USER MOD reduce.3.24.130724 H: found=0, std=0, add=995, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 992 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 125 ASN : amide:sc= 0.82 K(o=1.6,f=-2.6) USER MOD Set 1.2: A 129 LYS NZ :NH3+ 146:sc= 0.767 (180deg=0) USER MOD Set 2.1: A 78 SER OG : rot -95:sc= 1.72 USER MOD Set 2.2: A 80 CYS SG : rot 83:sc= 0.496 USER MOD Set 3.1: A 5 MET CE :methyl -151:sc= -0.435 (180deg=-2.44!) USER MOD Set 3.2: A 33 THR OG1 : rot 161:sc= 1 USER MOD Set 3.3: A 35 CYS SG : rot 23:sc= 0.319 USER MOD Set 3.4: A 73 TYR OH : rot 180:sc= 1.91 USER MOD Set 4.1: A 11 ASN : amide:sc= -1.57! C(o=2.5!,f=-2.6!) USER MOD Set 4.2: A 15 SER OG : rot 116:sc= 0.731 USER MOD Set 4.3: A 16 GLN : amide:sc= 1.1 K(o=2.5,f=-0.95) USER MOD Set 4.4: A 34 SER OG : rot -87:sc= 1.23 USER MOD Set 4.5: A 60 GLN : amide:sc= 1.01 K(o=2.5,f=0.2) USER MOD Set 5.1: A 12 SER OG : rot 81:sc= 0.336 USER MOD Set 5.2: A 13 CYS SG : rot -130:sc= -0.633 USER MOD Single : A 1 MET CE :methyl -136:sc= 0 (180deg=-0.0123) USER MOD Single : A 1 MET N :NH3+ -109:sc= 0.00797 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ -169:sc= 1.03 (180deg=0.951) USER MOD Single : A 3 LYS NZ :NH3+ 179:sc= 1.24 (180deg=1.19) USER MOD Single : A 8 CYS SG : rot 177:sc= -0.504 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 MET CE :methyl 180:sc= -0.175 (180deg=-0.175) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 88:sc= 1.02 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 120:sc=-0.000568 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= -1.44 X(o=-1.4,f=-1.8) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl -131:sc= -0.582 (180deg=-1.21) USER MOD Single : A 50 MET CE :methyl -113:sc= -3.74! (180deg=-13.5!) USER MOD Single : A 58 SER OG : rot -81:sc= 1.33 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot -172:sc= 1.31 USER MOD Single : A 67 ASN : amide:sc= 1.16 K(o=1.2,f=-0.55) USER MOD Single : A 69 ASN : amide:sc= 1.02 K(o=1,f=-0.013) USER MOD Single : A 82 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.255 X(o=-0.26,f=-0.068) USER MOD Single : A 92 THR OG1 : rot 1:sc= 0.158 USER MOD Single : A 93 GLN : amide:sc= 0.944 K(o=0.94,f=-0.043) USER MOD Single : A 100 GLN : amide:sc= 0.903 K(o=0.9,f=0) USER MOD Single : A 107 GLN : amide:sc= 0.705 K(o=0.7,f=-0.63) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 93:sc= 1.24 USER MOD Single : A 118 GLN : amide:sc= 0.232 K(o=0.23,f=-1.8!) USER MOD Single : A 120 LYS NZ :NH3+ -167:sc= 1.25 (180deg=1.22) USER MOD Single : A 131 SER OG : rot 79:sc= 0.0511 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.163 -0.386 -2.356 1.00 0.00 N ATOM 2 CA MET A 1 2.195 0.647 -2.628 1.00 0.00 C ATOM 3 C MET A 1 3.489 0.314 -1.886 1.00 0.00 C ATOM 4 O MET A 1 3.463 -0.119 -0.732 1.00 0.00 O ATOM 5 CB MET A 1 1.682 2.057 -2.272 1.00 0.00 C ATOM 6 CG MET A 1 2.722 3.180 -2.411 1.00 0.00 C ATOM 7 SD MET A 1 2.010 4.849 -2.463 1.00 0.00 S ATOM 8 CE MET A 1 1.369 4.903 -4.163 1.00 0.00 C ATOM 0 H1 MET A 1 1.010 -0.958 -3.211 1.00 0.00 H new ATOM 0 H2 MET A 1 1.483 -1.001 -1.581 1.00 0.00 H new ATOM 0 H3 MET A 1 0.272 0.077 -2.085 1.00 0.00 H new ATOM 0 HA MET A 1 2.410 0.646 -3.697 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.830 2.290 -2.911 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.316 2.046 -1.245 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.419 3.120 -1.575 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.300 3.015 -3.320 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.621 5.861 -4.617 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.815 4.097 -4.746 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.286 4.783 -4.147 1.00 0.00 H new ATOM 18 N LYS A 2 4.630 0.531 -2.547 1.00 0.00 N ATOM 19 CA LYS A 2 5.958 0.373 -1.947 1.00 0.00 C ATOM 20 C LYS A 2 6.495 1.764 -1.623 1.00 0.00 C ATOM 21 O LYS A 2 6.318 2.691 -2.411 1.00 0.00 O ATOM 22 CB LYS A 2 6.909 -0.356 -2.917 1.00 0.00 C ATOM 23 CG LYS A 2 6.713 -1.878 -3.007 1.00 0.00 C ATOM 24 CD LYS A 2 5.522 -2.298 -3.885 1.00 0.00 C ATOM 25 CE LYS A 2 5.568 -3.808 -4.168 1.00 0.00 C ATOM 26 NZ LYS A 2 4.548 -4.228 -5.164 1.00 0.00 N ATOM 0 H LYS A 2 4.658 0.824 -3.524 1.00 0.00 H new ATOM 0 HA LYS A 2 5.889 -0.227 -1.040 1.00 0.00 H new ATOM 0 HB2 LYS A 2 6.783 0.070 -3.912 1.00 0.00 H new ATOM 0 HB3 LYS A 2 7.936 -0.156 -2.612 1.00 0.00 H new ATOM 0 HG2 LYS A 2 7.622 -2.330 -3.404 1.00 0.00 H new ATOM 0 HG3 LYS A 2 6.571 -2.277 -2.003 1.00 0.00 H new ATOM 0 HD2 LYS A 2 4.587 -2.044 -3.386 1.00 0.00 H new ATOM 0 HD3 LYS A 2 5.542 -1.745 -4.824 1.00 0.00 H new ATOM 0 HE2 LYS A 2 6.560 -4.077 -4.532 1.00 0.00 H new ATOM 0 HE3 LYS A 2 5.411 -4.354 -3.238 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 4.490 -5.266 -5.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 3.622 -3.835 -4.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 4.817 -3.877 -6.105 1.00 0.00 H new ATOM 40 N LYS A 3 7.169 1.935 -0.489 1.00 0.00 N ATOM 41 CA LYS A 3 7.887 3.176 -0.211 1.00 0.00 C ATOM 42 C LYS A 3 9.311 3.048 -0.720 1.00 0.00 C ATOM 43 O LYS A 3 9.955 2.044 -0.423 1.00 0.00 O ATOM 44 CB LYS A 3 7.870 3.489 1.293 1.00 0.00 C ATOM 45 CG LYS A 3 6.835 4.579 1.584 1.00 0.00 C ATOM 46 CD LYS A 3 6.977 5.110 3.011 1.00 0.00 C ATOM 47 CE LYS A 3 6.019 6.287 3.207 1.00 0.00 C ATOM 48 NZ LYS A 3 6.210 6.937 4.523 1.00 0.00 N ATOM 0 H LYS A 3 7.233 1.234 0.249 1.00 0.00 H new ATOM 0 HA LYS A 3 7.394 4.002 -0.724 1.00 0.00 H new ATOM 0 HB2 LYS A 3 7.632 2.588 1.859 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.858 3.817 1.617 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.956 5.398 0.875 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.831 4.179 1.440 1.00 0.00 H new ATOM 0 HD2 LYS A 3 6.755 4.321 3.729 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.004 5.427 3.193 1.00 0.00 H new ATOM 0 HE2 LYS A 3 6.175 7.019 2.414 1.00 0.00 H new ATOM 0 HE3 LYS A 3 4.990 5.937 3.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 5.555 7.740 4.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 6.020 6.250 5.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 7.189 7.278 4.603 1.00 0.00 H new ATOM 62 N VAL A 4 9.836 4.066 -1.392 1.00 0.00 N ATOM 63 CA VAL A 4 11.222 4.120 -1.816 1.00 0.00 C ATOM 64 C VAL A 4 11.927 5.262 -1.101 1.00 0.00 C ATOM 65 O VAL A 4 11.372 6.351 -0.938 1.00 0.00 O ATOM 66 CB VAL A 4 11.284 4.229 -3.350 1.00 0.00 C ATOM 67 CG1 VAL A 4 10.625 5.469 -3.960 1.00 0.00 C ATOM 68 CG2 VAL A 4 12.732 4.174 -3.864 1.00 0.00 C ATOM 0 H VAL A 4 9.297 4.890 -1.660 1.00 0.00 H new ATOM 0 HA VAL A 4 11.749 3.205 -1.543 1.00 0.00 H new ATOM 0 HB VAL A 4 10.705 3.364 -3.674 1.00 0.00 H new ATOM 0 HG11 VAL A 4 10.729 5.440 -5.045 1.00 0.00 H new ATOM 0 HG12 VAL A 4 9.567 5.485 -3.698 1.00 0.00 H new ATOM 0 HG13 VAL A 4 11.109 6.366 -3.573 1.00 0.00 H new ATOM 0 HG21 VAL A 4 12.735 4.254 -4.951 1.00 0.00 H new ATOM 0 HG22 VAL A 4 13.301 5.000 -3.438 1.00 0.00 H new ATOM 0 HG23 VAL A 4 13.187 3.229 -3.568 1.00 0.00 H new ATOM 78 N MET A 5 13.168 5.004 -0.706 1.00 0.00 N ATOM 79 CA MET A 5 14.056 6.022 -0.162 1.00 0.00 C ATOM 80 C MET A 5 15.274 6.142 -1.070 1.00 0.00 C ATOM 81 O MET A 5 15.781 5.122 -1.538 1.00 0.00 O ATOM 82 CB MET A 5 14.458 5.645 1.272 1.00 0.00 C ATOM 83 CG MET A 5 15.453 6.642 1.874 1.00 0.00 C ATOM 84 SD MET A 5 14.839 8.339 2.030 1.00 0.00 S ATOM 85 CE MET A 5 14.062 8.227 3.660 1.00 0.00 C ATOM 0 H MET A 5 13.588 4.076 -0.755 1.00 0.00 H new ATOM 0 HA MET A 5 13.553 6.988 -0.122 1.00 0.00 H new ATOM 0 HB2 MET A 5 13.567 5.601 1.898 1.00 0.00 H new ATOM 0 HB3 MET A 5 14.899 4.648 1.274 1.00 0.00 H new ATOM 0 HG2 MET A 5 15.748 6.286 2.861 1.00 0.00 H new ATOM 0 HG3 MET A 5 16.352 6.652 1.257 1.00 0.00 H new ATOM 0 HE1 MET A 5 13.232 8.932 3.717 1.00 0.00 H new ATOM 0 HE2 MET A 5 13.689 7.215 3.817 1.00 0.00 H new ATOM 0 HE3 MET A 5 14.795 8.467 4.430 1.00 0.00 H new ATOM 95 N PHE A 6 15.781 7.364 -1.248 1.00 0.00 N ATOM 96 CA PHE A 6 17.058 