATOM 971 CG GLU A 66 8.664 17.002 -20.519 1.00 0.00 C ATOM 972 CD GLU A 66 8.874 18.067 -21.612 1.00 0.00 C ATOM 973 OE1 GLU A 66 9.800 18.906 -21.484 1.00 0.00 O ATOM 974 OE2 GLU A 66 8.117 18.078 -22.613 1.00 0.00 O ATOM 0 H GLU A 66 9.223 15.717 -18.559 1.00 0.00 H new ATOM 0 HA GLU A 66 6.878 16.960 -17.514 1.00 0.00 H new ATOM 0 HB2 GLU A 66 6.921 18.055 -19.823 1.00 0.00 H new ATOM 0 HB3 GLU A 66 8.345 18.297 -18.830 1.00 0.00 H new ATOM 0 HG2 GLU A 66 9.629 16.692 -20.117 1.00 0.00 H new ATOM 0 HG3 GLU A 66 8.200 16.116 -20.953 1.00 0.00 H new ATOM 981 N ASN A 67 6.204 14.369 -19.198 1.00 0.00 N ATOM 982 CA ASN A 67 5.073 13.486 -19.531 1.00 0.00 C ATOM 983 C ASN A 67 4.452 12.781 -18.298 1.00 0.00 C ATOM 984 O ASN A 67 3.377 12.188 -18.412 1.00 0.00 O ATOM 985 CB ASN A 67 5.494 12.508 -20.656 1.00 0.00 C ATOM 986 CG ASN A 67 5.648 11.062 -20.204 1.00 0.00 C ATOM 987 OD1 ASN A 67 4.866 10.188 -20.548 1.00 0.00 O ATOM 988 ND2 ASN A 67 6.635 10.771 -19.391 1.00 0.00 N ATOM 0 H ASN A 67 7.103 13.887 -19.170 1.00 0.00 H new ATOM 0 HA ASN A 67 4.259 14.106 -19.907 1.00 0.00 H new ATOM 0 HB2 ASN A 67 4.753 12.550 -21.454 1.00 0.00 H new ATOM 0 HB3 ASN A 67 6.439 12.846 -21.081 1.00 0.00 H new ATOM 0 HD21 ASN A 67 6.748 9.817 -19.047 1.00 0.00 H new ATOM 0 HD22 ASN A 67 7.289 11.498 -19.102 1.00 0.00 H new ATOM 995 N PHE A 68 5.117 12.822 -17.136 1.00 0.00 N ATOM 996 CA PHE A 68 4.773 12.044 -15.936 1.00 0.00 C ATOM 997 C PHE A 68 3.986 12.853 -14.882 1.00 0.00 C ATOM 998 O PHE A 68 3.771 14.059 -15.025 1.00 0.00 O ATOM 999 CB PHE A 68 6.059 11.411 -15.375 1.00 0.00 C ATOM 1000 CG PHE A 68 6.568 10.206 -16.149 1.00 0.00 C ATOM 1001 CD1 PHE A 68 5.756 9.065 -16.311 1.00 0.00 C ATOM 1002 CD2 PHE A 68 7.865 10.211 -16.687 1.00 0.00 C ATOM 1003 CE1 PHE A 68 6.237 7.946 -17.014 1.00 0.00 C ATOM 1004 CE2 PHE A 68 8.341 9.097 -17.403 1.00 0.00 C ATOM 1005 CZ PHE A 68 7.531 7.961 -17.559 1.00 0.00 C ATOM 0 H PHE A 68 5.935 13.416 -17.000 1.00 0.00 H new ATOM 0 HA PHE A 68 4.081 11.251 -16.222 1.00 0.00 H new ATOM 0 HB2 PHE A 68 6.842 12.169 -15.356 1.00 0.00 H new ATOM 0 HB3 PHE A 68 5.879 11.112 -14.342 1.00 0.00 H new ATOM 0 HD1 PHE A 68 4.760 9.050 -15.893 1.00 0.00 H new ATOM 0 HD2 PHE A 68 8.500 11.074 -16.551 1.00 0.00 H new ATOM 0 HE1 PHE A 68 5.611 7.074 -17.135 1.00 0.00 H new ATOM 0 HE2 PHE A 68 9.331 9.116 -17.833 1.00 0.00 H new ATOM 0 HZ PHE A 68 7.902 7.101 -18.097 1.00 0.00 H new ATOM 1015 N ASN A 69 3.537 12.167 -13.823 1.00 0.00 N ATOM 1016 CA ASN A 69 2.595 12.677 -12.817 1.00 0.00 C ATOM 1017 C ASN A 69 3.141 12.581 -11.378 1.00 0.00 C ATOM 1018 O ASN A 69 2.843 11.625 -10.661 1.00 0.00 O ATOM 1019 CB ASN A 69 1.231 11.971 -13.024 1.00 0.00 C ATOM 1020 CG ASN A 69 1.281 10.457 -13.226 1.00 0.00 C ATOM 1021 OD1 ASN A 69 0.968 9.939 -14.289 1.00 0.00 O ATOM 1022 ND2 ASN A 69 1.661 9.693 -12.227 1.00 0.00 N ATOM 0 H ASN A 69 3.830 11.208 -13.636 1.00 0.00 H new ATOM 0 HA ASN A 69 2.453 13.748 -12.959 1.00 0.00 H new ATOM 0 HB2 ASN A 69 0.601 12.181 -12.159 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.742 12.417 -13.890 1.00 0.00 H new ATOM 0 HD21 ASN A 69 1.693 8.680 -12.343 1.00 0.00 H new ATOM 0 HD22 ASN A 69 1.925 10.113 -11.336 1.00 0.00 H new ATOM 1029 N ALA A 70 3.899 13.592 -10.928 1.00 0.00 N ATOM 1030 CA ALA A 70 4.505 13.609 -9.588 1.00 0.00 C ATOM 1031 C ALA A 70 3.494 13.348 -8.453 1.00 0.00 C ATOM 1032 O ALA A 70 3.837 12.713 -7.456 1.00 0.00 O ATOM 1033 CB ALA A 70 5.180 14.956 -9.334 1.00 0.00 C ATOM 0 H ALA A 70 4.109 14.421 -11.483 1.00 0.00 H new ATOM 0 HA ALA A 70 5.231 12.796 -9.578 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.625 14.958 -8.339 1.00 0.00 H new ATOM 0 HB2 ALA A 70 5.958 15.120 -10.080 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.439 15.753 -9.401 1.00 0.00 H new ATOM 1039 N ASP A 71 2.246 13.799 -8.630 1.00 0.00 N ATOM 1040 CA ASP A 71 1.147 13.654 -7.667 1.00 0.00 C ATOM 1041 C ASP A 71 0.843 12.194 -7.271 1.00 0.00 C ATOM 1042 O ASP A 71 0.366 11.944 -6.161 1.00 0.00 O ATOM 1043 CB ASP A 71 -0.105 14.291 -8.285 1.00 0.00 C ATOM 1044 CG ASP A 71 -1.286 14.324 -7.299 1.00 0.00 C ATOM 1045 OD1 ASP A 71 -1.230 15.093 -6.308 1.00 0.00 O ATOM 1046 OD2 ASP A 71 -2.296 13.618 -7.538 1.00 0.00 O ATOM 0 H ASP A 71 1.964 14.292 -9.477 1.00 0.00 H new ATOM 0 HA ASP A 71 1.451 14.151 -6.746 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.127 15.307 -8.606 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.393 13.733 -9.176 1.00 0.00 H new ATOM 1051 N ASP A 72 1.133 11.229 -8.154 1.00 0.00 N ATOM 1052 CA ASP A 72 0.941 9.793 -7.895 1.00 0.00 C ATOM 1053 C ASP A 72 2.216 9.078 -7.408 1.00 0.00 C ATOM 1054 O ASP A 72 2.195 7.867 -7.197 1.00 0.00 O ATOM 1055 CB ASP A 72 0.350 9.099 -9.128 1.00 0.00 C ATOM 1056 CG ASP A 72 -0.332 7.758 -8.792 1.00 0.00 C ATOM 1057 OD1 ASP A 72 -1.159 7.706 -7.847 1.00 0.00 O ATOM 1058 OD2 ASP A 72 -0.097 6.761 -9.521 1.00 0.00 O ATOM 0 H ASP A 72 1.512 11.425 -9.080 1.00 0.00 H new ATOM 0 HA ASP A 72 0.231 9.720 -7.071 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.376 9.762 -9.599 1.00 0.00 H new ATOM 0 HB3 ASP A 72 1.143 8.925 -9.856 1.00 0.00 H new ATOM 1063 N TYR A 73 3.326 9.798 -7.213 1.00 0.00 N ATOM 1064 CA TYR A 73 4.573 9.252 -6.678 1.00 0.00 C ATOM 1065 C TYR A 73 4.760 9.772 -5.248 1.00 0.00 C ATOM 1066 O TYR A 73 5.226 10.890 -5.039 1.00 0.00 O ATOM 1067 CB TYR A 73 5.763 9.581 -7.601 1.00 0.00 C ATOM 1068 CG TYR A 73 5.530 9.406 -9.093 1.00 0.00 C ATOM 1069 CD1 TYR A 73 4.812 8.305 -9.602 1.00 0.00 C ATOM 1070 CD2 TYR A 73 6.036 10.375 -9.980 1.00 0.00 C ATOM 1071 CE1 TYR A 73 4.544 8.210 -10.981 1.00 0.00 C ATOM 1072 CE2 TYR A 73 5.759 10.290 -11.357 1.00 0.00 C ATOM 1073 CZ TYR A 73 4.993 9.220 -11.856 1.00 0.00 C ATOM 1074 OH TYR A 73 4.701 9.166 -13.183 1.00 0.00 O ATOM 0 H TYR A 73 3.382 10.794 -7.427 1.00 0.00 H new ATOM 0 HA TYR A 73 4.524 8.164 -6.641 1.00 0.00 H new ATOM 0 HB2 TYR A 73 6.060 10.614 -7.420 1.00 0.00 H new ATOM 0 HB3 TYR A 73 6.605 8.952 -7.311 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.466 7.532 -8.932 1.00 0.00 H new ATOM 0 HD2 TYR A 73 6.639 11.187 -9.602 1.00 0.00 H new ATOM 0 HE1 TYR A 73 3.995 7.364 -11.368 1.00 0.00 H new ATOM 0 HE2 TYR A 73 6.134 11.046 -12.031 1.00 0.00 H new ATOM 0 HH TYR A 73 3.845 8.706 -13.311 1.00 0.00 H new ATOM 1084 N ASP A 74 4.383 8.959 -4.253 1.00 0.00 N ATOM 1085 CA ASP A 74 4.521 9.304 -2.827 1.00 0.00 C ATOM 1086 C ASP A 74 5.951 9.758 -2.485 1.00 0.00 C ATOM 1087 O ASP A 74 6.144 10.681 -1.694 1.00 0.00 O ATOM 1088 CB ASP A 74 4.165 8.084 -1.965 1.00 0.00 C ATOM 1089 CG ASP A 74 2.726 7.608 -2.170 1.00 0.00 C ATOM 1090 OD1 ASP A 74 1.771 8.291 -1.739 1.00 0.00 O ATOM 1091 OD2 ASP A 74 2.569 6.532 -2.791 1.00 0.00 O ATOM 0 H ASP A 74 3.972 8.039 -4.412 1.00 0.00 H new ATOM 0 HA ASP A 74 3.841 10.130 -2.620 1.00 0.00 H new ATOM 0 HB2 ASP A 74 4.849 7.268 -2.199 1.00 0.00 H new ATOM 0 HB3 ASP A 74 4.314 8.332 -0.914 1.00 0.00 H new ATOM 1096 N VAL A 75 6.948 9.152 -3.135 1.00 0.00 N ATOM 1097 CA VAL A 75 8.354 9.540 -3.042 1.00 0.00 C ATOM 1098 C VAL A 75 8.927 9.827 -4.430 1.00 0.00 C ATOM 1099 O VAL A 75 8.723 9.051 -5.364 1.00 0.00 O ATOM 1100 CB VAL A 75 9.172 8.451 -2.339 1.00 0.00 C ATOM 1101 CG1 VAL A 75 10.631 8.884 -2.171 1.00 0.00 C ATOM 1102 CG2 VAL A 75 8.560 8.090 -0.978 1.00 0.00 C ATOM 0 H VAL A 75 6.794 8.358 -3.756 1.00 0.00 H new ATOM 0 HA VAL A 75 8.416 10.452 -2.449 1.00 0.00 H new ATOM 0 HB VAL A 75 9.148 7.562 -2.969 1.00 0.00 H new ATOM 0 HG11 VAL A 75 11.190 8.094 -1.670 1.00 0.00 H new ATOM 0 HG12 VAL A 75 11.070 9.073 -3.151 1.00 0.00 H new ATOM 0 HG13 VAL A 75 10.674 9.794 -1.573 1.00 0.00 H new ATOM 0 HG21 VAL A 75 9.161 7.315 -0.503 1.00 0.00 H new ATOM 0 HG22 VAL A 75 8.540 8.975 -0.342 1.00 0.00 H new ATOM 0 HG23 VAL A 75 7.544 7.723 -1.122 1.00 0.00 H new ATOM 1112 N VAL A 76 9.725 10.885 -4.552 1.00 0.00 N ATOM 1113 CA VAL A 76 10.524 11.179 -5.753 1.00 0.00 C ATOM 1114 C VAL A 76 12.001 11.252 -5.386 1.00 0.00 C ATOM 1115 O VAL A 76 12.369 11.830 -4.369 1.00 0.00 O ATOM 1116 CB VAL A 76 10.038 12.469 -6.434 1.00 0.00 C ATOM 1117 CG1 VAL A 76 11.000 12.997 -7.510 1.00 0.00 C ATOM 1118 CG2 VAL A 76 8.685 12.220 -7.111 1.00 0.00 C ATOM 0 H VAL A 76 9.841 11.577 -3.811 1.00 0.00 H new ATOM 0 HA VAL A 76 10.394 10.372 -6.474 1.00 0.00 H new ATOM 0 HB VAL A 76 9.970 13.215 -5.642 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.592 13.908 -7.947 1.00 0.00 H new ATOM 0 HG12 VAL A 76 11.968 13.213 -7.058 1.00 0.00 H new ATOM 0 HG13 VAL A 76 11.123 12.245 -8.289 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.345 13.137 -7.592 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.792 11.435 -7.860 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.955 11.911 -6.363 1.00 0.00 H new ATOM 1128 N ILE A 77 12.857 10.669 -6.216 1.00 0.00 N ATOM 1129 CA ILE A 77 14.303 10.612 -6.008 1.00 0.00 C ATOM 1130 C ILE A 77 15.017 11.251 -7.194 1.00 0.00 C ATOM 1131 O ILE A 77 14.738 10.886 -8.334 1.00 0.00 O ATOM 1132 CB ILE A 77 14.757 9.147 -5.860 1.00 0.00 C ATOM 1133 CG1 ILE A 77 13.932 8.297 -4.867 1.00 0.00 C ATOM 1134 CG2 ILE A 77 16.248 9.083 -5.507 1.00 0.00 C ATOM 1135 CD1 ILE A 77 13.972 8.772 -3.412 1.00 0.00 C ATOM 0 H ILE A 77 12.559 10.210 -7.077 1.00 0.00 H new ATOM 0 HA ILE A 77 14.553 11.156 -5.097 1.00 0.00 H new ATOM 0 HB ILE A 77 14.576 8.696 -6.836 1.00 0.00 H new ATOM 0 HG12 ILE A 77 12.894 8.284 -5.200 1.00 0.00 H new ATOM 0 HG13 ILE A 77 14.292 7.269 -4.907 1.00 0.00 H new ATOM 0 HG21 ILE A 77 16.554 8.042 -5.406 1.00 0.00 H new ATOM 0 HG22 ILE A 77 16.830 9.557 -6.298 1.00 0.00 H new ATOM 0 HG23 ILE A 77 16.422 9.605 -4.566 1.00 0.00 H new ATOM 0 HD11 ILE A 77 13.363 8.110 -2.796 1.00 0.00 H new ATOM 0 HD12 ILE A 77 15.001 8.757 -3.052 1.00 0.00 H new ATOM 0 HD13 ILE A 77 13.581 9.788 -3.350 1.00 0.00 H new ATOM 1147 N SER A 78 15.965 12.150 -6.952 1.00 0.00 N ATOM 1148 CA SER A 78 16.877 12.655 -7.983 1.00 0.00 C ATOM 1149 C SER A 78 18.197 11.890 -7.927 1.00 0.00 C ATOM 1150 O SER A 78 18.705 11.578 -6.853 1.00 0.00 O ATOM 1151 CB SER A 78 17.124 14.156 -7.843 1.00 0.00 C ATOM 1152 OG SER A 78 16.027 14.859 -8.402 1.00 0.00 O ATOM 0 H SER A 78 16.127 12.554 -6.030 1.00 0.00 H new ATOM 0 HA SER A 78 16.406 12.495 -8.953 1.00 0.00 H new ATOM 0 HB2 SER A 78 17.245 14.421 -6.793 1.00 0.00 H new ATOM 0 HB3 SER A 78 18.048 14.434 -8.351 1.00 0.00 H new ATOM 0 HG SER A 78 15.514 15.288 -7.686 1.00 0.00 H new ATOM 1158 N LEU A 79 18.753 11.563 -9.095 1.00 0.00 N ATOM 1159 CA LEU A 79 20.045 10.890 -9.266 1.00 0.00 C ATOM 1160 C LEU A 79 20.906 11.698 -10.239 1.00 0.00 C ATOM 1161 O LEU A 79 21.476 11.167 -11.189 1.00 0.00 O ATOM 1162 CB LEU A 79 19.841 9.403 -9.651 1.00 0.00 C ATOM 1163 CG LEU A 79 18.963 8.566 -8.687 1.00 0.00 C ATOM 1164 CD1 LEU A 79 17.482 8.594 -9.067 1.00 0.00 C ATOM 1165 CD2 LEU A 79 19.368 7.092 -8.756 1.00 0.00 C ATOM 0 H LEU A 79 18.298 11.768 -9.985 1.00 0.00 H new ATOM 0 HA LEU A 79 20.596 10.857 -8.326 1.00 0.00 H new ATOM 0 HB2 LEU A 79 19.394 9.364 -10.644 1.00 0.00 H new ATOM 0 HB3 LEU A 79 20.820 8.929 -9.723 1.00 0.00 H new ATOM 0 HG LEU A 79 19.111 9.003 -7.699 1.00 0.00 H new ATOM 0 HD11 LEU A 79 16.913 7.992 -8.359 1.00 0.00 H new ATOM 0 HD12 LEU A 79 17.119 9.622 -9.043 1.00 0.00 H new ATOM 0 HD13 LEU A 79 17.356 8.189 -10.071 1.00 0.00 H new ATOM 0 HD21 LEU A 79 18.746 6.511 -8.075 1.00 0.00 H new ATOM 0 HD22 LEU A 79 19.233 6.725 -9.773 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.414 6.988 -8.469 1.00 0.00 H new ATOM 1213 N VAL A 84 20.864 20.107 -10.599 1.00 0.00 N ATOM 1214 CA VAL A 84 19.428 19.818 -10.786 1.00 0.00 C ATOM 1215 C VAL A 84 18.688 19.900 -9.441 1.00 0.00 C ATOM 1216 O VAL A 84 19.181 19.367 -8.444 1.00 0.00 O ATOM 1217 CB VAL A 84 19.265 18.417 -11.417 1.00 0.00 C ATOM 1218 CG1 VAL A 84 17.793 18.051 -11.646 1.00 0.00 C ATOM 1219 CG2 VAL A 84 19.997 18.313 -12.762 1.00 0.00 C ATOM 0 HA VAL A 84 18.993 20.560 -11.455 1.00 0.00 H new ATOM 0 HB VAL A 84 19.702 17.721 -10.701 1.00 0.00 H new ATOM 0 HG11 VAL A 84 17.730 17.058 -12.091 1.00 0.00 H new ATOM 0 HG12 VAL A 84 17.264 18.056 -10.693 1.00 0.00 H new ATOM 0 HG13 VAL A 84 17.337 18.779 -12.317 1.00 0.00 H new ATOM 0 HG21 VAL A 84 19.859 17.314 -13.175 1.00 0.00 H new ATOM 0 HG22 VAL A 84 19.592 19.051 -13.455 1.00 0.00 H new ATOM 0 HG23 VAL A 84 21.060 18.501 -12.613 1.00 0.00 H new ATOM 1229 N ASN A 85 17.507 20.537 -9.409 1.00 0.00 N ATOM 1230 CA ASN A 85 16.747 20.755 -8.164 1.00 0.00 C ATOM 1231 C ASN A 85 15.220 20.505 -8.237 1.00 0.00 C ATOM 1232 O ASN A 85 14.550 20.606 -7.211 1.00 0.00 O ATOM 1233 CB ASN A 85 17.093 22.172 -7.661 1.00 0.00 C ATOM 1234 CG ASN A 85 16.934 22.316 -6.156 1.00 0.00 C ATOM 1235 OD1 ASN A 85 16.066 23.018 -5.653 1.00 0.00 O ATOM 1236 ND2 ASN A 85 17.791 21.677 -5.389 1.00 0.00 N ATOM 0 H ASN A 85 17.052 20.915 -10.240 1.00 0.00 H new ATOM 0 HA ASN A 85 17.057 19.989 -7.453 1.00 0.00 H new ATOM 0 HB2 ASN A 85 18.120 22.411 -7.938 1.00 0.00 H new ATOM 0 HB3 ASN A 85 16.451 22.897 -8.161 1.00 0.00 H new ATOM 0 HD21 ASN A 85 17.733 21.766 -4.375 1.00 0.00 H new ATOM 0 HD22 ASN A 85 18.514 21.092 -5.809 1.00 0.00 H new ATOM 1243 N LEU A 86 14.663 20.176 -9.417 1.00 0.00 N ATOM 1244 CA LEU A 86 13.223 19.934 -9.661 1.00 0.00 C ATOM 1245 C LEU A 86 12.263 20.967 -9.005 1.00 0.00 C ATOM 1246 O LEU A 86 11.470 20.599 -8.140 1.00 0.00 O ATOM 1247 CB LEU A 86 12.866 18.474 -9.287 1.00 0.00 C ATOM 1248 CG LEU A 86 13.609 17.336 -9.992 1.00 0.00 C ATOM 1249 CD1 LEU A 86 12.975 16.007 -9.568 1.00 0.00 C ATOM 1250 CD2 LEU A 86 13.469 17.474 -11.505 1.00 0.00 C ATOM 0 H LEU A 86 15.223 20.066 -10.262 1.00 0.00 H new ATOM 0 HA LEU A 86 13.062 20.082 -10.729 1.00 0.00 H new ATOM 0 HB2 LEU A 86 13.024 18.359 -8.215 1.00 0.00 H new ATOM 0 HB3 LEU A 86 11.800 18.337 -9.469 1.00 0.00 H new ATOM 0 HG LEU A 86 14.664 17.372 -9.721 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.492 15.184 -10.061 1.00 0.00 H new ATOM 0 HD12 LEU A 86 13.058 