7.636 -1.901 1.00 0.00 C ATOM 97 C PHE A 6 17.962 8.320 -0.869 1.00 0.00 C ATOM 98 O PHE A 6 17.545 9.323 -0.295 1.00 0.00 O ATOM 99 CB PHE A 6 16.876 8.515 -3.139 1.00 0.00 C ATOM 100 CG PHE A 6 15.973 7.902 -4.188 1.00 0.00 C ATOM 101 CD1 PHE A 6 16.499 6.977 -5.113 1.00 0.00 C ATOM 102 CD2 PHE A 6 14.610 8.250 -4.237 1.00 0.00 C ATOM 103 CE1 PHE A 6 15.673 6.409 -6.101 1.00 0.00 C ATOM 104 CE2 PHE A 6 13.790 7.656 -5.214 1.00 0.00 C ATOM 105 CZ PHE A 6 14.315 6.748 -6.141 1.00 0.00 C ATOM 0 H PHE A 6 15.303 8.209 -0.934 1.00 0.00 H new ATOM 0 HA PHE A 6 17.508 6.706 -2.247 1.00 0.00 H new ATOM 0 HB2 PHE A 6 16.464 9.477 -2.834 1.00 0.00 H new ATOM 0 HB3 PHE A 6 17.852 8.712 -3.582 1.00 0.00 H new ATOM 0 HD1 PHE A 6 17.542 6.703 -5.063 1.00 0.00 H new ATOM 0 HD2 PHE A 6 14.200 8.962 -3.536 1.00 0.00 H new ATOM 0 HE1 PHE A 6 16.083 5.718 -6.822 1.00 0.00 H new ATOM 0 HE2 PHE A 6 12.740 7.904 -5.249 1.00 0.00 H new ATOM 0 HZ PHE A 6 13.671 6.308 -6.888 1.00 0.00 H new ATOM 115 N VAL A 7 19.180 7.836 -0.625 1.00 0.00 N ATOM 116 CA VAL A 7 20.046 8.312 0.457 1.00 0.00 C ATOM 117 C VAL A 7 21.402 8.697 -0.129 1.00 0.00 C ATOM 118 O VAL A 7 22.127 7.812 -0.580 1.00 0.00 O ATOM 119 CB VAL A 7 20.231 7.212 1.530 1.00 0.00 C ATOM 120 CG1 VAL A 7 21.093 7.723 2.692 1.00 0.00 C ATOM 121 CG2 VAL A 7 18.902 6.681 2.079 1.00 0.00 C ATOM 0 H VAL A 7 19.600 7.091 -1.181 1.00 0.00 H new ATOM 0 HA VAL A 7 19.585 9.178 0.931 1.00 0.00 H new ATOM 0 HB VAL A 7 20.735 6.385 1.029 1.00 0.00 H new ATOM 0 HG11 VAL A 7 21.209 6.933 3.434 1.00 0.00 H new ATOM 0 HG12 VAL A 7 22.074 8.015 2.316 1.00 0.00 H new ATOM 0 HG13 VAL A 7 20.609 8.584 3.152 1.00 0.00 H new ATOM 0 HG21 VAL A 7 19.098 5.913 2.827 1.00 0.00 H new ATOM 0 HG22 VAL A 7 18.345 7.499 2.536 1.00 0.00 H new ATOM 0 HG23 VAL A 7 18.317 6.254 1.265 1.00 0.00 H new ATOM 131 N CYS A 8 21.776 9.981 -0.097 1.00 0.00 N ATOM 132 CA CYS A 8 23.082 10.431 -0.586 1.00 0.00 C ATOM 133 C CYS A 8 23.965 10.897 0.562 1.00 0.00 C ATOM 134 O CYS A 8 23.489 11.265 1.628 1.00 0.00 O ATOM 135 CB CYS A 8 22.886 11.492 -1.694 1.00 0.00 C ATOM 136 SG CYS A 8 24.455 12.079 -2.406 1.00 0.00 S ATOM 0 H CYS A 8 21.187 10.731 0.265 1.00 0.00 H new ATOM 0 HA CYS A 8 23.616 9.596 -1.039 1.00 0.00 H new ATOM 0 HB2 CYS A 8 22.269 11.070 -2.488 1.00 0.00 H new ATOM 0 HB3 CYS A 8 22.340 12.341 -1.283 1.00 0.00 H new ATOM 0 HG CYS A 8 24.208 12.910 -3.375 1.00 0.00 H new ATOM 142 N LYS A 9 25.276 10.948 0.335 1.00 0.00 N ATOM 143 CA LYS A 9 26.242 11.489 1.289 1.00 0.00 C ATOM 144 C LYS A 9 25.962 12.966 1.646 1.00 0.00 C ATOM 145 O LYS A 9 26.472 13.435 2.661 1.00 0.00 O ATOM 146 CB LYS A 9 27.666 11.282 0.719 1.00 0.00 C ATOM 147 CG LYS A 9 28.454 10.248 1.531 1.00 0.00 C ATOM 148 CD LYS A 9 29.862 10.046 0.955 1.00 0.00 C ATOM 149 CE LYS A 9 30.668 9.085 1.841 1.00 0.00 C ATOM 150 NZ LYS A 9 32.081 8.965 1.398 1.00 0.00 N ATOM 0 H LYS A 9 25.703 10.610 -0.528 1.00 0.00 H new ATOM 0 HA LYS A 9 26.149 10.950 2.232 1.00 0.00 H new ATOM 0 HB2 LYS A 9 27.599 10.956 -0.319 1.00 0.00 H new ATOM 0 HB3 LYS A 9 28.201 12.232 0.721 1.00 0.00 H new ATOM 0 HG2 LYS A 9 28.526 10.575 2.568 1.00 0.00 H new ATOM 0 HG3 LYS A 9 27.919 9.298 1.532 1.00 0.00 H new ATOM 0 HD2 LYS A 9 29.794 9.648 -0.057 1.00 0.00 H new ATOM 0 HD3 LYS A 9 30.375 11.005 0.887 1.00 0.00 H new ATOM 0 HE2 LYS A 9 30.641 9.436 2.873 1.00 0.00 H new ATOM 0 HE3 LYS A 9 30.200 8.101 1.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 32.587 8.307 2.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 32.110 8.606 0.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 32.537 9.899 1.436 1.00 0.00 H new ATOM 164 N ARG A 10 25.172 13.696 0.837 1.00 0.00 N ATOM 165 CA ARG A 10 24.916 15.137 0.999 1.00 0.00 C ATOM 166 C ARG A 10 23.449 15.567 0.801 1.00 0.00 C ATOM 167 O ARG A 10 23.141 16.744 0.963 1.00 0.00 O ATOM 168 CB ARG A 10 25.885 15.953 0.110 1.00 0.00 C ATOM 169 CG ARG A 10 26.109 15.451 -1.337 1.00 0.00 C ATOM 170 CD ARG A 10 27.327 14.523 -1.523 1.00 0.00 C ATOM 171 NE ARG A 10 28.597 15.142 -1.086 1.00 0.00 N ATOM 172 CZ ARG A 10 29.188 16.225 -1.617 1.00 0.00 C ATOM 173 NH1 ARG A 10 28.747 16.779 -2.739 1.00 0.00 N ATOM 174 NH2 ARG A 10 30.233 16.771 -1.005 1.00 0.00 N ATOM 0 H ARG A 10 24.685 13.292 0.037 1.00 0.00 H new ATOM 0 HA ARG A 10 25.112 15.359 2.048 1.00 0.00 H new ATOM 0 HB2 ARG A 10 25.515 16.977 0.059 1.00 0.00 H new ATOM 0 HB3 ARG A 10 26.853 15.988 0.609 1.00 0.00 H new ATOM 0 HG2 ARG A 10 25.214 14.922 -1.665 1.00 0.00 H new ATOM 0 HG3 ARG A 10 26.226 16.315 -1.991 1.00 0.00 H new ATOM 0 HD2 ARG A 10 27.165 13.603 -0.961 1.00 0.00 H new ATOM 0 HD3 ARG A 10 27.408 14.245 -2.574 1.00 0.00 H new ATOM 0 HE ARG A 10 29.074 14.701 -0.300 1.00 0.00 H new ATOM 0 HH11 ARG A 10 27.940 16.383 -3.221 1.00 0.00 H new ATOM 0 HH12 ARG A 10 29.215 17.601 -3.120 1.00 0.00 H new ATOM 0 HH21 ARG A 10 30.583 16.368 -0.136 1.00 0.00 H new ATOM 0 HH22 ARG A 10 30.685 17.593 -1.404 1.00 0.00 H new ATOM 188 N ASN A 11 22.539 14.645 0.457 1.00 0.00 N ATOM 189 CA ASN A 11 21.149 14.905 0.026 1.00 0.00 C ATOM 190 C ASN A 11 20.958 16.157 -0.866 1.00 0.00 C ATOM 191 O ASN A 11 19.956 16.864 -0.728 1.00 0.00 O ATOM 192 CB ASN A 11 20.155 14.920 1.203 1.00 0.00 C ATOM 193 CG ASN A 11 18.708 14.738 0.719 1.00 0.00 C ATOM 194 OD1 ASN A 11 18.427 14.433 -0.438 1.00 0.00 O ATOM 195 ND2 ASN A 11 17.733 14.894 1.593 1.00 0.00 N ATOM 0 H ASN A 11 22.758 13.649 0.471 1.00 0.00 H new ATOM 0 HA ASN A 11 20.921 14.051 -0.612 1.00 0.00 H new ATOM 0 HB2 ASN A 11 20.408 14.125 1.905 1.00 0.00 H new ATOM 0 HB3 ASN A 11 20.243 15.862 1.744 1.00 0.00 H new ATOM 0 HD21 ASN A 11 16.764 14.762 1.305 1.00 0.00 H new ATOM 0 HD22 ASN A 11 17.948 15.147 2.557 1.00 0.00 H new ATOM 202 N SER A 12 21.905 16.486 -1.752 1.00 0.00 N ATOM 203 CA SER A 12 21.867 17.752 -2.485 1.00 0.00 C ATOM 204 C SER A 12 21.509 17.559 -3.957 1.00 0.00 C ATOM 205 O SER A 12 20.812 18.409 -4.517 1.00 0.00 O ATOM 206 CB SER A 12 23.216 18.453 -2.341 1.00 0.00 C ATOM 207 OG SER A 12 24.245 17.578 -2.757 1.00 0.00 O ATOM 0 H SER A 12 22.704 15.893 -1.977 1.00 0.00 H new ATOM 0 HA SER A 12 21.081 18.372 -2.055 1.00 0.00 H new ATOM 0 HB2 SER A 12 23.232 19.363 -2.941 1.00 0.00 H new ATOM 0 HB3 SER A 12 23.374 18.752 -1.305 1.00 0.00 H new ATOM 0 HG SER A 12 24.312 17.593 -3.735 1.00 0.00 H new ATOM 213 N CYS A 13 21.956 16.454 -4.574 1.00 0.00 N ATOM 214 CA CYS A 13 21.864 16.263 -6.019 1.00 0.00 C ATOM 215 C CYS A 13 21.360 14.864 -6.374 1.00 0.00 C ATOM 216 O CYS A 13 20.239 14.764 -6.874 1.00 0.00 O ATOM 217 CB CYS A 13 23.222 16.532 -6.687 1.00 0.00 C ATOM 218 SG CYS A 13 23.972 18.079 -6.124 1.00 0.00 S ATOM 0 H CYS A 13 22.389 15.673 -4.081 1.00 0.00 H new ATOM 0 HA CYS A 13 21.137 16.981 -6.399 1.00 0.00 H new ATOM 0 HB2 CYS A 13 23.899 15.705 -6.474 1.00 0.00 H new ATOM 0 HB3 CYS A 13 23.091 16.567 -7.769 1.00 0.00 H new ATOM 0 HG CYS A 13 24.339 18.783 -7.153 1.00 0.00 H new ATOM 224 N ARG A 14 22.142 13.794 -6.124 1.00 0.00 N ATOM 225 CA ARG A 14 21.791 12.455 -6.635 1.00 0.00 C ATOM 226 C ARG A 14 20.386 12.057 -6.162 1.00 0.00 C ATOM 227 O ARG A 14 19.525 11.712 -6.968 1.00 0.00 O ATOM 228 CB ARG A 14 22.782 11.358 -6.186 1.00 0.00 C ATOM 229 CG ARG A 14 24.213 11.425 -6.742 1.00 0.00 C ATOM 230 CD ARG A 14 24.999 10.261 -6.118 1.00 0.00 C ATOM 231 NE ARG A 14 26.454 10.336 -6.338 1.00 0.00 N ATOM 232 CZ ARG A 14 27.403 10.270 -5.389 1.00 0.00 C ATOM 233 NH1 ARG A 14 27.092 10.224 -4.101 1.00 0.00 N ATOM 234 NH2 ARG A 14 28.686 10.274 -5.726 1.00 0.00 N ATOM 0 H ARG A 14 23.005 13.829 -5.582 1.00 0.00 H new ATOM 0 HA ARG A 14 21.832 12.526 -7.722 1.00 0.00 H new ATOM 0 HB2 ARG A 14 22.842 11.384 -5.098 1.00 0.00 H new ATOM 0 HB3 ARG A 14 22.360 10.391 -6.459 1.00 0.00 H new ATOM 0 HG2 ARG A 14 24.207 11.346 -7.829 1.00 0.00 H new ATOM 0 HG3 ARG A 14 24.678 12.379 -6.494 1.00 0.00 H new ATOM 0 HD2 ARG A 14 24.804 10.238 -5.046 1.00 0.00 H new ATOM 0 HD3 ARG A 14 24.627 9.323 -6.530 1.00 0.00 