15.893 -8.487 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.923 15.998 -9.854 1.00 0.00 H new ATOM 0 HD21 LEU A 86 14.001 16.659 -11.995 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.414 17.435 -11.778 1.00 0.00 H new ATOM 0 HD23 LEU A 86 13.891 18.427 -11.824 1.00 0.00 H new ATOM 1262 N PRO A 87 12.265 22.247 -9.435 1.00 0.00 N ATOM 1263 CA PRO A 87 11.378 23.289 -8.890 1.00 0.00 C ATOM 1264 C PRO A 87 9.852 23.010 -8.794 1.00 0.00 C ATOM 1265 O PRO A 87 9.231 23.607 -7.905 1.00 0.00 O ATOM 1266 CB PRO A 87 11.635 24.526 -9.759 1.00 0.00 C ATOM 1267 CG PRO A 87 13.080 24.345 -10.214 1.00 0.00 C ATOM 1268 CD PRO A 87 13.178 22.835 -10.412 1.00 0.00 C ATOM 0 HA PRO A 87 11.634 23.386 -7.835 1.00 0.00 H new ATOM 0 HB2 PRO A 87 10.950 24.572 -10.606 1.00 0.00 H new ATOM 0 HB3 PRO A 87 11.504 25.449 -9.193 1.00 0.00 H new ATOM 0 HG2 PRO A 87 13.286 24.889 -11.136 1.00 0.00 H new ATOM 0 HG3 PRO A 87 13.788 24.703 -9.467 1.00 0.00 H new ATOM 0 HD2 PRO A 87 12.898 22.555 -11.427 1.00 0.00 H new ATOM 0 HD3 PRO A 87 14.198 22.485 -10.254 1.00 0.00 H new ATOM 1276 N PRO A 88 9.203 22.179 -9.652 1.00 0.00 N ATOM 1277 CA PRO A 88 7.744 21.969 -9.606 1.00 0.00 C ATOM 1278 C PRO A 88 7.254 21.041 -8.468 1.00 0.00 C ATOM 1279 O PRO A 88 7.966 20.740 -7.511 1.00 0.00 O ATOM 1280 CB PRO A 88 7.363 21.425 -10.997 1.00 0.00 C ATOM 1281 CG PRO A 88 8.577 21.640 -11.884 1.00 0.00 C ATOM 1282 CD PRO A 88 9.727 21.610 -10.889 1.00 0.00 C ATOM 0 HA PRO A 88 7.249 22.912 -9.375 1.00 0.00 H new ATOM 0 HB2 PRO A 88 7.103 20.368 -10.943 1.00 0.00 H new ATOM 0 HB3 PRO A 88 6.493 21.948 -11.394 1.00 0.00 H new ATOM 0 HG2 PRO A 88 8.672 20.857 -12.637 1.00 0.00 H new ATOM 0 HG3 PRO A 88 8.527 22.590 -12.416 1.00 0.00 H new ATOM 0 HD2 PRO A 88 10.080 20.591 -10.731 1.00 0.00 H new ATOM 0 HD3 PRO A 88 10.575 22.188 -11.256 1.00 0.00 H new ATOM 1290 N GLU A 89 6.036 20.499 -8.618 1.00 0.00 N ATOM 1291 CA GLU A 89 5.416 19.479 -7.742 1.00 0.00 C ATOM 1292 C GLU A 89 6.255 18.197 -7.523 1.00 0.00 C ATOM 1293 O GLU A 89 5.994 17.414 -6.612 1.00 0.00 O ATOM 1294 CB GLU A 89 4.015 19.133 -8.283 1.00 0.00 C ATOM 1295 CG GLU A 89 3.998 18.694 -9.758 1.00 0.00 C ATOM 1296 CD GLU A 89 2.573 18.288 -10.199 1.00 0.00 C ATOM 1297 OE1 GLU A 89 1.727 19.192 -10.411 1.00 0.00 O ATOM 1298 OE2 GLU A 89 2.291 17.075 -10.355 1.00 0.00 O ATOM 0 H GLU A 89 5.423 20.769 -9.388 1.00 0.00 H new ATOM 0 HA GLU A 89 5.352 19.929 -6.751 1.00 0.00 H new ATOM 0 HB2 GLU A 89 3.589 18.336 -7.674 1.00 0.00 H new ATOM 0 HB3 GLU A 89 3.368 20.003 -8.167 1.00 0.00 H new ATOM 0 HG2 GLU A 89 4.359 19.507 -10.387 1.00 0.00 H new ATOM 0 HG3 GLU A 89 4.679 17.855 -9.899 1.00 0.00 H new ATOM 1305 N TRP A 90 7.325 18.001 -8.292 1.00 0.00 N ATOM 1306 CA TRP A 90 8.311 16.924 -8.130 1.00 0.00 C ATOM 1307 C TRP A 90 9.054 16.925 -6.782 1.00 0.00 C ATOM 1308 O TRP A 90 9.610 15.895 -6.403 1.00 0.00 O ATOM 1309 CB TRP A 90 9.263 16.983 -9.322 1.00 0.00 C ATOM 1310 CG TRP A 90 8.592 16.524 -10.578 1.00 0.00 C ATOM 1311 CD1 TRP A 90 7.891 17.290 -11.444 1.00 0.00 C ATOM 1312 CD2 TRP A 90 8.517 15.170 -11.105 1.00 0.00 C ATOM 1313 NE1 TRP A 90 7.262 16.480 -12.371 1.00 0.00 N ATOM 1314 CE2 TRP A 90 7.619 15.159 -12.210 1.00 0.00 C ATOM 1315 CE3 TRP A 90 9.159 13.960 -10.779 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 7.329 13.987 -12.926 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 8.940 12.800 -11.540 1.00 0.00 C ATOM 1318 CH2 TRP A 90 8.023 12.810 -12.605 1.00 0.00 C ATOM 0 H TRP A 90 7.541 18.612 -9.079 1.00 0.00 H new ATOM 0 HA TRP A 90 7.776 15.974 -8.111 1.00 0.00 H new ATOM 0 HB2 TRP A 90 9.623 18.003 -9.452 1.00 0.00 H new ATOM 0 HB3 TRP A 90 10.135 16.360 -9.125 1.00 0.00 H new ATOM 0 HD1 TRP A 90 7.832 18.368 -11.416 1.00 0.00 H new ATOM 0 HE1 TRP A 90 6.615 16.818 -13.084 1.00 0.00 H new ATOM 0 HE3 TRP A 90 9.829 13.923 -9.933 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 6.586 13.991 -13.709 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 9.480 11.894 -11.305 1.00 0.00 H new ATOM 0 HH2 TRP A 90 7.852 11.910 -13.177 1.00 0.00 H new ATOM 1329 N VAL A 91 9.021 18.034 -6.033 1.00 0.00 N ATOM 1330 CA VAL A 91 9.591 18.141 -4.671 1.00 0.00 C ATOM 1331 C VAL A 91 8.552 18.441 -3.579 1.00 0.00 C ATOM 1332 O VAL A 91 8.914 18.569 -2.409 1.00 0.00 O ATOM 1333 CB VAL A 91 10.776 19.129 -4.612 1.00 0.00 C ATOM 1334 CG1 VAL A 91 11.902 18.690 -5.546 1.00 0.00 C ATOM 1335 CG2 VAL A 91 10.374 20.579 -4.913 1.00 0.00 C ATOM 0 H VAL A 91 8.591 18.901 -6.356 1.00 0.00 H new ATOM 0 HA VAL A 91 9.974 17.145 -4.447 1.00 0.00 H new ATOM 0 HB VAL A 91 11.132 19.108 -3.582 1.00 0.00 H new ATOM 0 HG11 VAL A 91 12.724 19.403 -5.485 1.00 0.00 H new ATOM 0 HG12 VAL A 91 12.256 17.702 -5.250 1.00 0.00 H new ATOM 0 HG13 VAL A 91 11.531 18.651 -6.570 1.00 0.00 H new ATOM 0 HG21 VAL A 91 11.254 21.220 -4.855 1.00 0.00 H new ATOM 0 HG22 VAL A 91 9.948 20.638 -5.914 1.00 0.00 H new ATOM 0 HG23 VAL A 91 9.635 20.910 -4.184 1.00 0.00 H new ATOM 1345 N THR A 92 7.259 18.511 -3.925 1.00 0.00 N ATOM 1346 CA THR A 92 6.149 18.731 -2.969 1.00 0.00 C ATOM 1347 C THR A 92 5.508 17.419 -2.482 1.00 0.00 C ATOM 1348 O THR A 92 4.532 17.441 -1.727 1.00 0.00 O ATOM 1349 CB THR A 92 5.076 19.677 -3.536 1.00 0.00 C ATOM 1350 OG1 THR A 92 4.412 19.062 -4.617 1.00 0.00 O ATOM 1351 CG2 THR A 92 5.658 20.994 -4.049 1.00 0.00 C ATOM 0 H THR A 92 6.943 18.416 -4.890 1.00 0.00 H new ATOM 0 HA THR A 92 6.602 19.211 -2.102 1.00 0.00 H new ATOM 0 HB THR A 92 4.395 19.890 -2.712 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.053 18.534 -5.137 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.855 21.620 -4.437 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.160 21.512 -3.232 1.00 0.00 H new ATOM 0 HG23 THR A 92 6.375 20.790 -4.844 1.00 0.00 H new ATOM 1359 N GLN A 93 6.058 16.267 -2.893 1.00 0.00 N ATOM 1360 CA GLN A 93 5.607 14.934 -2.479 1.00 0.00 C ATOM 1361 C GLN A 93 6.059 14.596 -1.042 1.00 0.00 C ATOM 1362 O GLN A 93 6.743 15.388 -0.385 1.00 0.00 O ATOM 1363 CB GLN A 93 6.045 13.885 -3.524 1.00 0.00 C ATOM 1364 CG GLN A 93 5.614 14.233 -4.962 1.00 0.00 C ATOM 1365 CD GLN A 93 4.149 14.677 -5.058 1.00 0.00 C ATOM 1366 OE1 GLN A 93 3.225 14.035 -4.571 1.00 0.00 O ATOM 1367 NE2 GLN A 93 3.885 15.833 -5.633 1.00 0.00 N ATOM 0 H GLN A 93 6.848 16.238 -3.538 1.00 0.00 H new ATOM 0 HA GLN A 93 4.518 14.921 -2.444 1.00 0.00 H new ATOM 0 HB2 GLN A 93 7.130 13.784 -3.493 1.00 0.00 H new ATOM 0 HB3 GLN A 93 5.626 12.916 -3.252 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.254 15.027 -5.345 1.00 0.00 H new ATOM 0 HG3 GLN A 93 5.767 13.364 -5.602 1.00 0.00 H new ATOM 0 HE21 GLN A 93 4.640 16.382 -6.044 1.00 0.00 H new ATOM 0 HE22 GLN A 93 2.926 16.178 -5.667 1.00 0.00 H new ATOM 1376 N GLU A 94 5.664 13.430 -0.526 1.00 0.00 N ATOM 1377 CA GLU A 94 5.840 13.087 0.900 1.00 0.00 C ATOM 1378 C GLU A 94 7.321 12.964 1.306 1.00 0.00 C ATOM 1379 O GLU A 94 7.700 13.431 2.385 1.00 0.00 O ATOM 1380 CB GLU A 94 5.042 11.817 1.241 1.00 0.00 C ATOM 1381 CG GLU A 94 5.165 11.439 2.719 1.00 0.00 C ATOM 1382 CD GLU A 94 4.217 10.285 3.078 1.00 0.00 C ATOM 1383 OE1 GLU A 94 4.623 9.104 2.959 1.00 0.00 O ATOM 1384 OE2 GLU A 94 3.061 10.540 3.498 1.00 0.00 O ATOM 0 H GLU A 94 5.215 12.697 -1.075 1.00 0.00 H new ATOM 0 HA GLU A 94 5.443 13.914 1.489 1.00 0.00 H new ATOM 0 HB2 GLU A 94 3.992 11.972 0.993 1.00 0.00 H new ATOM 0 HB3 GLU A 94 5.396 10.990 0.625 1.00 0.00 H new ATOM 0 HG2 GLU A 94 6.193 11.151 2.939 1.00 0.00 H new ATOM 0 HG3 GLU A 94 4.938 12.306 3.339 1.00 0.00 H new ATOM 1391 N ILE A 95 8.161 12.395 0.433 1.00 0.00 N ATOM 1392 CA ILE A 95 9.625 12.377 0.585 1.00 0.00 C ATOM 1393 C ILE A 95 10.303 12.750 -0.741 1.00 0.00 C ATOM 1394 O ILE A 95 9.897 12.291 -1.812 1.00 0.00 O ATOM 1395 CB ILE A 95 10.140 11.004 1.108 1.00 0.00 C ATOM 1396 CG1 ILE A 95 9.442 10.567 2.419 1.00 0.00 C ATOM 1397 CG2 ILE A 95 11.672 11.014 1.284 1.00 0.00 C ATOM 1398 CD1 ILE A 95 9.949 9.233 2.986 1.00 0.00 C ATOM 0 H ILE A 95 7.839 11.926 -0.414 1.00 0.00 H new ATOM 0 HA ILE A 95 9.889 13.122 1.335 1.00 0.00 H new ATOM 0 HB ILE A 95 9.882 10.267 0.348 1.00 0.00 H new ATOM 0 HG12 ILE A 95 9.583 11.345 3.169 1.00 0.00 H new ATOM 0 HG13 ILE A 95 8.370 10.488 2.238 1.00 0.00 H new ATOM 0 HG21 ILE A 95 12.003 10.042 1.650 1.00 0.00 H new ATOM 0 HG22 ILE A 95 12.147 11.221 0.325 1.00 0.00 H new ATOM 0 HG23 ILE A 95 11.951 11.786 2.001 1.00 0.00 H new ATOM 0 HD11 ILE A 95 9.409 8.999 3.904 1.00 0.00 H new ATOM 0 HD12 ILE A 95 9.783 8.441 2.256 1.00 0.00 H new ATOM 0 HD13 ILE A 95 11.015 9.311 3.201 1.00 0.00 H new ATOM 1410 N PHE A 96 11.367 13.552 -0.654 1.00 0.00 N ATOM 1411 CA PHE A 96 12.288 13.828 -1.757 1.00 0.00 C ATOM 1412 C PHE A 96 13.738 13.623 -1.280 1.00 0.00 C ATOM 1413 O PHE A 96 14.123 14.130 -0.223 1.00 0.00 O ATOM 1414 CB PHE A 96 12.040 15.214 -2.370 1.00 0.00 C ATOM 1415 CG PHE A 96 13.073 15.580 -3.424 1.00 0.00 C ATOM 1416 CD1 PHE A 96 12.933 15.159 -4.765 1.00 0.00 C ATOM 1417 CD2 PHE A 96 14.225 16.295 -3.038 1.00 0.00 C ATOM 1418 CE1 PHE A 96 13.959 15.414 -5.692 1.00 0.00 C ATOM 1419 CE2 PHE A 96 15.240 16.569 -3.973 1.00 0.00 C ATOM 1420 CZ PHE A 96 15.108 16.121 -5.297 1.00 0.00 C ATOM 0 H PHE A 96 11.617 14.039 0.207 1.00 0.00 H new ATOM 0 HA PHE A 96 12.105 13.121 -2.566 1.00 0.00 H new ATOM 0 HB2 PHE A 96 11.046 15.237 -2.817 1.00 0.00 H new ATOM 0 HB3 PHE A 96 12.051 15.964 -1.579 1.00 0.00 H new ATOM 0 HD1 PHE A 96 12.038 14.641 -5.078 1.00 0.00 H new ATOM 0 HD2 PHE A 96 14.329 16.635 -2.018 1.00 0.00 H new ATOM 0 HE1 PHE A 96 13.864 15.066 -6.710 1.00 0.00 H new ATOM 0 HE2 PHE A 96 16.118 17.122 -3.673 1.00 0.00 H new ATOM 0 HZ PHE A 96 15.891 16.320 -6.014 1.00 0.00 H new ATOM 1430 N GLU A 97 14.540 12.878 -2.047 1.00 0.00 N ATOM 1431 CA GLU A 97 15.970 12.636 -1.783 1.00 0.00 C ATOM 1432 C GLU A 97 16.812 12.830 -3.057 1.00 0.00 C ATOM 1433 O GLU A 97 16.323 12.635 -4.169 1.00 0.00 O ATOM 1434 CB GLU A 97 16.214 11.226 -1.205 1.00 0.00 C ATOM 1435 CG GLU A 97 15.548 10.961 0.158 1.00 0.00 C ATOM 1436 CD GLU A 97 15.923 9.593 0.783 1.00 0.00 C ATOM 1437 OE1 GLU A 97 16.928 8.970 0.366 1.00 0.00 O ATOM 1438 OE2 GLU A 97 15.223 9.151 1.731 1.00 0.00 O ATOM 0 H GLU A 97 14.208 12.412 -2.892 1.00 0.00 H new ATOM 0 HA GLU A 97 16.282 13.369 -1.039 1.00 0.00 H new ATOM 0 HB2 GLU A 97 15.851 10.488 -1.920 1.00 0.00 H new ATOM 0 HB3 GLU A 97 17.288 11.071 -1.105 1.00 0.00 H new ATOM 0 HG2 GLU A 97 15.829 11.755 0.850 1.00 0.00 H new ATOM 0 HG3 GLU A 97 14.466 11.011 0.039 1.00 0.00 H new ATOM 1445 N ASP A 98 18.095 13.181 -2.902 1.00 0.00 N ATOM 1446 CA ASP A 98 19.023 13.432 -4.016 1.00 0.00 C ATOM 1447 C ASP A 98 20.314 12.601 -3.866 1.00 0.00 C ATOM 1448 O ASP A 98 21.199 12.926 -3.072 1.00 0.00 O ATOM 1449 CB ASP A 98 19.294 14.939 -4.108 1.00 0.00 C ATOM 1450 CG ASP A 98 20.272 15.279 -5.245 1.00 0.00 C ATOM 1451 OD1 ASP A 98 20.117 14.722 -6.357 1.00 0.00 O ATOM 1452 OD2 ASP A 98 21.180 16.117 -5.022 1.00 0.00 O ATOM 0 H ASP A 98 18.526 13.301 -1.985 1.00 0.00 H new ATOM 0 HA ASP A 98 18.571 13.109 -4.954 1.00 0.00 H new ATOM 0 HB2 ASP A 98 18.354 15.467 -4.268 1.00 0.00 H new ATOM 0 HB3 ASP A 98 19.702 15.293 -3.161 1.00 0.00 H new ATOM 1457 N TRP A 99 20.402 11.498 -4.615 1.00 0.00 N ATOM 1458 CA TRP A 99 21.477 10.502 -4.557 1.00 0.00 C ATOM 1459 C TRP A 99 22.554 10.790 -5.616 1.00 0.00 C ATOM 1460 O TRP A 99 22.514 10.273 -6.734 1.00 0.00 O ATOM 1461 CB TRP A 99 20.883 9.088 -4.700 1.00 0.00 C ATOM 1462 CG TRP A 99 19.768 8.671 -3.780 1.00 0.00 C ATOM 1463 CD1 TRP A 99 19.407 9.244 -2.605 1.00 0.00 C ATOM 1464 CD2 TRP A 99 18.849 7.555 -3.968 1.00 0.00 C ATOM 1465 NE1 TRP A 99 18.319 8.576 -2.075 1.00 0.00 N ATOM 1466 CE2 TRP A 99 17.930 7.530 -2.878 1.00 0.00 C ATOM 1467 CE3 TRP A 99 18.703 6.554 -4.952 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 16.921 6.563 -2.768 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 17.681 5.586 -4.863 1.00 0.00 C ATOM 1470 CH2 TRP A 99 16.793 5.588 -3.772 1.00 0.00 C ATOM 0 H TRP A 99 19.693 11.264 -5.310 1.00 0.00 H new ATOM 0 HA TRP A 99 21.971 10.563 -3.587 1.00 0.00 H new ATOM 0 HB2 TRP A 99 20.522 8.984 -5.723 1.00 0.00 H new ATOM 0 HB3 TRP A 99 21.697 8.374 -4.575 1.00 0.00 H new ATOM 0 HD1 TRP A 99 19.896 10.094 -2.152 1.00 0.00 H new ATOM 0 HE1 TRP A 99 17.862 8.828 -1.198 1.00 0.00 H new ATOM 0 HE3 TRP A 99 19.386 6.529 -5.788 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 16.250 6.567 -1.922 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 17.580 4.839 -5.637 1.00 0.00 H new ATOM 0 HH2 TRP A 99 16.015 4.842 -3.706 1.00 0.00 H new ATOM 1481 N GLN A 100 23.521 11.640 -5.271 1.00 0.00 N ATOM 1482 CA GLN A 100 24.609 12.040 -6.169 1.00 0.00 C ATOM 1483 C GLN A 100 25.668 10.923 -6.269 1.00 0.00 C ATOM 1484 O GLN A 100 26.302 10.563 -5.275 1.00 0.00 O ATOM 1485 CB GLN A 100 25.212 13.377 -5.697 1.00 0.00 C ATOM 1486 CG GLN A 100 24.167 14.510 -5.650 1.00 0.00 C ATOM 1487 CD GLN A 100 24.739 15.874 -5.260 1.00 0.00 C ATOM 1488 OE1 GLN A 100 25.939 16.110 -5.210 1.00 0.00 O ATOM 1489 NE2 GLN A 100 23.886 16.833 -4.977 1.00 0.00 N ATOM 0 H GLN A 100 23.573 12.076 -4.350 1.00 0.00 H new ATOM 0 HA GLN A 100 24.214 12.192 -7.173 1.00 0.00 H new ATOM 0 HB2 GLN A 100 25.647 13.246 -4.706 1.00 0.00 H new ATOM 0 HB3 GLN A 100 26.024 13.663 -6.366 1.00 0.00 H new ATOM 0 HG2 GLN A 100 23.693 14.593 -6.628 1.00 0.00 H new ATOM 0 HG3 GLN A 100 23.386 14.239 -4.940 1.00 0.00 H new ATOM 0 HE21 GLN A 100 22.883 16.651 -5.015 1.00 0.00 H new ATOM 0 HE22 GLN A 100 24.227 17.759 -4.720 1.00 0.00 H new ATOM 1498 N LEU A 101 25.850 10.369 -7.474 1.00 0.00 N ATOM 1499 CA LEU A 101 26.773 9.267 -7.809 1.00 0.00 C ATOM 1500 C LEU A 101 27.487 9.526 -9.150 1.00 0.00 C ATOM 1501 O LEU A 101 27.126 10.440 -9.895 1.00 0.00 O ATOM 1502 CB LEU A 101 25.976 7.938 -7.853 1.00 0.00 C ATOM 1503 CG LEU A 101 25.472 7.380 -6.504 1.00 0.00 C ATOM 1504 CD1 LEU A 101 24.702 6.081 -6.748 1.00 0.00 C ATOM 1505 CD2 LEU A 101 26.615 7.058 -5.544 