H new ATOM 0 HE ARG A 14 26.771 10.449 -7.301 1.00 0.00 H new ATOM 0 HH11 ARG A 14 26.114 10.238 -3.812 1.00 0.00 H new ATOM 0 HH12 ARG A 14 27.831 10.174 -3.399 1.00 0.00 H new ATOM 0 HH21 ARG A 14 28.955 10.327 -6.708 1.00 0.00 H new ATOM 0 HH22 ARG A 14 29.403 10.224 -5.003 1.00 0.00 H new ATOM 248 N SER A 15 20.161 12.123 -4.847 1.00 0.00 N ATOM 249 CA SER A 15 18.938 11.675 -4.191 1.00 0.00 C ATOM 250 C SER A 15 17.765 12.583 -4.568 1.00 0.00 C ATOM 251 O SER A 15 16.671 12.105 -4.856 1.00 0.00 O ATOM 252 CB SER A 15 19.186 11.715 -2.677 1.00 0.00 C ATOM 253 OG SER A 15 19.782 12.954 -2.334 1.00 0.00 O ATOM 0 H SER A 15 20.847 12.501 -4.194 1.00 0.00 H new ATOM 0 HA SER A 15 18.683 10.664 -4.508 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.246 11.589 -2.139 1.00 0.00 H new ATOM 0 HB3 SER A 15 19.836 10.891 -2.381 1.00 0.00 H new ATOM 0 HG SER A 15 19.173 13.462 -1.759 1.00 0.00 H new ATOM 259 N GLN A 16 18.003 13.896 -4.577 1.00 0.00 N ATOM 260 CA GLN A 16 17.004 14.920 -4.856 1.00 0.00 C ATOM 261 C GLN A 16 16.415 14.731 -6.254 1.00 0.00 C ATOM 262 O GLN A 16 15.194 14.725 -6.418 1.00 0.00 O ATOM 263 CB GLN A 16 17.679 16.296 -4.717 1.00 0.00 C ATOM 264 CG GLN A 16 17.884 16.680 -3.245 1.00 0.00 C ATOM 265 CD GLN A 16 16.582 17.071 -2.547 1.00 0.00 C ATOM 266 OE1 GLN A 16 15.674 17.655 -3.135 1.00 0.00 O ATOM 267 NE2 GLN A 16 16.458 16.761 -1.274 1.00 0.00 N ATOM 0 H GLN A 16 18.926 14.284 -4.384 1.00 0.00 H new ATOM 0 HA GLN A 16 16.178 14.844 -4.149 1.00 0.00 H new ATOM 0 HB2 GLN A 16 18.642 16.282 -5.227 1.00 0.00 H new ATOM 0 HB3 GLN A 16 17.068 17.053 -5.209 1.00 0.00 H new ATOM 0 HG2 GLN A 16 18.337 15.842 -2.716 1.00 0.00 H new ATOM 0 HG3 GLN A 16 18.586 17.511 -3.186 1.00 0.00 H new ATOM 0 HE21 GLN A 16 17.215 16.276 -0.791 1.00 0.00 H new ATOM 0 HE22 GLN A 16 15.605 17.005 -0.770 1.00 0.00 H new ATOM 276 N MET A 17 17.281 14.534 -7.251 1.00 0.00 N ATOM 277 CA MET A 17 16.848 14.254 -8.609 1.00 0.00 C ATOM 278 C MET A 17 16.137 12.907 -8.683 1.00 0.00 C ATOM 279 O MET A 17 15.063 12.825 -9.280 1.00 0.00 O ATOM 280 CB MET A 17 18.049 14.292 -9.555 1.00 0.00 C ATOM 281 CG MET A 17 18.399 15.730 -9.953 1.00 0.00 C ATOM 282 SD MET A 17 19.379 15.899 -11.472 1.00 0.00 S ATOM 283 CE MET A 17 20.990 15.337 -10.876 1.00 0.00 C ATOM 0 H MET A 17 18.294 14.565 -7.134 1.00 0.00 H new ATOM 0 HA MET A 17 16.137 15.021 -8.917 1.00 0.00 H new ATOM 0 HB2 MET A 17 18.909 13.826 -9.073 1.00 0.00 H new ATOM 0 HB3 MET A 17 17.829 13.708 -10.449 1.00 0.00 H new ATOM 0 HG2 MET A 17 17.473 16.292 -10.074 1.00 0.00 H new ATOM 0 HG3 MET A 17 18.948 16.193 -9.133 1.00 0.00 H new ATOM 0 HE1 MET A 17 21.714 15.378 -11.690 1.00 0.00 H new ATOM 0 HE2 MET A 17 21.322 15.982 -10.062 1.00 0.00 H new ATOM 0 HE3 MET A 17 20.907 14.312 -10.516 1.00 0.00 H new ATOM 293 N ALA A 18 16.696 11.869 -8.046 1.00 0.00 N ATOM 294 CA ALA A 18 16.081 10.551 -8.022 1.00 0.00 C ATOM 295 C ALA A 18 14.643 10.629 -7.516 1.00 0.00 C ATOM 296 O ALA A 18 13.757 9.981 -8.078 1.00 0.00 O ATOM 297 CB ALA A 18 16.902 9.590 -7.163 1.00 0.00 C ATOM 0 H ALA A 18 17.579 11.926 -7.539 1.00 0.00 H new ATOM 0 HA ALA A 18 16.060 10.169 -9.043 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.426 8.610 -7.157 1.00 0.00 H new ATOM 0 HB2 ALA A 18 17.908 9.503 -7.574 1.00 0.00 H new ATOM 0 HB3 ALA A 18 16.959 9.971 -6.143 1.00 0.00 H new ATOM 303 N GLU A 19 14.406 11.459 -6.496 1.00 0.00 N ATOM 304 CA GLU A 19 13.067 11.646 -5.965 1.00 0.00 C ATOM 305 C GLU A 19 12.166 12.260 -7.028 1.00 0.00 C ATOM 306 O GLU A 19 11.132 11.670 -7.338 1.00 0.00 O ATOM 307 CB GLU A 19 13.043 12.424 -4.635 1.00 0.00 C ATOM 308 CG GLU A 19 11.627 12.940 -4.293 1.00 0.00 C ATOM 309 CD GLU A 19 11.378 13.256 -2.805 1.00 0.00 C ATOM 310 OE1 GLU A 19 12.345 13.374 -2.023 1.00 0.00 O ATOM 311 OE2 GLU A 19 10.195 13.376 -2.411 1.00 0.00 O ATOM 0 H GLU A 19 15.127 12.008 -6.027 1.00 0.00 H new ATOM 0 HA GLU A 19 12.670 10.663 -5.712 1.00 0.00 H new ATOM 0 HB2 GLU A 19 13.398 11.779 -3.831 1.00 0.00 H new ATOM 0 HB3 GLU A 19 13.732 13.267 -4.695 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.438 13.842 -4.875 1.00 0.00 H new ATOM 0 HG3 GLU A 19 10.900 12.194 -4.615 1.00 0.00 H new ATOM 318 N GLY A 20 12.553 13.403 -7.597 1.00 0.00 N ATOM 319 CA GLY A 20 11.748 14.093 -8.596 1.00 0.00 C ATOM 320 C GLY A 20 11.357 13.169 -9.756 1.00 0.00 C ATOM 321 O GLY A 20 10.203 13.210 -10.193 1.00 0.00 O ATOM 0 H GLY A 20 13.431 13.872 -7.376 1.00 0.00 H new ATOM 0 HA2 GLY A 20 10.847 14.487 -8.126 1.00 0.00 H new ATOM 0 HA3 GLY A 20 12.304 14.946 -8.984 1.00 0.00 H new ATOM 325 N PHE A 21 12.262 12.298 -10.231 1.00 0.00 N ATOM 326 CA PHE A 21 11.888 11.352 -11.278 1.00 0.00 C ATOM 327 C PHE A 21 10.860 10.374 -10.705 1.00 0.00 C ATOM 328 O PHE A 21 9.813 10.179 -11.304 1.00 0.00 O ATOM 329 CB PHE A 21 13.075 10.580 -11.885 1.00 0.00 C ATOM 330 CG PHE A 21 14.294 11.394 -12.269 1.00 0.00 C ATOM 331 CD1 PHE A 21 14.195 12.527 -13.104 1.00 0.00 C ATOM 332 CD2 PHE A 21 15.543 11.026 -11.744 1.00 0.00 C ATOM 333 CE1 PHE A 21 15.304 13.378 -13.266 1.00 0.00 C ATOM 334 CE2 PHE A 21 16.658 11.850 -11.942 1.00 0.00 C ATOM 335 CZ PHE A 21 16.525 13.048 -12.655 1.00 0.00 C ATOM 0 H PHE A 21 13.229 12.234 -9.914 1.00 0.00 H new ATOM 0 HA PHE A 21 11.470 11.932 -12.100 1.00 0.00 H new ATOM 0 HB2 PHE A 21 13.386 9.818 -11.170 1.00 0.00 H new ATOM 0 HB3 PHE A 21 12.722 10.057 -12.774 1.00 0.00 H new ATOM 0 HD1 PHE A 21 13.270 12.741 -13.618 1.00 0.00 H new ATOM 0 HD2 PHE A 21 15.644 10.106 -11.187 1.00 0.00 H new ATOM 0 HE1 PHE A 21 15.217 14.278 -13.856 1.00 0.00 H new ATOM 0 HE2 PHE A 21 17.620 11.562 -11.545 1.00 0.00 H new ATOM 0 HZ PHE A 21 17.365 13.722 -12.735 1.00 0.00 H new ATOM 345 N ALA A 22 11.108 9.779 -9.537 1.00 0.00 N ATOM 346 CA ALA A 22 10.275 8.731 -8.958 1.00 0.00 C ATOM 347 C ALA A 22 8.836 9.181 -8.714 1.00 0.00 C ATOM 348 O ALA A 22 7.913 8.464 -9.101 1.00 0.00 O ATOM 349 CB ALA A 22 10.921 8.246 -7.660 1.00 0.00 C ATOM 0 H ALA A 22 11.912 10.020 -8.957 1.00 0.00 H new ATOM 0 HA ALA A 22 10.215 7.914 -9.677 1.00 0.00 H new ATOM 0 HB1 ALA A 22 10.306 7.462 -7.218 1.00 0.00 H new ATOM 0 HB2 ALA A 22 11.914 7.851 -7.873 1.00 0.00 H new ATOM 0 HB3 ALA A 22 11.004 9.079 -6.962 1.00 0.00 H new ATOM 355 N LYS A 23 8.609 10.364 -8.133 1.00 0.00 N ATOM 356 CA LYS A 23 7.258 10.891 -7.967 1.00 0.00 C ATOM 357 C LYS A 23 6.596 11.277 -9.290 1.00 0.00 C ATOM 358 O LYS A 23 5.401 11.558 -9.289 1.00 0.00 O ATOM 359 CB LYS A 23 7.196 12.037 -6.948 1.00 0.00 C ATOM 360 CG LYS A 23 8.367 13.020 -7.005 1.00 0.00 C ATOM 361 CD LYS A 23 8.006 14.378 -6.409 1.00 0.00 C ATOM 362 CE LYS A 23 7.299 15.207 -7.488 1.00 0.00 C ATOM 363 NZ LYS A 23 6.868 16.536 -6.988 1.00 0.00 N ATOM 0 H LYS A 23 9.345 10.971 -7.772 1.00 0.00 H new ATOM 0 HA LYS A 23 6.673 10.066 -7.560 1.00 0.00 H new ATOM 0 HB2 LYS A 23 6.270 12.590 -7.103 1.00 0.00 H new ATOM 0 HB3 LYS A 23 7.149 11.610 -5.946 1.00 0.00 H new ATOM 0 HG2 LYS A 23 9.217 12.602 -6.466 1.00 0.00 H new ATOM 0 HG3 LYS A 23 8.680 13.151 -8.041 1.00 0.00 H new ATOM 0 HD2 LYS A 23 7.357 14.251 -5.542 1.00 0.00 H new ATOM 0 HD3 LYS A 23 8.903 14.891 -6.064 1.00 0.00 H new ATOM 0 HE2 LYS A 23 7.969 15.341 -8.337 1.00 0.00 H new ATOM 0 HE3 LYS A 23 6.430 14.659 -7.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 6.396 17.058 -7.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 6.207 16.411 -6.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 7.699 17.072 -6.665 1.00 0.00 H new ATOM 377 N THR A 24 7.309 11.284 -10.413 1.00 0.00 N ATOM 378 CA THR A 24 6.694 11.430 -11.714 1.00 0.00 C ATOM 379 C THR A 24 6.428 10.057 -12.346 1.00 0.00 C ATOM 380 O THR A 24 5.334 9.789 -12.842 1.00 0.00 O ATOM 381 CB THR A 24 7.636 12.292 -12.569 1.00 0.00 C ATOM 382 OG1 THR A 24 7.962 13.484 -11.876 1.00 0.00 O ATOM 383 CG2 THR A 24 6.965 12.663 -13.883 1.00 0.00 C ATOM 0 H THR A 24 8.324 11.189 -10.439 1.00 0.00 H new ATOM 0 HA THR A 24 5.723 11.918 -11.637 1.00 0.00 H new ATOM 0 HB THR A 24 8.540 11.717 -12.768 1.00 0.00 H new ATOM 0 HG1 THR A 24 8.745 13.328 -11.307 1.00 0.00 H new ATOM 0 HG21 THR A 24 7.644 13.274 -14.478 1.00 0.00 H new ATOM 0 HG22 THR A 24 6.716 11.756 -14.433 1.00 0.00 H new ATOM 0 HG23 THR A 24 6.054 13.226 -13.680 1.00 0.00 H new ATOM 391 N LEU A 25 7.434 9.185 -12.317 1.00 0.00 N ATOM 392 CA LEU A 25 7.484 7.917 -13.028 1.00 0.00 C ATOM 393 C LEU A 25 6.628 6.855 -12.357 1.00 0.00 C ATOM 394 O LEU A 25 5.939 6.093 -13.036 1.00 0.00 O ATOM 395 CB LEU A 25 8.933 7.406 -13.027 1.00 0.00 C ATOM 396 CG LEU A 25 9.937 8.241 -13.839 1.00 0.00 C ATOM 397 CD1 LEU A 25 11.333 7.722 -13.495 1.00 0.00 C ATOM 398 CD2 LEU A 25 9.674 8.133 -15.343 1.00 0.00 C ATOM 0 H LEU A 25 8.277 9.356 -11.768 1.00 0.00 H new ATOM 0 HA LEU A 25 7.109 8.090 -14.037 1.00 0.00 H new ATOM 0 HB2 LEU A 25 9.280 7.357 -11.995 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.939 6.387 -13.414 1.00 0.00 H new ATOM 0 HG LEU A 25 9.839 9.296 -13.585 1.00 0.00 H new ATOM 0 HD11 LEU A 25 12.079 8.289 -14.052 1.00 0.00 H new ATOM 0 HD12 LEU A 25 11.511 7.839 -12.426 1.00 0.00 H new ATOM 0 HD13 LEU A 25 11.405 6.668 -13.762 1.00 0.00 H new ATOM 0 HD21 LEU A 25 10.403 8.736 -15.884 1.00 0.00 H new ATOM 0 HD22 LEU A 25 9.762 7.092 -15.654 1.00 0.00 H new ATOM 0 HD23 LEU A 25 8.669 8.494 -15.564 1.00 0.00 H new ATOM 410 N GLY A 26 6.702 6.799 -11.028 1.00 0.00 N ATOM 411 CA GLY A 26 6.143 5.717 -10.240 1.00 0.00 C ATOM 412 C GLY A 26 5.074 6.135 -9.246 1.00 0.00 C ATOM 413 O GLY A 26 4.491 5.246 -8.623 1.00 0.00 O ATOM 0 H GLY A 26 7.160 7.517 -10.467 1.00 0.00 H new ATOM 0 HA2 GLY A 26 5.719 4.976 -10.917 1.00 0.00 H new ATOM 0 HA3 GLY A 26 6.951 5.227 -9.697 1.00 0.00 H new ATOM 417 N ALA A 27 4.793 7.432 -9.077 1.00 0.00 N ATOM 418 CA ALA A 27 3.630 7.868 -8.309 1.00 0.00 C ATOM 419 C ALA A 27 2.378 7.174 -8.867 1.00 0.00 C ATOM 420 O ALA A 27 1.967 7.440 -10.000 1.00 0.00 O ATOM 421 CB ALA A 27 3.506 9.396 -8.334 1.00 0.00 C ATOM 0 H ALA A 27 5.354 8.192 -9.461 1.00 0.00 H new ATOM 0 HA ALA A 27 3.745 7.583 -7.263 1.00 0.00 H new ATOM 0 HB1 ALA A 27 2.633 9.700 -7.756 1.00 0.00 H new ATOM 0 HB2 ALA A 27 4.401 9.841 -7.900 1.00 0.00 H new ATOM 0 HB3 ALA A 27 3.395 9.735 -9.364 1.00 0.00 H new ATOM 427 N GLY A 28 1.826 6.240 -8.088 1.00 0.00 N ATOM 428 CA GLY A 28 0.772 5.316 -8.505 1.00 0.00 C ATOM 429 C GLY A 28 1.050 3.892 -8.010 1.00 0.00 C ATOM 430 O GLY A 28 0.107 3.162 -7.697 1.00 0.00 O ATOM 0 H GLY A 28 2.111 6.103 -7.118 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -0.188 5.657 -8.117 1.00 0.00 H new ATOM 0 HA3 GLY A 28 0.695 5.316 -9.592 1.00 0.00 H new ATOM 434 N LYS A 29 2.330 3.515 -7.860 1.00 0.00 N ATOM 435 CA LYS A 29 2.764 2.265 -7.220 1.00 0.00 C ATOM 436 C LYS A 29 3.781 2.520 -6.117 1.00 0.00 C ATOM 437 O LYS A 29 3.906 1.684 -5.219 1.00 0.00 O ATOM 438 CB LYS A 29 3.327 1.248 -8.234 1.00 0.00 C ATOM 439 CG LYS A 29 4.661 1.644 -8.901 1.00 0.00 C ATOM 440 CD LYS A 29 4.505 2.418 -10.208 1.00 0.00 C ATOM 441 CE LYS A 29 4.088 1.469 -11.342 1.00 0.00 C ATOM 442 NZ LYS A 29 3.969 2.155 -12.654 1.00 0.00 N ATOM 0 H LYS A 29 3.109 4.085 -8.189 1.00 0.00 H new ATOM 0 HA LYS A 29 1.869 1.830 -6.774 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.464 0.293 -7.727 1.00 0.00 H new ATOM 0 HB3 LYS A 29 2.583 1.090 -9.015 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.238 2.248 -8.201 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.239 0.741 -9.094 1.00 0.00 H new ATOM 0 HD2 LYS A 29 3.758 3.202 -10.087 1.00 0.00 H new ATOM 0 HD3 LYS A 29 5.444 2.909 -10.462 1.00 0.00 H new ATOM 0 HE2 LYS A 29 4.819 0.664 -11.423 1.00 0.00 H new ATOM 0 HE3 LYS A 29 3.133 1.008 -11.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 3.686 1.467 -13.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 3.252 2.906 -12.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 4.886 2.573 -12.912 1.00 0.00 H new ATOM 456 N ILE A 30 4.473 3.663 -6.157 1.00 0.00 N ATOM 457 CA ILE A 30 5.421 4.046 -5.125 1.00 0.00 C ATOM 458 C ILE A 30 5.135 5.421 -4.536 1.00 0.00 C ATOM 459 O ILE A 30 4.535 6.283 -5.181 1.00 0.00 O ATOM 460 CB ILE A 30 6.881 3.977 -5.624 1.00 0.00 C ATOM 461 CG1 ILE A 30 7.134 4.772 -6.919 1.00 0.00 C ATOM 462 CG2 ILE A 30 7.328 2.525 -5.789 1.00 0.00 C ATOM 463 CD1 ILE A 30 8.599 5.175 -7.114 1.00 0.00 C ATOM 0 H ILE A 30 4.386 4.345 -6.911 1.00 0.00 H new ATOM 0 HA ILE A 30 5.292 3.314 -4.328 1.00 0.00 H new ATOM 0 HB ILE A 30 7.483 4.457 -4.853 1.00 0.00 H new ATOM 0 HG12 ILE A 30 6.814 4.173 -7.772 1.00 0.00 H new ATOM 0 HG13 ILE A 30 6.517 5.670 -6.911 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.359 2.500 -6.141 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.259 2.012 -4.830 1.00 0.00 H new ATOM 0 HG23 ILE A 30 6.685 2.026 -6.514 1.00 0.00 H new ATOM 0 HD11 ILE A 30 8.702 5.731 -8.046 1.00 0.00 H new ATOM 0 HD12 ILE A 30 8.918 5.801 -6.280 1.00 0.00 H new ATOM 0 HD13 ILE A 30 9.220 4.280 -7.155 1.00 0.00 H new ATOM 475 N ALA A 31 5.635 5.606 -3.315 1.00 0.00 N ATOM 476 CA ALA A 31 5.722 6.863 -2.593 1.00 0.00 C ATOM 477 C ALA A 31 7.203 7.033 -2.267 1.00 0.00 C ATOM 478 O ALA A 31 7.843 6.078 -1.824 1.00 0.00 O ATOM 479 CB ALA A 31 4.891 6.796 -1.307 1.00 0.00 C ATOM 0 H ALA A 31 6.013 4.828 -2.774 1.00 0.00 H new ATOM 0 HA ALA A 31 5.336 7.699 -3.175 1.00 0.00 H new ATOM 0 HB1 ALA A 31 4.965 7.745 -0.776 1.00 0.00 H new ATOM 0 HB2 ALA A 31 3.848 6.601 -1.557 1.00 0.00 H new ATOM 0 HB3 ALA A 31 5.268 5.994 -0.672 1.00 0.00 H new ATOM 485 N VAL A 32 7.757 8.218 -2.499 1.00 0.00 N ATOM 486 CA VAL A 32 9.185 8.458 -2.441 1.00 0.00 C ATOM 487 C VAL A 32 9.592 9.451 -1.348 1.00 0.00 C ATOM 488 O VAL A 32 8.797 10.287 -0.910 1.00 0.00 O ATOM 489 CB VAL A 32 9.598 8.917 -3.849 1.00 0.00 C ATOM 490 CG1 VAL A 32 8.741 10.033 -4.464 1.00 0.00 C ATOM 491 CG2 VAL A 32 11.063 9.335 -3.900 1.00 0.00 C ATOM 0 H VAL A 32 7.214 9.048 -2.736 1.00 0.00 H new ATOM 0 HA VAL A 32 9.711 7.546 -2.158 1.00 0.00 H new ATOM 0 HB VAL A 32 9.428 8.029 -4.458 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.120 10.278 -5.456 1.00 0.00 H new ATOM 0 HG12 VAL A 32 7.707 9.696 -4.544 1.00 0.00 H new ATOM 0 HG13 VAL A 32 8.786 10.918 -3.829 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.316 9.653 -4.912 1.00 0.00 H new ATOM 0 HG22 VAL A 32 11.230 10.160 -3.208 1.00 0.00 H new ATOM 0 HG23 VAL A 32 11.692 8.491 -3.617 1.00 0.00 H new ATOM 501 N THR A 33 10.859 9.363 -0.937 1.00 0.00 N ATOM 502 CA THR A 33 11.556 10.315 -0.101 1.00 0.00 C ATOM 503 C THR A 33 13.039 10.300 -0.512 1.00 0.00 C ATOM 504 O THR A 33 13.571 9.250 -0.880 1.00 0.00 O ATOM 505 CB THR A 33 11.410 9.925 1.385 1.00 0.00 C ATOM 506 OG1 THR A 33 10.081 9.564 1.730 1.00 0.00 O ATOM 507 CG2 THR A 33 11.841 11.047 2.332 1.00 0.00 C ATOM 0 H THR A 33 11.451 8.575 -1.200 1.00 0.00 H new ATOM 0 HA THR A 33 11.137 11.313 -0.229 1.00 0.00 H new ATOM 0 HB THR A 33 12.068 9.064 1.504 1.00 0.00 H new ATOM 0 HG1 THR A 33 10.088 9.052 2.566 1.00 0.00 H new ATOM 0 HG21 THR A 33 11.718 10.719 3.364 1.00 0.00 H new ATOM 0 HG22 THR A 33 12.887 11.293 2.152 1.00 0.00 H new ATOM 0 HG23 THR A 33 11.225 11.929 2.155 1.00 0.00 H new ATOM 515 N SER A 34 13.712 11.447 -0.453 1.00 0.00 N ATOM 516 CA SER A 34 15.152 11.587 -0.578 1.00 0.00 C ATOM 517 C SER A 34 15.708 12.120 0.746 1.00 0.00 C ATOM 518 O SER A 34 15.086 12.957 1.408 1.00 0.00 O ATOM 519 CB SER A 34 15.493 12.479 -1.772 1.00 0.00 C ATOM 520 OG SER A 34 14.845 13.733 -1.760 1.00 0.00 O ATOM 0 H SER A 34 13.243 12.341 -0.310 1.00 0.00 H new ATOM 0 HA SER A 34 15.621 10.622 -0.774 1.00 0.00 H new ATOM 0 HB2 SER A 34 16.571 12.640 -1.795 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.229 11.955 -2.690 1.00 0.00 H new ATOM 0 HG SER A 34 13.965 13.651 -2.184 1.00 0.00 H new ATOM 526 N CYS A 35 16.870 11.621 1.160 1.00 0.00 N ATOM 527 CA CYS A 35 17.482 11.845 2.455 1.00 0.00 C ATOM 528 C CYS A 35 18.989 11.751 2.247 1.00 0.00 C ATOM 529 O CYS A 35 19.471 11.556 