1.00 0.00 C ATOM 0 H LEU A 101 25.330 10.693 -8.290 1.00 0.00 H new ATOM 0 HA LEU A 101 27.545 9.201 -7.042 1.00 0.00 H new ATOM 0 HB2 LEU A 101 25.114 8.081 -8.504 1.00 0.00 H new ATOM 0 HB3 LEU A 101 26.606 7.180 -8.320 1.00 0.00 H new ATOM 0 HG LEU A 101 24.842 8.150 -6.058 1.00 0.00 H new ATOM 0 HD11 LEU A 101 24.345 5.685 -5.797 1.00 0.00 H new ATOM 0 HD12 LEU A 101 23.852 6.279 -7.400 1.00 0.00 H new ATOM 0 HD13 LEU A 101 25.360 5.352 -7.221 1.00 0.00 H new ATOM 0 HD21 LEU A 101 26.208 6.669 -4.611 1.00 0.00 H new ATOM 0 HD22 LEU A 101 27.269 6.311 -5.994 1.00 0.00 H new ATOM 0 HD23 LEU A 101 27.186 7.964 -5.341 1.00 0.00 H new ATOM 1517 N GLU A 102 28.492 8.701 -9.463 1.00 0.00 N ATOM 1518 CA GLU A 102 29.221 8.726 -10.735 1.00 0.00 C ATOM 1519 C GLU A 102 28.334 8.421 -11.950 1.00 0.00 C ATOM 1520 O GLU A 102 27.171 8.025 -11.849 1.00 0.00 O ATOM 1521 CB GLU A 102 30.385 7.714 -10.683 1.00 0.00 C ATOM 1522 CG GLU A 102 31.537 8.098 -9.759 1.00 0.00 C ATOM 1523 CD GLU A 102 32.132 9.484 -10.075 1.00 0.00 C ATOM 1524 OE1 GLU A 102 32.494 9.745 -11.247 1.00 0.00 O ATOM 1525 OE2 GLU A 102 32.240 10.329 -9.153 1.00 0.00 O ATOM 0 H GLU A 102 28.829 7.981 -8.824 1.00 0.00 H new ATOM 0 HA GLU A 102 29.595 9.742 -10.863 1.00 0.00 H new ATOM 0 HB2 GLU A 102 29.992 6.748 -10.366 1.00 0.00 H new ATOM 0 HB3 GLU A 102 30.777 7.583 -11.692 1.00 0.00 H new ATOM 0 HG2 GLU A 102 31.186 8.087 -8.727 1.00 0.00 H new ATOM 0 HG3 GLU A 102 32.322 7.346 -9.836 1.00 0.00 H new ATOM 1532 N ASP A 103 28.920 8.592 -13.131 1.00 0.00 N ATOM 1533 CA ASP A 103 28.267 8.467 -14.432 1.00 0.00 C ATOM 1534 C ASP A 103 28.928 7.360 -15.277 1.00 0.00 C ATOM 1535 O ASP A 103 29.932 7.633 -15.937 1.00 0.00 O ATOM 1536 CB ASP A 103 28.279 9.854 -15.089 1.00 0.00 C ATOM 1537 CG ASP A 103 27.151 9.965 -16.112 1.00 0.00 C ATOM 1538 OD1 ASP A 103 26.006 10.231 -15.678 1.00 0.00 O ATOM 1539 OD2 ASP A 103 27.361 9.742 -17.323 1.00 0.00 O ATOM 0 H ASP A 103 29.908 8.832 -13.212 1.00 0.00 H new ATOM 0 HA ASP A 103 27.229 8.149 -14.331 1.00 0.00 H new ATOM 0 HB2 ASP A 103 28.166 10.626 -14.328 1.00 0.00 H new ATOM 0 HB3 ASP A 103 29.239 10.025 -15.576 1.00 0.00 H new ATOM 1544 N PRO A 104 28.425 6.104 -15.233 1.00 0.00 N ATOM 1545 CA PRO A 104 29.093 4.941 -15.840 1.00 0.00 C ATOM 1546 C PRO A 104 29.106 4.886 -17.374 1.00 0.00 C ATOM 1547 O PRO A 104 29.866 4.113 -17.950 1.00 0.00 O ATOM 1548 CB PRO A 104 28.373 3.716 -15.278 1.00 0.00 C ATOM 1549 CG PRO A 104 27.775 4.201 -13.970 1.00 0.00 C ATOM 1550 CD PRO A 104 27.369 5.621 -14.344 1.00 0.00 C ATOM 0 HA PRO A 104 30.152 4.996 -15.587 1.00 0.00 H new ATOM 0 HB2 PRO A 104 27.601 3.360 -15.961 1.00 0.00 H new ATOM 0 HB3 PRO A 104 29.063 2.888 -15.117 1.00 0.00 H new ATOM 0 HG2 PRO A 104 26.923 3.597 -13.657 1.00 0.00 H new ATOM 0 HG3 PRO A 104 28.497 4.180 -13.154 1.00 0.00 H new ATOM 0 HD2 PRO A 104 26.399 5.634 -14.842 1.00 0.00 H new ATOM 0 HD3 PRO A 104 27.282 6.251 -13.459 1.00 0.00 H new ATOM 1558 N ASP A 105 28.278 5.688 -18.037 1.00 0.00 N ATOM 1559 CA ASP A 105 28.107 5.736 -19.496 1.00 0.00 C ATOM 1560 C ASP A 105 29.442 6.032 -20.220 1.00 0.00 C ATOM 1561 O ASP A 105 29.901 7.177 -20.280 1.00 0.00 O ATOM 1562 CB ASP A 105 27.030 6.802 -19.769 1.00 0.00 C ATOM 1563 CG ASP A 105 26.560 6.958 -21.225 1.00 0.00 C ATOM 1564 OD1 ASP A 105 27.051 6.267 -22.144 1.00 0.00 O ATOM 1565 OD2 ASP A 105 25.622 7.764 -21.440 1.00 0.00 O ATOM 0 H ASP A 105 27.677 6.356 -17.554 1.00 0.00 H new ATOM 0 HA ASP A 105 27.790 4.771 -19.890 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.160 6.571 -19.154 1.00 0.00 H new ATOM 0 HB3 ASP A 105 27.412 7.765 -19.431 1.00 0.00 H new ATOM 1570 N GLY A 106 30.085 4.979 -20.753 1.00 0.00 N ATOM 1571 CA GLY A 106 31.395 5.057 -21.416 1.00 0.00 C ATOM 1572 C GLY A 106 32.618 4.929 -20.489 1.00 0.00 C ATOM 1573 O GLY A 106 33.731 5.241 -20.918 1.00 0.00 O ATOM 0 H GLY A 106 29.701 4.034 -20.734 1.00 0.00 H new ATOM 0 HA2 GLY A 106 31.448 4.271 -22.169 1.00 0.00 H new ATOM 0 HA3 GLY A 106 31.459 6.009 -21.943 1.00 0.00 H new ATOM 1577 N GLN A 107 32.435 4.488 -19.235 1.00 0.00 N ATOM 1578 CA GLN A 107 33.506 4.299 -18.243 1.00 0.00 C ATOM 1579 C GLN A 107 34.093 2.870 -18.306 1.00 0.00 C ATOM 1580 O GLN A 107 34.861 2.547 -19.215 1.00 0.00 O ATOM 1581 CB GLN A 107 33.019 4.669 -16.827 1.00 0.00 C ATOM 1582 CG GLN A 107 32.405 6.057 -16.659 1.00 0.00 C ATOM 1583 CD GLN A 107 33.356 7.246 -16.679 1.00 0.00 C ATOM 1584 OE1 GLN A 107 34.545 7.163 -16.963 1.00 0.00 O ATOM 1585 NE2 GLN A 107 32.837 8.411 -16.346 1.00 0.00 N ATOM 0 H GLN A 107 31.513 4.246 -18.873 1.00 0.00 H new ATOM 0 HA GLN A 107 34.319 4.980 -18.492 1.00 0.00 H new ATOM 0 HB2 GLN A 107 32.281 3.930 -16.516 1.00 0.00 H new ATOM 0 HB3 GLN A 107 33.863 4.584 -16.143 1.00 0.00 H new ATOM 0 HG2 GLN A 107 31.670 6.199 -17.451 1.00 0.00 H new ATOM 0 HG3 GLN A 107 31.863 6.074 -15.714 1.00 0.00 H new ATOM 0 HE21 GLN A 107 31.847 8.479 -16.110 1.00 0.00 H new ATOM 0 HE22 GLN A 107 33.425 9.244 -16.325 1.00 0.00 H new ATOM 1594 N SER A 108 33.735 2.016 -17.340 1.00 0.00 N ATOM 1595 CA SER A 108 34.151 0.614 -17.209 1.00 0.00 C ATOM 1596 C SER A 108 33.116 -0.181 -16.405 1.00 0.00 C ATOM 1597 O SER A 108 32.291 0.400 -15.695 1.00 0.00 O ATOM 1598 CB SER A 108 35.522 0.525 -16.520 1.00 0.00 C ATOM 1599 OG SER A 108 35.421 0.828 -15.136 1.00 0.00 O ATOM 0 H SER A 108 33.111 2.301 -16.585 1.00 0.00 H new ATOM 0 HA SER A 108 34.226 0.186 -18.209 1.00 0.00 H new ATOM 0 HB2 SER A 108 35.931 -0.477 -16.647 1.00 0.00 H new ATOM 0 HB3 SER A 108 36.217 1.216 -16.997 1.00 0.00 H new ATOM 0 HG SER A 108 36.307 0.762 -14.721 1.00 0.00 H new ATOM 1605 N LEU A 109 33.181 -1.515 -16.458 1.00 0.00 N ATOM 1606 CA LEU A 109 32.287 -2.390 -15.681 1.00 0.00 C ATOM 1607 C LEU A 109 32.488 -2.216 -14.174 1.00 0.00 C ATOM 1608 O LEU A 109 31.531 -2.186 -13.415 1.00 0.00 O ATOM 1609 CB LEU A 109 32.509 -3.854 -16.092 1.00 0.00 C ATOM 1610 CG LEU A 109 32.338 -4.146 -17.594 1.00 0.00 C ATOM 1611 CD1 LEU A 109 32.468 -5.654 -17.798 1.00 0.00 C ATOM 1612 CD2 LEU A 109 31.000 -3.660 -18.152 1.00 0.00 C ATOM 0 H LEU A 109 33.851 -2.021 -17.037 1.00 0.00 H new ATOM 0 HA LEU A 109 31.258 -2.105 -15.902 1.00 0.00 H new ATOM 0 HB2 LEU A 109 33.514 -4.150 -15.793 1.00 0.00 H new ATOM 0 HB3 LEU A 109 31.813 -4.481 -15.535 1.00 0.00 H new ATOM 0 HG LEU A 109 33.110 -3.600 -18.136 1.00 0.00 H new ATOM 0 HD11 LEU A 109 32.351 -5.890 -18.856 1.00 0.00 H new ATOM 0 HD12 LEU A 109 33.450 -5.984 -17.460 1.00 0.00 H new ATOM 0 HD13 LEU A 109 31.696 -6.167 -17.224 1.00 0.00 H new ATOM 0 HD21 LEU A 109 30.942 -3.896 -19.215 1.00 0.00 H new ATOM 0 HD22 LEU A 109 30.185 -4.155 -17.625 1.00 0.00 H new ATOM 0 HD23 LEU A 109 30.919 -2.582 -18.015 1.00 0.00 H new ATOM 1624 N GLU A 110 33.728 -2.009 -13.742 1.00 0.00 N ATOM 1625 CA GLU A 110 34.056 -1.696 -12.343 1.00 0.00 C ATOM 1626 C GLU A 110 33.381 -0.400 -11.867 1.00 0.00 C ATOM 1627 O GLU A 110 32.844 -0.353 -10.758 1.00 0.00 O ATOM 1628 CB GLU A 110 35.583 -1.638 -12.191 1.00 0.00 C ATOM 1629 CG GLU A 110 36.030 -1.455 -10.734 1.00 0.00 C ATOM 1630 CD GLU A 110 37.566 -1.514 -10.625 1.00 0.00 C ATOM 1631 OE1 GLU A 110 38.233 -0.457 -10.745 1.00 0.00 O ATOM 1632 OE2 GLU A 110 38.123 -2.620 -10.415 1.00 0.00 O ATOM 0 H GLU A 110 34.544 -2.053 -14.352 1.00 0.00 H new ATOM 0 HA GLU A 110 33.664 -2.485 -11.702 1.00 0.00 H new ATOM 0 HB2 GLU A 110 36.018 -2.556 -12.587 1.00 0.00 H new ATOM 0 HB3 GLU A 110 35.972 -0.816 -12.792 1.00 0.00 H new ATOM 0 HG2 GLU A 110 35.670 -0.499 -10.355 1.00 0.00 H new ATOM 0 HG3 GLU A 110 35.586 -2.232 -10.112 1.00 0.00 H new ATOM 1639 N VAL A 111 33.308 0.630 -12.718 1.00 0.00 N ATOM 1640 CA VAL A 111 32.582 1.874 -12.406 1.00 0.00 C ATOM 1641 C VAL A 111 31.068 1.660 -12.424 1.00 0.00 C ATOM 1642 O VAL A 111 30.389 2.170 -11.534 1.00 0.00 O ATOM 1643 CB VAL A 111 33.027 3.017 -13.333 1.00 0.00 C ATOM 1644 CG1 VAL A 111 32.188 4.288 -13.167 1.00 0.00 C ATOM 1645 CG2 VAL A 111 34.483 3.409 -13.052 1.00 0.00 C ATOM 0 H VAL A 111 33.747 0.629 -13.639 1.00 0.00 H new ATOM 0 HA VAL A 111 32.838 2.170 -11.389 1.00 0.00 H new ATOM 0 HB VAL A 111 32.900 2.631 -14.344 1.00 0.00 H new ATOM 0 HG11 VAL A 111 32.553 5.056 -13.849 1.00 0.00 H new ATOM 0 HG12 VAL A 111 31.145 4.067 -13.393 1.00 0.00 H new ATOM 0 HG13 VAL A 111 32.269 4.646 -12.141 1.00 0.00 H new ATOM 0 HG21 VAL A 111 34.777 4.219 -13.719 1.00 0.00 H new ATOM 0 HG22 VAL A 111 34.578 3.738 -12.017 1.00 0.00 H new ATOM 0 HG23 VAL A 111 35.130 2.548 -13.220 1.00 0.00 H new ATOM 1655 N PHE A 112 30.522 0.842 -13.339 1.00 0.00 N ATOM 1656 CA PHE A 112 29.098 0.467 -13.280 1.00 0.00 C ATOM 1657 C PHE A 112 28.766 -0.260 -11.979 1.00 0.00 C ATOM 1658 O PHE A 112 27.829 0.126 -11.294 1.00 0.00 O ATOM 1659 CB PHE A 112 28.715 -0.420 -14.469 1.00 0.00 C ATOM 1660 CG PHE A 112 28.139 0.311 -15.658 1.00 0.00 C ATOM 1661 CD1 PHE A 112 26.769 0.630 -15.680 1.00 0.00 C ATOM 1662 CD2 PHE A 112 28.958 0.655 -16.745 1.00 0.00 C ATOM 1663 CE1 PHE A 112 26.220 1.297 -16.790 1.00 0.00 C ATOM 1664 CE2 PHE A 112 28.414 1.335 -17.846 1.00 0.00 C ATOM 1665 CZ PHE A 112 27.048 1.660 -17.867 1.00 0.00 C ATOM 0 H PHE A 112 31.036 0.432 -14.119 1.00 0.00 H new ATOM 0 HA PHE A 112 28.522 1.391 -13.322 1.00 0.00 H new ATOM 0 HB2 PHE A 112 29.600 -0.967 -14.793 1.00 0.00 H new ATOM 0 HB3 PHE A 112 27.989 -1.159 -14.131 1.00 0.00 H new ATOM 0 HD1 PHE A 112 26.139 0.363 -14.845 1.00 0.00 H new ATOM 0 HD2 PHE A 112 30.007 0.397 -16.734 1.00 0.00 H new ATOM 0 HE1 PHE A 112 25.166 1.530 -16.815 1.00 0.00 H new ATOM 0 HE2 PHE A 112 29.047 1.608 -18.678 1.00 0.00 H new ATOM 0 HZ PHE A 112 26.633 2.190 -18.712 1.00 0.00 H new ATOM 1675 N ARG A 113 29.565 -1.256 -11.584 1.00 0.00 N ATOM 1676 CA ARG A 113 29.393 -2.017 -10.326 1.00 0.00 C ATOM 1677 C ARG A 113 29.517 -1.115 -9.088 1.00 0.00 C ATOM 1678 O ARG A 113 28.727 -1.248 -8.155 1.00 0.00 O ATOM 1679 CB ARG A 113 30.423 -3.162 -10.292 1.00 0.00 C ATOM 1680 CG ARG A 113 30.143 -4.248 -11.351 1.00 0.00 C ATOM 1681 CD ARG A 113 31.310 -5.237 -11.417 1.00 0.00 C ATOM 1682 NE ARG A 113 31.126 -6.265 -12.458 1.00 0.00 N ATOM 1683 CZ ARG A 113 32.065 -6.794 -13.225 1.00 0.00 C ATOM 1684 NH1 ARG A 113 33.305 -6.387 -13.209 1.00 0.00 N ATOM 1685 NH2 ARG A 113 31.769 -7.763 -14.034 1.00 0.00 N ATOM 0 H ARG A 113 30.366 -1.567 -12.134 1.00 0.00 H new ATOM 0 HA ARG A 113 28.386 -2.433 -10.300 1.00 0.00 H new ATOM 0 HB2 ARG A 113 31.420 -2.753 -10.453 1.00 0.00 H new ATOM 0 HB3 ARG A 113 30.421 -3.617 -9.302 1.00 0.00 H new ATOM 0 HG2 ARG A 113 29.222 -4.777 -11.105 1.00 0.00 H new ATOM 0 HG3 ARG A 113 29.994 -3.785 -12.326 1.00 0.00 H new ATOM 0 HD2 ARG A 113 32.233 -4.691 -11.610 1.00 0.00 H new ATOM 0 HD3 ARG A 113 31.424 -5.723 -10.448 1.00 0.00 H new ATOM 0 HE ARG A 113 30.175 -6.604 -12.602 1.00 0.00 H new ATOM 0 HH11 ARG A 113 33.585 -5.630 -12.586 1.00 0.00 H new ATOM 0 HH12 ARG A 113 33.994 -6.826 -13.819 1.00 0.00 H new ATOM 0 HH21 ARG A 113 30.813 -8.116 -14.078 1.00 0.00 H new ATOM 0 HH22 ARG A 113 32.492 -8.172 -14.626 1.00 0.00 H new ATOM 1699 N THR A 114 30.428 -0.140 -9.126 1.00 0.00 N ATOM 1700 CA THR A 114 30.626 0.859 -8.049 1.00 0.00 C ATOM 1701 C THR A 114 29.386 1.739 -7.844 1.00 0.00 C ATOM 1702 O THR A 114 28.976 1.987 -6.710 1.00 0.00 O ATOM 1703 CB THR A 114 31.868 1.723 -8.347 1.00 0.00 C ATOM 1704 OG1 THR A 114 33.029 0.920 -8.319 1.00 0.00 O ATOM 1705 CG2 THR A 114 32.086 2.847 -7.333 1.00 0.00 C ATOM 0 H THR A 114 31.063 -0.012 -9.914 1.00 0.00 H new ATOM 0 HA THR A 114 30.787 0.315 -7.119 1.00 0.00 H new ATOM 0 HB THR A 114 31.690 2.164 -9.328 1.00 0.00 H new ATOM 0 HG1 THR A 114 33.096 0.412 -9.154 1.00 0.00 H new ATOM 0 HG21 THR A 114 32.977 3.414 -7.604 1.00 0.00 H new ATOM 0 HG22 THR A 114 31.220 3.509 -7.332 1.00 0.00 H new ATOM 0 HG23 THR A 114 32.217 2.420 -6.339 1.00 0.00 H new ATOM 1713 N VAL A 115 28.749 2.183 -8.934 1.00 0.00 N ATOM 1714 CA VAL A 115 27.460 2.906 -8.891 1.00 0.00 C ATOM 1715 C VAL A 115 26.294 1.983 -8.518 1.00 0.00 C ATOM 1716 O VAL A 115 25.516 2.324 -7.632 1.00 0.00 O ATOM 1717 CB VAL A 115 27.245 3.642 -10.232 1.00 0.00 C ATOM 1718 CG1 VAL A 115 25.850 4.251 -10.398 1.00 0.00 C ATOM 1719 CG2 VAL A 115 28.243 4.796 -10.331 1.00 0.00 C ATOM 0 H VAL A 115 29.110 2.053 -9.879 1.00 0.00 H new ATOM 0 HA VAL A 115 27.494 3.652 -8.097 1.00 0.00 H new ATOM 0 HB VAL A 115 27.378 2.888 -11.007 1.00 0.00 H new ATOM 0 HG11 VAL A 115 25.783 4.749 -11.365 1.00 0.00 H new ATOM 0 HG12 VAL A 115 25.100 3.462 -10.343 1.00 0.00 H new ATOM 0 HG13 VAL A 115 25.673 4.976 -9.604 1.00 0.00 H new ATOM 0 HG21 VAL A 115 28.099 5.322 -11.275 1.00 0.00 H new ATOM 0 HG22 VAL A 115 28.084 5.487 -9.503 1.00 0.00 H new ATOM 0 HG23 VAL A 115 29.259 4.403 -10.286 1.00 0.00 H new ATOM 1729 N ARG A 116 26.197 0.798 -9.133 1.00 0.00 N ATOM 1730 CA ARG A 116 25.116 -0.197 -8.947 1.00 0.00 C ATOM 1731 C ARG A 116 24.903 -0.556 -7.477 1.00 0.00 C ATOM 1732 O ARG A 116 23.771 -0.527 -7.013 1.00 0.00 O ATOM 1733 CB ARG A 116 25.446 -1.442 -9.808 1.00 0.00 C ATOM 1734 CG ARG A 116 24.340 -2.510 -9.810 1.00 0.00 C ATOM 1735 CD ARG A 116 24.795 -3.835 -10.435 1.00 0.00 C ATOM 1736 NE ARG A 116 25.783 -4.534 -9.579 1.00 0.00 N ATOM 1737 CZ ARG A 116 26.650 -5.458 -9.958 1.00 0.00 C ATOM 1738 NH1 ARG A 116 26.643 -5.942 -11.160 1.00 0.00 N ATOM 1739 NH2 ARG A 116 27.557 -5.902 -9.142 1.00 0.00 N ATOM 0 H ARG A 116 26.898 0.486 -9.805 1.00 0.00 H new ATOM 0 HA ARG A 116 24.171 0.234 -9.277 1.00 0.00 H new ATOM 0 HB2 ARG A 116 25.631 -1.123 -10.834 1.00 0.00 H new ATOM 0 HB3 ARG A 116 26.370 -1.890 -9.442 1.00 0.00 H new ATOM 0 HG2 ARG A 116 24.013 -2.690 -8.786 1.00 0.00 H new ATOM 0 HG3 ARG A 116 23.477 -2.132 -10.358 1.00 0.00 H new ATOM 0 HD2 ARG A 116 23.930 -4.479 -10.593 1.00 0.00 H new ATOM 0 HD3 ARG A 116 25.233 -3.644 -11.415 1.00 0.00 H new ATOM 0 HE ARG A 116 25.795 -4.275 -8.593 1.00 0.00 H new ATOM 0 HH11 ARG A 116 25.958 -5.611 -11.839 1.00 0.00 H new ATOM 0 HH12 ARG A 116 27.323 -6.654 -11.427 