1.125 1.00 0.00 O ATOM 530 CB CYS A 35 16.980 10.817 3.480 1.00 0.00 C ATOM 531 SG CYS A 35 15.386 11.365 4.149 1.00 0.00 S ATOM 0 H CYS A 35 17.436 11.017 0.564 1.00 0.00 H new ATOM 0 HA CYS A 35 17.217 12.824 2.856 1.00 0.00 H new ATOM 0 HB2 CYS A 35 16.873 9.840 3.009 1.00 0.00 H new ATOM 0 HB3 CYS A 35 17.706 10.705 4.285 1.00 0.00 H new ATOM 0 HG CYS A 35 14.818 12.177 3.308 1.00 0.00 H new ATOM 537 N GLY A 36 19.763 11.878 3.318 1.00 0.00 N ATOM 538 CA GLY A 36 21.185 11.661 3.213 1.00 0.00 C ATOM 539 C GLY A 36 21.854 11.493 4.552 1.00 0.00 C ATOM 540 O GLY A 36 21.237 11.744 5.591 1.00 0.00 O ATOM 0 H GLY A 36 19.430 12.126 4.250 1.00 0.00 H new ATOM 0 HA2 GLY A 36 21.368 10.773 2.607 1.00 0.00 H new ATOM 0 HA3 GLY A 36 21.638 12.503 2.690 1.00 0.00 H new ATOM 544 N LEU A 37 23.117 11.061 4.489 1.00 0.00 N ATOM 545 CA LEU A 37 23.955 10.823 5.669 1.00 0.00 C ATOM 546 C LEU A 37 24.044 12.084 6.529 1.00 0.00 C ATOM 547 O LEU A 37 24.050 12.007 7.757 1.00 0.00 O ATOM 548 CB LEU A 37 25.369 10.362 5.265 1.00 0.00 C ATOM 549 CG LEU A 37 25.489 8.851 4.997 1.00 0.00 C ATOM 550 CD1 LEU A 37 24.572 8.353 3.877 1.00 0.00 C ATOM 551 CD2 LEU A 37 26.938 8.482 4.670 1.00 0.00 C ATOM 0 H LEU A 37 23.592 10.864 3.608 1.00 0.00 H new ATOM 0 HA LEU A 37 23.488 10.029 6.251 1.00 0.00 H new ATOM 0 HB2 LEU A 37 25.673 10.903 4.369 1.00 0.00 H new ATOM 0 HB3 LEU A 37 26.068 10.636 6.056 1.00 0.00 H new ATOM 0 HG LEU A 37 25.168 8.357 5.914 1.00 0.00 H new ATOM 0 HD11 LEU A 37 24.710 7.280 3.744 1.00 0.00 H new ATOM 0 HD12 LEU A 37 23.534 8.555 4.140 1.00 0.00 H new ATOM 0 HD13 LEU A 37 24.818 8.869 2.949 1.00 0.00 H new ATOM 0 HD21 LEU A 37 27.007 7.410 4.483 1.00 0.00 H new ATOM 0 HD22 LEU A 37 27.261 9.027 3.783 1.00 0.00 H new ATOM 0 HD23 LEU A 37 27.579 8.746 5.511 1.00 0.00 H new ATOM 563 N GLU A 38 24.085 13.241 5.873 1.00 0.00 N ATOM 564 CA GLU A 38 23.957 14.558 6.464 1.00 0.00 C ATOM 565 C GLU A 38 23.326 15.441 5.384 1.00 0.00 C ATOM 566 O GLU A 38 23.495 15.185 4.186 1.00 0.00 O ATOM 567 CB GLU A 38 25.339 15.068 6.914 1.00 0.00 C ATOM 568 CG GLU A 38 25.332 16.456 7.573 1.00 0.00 C ATOM 569 CD GLU A 38 24.392 16.539 8.790 1.00 0.00 C ATOM 570 OE1 GLU A 38 23.175 16.755 8.596 1.00 0.00 O ATOM 571 OE2 GLU A 38 24.866 16.402 9.941 1.00 0.00 O ATOM 0 H GLU A 38 24.215 13.280 4.862 1.00 0.00 H new ATOM 0 HA GLU A 38 23.333 14.559 7.358 1.00 0.00 H new ATOM 0 HB2 GLU A 38 25.764 14.351 7.616 1.00 0.00 H new ATOM 0 HB3 GLU A 38 26.000 15.096 6.048 1.00 0.00 H new ATOM 0 HG2 GLU A 38 26.345 16.709 7.885 1.00 0.00 H new ATOM 0 HG3 GLU A 38 25.030 17.201 6.836 1.00 0.00 H new ATOM 578 N SER A 39 22.572 16.451 5.807 1.00 0.00 N ATOM 579 CA SER A 39 21.926 17.380 4.887 1.00 0.00 C ATOM 580 C SER A 39 22.868 18.503 4.441 1.00 0.00 C ATOM 581 O SER A 39 23.673 19.020 5.222 1.00 0.00 O ATOM 582 CB SER A 39 20.692 17.996 5.549 1.00 0.00 C ATOM 583 OG SER A 39 19.767 16.979 5.862 1.00 0.00 O ATOM 0 H SER A 39 22.392 16.648 6.792 1.00 0.00 H new ATOM 0 HA SER A 39 21.639 16.810 4.004 1.00 0.00 H new ATOM 0 HB2 SER A 39 20.981 18.530 6.454 1.00 0.00 H new ATOM 0 HB3 SER A 39 20.234 18.725 4.881 1.00 0.00 H new ATOM 0 HG SER A 39 19.607 16.969 6.829 1.00 0.00 H new ATOM 589 N SER A 40 22.668 18.924 3.196 1.00 0.00 N ATOM 590 CA SER A 40 23.221 20.099 2.538 1.00 0.00 C ATOM 591 C SER A 40 22.091 20.596 1.625 1.00 0.00 C ATOM 592 O SER A 40 21.173 19.826 1.320 1.00 0.00 O ATOM 593 CB SER A 40 24.478 19.743 1.728 1.00 0.00 C ATOM 594 OG SER A 40 25.489 19.173 2.548 1.00 0.00 O ATOM 0 H SER A 40 22.059 18.402 2.566 1.00 0.00 H new ATOM 0 HA SER A 40 23.538 20.860 3.251 1.00 0.00 H new ATOM 0 HB2 SER A 40 24.214 19.042 0.936 1.00 0.00 H new ATOM 0 HB3 SER A 40 24.865 20.640 1.244 1.00 0.00 H new ATOM 0 HG SER A 40 26.272 18.958 2.000 1.00 0.00 H new ATOM 600 N ARG A 41 22.088 21.870 1.218 1.00 0.00 N ATOM 601 CA ARG A 41 20.993 22.422 0.419 1.00 0.00 C ATOM 602 C ARG A 41 20.816 21.619 -0.868 1.00 0.00 C ATOM 603 O ARG A 41 21.796 21.135 -1.441 1.00 0.00 O ATOM 604 CB ARG A 41 21.213 23.923 0.136 1.00 0.00 C ATOM 605 CG ARG A 41 22.404 24.236 -0.788 1.00 0.00 C ATOM 606 CD ARG A 41 22.571 25.751 -0.966 1.00 0.00 C ATOM 607 NE ARG A 41 23.660 26.072 -1.907 1.00 0.00 N ATOM 608 CZ ARG A 41 24.964 26.182 -1.613 1.00 0.00 C ATOM 609 NH1 ARG A 41 25.401 26.001 -0.368 1.00 0.00 N ATOM 610 NH2 ARG A 41 25.832 26.475 -2.576 1.00 0.00 N ATOM 0 H ARG A 41 22.831 22.536 1.429 1.00 0.00 H new ATOM 0 HA ARG A 41 20.069 22.339 0.991 1.00 0.00 H new ATOM 0 HB2 ARG A 41 20.307 24.331 -0.311 1.00 0.00 H new ATOM 0 HB3 ARG A 41 21.361 24.440 1.084 1.00 0.00 H new ATOM 0 HG2 ARG A 41 23.316 23.812 -0.369 1.00 0.00 H new ATOM 0 HG3 ARG A 41 22.250 23.766 -1.759 1.00 0.00 H new ATOM 0 HD2 ARG A 41 21.637 26.180 -1.330 1.00 0.00 H new ATOM 0 HD3 ARG A 41 22.778 26.211 0.001 1.00 0.00 H new ATOM 0 HE ARG A 41 23.395 26.226 -2.880 1.00 0.00 H new ATOM 0 HH11 ARG A 41 24.741 25.776 0.376 1.00 0.00 H new ATOM 0 HH12 ARG A 41 26.396 26.088 -0.159 1.00 0.00 H new ATOM 0 HH21 ARG A 41 25.505 26.615 -3.532 1.00 0.00 H new ATOM 0 HH22 ARG A 41 26.825 26.560 -2.359 1.00 0.00 H new ATOM 624 N VAL A 42 19.573 21.494 -1.331 1.00 0.00 N ATOM 625 CA VAL A 42 19.326 20.956 -2.660 1.00 0.00 C ATOM 626 C VAL A 42 19.977 21.930 -3.648 1.00 0.00 C ATOM 627 O VAL A 42 19.881 23.153 -3.498 1.00 0.00 O ATOM 628 CB VAL A 42 17.835 20.660 -2.899 1.00 0.00 C ATOM 629 CG1 VAL A 42 16.885 21.821 -2.581 1.00 0.00 C ATOM 630 CG2 VAL A 42 17.606 20.175 -4.339 1.00 0.00 C ATOM 0 H VAL A 42 18.735 21.755 -0.811 1.00 0.00 H new ATOM 0 HA VAL A 42 19.778 19.974 -2.797 1.00 0.00 H new ATOM 0 HB VAL A 42 17.586 19.874 -2.186 1.00 0.00 H new ATOM 0 HG11 VAL A 42 15.858 21.516 -2.781 1.00 0.00 H new ATOM 0 HG12 VAL A 42 16.984 22.095 -1.531 1.00 0.00 H new ATOM 0 HG13 VAL A 42 17.137 22.678 -3.205 1.00 0.00 H new ATOM 0 HG21 VAL A 42 16.546 19.971 -4.490 1.00 0.00 H new ATOM 0 HG22 VAL A 42 17.930 20.946 -5.038 1.00 0.00 H new ATOM 0 HG23 VAL A 42 18.179 19.264 -4.512 1.00 0.00 H new ATOM 640 N HIS A 43 20.707 21.375 -4.608 1.00 0.00 N ATOM 641 CA HIS A 43 21.566 22.146 -5.490 1.00 0.00 C ATOM 642 C HIS A 43 20.730 22.829 -6.586 1.00 0.00 C ATOM 643 O HIS A 43 19.744 22.242 -7.036 1.00 0.00 O ATOM 644 CB HIS A 43 22.630 21.190 -6.030 1.00 0.00 C ATOM 645 CG HIS A 43 23.915 21.876 -6.400 1.00 0.00 C ATOM 646 ND1 HIS A 43 24.353 22.158 -7.670 1.00 0.00 N ATOM 647 CD2 HIS A 43 24.851 22.372 -5.530 1.00 0.00 C ATOM 648 CE1 HIS A 43 25.522 22.811 -7.571 1.00 0.00 C ATOM 649 NE2 HIS A 43 25.870 22.970 -6.283 1.00 0.00 N ATOM 0 H HIS A 43 20.718 20.372 -4.795 1.00 0.00 H new ATOM 0 HA HIS A 43 22.067 22.960 -4.966 1.00 0.00 H new ATOM 0 HB2 HIS A 43 22.837 20.427 -5.280 1.00 0.00 H new ATOM 0 HB3 HIS A 43 22.235 20.676 -6.907 1.00 0.00 H new ATOM 0 HD2 HIS A 43 24.810 22.312 -4.452 1.00 0.00 H new ATOM 0 HE1 HIS A 43 26.103 23.161 -8.412 1.00 0.00 H new ATOM 0 HE2 HIS A 43 26.706 23.432 -5.926 1.00 0.00 H new ATOM 657 N PRO A 44 21.078 24.047 -7.046 1.00 0.00 N ATOM 658 CA PRO A 44 20.193 24.813 -7.915 1.00 0.00 C ATOM 659 C PRO A 44 20.206 24.317 -9.358 1.00 0.00 C ATOM 660 O PRO A 44 19.149 24.194 -9.962 1.00 0.00 O ATOM 661 CB PRO A 44 20.661 26.265 -7.793 1.00 0.00 C ATOM 662 CG PRO A 44 22.151 26.139 -7.474 1.00 0.00 C ATOM 663 CD PRO A 44 22.245 24.837 -6.677 1.00 0.00 C ATOM 0 HA PRO A 44 19.152 24.702 -7.610 1.00 0.00 H new ATOM 0 HB2 PRO A 44 20.495 26.818 -8.717 1.00 0.00 H new ATOM 0 HB3 PRO A 44 20.126 26.793 -7.004 1.00 0.00 H new ATOM 0 HG2 PRO A 44 22.752 26.096 -8.382 1.00 0.00 H new ATOM 0 HG3 PRO A 44 22.509 26.990 -6.894 1.00 0.00 H new ATOM 0 HD2 PRO A 44 23.166 24.303 -6.911 1.00 0.00 H new ATOM 0 HD3 PRO A 44 22.256 25.037 -5.606 1.00 0.00 H new ATOM 671 N THR A 45 21.354 23.963 -9.930 1.00 0.00 N ATOM 672 CA THR A 45 21.392 23.488 -11.312 1.00 0.00 C ATOM 673 C THR A 45 20.598 22.183 -11.476 1.00 0.00 C ATOM 674 O THR A 45 20.043 21.937 -12.543 1.00 0.00 O ATOM 675 CB THR A 45 22.869 23.348 -11.713 1.00 0.00 C ATOM 676 OG1 THR A 45 23.536 24.577 -11.473 1.00 0.00 O ATOM 677 CG2 THR A 45 23.100 22.905 -13.158 1.00 0.00 C ATOM 0 H THR A 45 22.261 23.995 -9.465 1.00 0.00 H new ATOM 0 HA THR A 45 20.908 24.200 -11.980 1.00 0.00 H new ATOM 0 HB THR A 45 23.276 22.548 -11.095 1.00 0.00 H new ATOM 0 HG1 THR A 45 24.479 24.492 -11.726 1.00 0.00 H new ATOM 0 HG21 THR A 45 24.171 22.834 -13.350 1.00 0.00 H new ATOM 0 HG22 THR A 45 22.637 21.931 -13.319 1.00 0.00 H new ATOM 0 HG23 THR A 45 22.657 23.634 -13.837 1.00 0.00 H new ATOM 685 N ALA A 46 20.432 21.399 -10.402 1.00 0.00 N ATOM 686 CA ALA A 46 19.577 20.218 -10.382 1.00 0.00 C ATOM 687 C ALA A 46 18.180 20.529 -10.914 1.00 0.00 C ATOM 688 O ALA A 46 17.606 19.739 -11.665 1.00 0.00 O ATOM 689 CB ALA A 46 19.438 19.753 -8.935 1.00 0.00 C ATOM 0 H ALA A 46 20.898 21.576 -9.512 1.00 0.00 H new ATOM 0 HA ALA A 46 20.029 19.454 -11.014 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.801 18.869 -8.896 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.422 19.509 -8.535 1.00 0.00 H new ATOM 0 HB3 ALA A 46 18.991 20.548 -8.339 1.00 0.00 H new ATOM 695 N ILE A 47 17.652 21.699 -10.535 1.00 0.00 N ATOM 696 CA ILE A 47 16.341 22.156 -10.910 1.00 0.00 C ATOM 697 C ILE A 47 16.254 22.161 -12.440 1.00 0.00 C ATOM 698 O ILE A 47 15.272 21.694 -13.010 1.00 0.00 O ATOM 699 CB ILE A 47 16.135 23.572 -10.326 1.00 0.00 C ATOM 700 CG1 ILE A 47 16.284 23.630 -8.785 1.00 0.00 C ATOM 701 CG2 ILE A 47 14.768 24.106 -10.749 1.00 0.00 C ATOM 702 CD1 ILE A 47 16.518 25.055 -8.264 1.00 0.00 C ATOM 0 H ILE A 47 18.153 22.361 -9.942 1.00 0.00 H new ATOM 0 HA ILE A 47 15.559 21.504 -10.520 1.00 0.00 H new ATOM 0 HB ILE A 47 16.927 24.202 -10.731 1.00 0.00 H new ATOM 0 HG12 ILE A 47 15.386 23.222 -8.322 1.00 0.00 H new ATOM 0 HG13 ILE A 47 17.116 22.995 -8.481 1.00 0.00 H new ATOM 0 HG21 ILE A 47 14.624 25.105 -10.337 1.00 0.00 H new ATOM 0 HG22 ILE A 47 14.716 24.152 -11.837 1.00 0.00 H new ATOM 0 HG23 ILE A 47 13.987 23.443 -10.376 1.00 0.00 H new ATOM 0 HD11 ILE A 47 16.615 25.034 -7.179 1.00 0.00 H new ATOM 0 HD12 ILE A 47 17.431 25.457 -8.702 1.00 0.00 H new ATOM 0 HD13 ILE A 47 15.674 25.687 -8.541 1.00 0.00 H new ATOM 714 N ALA A 48 17.303 22.663 -13.097 1.00 0.00 N ATOM 715 CA ALA A 48 17.353 22.903 -14.517 1.00 0.00 C ATOM 716 C ALA A 48 17.338 21.584 -15.276 1.00 0.00 C ATOM 717 O ALA A 48 16.695 21.474 -16.313 1.00 0.00 O ATOM 718 CB ALA A 48 18.596 23.731 -14.861 1.00 0.00 C ATOM 0 H ALA A 48 18.169 22.919 -12.623 1.00 0.00 H new ATOM 0 HA ALA A 48 16.472 23.470 -14.818 1.00 0.00 H new ATOM 0 HB1 ALA A 48 18.628 23.909 -15.936 1.00 0.00 H new ATOM 0 HB2 ALA A 48 18.554 24.685 -14.336 1.00 0.00 H new ATOM 0 HB3 ALA A 48 19.491 23.188 -14.556 1.00 0.00 H new ATOM 724 N MET A 49 18.017 20.572 -14.744 1.00 0.00 N ATOM 725 CA MET A 49 18.071 19.245 -15.339 1.00 0.00 C ATOM 726 C MET A 49 16.698 18.560 -15.248 1.00 0.00 C ATOM 727 O MET A 49 16.192 17.935 -16.187 1.00 0.00 O ATOM 728 CB MET A 49 19.144 18.412 -14.636 1.00 0.00 C ATOM 729 CG MET A 49 20.390 19.154 -14.149 1.00 0.00 C ATOM 730 SD MET A 49 21.127 20.476 -15.172 1.00 0.00 S ATOM 731 CE MET A 49 21.401 19.639 -16.741 1.00 0.00 C ATOM 0 H MET A 49 18.550 20.653 -13.878 1.00 0.00 H new ATOM 0 HA MET A 49 18.331 19.334 -16.394 1.00 0.00 H new ATOM 0 HB2 MET A 49 18.684 17.922 -13.778 1.00 0.00 H new ATOM 0 HB3 MET A 49 19.464 17.625 -15.319 1.00 0.00 H new ATOM 0 HG2 MET A 49 20.148 19.591 -13.180 1.00 0.00 H new ATOM 0 HG3 MET A 49 21.165 18.407 -13.978 1.00 0.00 H new ATOM 0 HE1 MET A 49 22.420 19.826 -17.080 1.00 0.00 H new ATOM 0 HE2 MET A 49 21.252 18.567 -16.612 1.00 0.00 H new ATOM 0 HE3 MET A 49 20.697 20.017 -17.483 1.00 0.00 H new ATOM 741 N MET A 50 16.045 18.706 -14.101 1.00 0.00 N ATOM 742 CA MET A 50 14.703 18.183 -13.931 1.00 0.00 C ATOM 743 C MET A 50 13.735 18.936 -14.830 1.00 0.00 C ATOM 744 O MET A 50 12.861 18.309 -15.417 1.00 0.00 O ATOM 745 CB MET A 50 14.316 18.189 -12.457 1.00 0.00 C ATOM 746 CG MET A 50 15.211 17.157 -11.754 1.00 0.00 C ATOM 747 SD MET A 50 14.381 16.116 -10.542 1.00 0.00 S ATOM 748 CE MET A 50 13.233 15.259 -11.622 1.00 0.00 C ATOM 0 H MET A 50 16.424 19.180 -13.281 1.00 0.00 H new ATOM 0 HA MET A 50 14.661 17.140 -14.245 1.00 0.00 H new ATOM 0 HB2 MET A 50 14.457 19.180 -12.025 1.00 0.00 H new ATOM 0 HB3 MET A 50 13.263 17.934 -12.334 1.00 0.00 H new ATOM 0 HG2 MET A 50 15.662 16.516 -12.511 1.00 0.00 H new ATOM 0 HG3 MET A 50 16.025 17.685 -11.258 1.00 0.00 H new ATOM 0 HE1 MET A 50 12.214 15.561 -11.383 1.00 0.00 H new ATOM 0 HE2 MET A 50 13.452 15.511 -12.660 1.00 0.00 H new ATOM 0 HE3 MET A 50 13.335 14.183 -11.481 1.00 0.00 H new ATOM 758 N GLU A 51 13.951 20.230 -15.050 1.00 0.00 N ATOM 759 CA GLU A 51 13.209 20.985 -16.045 1.00 0.00 C ATOM 760 C GLU A 51 13.426 20.426 -17.458 1.00 0.00 C ATOM 761 O GLU A 51 12.506 20.498 -18.273 1.00 0.00 O ATOM 762 CB GLU A 51 13.590 22.467 -15.965 1.00 0.00 C ATOM 763 CG GLU A 51 12.782 23.223 -14.902 1.00 0.00 C ATOM 764 CD GLU A 51 13.075 24.733 -14.943 1.00 0.00 C ATOM 765 OE1 GLU A 51 14.174 25.166 -14.529 1.00 0.00 O ATOM 766 OE2 GLU A 51 12.198 25.510 -15.388 1.00 0.00 O ATOM 0 H GLU A 51 14.644 20.780 -14.543 1.00 0.00 H new ATOM 0 HA GLU A 51 12.145 20.887 -15.828 1.00 0.00 H new ATOM 0 HB2 GLU A 51 14.653 22.554 -15.739 1.00 0.00 H new ATOM 0 HB3 GLU A 51 13.431 22.933 -16.937 1.00 0.00 H new ATOM 0 HG2 GLU A 51 11.717 23.053 -15.063 1.00 0.00 H new ATOM 0 HG3 GLU A 51 13.022 22.831 -13.914 1.00 0.00 H new ATOM 773 N GLU A 52 14.580 19.811 -17.748 1.00 0.00 N ATOM 774 CA GLU A 52 14.814 19.135 -19.027 1.00 0.00 C ATOM 775 C GLU A 52 13.824 17.999 -19.218 1.00 0.00 C ATOM 776 O GLU A 52 13.295 17.820 -20.317 1.00 0.00 O ATOM 777 CB GLU A 52 16.227 18.552 -19.200 1.00 0.00 C ATOM 778 CG GLU A 52 17.317 19.610 -19.037 1.00 0.00 C ATOM 779 CD GLU A 52 18.706 19.082 -19.405 1.00 0.00 C ATOM 780 OE1 GLU A 52 19.112 18.012 -18.894 1.00 0.00 O ATOM 781 OE2 GLU A 52 19.403 19.749 -20.203 1.00 0.00 O ATOM 0 H GLU A 52 15.372 19.769 -17.106 1.00 0.00 H new ATOM 0 HA GLU A 52 14.688 19.919 -19.774 1.00 0.00 H new ATOM 0 HB2 GLU A 52 16.382 17.759 -18.469 1.00 0.00 H new ATOM 0 HB3 GLU A 52 16.311 18.097 -20.187 1.00 0.00 H new ATOM 0 HG2 GLU A 52 17.081 20.470 -19.664 1.00 0.00 H new ATOM 0 HG3 GLU A 52 17.327 19.961 -18.005 1.00 0.00 H new ATOM 788 N VAL A 53 13.556 17.253 -18.144 1.00 0.00 N ATOM 789 CA VAL A 53 12.593 16.155 -18.196 1.00 0.00 C ATOM 790 C VAL A 53 11.174 16.602 -17.791 1.00 0.00 C ATOM 791 O VAL A 53 10.264 15.775 -17.714 1.00 0.00 O ATOM 792 CB VAL A 53 13.142 14.934 -17.441 1.00 0.00 C ATOM 793 CG1 VAL A 53 14.285 14.282 -18.236 1.00 0.00 C ATOM 794 CG2 VAL A 53 13.633 15.242 -16.027 1.00 0.00 C ATOM 0 H VAL A 53 13.991 17.390 -17.232 1.00 0.00 H new ATOM 0 HA VAL A 53 12.468 15.832 -19.229 1.00 0.00 H new ATOM 0 HB VAL A 53 12.298 14.252 -17.342 1.00 0.00 H new ATOM 0 HG11 VAL A 53 14.663 13.419 -17.688 1.00 0.00 H new ATOM 0 HG12 VAL A 53 13.914 13.960 -19.209 1.00 0.00 H new ATOM 0 HG13 VAL A 53 15.089 15.004 -18.375 1.00 0.00 H new ATOM 0 HG21 VAL A 53 14.004 14.328 -15.564 1.00 0.00 H new ATOM 0 HG22 VAL A 53 14.436 15.977 -16.073 1.00 0.00 H new ATOM 0 HG23 VAL A 53 12.809 15.641 -15.435 1.00 0.00 H new ATOM 804 N GLY A 54 10.954 17.907 -17.597 1.00 0.00 N ATOM 805 CA GLY A 54 9.633 18.494 -17.398 1.00 0.00 C ATOM 806 C GLY A 54 9.156 18.390 -15.949 1.00 0.00 C ATOM 807 O GLY A 54 7.948 18.371 -15.704 1.00 0.00 O ATOM 0 H GLY A 54 11.707 18.595 -17.574 1.00 0.00 H new ATOM 0 HA2 GLY A 54 9.657 19.543 -17.694 1.00 0.00 H new ATOM 0 HA3 GLY A 54 8.916 17.995 -18.050 1.00 0.00 H new ATOM 811 N ILE A 55 10.088 18.299 -14.998 1.00 0.00 N ATOM 812 CA ILE A 55 9.827 18.197 -13.564 1.00 0.00 C ATOM 813 C ILE A 55 10.581 19.361 -12.879 1.00 0.00 C ATOM 814 O ILE A 55 11.138 20.231 -13.550 1.00 0.00 O ATOM 815 CB ILE A 55 10.214 16.773 -13.079 1.00 0.00 C ATOM 816 CG1 ILE A 55 9.638 15.634 -13.966 1.00 