1.00 0.00 H new ATOM 0 HH21 ARG A 116 27.609 -5.538 -8.191 1.00 0.00 H new ATOM 0 HH22 ARG A 116 28.217 -6.615 -9.452 1.00 0.00 H new ATOM 1753 N GLY A 117 25.977 -0.825 -6.737 1.00 0.00 N ATOM 1754 CA GLY A 117 25.902 -1.187 -5.309 1.00 0.00 C ATOM 1755 C GLY A 117 25.301 -0.079 -4.436 1.00 0.00 C ATOM 1756 O GLY A 117 24.507 -0.355 -3.539 1.00 0.00 O ATOM 0 H GLY A 117 26.928 -0.800 -7.104 1.00 0.00 H new ATOM 0 HA2 GLY A 117 25.303 -2.091 -5.201 1.00 0.00 H new ATOM 0 HA3 GLY A 117 26.903 -1.423 -4.948 1.00 0.00 H new ATOM 1760 N GLN A 118 25.599 1.187 -4.752 1.00 0.00 N ATOM 1761 CA GLN A 118 25.056 2.345 -4.030 1.00 0.00 C ATOM 1762 C GLN A 118 23.607 2.637 -4.443 1.00 0.00 C ATOM 1763 O GLN A 118 22.756 2.785 -3.573 1.00 0.00 O ATOM 1764 CB GLN A 118 25.995 3.552 -4.203 1.00 0.00 C ATOM 1765 CG GLN A 118 27.353 3.295 -3.520 1.00 0.00 C ATOM 1766 CD GLN A 118 28.371 4.393 -3.815 1.00 0.00 C ATOM 1767 OE1 GLN A 118 28.507 5.370 -3.091 1.00 0.00 O ATOM 1768 NE2 GLN A 118 29.127 4.274 -4.889 1.00 0.00 N ATOM 0 H GLN A 118 26.225 1.438 -5.517 1.00 0.00 H new ATOM 0 HA GLN A 118 25.012 2.118 -2.965 1.00 0.00 H new ATOM 0 HB2 GLN A 118 26.149 3.749 -5.264 1.00 0.00 H new ATOM 0 HB3 GLN A 118 25.532 4.442 -3.777 1.00 0.00 H new ATOM 0 HG2 GLN A 118 27.206 3.220 -2.443 1.00 0.00 H new ATOM 0 HG3 GLN A 118 27.749 2.337 -3.855 1.00 0.00 H new ATOM 0 HE21 GLN A 118 29.022 3.464 -5.499 1.00 0.00 H new ATOM 0 HE22 GLN A 118 29.817 4.992 -5.109 1.00 0.00 H new ATOM 1777 N VAL A 119 23.273 2.603 -5.742 1.00 0.00 N ATOM 1778 CA VAL A 119 21.870 2.693 -6.218 1.00 0.00 C ATOM 1779 C VAL A 119 20.990 1.597 -5.587 1.00 0.00 C ATOM 1780 O VAL A 119 19.893 1.890 -5.114 1.00 0.00 O ATOM 1781 CB VAL A 119 21.789 2.656 -7.763 1.00 0.00 C ATOM 1782 CG1 VAL A 119 20.346 2.762 -8.258 1.00 0.00 C ATOM 1783 CG2 VAL A 119 22.536 3.836 -8.397 1.00 0.00 C ATOM 0 H VAL A 119 23.957 2.513 -6.493 1.00 0.00 H new ATOM 0 HA VAL A 119 21.480 3.658 -5.893 1.00 0.00 H new ATOM 0 HB VAL A 119 22.235 1.704 -8.051 1.00 0.00 H new ATOM 0 HG11 VAL A 119 20.332 2.732 -9.348 1.00 0.00 H new ATOM 0 HG12 VAL A 119 19.764 1.928 -7.865 1.00 0.00 H new ATOM 0 HG13 VAL A 119 19.912 3.701 -7.915 1.00 0.00 H new ATOM 0 HG21 VAL A 119 22.457 3.776 -9.482 1.00 0.00 H new ATOM 0 HG22 VAL A 119 22.097 4.772 -8.052 1.00 0.00 H new ATOM 0 HG23 VAL A 119 23.586 3.800 -8.107 1.00 0.00 H new ATOM 1793 N LYS A 120 21.491 0.354 -5.511 1.00 0.00 N ATOM 1794 CA LYS A 120 20.820 -0.764 -4.826 1.00 0.00 C ATOM 1795 C LYS A 120 20.566 -0.442 -3.355 1.00 0.00 C ATOM 1796 O LYS A 120 19.420 -0.469 -2.919 1.00 0.00 O ATOM 1797 CB LYS A 120 21.666 -2.042 -4.966 1.00 0.00 C ATOM 1798 CG LYS A 120 20.956 -3.253 -4.348 1.00 0.00 C ATOM 1799 CD LYS A 120 21.839 -4.507 -4.379 1.00 0.00 C ATOM 1800 CE LYS A 120 21.024 -5.701 -3.863 1.00 0.00 C ATOM 1801 NZ LYS A 120 21.894 -6.872 -3.549 1.00 0.00 N ATOM 0 H LYS A 120 22.384 0.093 -5.928 1.00 0.00 H new ATOM 0 HA LYS A 120 19.850 -0.925 -5.297 1.00 0.00 H new ATOM 0 HB2 LYS A 120 21.866 -2.234 -6.020 1.00 0.00 H new ATOM 0 HB3 LYS A 120 22.631 -1.897 -4.480 1.00 0.00 H new ATOM 0 HG2 LYS A 120 20.682 -3.027 -3.318 1.00 0.00 H new ATOM 0 HG3 LYS A 120 20.030 -3.447 -4.889 1.00 0.00 H new ATOM 0 HD2 LYS A 120 22.187 -4.698 -5.394 1.00 0.00 H new ATOM 0 HD3 LYS A 120 22.725 -4.360 -3.761 1.00 0.00 H new ATOM 0 HE2 LYS A 120 20.474 -5.407 -2.969 1.00 0.00 H new ATOM 0 HE3 LYS A 120 20.285 -5.987 -4.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 21.307 -7.658 -3.204 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 22.400 -7.169 -4.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 22.583 -6.606 -2.816 1.00 0.00 H new ATOM 1815 N GLU A 121 21.610 -0.111 -2.591 1.00 0.00 N ATOM 1816 CA GLU A 121 21.455 0.116 -1.147 1.00 0.00 C ATOM 1817 C GLU A 121 20.593 1.335 -0.845 1.00 0.00 C ATOM 1818 O GLU A 121 19.786 1.261 0.076 1.00 0.00 O ATOM 1819 CB GLU A 121 22.810 0.103 -0.416 1.00 0.00 C ATOM 1820 CG GLU A 121 23.455 1.466 -0.122 1.00 0.00 C ATOM 1821 CD GLU A 121 22.945 2.099 1.192 1.00 0.00 C ATOM 1822 OE1 GLU A 121 23.234 1.560 2.288 1.00 0.00 O ATOM 1823 OE2 GLU A 121 22.290 3.166 1.133 1.00 0.00 O ATOM 0 H GLU A 121 22.561 0.005 -2.940 1.00 0.00 H new ATOM 0 HA GLU A 121 20.900 -0.728 -0.738 1.00 0.00 H new ATOM 0 HB2 GLU A 121 22.680 -0.422 0.530 1.00 0.00 H new ATOM 0 HB3 GLU A 121 23.511 -0.482 -1.011 1.00 0.00 H new ATOM 0 HG2 GLU A 121 24.537 1.346 -0.066 1.00 0.00 H new ATOM 0 HG3 GLU A 121 23.252 2.145 -0.950 1.00 0.00 H new ATOM 1830 N ARG A 122 20.644 2.395 -1.664 1.00 0.00 N ATOM 1831 CA ARG A 122 19.760 3.549 -1.496 1.00 0.00 C ATOM 1832 C ARG A 122 18.298 3.139 -1.654 1.00 0.00 C ATOM 1833 O ARG A 122 17.489 3.483 -0.799 1.00 0.00 O ATOM 1834 CB ARG A 122 20.151 4.666 -2.472 1.00 0.00 C ATOM 1835 CG ARG A 122 21.500 5.370 -2.215 1.00 0.00 C ATOM 1836 CD ARG A 122 21.483 6.373 -1.053 1.00 0.00 C ATOM 1837 NE ARG A 122 21.539 5.698 0.258 1.00 0.00 N ATOM 1838 CZ ARG A 122 21.341 6.206 1.457 1.00 0.00 C ATOM 1839 NH1 ARG A 122 20.971 7.440 1.656 1.00 0.00 N ATOM 1840 NH2 ARG A 122 21.522 5.430 2.481 1.00 0.00 N ATOM 0 H ARG A 122 21.290 2.474 -2.449 1.00 0.00 H new ATOM 0 HA ARG A 122 19.877 3.938 -0.485 1.00 0.00 H new ATOM 0 HB2 ARG A 122 20.172 4.247 -3.478 1.00 0.00 H new ATOM 0 HB3 ARG A 122 19.365 5.421 -2.458 1.00 0.00 H new ATOM 0 HG2 ARG A 122 22.258 4.613 -2.014 1.00 0.00 H new ATOM 0 HG3 ARG A 122 21.803 5.891 -3.123 1.00 0.00 H new ATOM 0 HD2 ARG A 122 22.330 7.053 -1.148 1.00 0.00 H new ATOM 0 HD3 ARG A 122 20.579 6.980 -1.111 1.00 0.00 H new ATOM 0 HE ARG A 122 21.761 4.703 0.232 1.00 0.00 H new ATOM 0 HH11 ARG A 122 20.821 8.062 0.862 1.00 0.00 H new ATOM 0 HH12 ARG A 122 20.831 7.784 2.606 1.00 0.00 H new ATOM 0 HH21 ARG A 122 21.808 4.461 2.342 1.00 0.00 H new ATOM 0 HH22 ARG A 122 21.378 5.789 3.425 1.00 0.00 H new ATOM 1854 N VAL A 123 17.963 2.313 -2.646 1.00 0.00 N ATOM 1855 CA VAL A 123 16.628 1.703 -2.753 1.00 0.00 C ATOM 1856 C VAL A 123 16.283 0.806 -1.566 1.00 0.00 C ATOM 1857 O VAL A 123 15.208 0.976 -0.999 1.00 0.00 O ATOM 1858 CB VAL A 123 16.476 0.963 -4.097 1.00 0.00 C ATOM 1859 CG1 VAL A 123 15.311 -0.024 -4.106 1.00 0.00 C ATOM 1860 CG2 VAL A 123 16.294 1.971 -5.233 1.00 0.00 C ATOM 0 H VAL A 123 18.601 2.046 -3.396 1.00 0.00 H new ATOM 0 HA VAL A 123 15.902 2.516 -2.726 1.00 0.00 H new ATOM 0 HB VAL A 123 17.391 0.388 -4.241 1.00 0.00 H new ATOM 0 HG11 VAL A 123 15.256 -0.513 -5.079 1.00 0.00 H new ATOM 0 HG12 VAL A 123 15.464 -0.775 -3.331 1.00 0.00 H new ATOM 0 HG13 VAL A 123 14.380 0.510 -3.915 1.00 0.00 H new ATOM 0 HG21 VAL A 123 16.188 1.439 -6.178 1.00 0.00 H new ATOM 0 HG22 VAL A 123 15.401 2.568 -5.050 1.00 0.00 H new ATOM 0 HG23 VAL A 123 17.164 2.626 -5.281 1.00 0.00 H new ATOM 1870 N GLU A 124 17.152 -0.114 -1.141 1.00 0.00 N ATOM 1871 CA GLU A 124 16.863 -0.978 0.019 1.00 0.00 C ATOM 1872 C GLU A 124 16.642 -0.184 1.305 1.00 0.00 C ATOM 1873 O GLU A 124 15.760 -0.513 2.100 1.00 0.00 O ATOM 1874 CB GLU A 124 17.959 -2.020 