0.00 C ATOM 817 CG2 ILE A 55 9.752 16.499 -11.629 1.00 0.00 C ATOM 818 CD1 ILE A 55 10.510 14.380 -13.906 1.00 0.00 C ATOM 0 H ILE A 55 11.084 18.294 -15.216 1.00 0.00 H new ATOM 0 HA ILE A 55 8.774 18.306 -13.304 1.00 0.00 H new ATOM 0 HB ILE A 55 11.302 16.765 -13.144 1.00 0.00 H new ATOM 0 HG12 ILE A 55 8.627 15.391 -13.637 1.00 0.00 H new ATOM 0 HG13 ILE A 55 9.564 15.977 -14.998 1.00 0.00 H new ATOM 0 HG21 ILE A 55 10.047 15.491 -11.338 1.00 0.00 H new ATOM 0 HG22 ILE A 55 10.216 17.221 -10.957 1.00 0.00 H new ATOM 0 HG23 ILE A 55 8.668 16.592 -11.569 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.077 13.605 -14.538 1.00 0.00 H new ATOM 0 HD12 ILE A 55 11.513 14.617 -14.259 1.00 0.00 H new ATOM 0 HD13 ILE A 55 10.563 14.022 -12.878 1.00 0.00 H new ATOM 830 N ASP A 56 10.584 19.424 -11.548 1.00 0.00 N ATOM 831 CA ASP A 56 11.183 20.490 -10.748 1.00 0.00 C ATOM 832 C ASP A 56 11.678 19.910 -9.418 1.00 0.00 C ATOM 833 O ASP A 56 11.144 18.899 -8.954 1.00 0.00 O ATOM 834 CB ASP A 56 10.115 21.560 -10.466 1.00 0.00 C ATOM 835 CG ASP A 56 10.576 22.530 -9.374 1.00 0.00 C ATOM 836 OD1 ASP A 56 11.623 23.186 -9.567 1.00 0.00 O ATOM 837 OD2 ASP A 56 9.951 22.574 -8.293 1.00 0.00 O ATOM 0 H ASP A 56 10.150 18.702 -10.973 1.00 0.00 H new ATOM 0 HA ASP A 56 12.021 20.932 -11.288 1.00 0.00 H new ATOM 0 HB2 ASP A 56 9.901 22.113 -11.380 1.00 0.00 H new ATOM 0 HB3 ASP A 56 9.186 21.078 -10.160 1.00 0.00 H new ATOM 842 N ILE A 57 12.658 20.574 -8.794 1.00 0.00 N ATOM 843 CA ILE A 57 13.101 20.292 -7.428 1.00 0.00 C ATOM 844 C ILE A 57 13.136 21.554 -6.552 1.00 0.00 C ATOM 845 O ILE A 57 13.178 21.427 -5.331 1.00 0.00 O ATOM 846 CB ILE A 57 14.459 19.553 -7.371 1.00 0.00 C ATOM 847 CG1 ILE A 57 14.971 18.963 -8.693 1.00 0.00 C ATOM 848 CG2 ILE A 57 14.368 18.446 -6.310 1.00 0.00 C ATOM 849 CD1 ILE A 57 16.343 18.309 -8.516 1.00 0.00 C ATOM 0 H ILE A 57 13.173 21.336 -9.234 1.00 0.00 H new ATOM 0 HA ILE A 57 12.349 19.618 -7.018 1.00 0.00 H new ATOM 0 HB ILE A 57 15.194 20.317 -7.119 1.00 0.00 H new ATOM 0 HG12 ILE A 57 14.259 18.225 -9.064 1.00 0.00 H new ATOM 0 HG13 ILE A 57 15.035 19.750 -9.444 1.00 0.00 H new ATOM 0 HG21 ILE A 57 15.318 17.914 -6.257 1.00 0.00 H new ATOM 0 HG22 ILE A 57 14.145 18.890 -5.340 1.00 0.00 H new ATOM 0 HG23 ILE A 57 13.576 17.748 -6.580 1.00 0.00 H new ATOM 0 HD11 ILE A 57 16.677 17.901 -9.470 1.00 0.00 H new ATOM 0 HD12 ILE A 57 17.059 19.054 -8.169 1.00 0.00 H new ATOM 0 HD13 ILE A 57 16.271 17.505 -7.783 1.00 0.00 H new ATOM 861 N SER A 58 13.088 22.760 -7.130 1.00 0.00 N ATOM 862 CA SER A 58 13.043 24.014 -6.374 1.00 0.00 C ATOM 863 C SER A 58 11.914 24.033 -5.323 1.00 0.00 C ATOM 864 O SER A 58 12.058 24.662 -4.272 1.00 0.00 O ATOM 865 CB SER A 58 12.927 25.210 -7.332 1.00 0.00 C ATOM 866 OG SER A 58 11.710 25.248 -8.046 1.00 0.00 O ATOM 0 H SER A 58 13.079 22.892 -8.141 1.00 0.00 H new ATOM 0 HA SER A 58 13.979 24.093 -5.822 1.00 0.00 H new ATOM 0 HB2 SER A 58 13.033 26.133 -6.762 1.00 0.00 H new ATOM 0 HB3 SER A 58 13.754 25.178 -8.042 1.00 0.00 H new ATOM 0 HG SER A 58 11.763 24.643 -8.815 1.00 0.00 H new ATOM 872 N GLY A 59 10.801 23.336 -5.591 1.00 0.00 N ATOM 873 CA GLY A 59 9.628 23.284 -4.731 1.00 0.00 C ATOM 874 C GLY A 59 9.787 22.376 -3.506 1.00 0.00 C ATOM 875 O GLY A 59 8.904 22.388 -2.645 1.00 0.00 O ATOM 0 H GLY A 59 10.697 22.779 -6.439 1.00 0.00 H new ATOM 0 HA2 GLY A 59 9.394 24.294 -4.393 1.00 0.00 H new ATOM 0 HA3 GLY A 59 8.776 22.939 -5.317 1.00 0.00 H new ATOM 879 N GLN A 60 10.878 21.608 -3.397 1.00 0.00 N ATOM 880 CA GLN A 60 11.176 20.736 -2.274 1.00 0.00 C ATOM 881 C GLN A 60 12.538 21.074 -1.657 1.00 0.00 C ATOM 882 O GLN A 60 13.284 21.908 -2.175 1.00 0.00 O ATOM 883 CB GLN A 60 11.046 19.264 -2.705 1.00 0.00 C ATOM 884 CG GLN A 60 12.116 18.759 -3.685 1.00 0.00 C ATOM 885 CD GLN A 60 12.039 17.249 -3.938 1.00 0.00 C ATOM 886 OE1 GLN A 60 10.968 16.680 -4.135 1.00 0.00 O ATOM 887 NE2 GLN A 60 13.175 16.569 -3.960 1.00 0.00 N ATOM 0 H GLN A 60 11.598 21.582 -4.119 1.00 0.00 H new ATOM 0 HA GLN A 60 10.446 20.901 -1.481 1.00 0.00 H new ATOM 0 HB2 GLN A 60 11.074 18.639 -1.812 1.00 0.00 H new ATOM 0 HB3 GLN A 60 10.066 19.124 -3.162 1.00 0.00 H new ATOM 0 HG2 GLN A 60 12.008 19.286 -4.633 1.00 0.00 H new ATOM 0 HG3 GLN A 60 13.103 19.005 -3.294 1.00 0.00 H new ATOM 0 HE21 GLN A 60 14.060 17.049 -3.795 1.00 0.00 H new ATOM 0 HE22 GLN A 60 13.165 15.565 -4.141 1.00 0.00 H new ATOM 896 N THR A 61 12.855 20.423 -0.540 1.00 0.00 N ATOM 897 CA THR A 61 14.028 20.690 0.281 1.00 0.00 C ATOM 898 C THR A 61 14.805 19.399 0.553 1.00 0.00 C ATOM 899 O THR A 61 14.371 18.294 0.203 1.00 0.00 O ATOM 900 CB THR A 61 13.557 21.374 1.583 1.00 0.00 C ATOM 901 OG1 THR A 61 12.457 20.694 2.171 1.00 0.00 O ATOM 902 CG2 THR A 61 13.091 22.798 1.284 1.00 0.00 C ATOM 0 H THR A 61 12.279 19.667 -0.170 1.00 0.00 H new ATOM 0 HA THR A 61 14.716 21.356 -0.240 1.00 0.00 H new ATOM 0 HB THR A 61 14.405 21.363 2.267 1.00 0.00 H new ATOM 0 HG1 THR A 61 12.189 21.155 2.993 1.00 0.00 H new ATOM 0 HG21 THR A 61 12.760 23.274 2.207 1.00 0.00 H new ATOM 0 HG22 THR A 61 13.916 23.369 0.857 1.00 0.00 H new ATOM 0 HG23 THR A 61 12.264 22.769 0.574 1.00 0.00 H new ATOM 910 N SER A 62 15.964 19.536 1.190 1.00 0.00 N ATOM 911 CA SER A 62 16.765 18.430 1.679 1.00 0.00 C ATOM 912 C SER A 62 16.481 18.191 3.167 1.00 0.00 C ATOM 913 O SER A 62 16.083 19.100 3.901 1.00 0.00 O ATOM 914 CB SER A 62 18.229 18.741 1.368 1.00 0.00 C ATOM 915 OG SER A 62 18.577 20.065 1.724 1.00 0.00 O ATOM 0 H SER A 62 16.379 20.447 1.383 1.00 0.00 H new ATOM 0 HA SER A 62 16.510 17.494 1.182 1.00 0.00 H new ATOM 0 HB2 SER A 62 18.870 18.041 1.904 1.00 0.00 H new ATOM 0 HB3 SER A 62 18.413 18.591 0.304 1.00 0.00 H new ATOM 0 HG SER A 62 19.481 20.263 1.402 1.00 0.00 H new ATOM 921 N ASP A 63 16.652 16.940 3.592 1.00 0.00 N ATOM 922 CA ASP A 63 16.284 16.436 4.917 1.00 0.00 C ATOM 923 C ASP A 63 17.235 15.295 5.307 1.00 0.00 C ATOM 924 O ASP A 63 17.709 14.596 4.400 1.00 0.00 O ATOM 925 CB ASP A 63 14.842 15.903 4.855 1.00 0.00 C ATOM 926 CG ASP A 63 14.126 16.029 6.204 1.00 0.00 C ATOM 927 OD1 ASP A 63 13.927 17.168 6.684 1.00 0.00 O ATOM 928 OD2 ASP A 63 13.716 14.994 6.765 1.00 0.00 O ATOM 0 H ASP A 63 17.067 16.220 3.000 1.00 0.00 H new ATOM 0 HA ASP A 63 16.355 17.234 5.657 1.00 0.00 H new ATOM 0 HB2 ASP A 63 14.285 16.452 4.096 1.00 0.00 H new ATOM 0 HB3 ASP A 63 14.855 14.857 4.547 1.00 0.00 H new ATOM 933 N PRO A 64 17.552 15.080 6.597 1.00 0.00 N ATOM 934 CA PRO A 64 18.493 14.043 6.997 1.00 0.00 C ATOM 935 C PRO A 64 17.793 12.685 7.113 1.00 0.00 C ATOM 936 O PRO A 64 16.620 12.599 7.484 1.00 0.00 O ATOM 937 CB PRO A 64 19.040 14.507 8.351 1.00 0.00 C ATOM 938 CG PRO A 64 17.869 15.279 8.957 1.00 0.00 C ATOM 939 CD PRO A 64 17.198 15.915 7.738 1.00 0.00 C ATOM 0 HA PRO A 64 19.290 13.906 6.266 1.00 0.00 H new ATOM 0 HB2 PRO A 64 19.333 13.664 8.977 1.00 0.00 H new ATOM 0 HB3 PRO A 64 19.921 15.138 8.234 1.00 0.00 H new ATOM 0 HG2 PRO A 64 17.187 14.619 9.493 1.00 0.00 H new ATOM 0 HG3 PRO A 64 18.209 16.032 9.668 1.00 0.00 H new ATOM 0 HD2 PRO A 64 16.117 15.959 7.868 1.00 0.00 H new ATOM 0 HD3 PRO A 64 17.543 16.939 7.593 1.00 0.00 H new ATOM 947 N ILE A 65 18.555 11.608 6.891 1.00 0.00 N ATOM 948 CA ILE A 65 18.096 10.234 7.125 1.00 0.00 C ATOM 949 C ILE A 65 17.587 10.053 8.567 1.00 0.00 C ATOM 950 O ILE A 65 16.642 9.305 8.818 1.00 0.00 O ATOM 951 CB ILE A 65 19.222 9.255 6.748 1.00 0.00 C ATOM 952 CG1 ILE A 65 18.648 7.830 6.698 1.00 0.00 C ATOM 953 CG2 ILE A 65 20.463 9.343 7.662 1.00 0.00 C ATOM 954 CD1 ILE A 65 19.611 6.873 6.008 1.00 0.00 C ATOM 0 H ILE A 65 19.512 11.665 6.542 1.00 0.00 H new ATOM 0 HA ILE A 65 17.240 10.015 6.487 1.00 0.00 H new ATOM 0 HB ILE A 65 19.591 9.541 5.763 1.00 0.00 H new ATOM 0 HG12 ILE A 65 18.447 7.480 7.711 1.00 0.00 H new ATOM 0 HG13 ILE A 65 17.696 7.837 6.168 1.00 0.00 H new ATOM 0 HG21 ILE A 65 21.211 8.622 7.331 1.00 0.00 H new ATOM 0 HG22 ILE A 65 20.881 10.348 7.612 1.00 