0.234 1.00 0.00 C ATOM 1875 CG GLU A 124 18.067 -3.013 -0.914 1.00 0.00 C ATOM 1876 CD GLU A 124 19.092 -4.108 -0.551 1.00 0.00 C ATOM 1877 OE1 GLU A 124 20.316 -3.877 -0.698 1.00 0.00 O ATOM 1878 OE2 GLU A 124 18.680 -5.203 -0.096 1.00 0.00 O ATOM 0 H GLU A 124 18.059 -0.284 -1.576 1.00 0.00 H new ATOM 0 HA GLU A 124 15.931 -1.491 -0.219 1.00 0.00 H new ATOM 0 HB2 GLU A 124 18.916 -1.513 0.360 1.00 0.00 H new ATOM 0 HB3 GLU A 124 17.761 -2.562 1.159 1.00 0.00 H new ATOM 0 HG2 GLU A 124 17.094 -3.462 -1.113 1.00 0.00 H new ATOM 0 HG3 GLU A 124 18.374 -2.500 -1.825 1.00 0.00 H new ATOM 1885 N ASN A 125 17.377 0.913 1.470 1.00 0.00 N ATOM 1886 CA ASN A 125 17.211 1.795 2.612 1.00 0.00 C ATOM 1887 C ASN A 125 15.915 2.618 2.522 1.00 0.00 C ATOM 1888 O ASN A 125 15.323 2.938 3.549 1.00 0.00 O ATOM 1889 CB ASN A 125 18.504 2.618 2.828 1.00 0.00 C ATOM 1890 CG ASN A 125 18.309 4.123 2.799 1.00 0.00 C ATOM 1891 OD1 ASN A 125 18.279 4.799 3.815 1.00 0.00 O ATOM 1892 ND2 ASN A 125 18.171 4.684 1.622 1.00 0.00 N ATOM 0 H ASN A 125 18.101 1.211 0.816 1.00 0.00 H new ATOM 0 HA ASN A 125 17.074 1.205 3.518 1.00 0.00 H new ATOM 0 HB2 ASN A 125 18.940 2.340 3.788 1.00 0.00 H new ATOM 0 HB3 ASN A 125 19.226 2.344 2.059 1.00 0.00 H new ATOM 0 HD21 ASN A 125 18.037 5.693 1.550 1.00 0.00 H new ATOM 0 HD22 ASN A 125 18.197 4.112 0.778 1.00 0.00 H new ATOM 1899 N LEU A 126 15.440 2.913 1.307 1.00 0.00 N ATOM 1900 CA LEU A 126 14.188 3.629 1.073 1.00 0.00 C ATOM 1901 C LEU A 126 12.959 2.740 1.271 1.00 0.00 C ATOM 1902 O LEU A 126 12.032 3.151 1.961 1.00 0.00 O ATOM 1903 CB LEU A 126 14.244 4.267 -0.325 1.00 0.00 C ATOM 1904 CG LEU A 126 12.932 4.922 -0.780 1.00 0.00 C ATOM 1905 CD1 LEU A 126 12.512 6.077 0.129 1.00 0.00 C ATOM 1906 CD2 LEU A 126 13.112 5.450 -2.193 1.00 0.00 C ATOM 0 H LEU A 126 15.925 2.656 0.447 1.00 0.00 H new ATOM 0 HA LEU A 126 14.080 4.418 1.818 1.00 0.00 H new ATOM 0 HB2 LEU A 126 15.033 5.019 -0.336 1.00 0.00 H new ATOM 0 HB3 LEU A 126 14.523 3.501 -1.049 1.00 0.00 H new ATOM 0 HG LEU A 126 12.150 4.164 -0.736 1.00 0.00 H new ATOM 0 HD11 LEU A 126 11.579 6.506 -0.236 1.00 0.00 H new ATOM 0 HD12 LEU A 126 12.369 5.707 1.144 1.00 0.00 H new ATOM 0 HD13 LEU A 126 13.288 6.842 0.127 1.00 0.00 H new ATOM 0 HD21 LEU A 126 12.186 5.918 -2.527 1.00 0.00 H new ATOM 0 HD22 LEU A 126 13.916 6.186 -2.207 1.00 0.00 H new ATOM 0 HD23 LEU A 126 13.363 4.626 -2.860 1.00 0.00 H new ATOM 1918 N ILE A 127 12.928 1.515 0.735 1.00 0.00 N ATOM 1919 CA ILE A 127 11.753 0.641 0.925 1.00 0.00 C ATOM 1920 C ILE A 127 11.532 0.261 2.390 1.00 0.00 C ATOM 1921 O ILE A 127 10.391 0.075 2.800 1.00 0.00 O ATOM 1922 CB ILE A 127 11.777 -0.604 0.018 1.00 0.00 C ATOM 1923 CG1 ILE A 127 13.019 -1.500 0.219 1.00 0.00 C ATOM 1924 CG2 ILE A 127 11.618 -0.136 -1.442 1.00 0.00 C ATOM 1925 CD1 ILE A 127 13.205 -2.594 -0.837 1.00 0.00 C ATOM 0 H ILE A 127 13.680 1.109 0.179 1.00 0.00 H new ATOM 0 HA ILE A 127 10.895 1.239 0.616 1.00 0.00 H new ATOM 0 HB ILE A 127 10.944 -1.250 0.295 1.00 0.00 H new ATOM 0 HG12 ILE A 127 13.907 -0.868 0.226 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.954 -1.970 1.200 1.00 0.00 H new ATOM 0 HG21 ILE A 127 11.632 -1.001 -2.105 1.00 0.00 H new ATOM 0 HG22 ILE A 127 10.671 0.392 -1.554 1.00 0.00 H new ATOM 0 HG23 ILE A 127 12.439 0.533 -1.701 1.00 0.00 H new ATOM 0 HD11 ILE A 127 14.102 -3.170 -0.610 1.00 0.00 H new ATOM 0 HD12 ILE A 127 12.339 -3.256 -0.832 1.00 0.00 H new ATOM 0 HD13 ILE A 127 13.306 -2.136 -1.821 1.00 0.00 H new ATOM 1937 N ALA A 128 12.589 0.258 3.204 1.00 0.00 N ATOM 1938 CA ALA A 128 12.452 0.079 4.646 1.00 0.00 C ATOM 1939 C ALA A 128 11.683 1.235 5.334 1.00 0.00 C ATOM 1940 O ALA A 128 11.053 1.031 6.375 1.00 0.00 O ATOM 1941 CB ALA A 128 13.860 -0.046 5.239 1.00 0.00 C ATOM 0 H ALA A 128 13.551 0.378 2.886 1.00 0.00 H new ATOM 0 HA ALA A 128 11.862 -0.820 4.825 1.00 0.00 H new ATOM 0 HB1 ALA A 128 13.790 -0.181 6.318 1.00 0.00 H new ATOM 0 HB2 ALA A 128 14.366 -0.905 4.798 1.00 0.00 H new ATOM 0 HB3 ALA A 128 14.427 0.859 5.023 1.00 0.00 H new ATOM 1947 N LYS A 129 11.733 2.446 4.749 1.00 0.00 N ATOM 1948 CA LYS A 129 11.107 3.678 5.269 1.00 0.00 C ATOM 1949 C LYS A 129 9.643 3.833 4.841 1.00 0.00 C ATOM 1950 O LYS A 129 8.838 4.318 5.636 1.00 0.00 O ATOM 1951 CB LYS A 129 11.934 4.908 4.831 1.00 0.00 C ATOM 1952 CG LYS A 129 13.353 4.925 5.436 1.00 0.00 C ATOM 1953 CD LYS A 129 14.298 5.933 4.755 1.00 0.00 C ATOM 1954 CE LYS A 129 13.835 7.383 4.957 1.00 0.00 C ATOM 1955 NZ LYS A 129 14.799 8.377 4.399 1.00 0.00 N ATOM 0 H LYS A 129 12.228 2.600 3.870 1.00 0.00 H new ATOM 0 HA LYS A 129 11.102 3.604 6.356 1.00 0.00 H new ATOM 0 HB2 LYS A 129 12.008 4.921 3.744 1.00 0.00 H new ATOM 0 HB3 LYS A 129 11.408 5.816 5.125 1.00 0.00 H new ATOM 0 HG2 LYS A 129 13.284 5.163 6.497 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.784 3.927 5.361 1.00 0.00 H new ATOM 0 HD2 LYS A 129 15.304 5.815 5.156 1.00 0.00 H new ATOM 0 HD3 LYS A 129 14.353 5.715 3.688 1.00 0.00 H new ATOM 0 HE2 LYS A 129 12.863 7.519 4.483 1.00 0.00 H new ATOM 0 HE3 LYS A 129 13.700 7.572 6.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 14.612 9.312 4.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 15.770 8.085 4.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 14.687 8.427 3.366 1.00 0.00 H new ATOM 1969 N ILE A 130 9.298 3.436 3.605 1.00 0.00 N ATOM 1970 CA ILE A 130 7.981 3.717 2.983 1.00 0.00 C ATOM 1971 C ILE A 130 7.128 2.498 2.562 1.00 0.00 C ATOM 1972 O ILE A 130 6.068 2.693 1.964 1.00 0.00 O ATOM 1973 CB ILE A 130 8.080 4.814 1.890 1.00 0.00 C ATOM 1974 CG1 ILE A 130 9.141 4.582 0.796 1.00 0.00 C ATOM 1975 CG2 ILE A 130 8.363 6.174 2.549 1.00 0.00 C ATOM 1976 CD1 ILE A 130 8.921 3.316 -0.027 1.00 0.00 C ATOM 0 H ILE A 130 9.926 2.907 3.000 1.00 0.00 H new ATOM 0 HA ILE A 130 7.390 4.117 3.807 1.00 0.00 H new ATOM 0 HB ILE A 130 7.115 4.782 1.385 1.00 0.00 H new ATOM 0 HG12 ILE A 130 9.150 5.441 0.126 1.00 0.00 H new ATOM 0 HG13 ILE A 130 10.124 4.532 1.263 1.00 0.00 H new ATOM 0 HG21 ILE A 130 8.432 6.943 1.780 1.00 0.00 H new ATOM 0 HG22 ILE A 130 7.554 6.420 3.237 1.00 0.00 H new ATOM 0 HG23 ILE A 130 9.303 6.124 3.098 1.00 0.00 H new ATOM 0 HD11 ILE A 130 9.710 3.226 -0.774 1.00 0.00 H new ATOM 0 HD12 ILE A 130 8.943 2.447 0.630 1.00 0.00 H new ATOM 0 HD13 ILE A 130 7.953 3.370 -0.526 1.00 0.00 H new ATOM 1988 N SER A 131 7.531 1.258 2.878 1.00 0.00 N ATOM 1989 CA SER A 131 6.670 0.065 2.713 1.00 0.00 C ATOM 1990 C SER A 131 5.398 0.170 3.577 1.00 0.00 C ATOM 1991 O SER A 131 4.280 0.145 3.008 1.00 0.00 O ATOM 1992 CB SER A 131 7.456 -1.209 3.030 1.00 0.00 C ATOM 1993 OG SER A 131 6.616 -2.343 2.919 1.00 0.00 O ATOM 1994 OXT SER A 131 5.515 0.294 4.822 1.00 0.00 O ATOM 0 H SER A 131 8.456 1.049 3.253 1.00 0.00 H new ATOM 0 HA SER A 131 6.350 0.016 1.672 1.00 0.00 H new ATOM 0 HB2 SER A 131 8.299 -1.304 2.346 1.00 0.00 H new ATOM 0 HB3 SER A 131 7.868 -1.150 4.038 1.00 0.00 H new ATOM 0 HG SER A 131 7.010 -3.092 3.414 1.00 0.00 H new