0.00 H new ATOM 0 HG23 ILE A 65 20.175 9.121 8.689 1.00 0.00 H new ATOM 0 HD11 ILE A 65 19.178 5.873 5.988 1.00 0.00 H new ATOM 0 HD12 ILE A 65 19.791 7.211 4.988 1.00 0.00 H new ATOM 0 HD13 ILE A 65 20.554 6.849 6.554 1.00 0.00 H new ATOM 966 N GLU A 66 18.188 10.809 9.490 1.00 0.00 N ATOM 967 CA GLU A 66 17.929 10.859 10.924 1.00 0.00 C ATOM 968 C GLU A 66 16.438 11.048 11.240 1.00 0.00 C ATOM 969 O GLU A 66 15.967 10.626 12.297 1.00 0.00 O ATOM 970 CB GLU A 66 18.726 12.034 11.523 1.00 0.00 C ATOM 971 CG GLU A 66 20.248 11.932 11.316 1.00 0.00 C ATOM 972 CD GLU A 66 20.906 10.950 12.303 1.00 0.00 C ATOM 973 OE1 GLU A 66 20.980 9.737 12.007 1.00 0.00 O ATOM 974 OE2 GLU A 66 21.370 11.386 13.382 1.00 0.00 O ATOM 0 H GLU A 66 18.931 11.456 9.226 1.00 0.00 H new ATOM 0 HA GLU A 66 18.237 9.908 11.359 1.00 0.00 H new ATOM 0 HB2 GLU A 66 18.371 12.964 11.078 1.00 0.00 H new ATOM 0 HB3 GLU A 66 18.519 12.092 12.592 1.00 0.00 H new ATOM 0 HG2 GLU A 66 20.453 11.610 10.295 1.00 0.00 H new ATOM 0 HG3 GLU A 66 20.696 12.919 11.435 1.00 0.00 H new ATOM 981 N ASN A 67 15.702 11.709 10.338 1.00 0.00 N ATOM 982 CA ASN A 67 14.317 12.113 10.546 1.00 0.00 C ATOM 983 C ASN A 67 13.312 10.993 10.227 1.00 0.00 C ATOM 984 O ASN A 67 12.116 11.174 10.461 1.00 0.00 O ATOM 985 CB ASN A 67 14.051 13.362 9.694 1.00 0.00 C ATOM 986 CG ASN A 67 12.735 14.066 10.020 1.00 0.00 C ATOM 987 OD1 ASN A 67 12.250 14.066 11.150 1.00 0.00 O ATOM 988 ND2 ASN A 67 12.162 14.737 9.039 1.00 0.00 N ATOM 0 H ASN A 67 16.066 11.981 9.425 1.00 0.00 H new ATOM 0 HA ASN A 67 14.173 12.337 11.603 1.00 0.00 H new ATOM 0 HB2 ASN A 67 14.872 14.066 9.832 1.00 0.00 H new ATOM 0 HB3 ASN A 67 14.049 13.078 8.642 1.00 0.00 H new ATOM 0 HD21 ASN A 67 11.306 15.264 9.213 1.00 0.00 H new ATOM 0 HD22 ASN A 67 12.575 14.729 8.106 1.00 0.00 H new ATOM 995 N PHE A 68 13.751 9.834 9.715 1.00 0.00 N ATOM 996 CA PHE A 68 12.880 8.724 9.350 1.00 0.00 C ATOM 997 C PHE A 68 13.378 7.408 9.966 1.00 0.00 C ATOM 998 O PHE A 68 14.370 7.371 10.698 1.00 0.00 O ATOM 999 CB PHE A 68 12.816 8.638 7.819 1.00 0.00 C ATOM 1000 CG PHE A 68 12.122 9.799 7.138 1.00 0.00 C ATOM 1001 CD1 PHE A 68 12.850 10.940 6.751 1.00 0.00 C ATOM 1002 CD2 PHE A 68 10.742 9.723 6.873 1.00 0.00 C ATOM 1003 CE1 PHE A 68 12.192 12.007 6.117 1.00 0.00 C ATOM 1004 CE2 PHE A 68 10.083 10.799 6.251 1.00 0.00 C ATOM 1005 CZ PHE A 68 10.808 11.944 5.877 1.00 0.00 C ATOM 0 H PHE A 68 14.739 9.646 9.543 1.00 0.00 H new ATOM 0 HA PHE A 68 11.878 8.896 9.744 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.832 8.565 7.432 1.00 0.00 H new ATOM 0 HB3 PHE A 68 12.303 7.716 7.544 1.00 0.00 H new ATOM 0 HD1 PHE A 68 13.912 10.995 6.941 1.00 0.00 H new ATOM 0 HD2 PHE A 68 10.188 8.837 7.148 1.00 0.00 H new ATOM 0 HE1 PHE A 68 12.751 12.879 5.813 1.00 0.00 H new ATOM 0 HE2 PHE A 68 9.021 10.746 6.061 1.00 0.00 H new ATOM 0 HZ PHE A 68 10.303 12.774 5.406 1.00 0.00 H new ATOM 1015 N ASN A 69 12.681 6.320 9.634 1.00 0.00 N ATOM 1016 CA ASN A 69 12.997 4.935 9.970 1.00 0.00 C ATOM 1017 C ASN A 69 12.902 4.121 8.686 1.00 0.00 C ATOM 1018 O ASN A 69 11.969 4.317 7.906 1.00 0.00 O ATOM 1019 CB ASN A 69 12.034 4.365 11.037 1.00 0.00 C ATOM 1020 CG ASN A 69 10.559 4.772 10.931 1.00 0.00 C ATOM 1021 OD1 ASN A 69 9.920 5.042 11.945 1.00 0.00 O ATOM 1022 ND2 ASN A 69 9.972 4.844 9.746 1.00 0.00 N ATOM 0 H ASN A 69 11.823 6.390 9.086 1.00 0.00 H new ATOM 0 HA ASN A 69 13.999 4.884 10.396 1.00 0.00 H new ATOM 0 HB2 ASN A 69 12.089 3.277 10.997 1.00 0.00 H new ATOM 0 HB3 ASN A 69 12.399 4.667 12.019 1.00 0.00 H new ATOM 0 HD21 ASN A 69 8.993 5.123 9.678 1.00 0.00 H new ATOM 0 HD22 ASN A 69 10.499 4.621 8.902 1.00 0.00 H new ATOM 1029 N ALA A 70 13.828 3.189 8.488 1.00 0.00 N ATOM 1030 CA ALA A 70 13.905 2.343 7.305 1.00 0.00 C ATOM 1031 C ALA A 70 12.747 1.357 7.239 1.00 0.00 C ATOM 1032 O ALA A 70 12.385 0.929 6.150 1.00 0.00 O ATOM 1033 CB ALA A 70 15.205 1.537 7.323 1.00 0.00 C ATOM 0 H ALA A 70 14.566 2.997 9.166 1.00 0.00 H new ATOM 0 HA ALA A 70 13.865 3.002 6.438 1.00 0.00 H new ATOM 0 HB1 ALA A 70 15.255 0.907 6.435 1.00 0.00 H new ATOM 0 HB2 ALA A 70 16.056 2.219 7.333 1.00 0.00 H new ATOM 0 HB3 ALA A 70 15.232 0.910 8.214 1.00 0.00 H new ATOM 1039 N ASP A 71 12.178 0.989 8.391 1.00 0.00 N ATOM 1040 CA ASP A 71 11.180 -0.073 8.510 1.00 0.00 C ATOM 1041 C ASP A 71 9.927 0.211 7.678 1.00 0.00 C ATOM 1042 O ASP A 71 9.217 -0.715 7.282 1.00 0.00 O ATOM 1043 CB ASP A 71 10.803 -0.248 9.986 1.00 0.00 C ATOM 1044 CG ASP A 71 9.743 -1.346 10.179 1.00 0.00 C ATOM 1045 OD1 ASP A 71 10.072 -2.544 10.025 1.00 0.00 O ATOM 1046 OD2 ASP A 71 8.588 -1.023 10.537 1.00 0.00 O ATOM 0 H ASP A 71 12.404 1.430 9.282 1.00 0.00 H new ATOM 0 HA ASP A 71 11.620 -0.991 8.121 1.00 0.00 H new ATOM 0 HB2 ASP A 71 11.694 -0.498 10.562 1.00 0.00 H new ATOM 0 HB3 ASP A 71 10.424 0.696 10.379 1.00 0.00 H new ATOM 1051 N ASP A 72 9.658 1.490 7.394 1.00 0.00 N ATOM 1052 CA ASP A 72 8.480 1.924 6.667 1.00 0.00 C ATOM 1053 C ASP A 72 8.746 1.962 5.160 1.00 0.00 C ATOM 1054 O ASP A 72 7.802 2.047 4.378 1.00 0.00 O ATOM 1055 CB ASP A 72 8.036 3.292 7.200 1.00 0.00 C ATOM 1056 CG ASP A 72 6.641 3.705 6.703 1.00 0.00 C ATOM 1057 OD1 ASP A 72 5.691 2.892 6.767 1.00 0.00 O ATOM 1058 OD2 ASP A 72 6.472 4.889 6.335 1.00 0.00 O ATOM 0 H ASP A 72 10.269 2.259 7.671 1.00 0.00 H new ATOM 0 HA ASP A 72 7.673 1.208 6.824 1.00 0.00 H new ATOM 0 HB2 ASP A 72 8.035 3.269 8.290 1.00 0.00 H new ATOM 0 HB3 ASP A 72 8.762 4.047 6.898 1.00 0.00 H new ATOM 1063 N TYR A 73 10.015 1.873 4.740 1.00 0.00 N ATOM 1064 CA TYR A 73 10.440 1.883 3.360 1.00 0.00 C ATOM 1065 C TYR A 73 10.577 0.451 2.851 1.00 0.00 C ATOM 1066 O TYR A 73 11.162 -0.407 3.512 1.00 0.00 O ATOM 1067 CB TYR A 73 11.726 2.707 3.204 1.00 0.00 C ATOM 1068 CG TYR A 73 11.490 4.188 3.448 1.00 0.00 C ATOM 1069 CD1 TYR A 73 11.061 5.008 2.391 1.00 0.00 C ATOM 1070 CD2 TYR A 73 11.642 4.737 4.734 1.00 0.00 C ATOM 1071 CE1 TYR A 73 10.749 6.357 2.621 1.00 0.00 C ATOM 1072 CE2 TYR A 73 11.350 6.093 4.983 1.00 0.00 C ATOM 1073 CZ TYR A 73 10.874 6.901 3.919 1.00 0.00 C ATOM 1074 OH TYR A 73 10.561 8.205 4.134 1.00 0.00 O ATOM 0 H TYR A 73 10.796 1.789 5.391 1.00 0.00 H new ATOM 0 HA TYR A 73 9.687 2.369 2.741 1.00 0.00 H new ATOM 0 HB2 TYR A 73 12.478 2.340 3.903 1.00 0.00 H new ATOM 0 HB3 TYR A 73 12.127 2.565 2.201 1.00 0.00 H new ATOM 0 HD1 TYR A 73 10.971 4.598 1.396 1.00 0.00 H new ATOM 0 HD2 TYR A 73 11.988 4.110 5.543 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.413 6.980 1.805 1.00 0.00 H new ATOM 0 HE2 TYR A 73 11.487 6.511 5.970 1.00 0.00 H new ATOM 0 HH TYR A 73 10.700 8.423 5.079 1.00 0.00 H new ATOM 1084 N ASP A 74 10.024 0.190 1.666 1.00 0.00 N ATOM 1085 CA ASP A 74 10.172 -1.092 0.990 1.00 0.00 C ATOM 1086 C ASP A 74 11.571 -1.195 0.388 1.00 0.00 C ATOM 1087 O ASP A 74 12.237 -2.221 0.525 1.00 0.00 O ATOM 1088 CB ASP A 74 9.140 -1.239 -0.129 1.00 0.00 C ATOM 1089 CG ASP A 74 9.276 -2.613 -0.805 1.00 0.00 C ATOM 1090 OD1 ASP A 74 8.672 -3.584 -0.298 1.00 0.00 O ATOM 1091 OD2 ASP A 74 9.950 -2.707 -1.853 1.00 0.00 O ATOM 0 H ASP A 74 9.460 0.865 1.150 1.00 0.00 H new ATOM 0 HA ASP A 74 10.017 -1.884 1.722 1.00 0.00 H new ATOM 0 HB2 ASP A 74 8.135 -1.124 0.277 1.00 0.00 H new ATOM 0 HB3 ASP A 74 9.278 -0.448 -0.866 1.00 0.00 H new ATOM 1096 N VAL A 75 12.039 -0.101 -0.222 1.00 0.00 N ATOM 1097 CA VAL A 75 13.248 -0.100 -1.029 1.00 0.00 C ATOM 1098 C VAL A 75 14.136 1.073 -0.653 1.00 0.00 C ATOM 1099 O VAL A 75 13.658 2.191 -0.454 1.00 0.00 O ATOM 1100 CB VAL A 75 12.870 -0.173 -2.524 1.00 0.00 C ATOM 1101 CG1 VAL A 75 11.683 0.664 -3.001 1.00 0.00 C ATOM 1102 CG2 VAL A 75 14.066 0.060 -3.460 1.00 0.00 C ATOM 0 H VAL A 75 11.582 0.809 -0.165 1.00 0.00 H new ATOM 0 HA VAL A 75 13.850 -0.986 -0.826 1.00 0.00 H new ATOM 0 HB VAL A 75 12.528 -1.206 -2.589 1.00 0.00 H new ATOM 0 HG11 VAL A 75 11.537 0.512 -4.070 1.00 0.00 H new ATOM 0 HG12 VAL A 75 10.784 0.359 -2.465 1.00 0.00 H new ATOM 0 HG13 VAL A 75 11.881 1.719 -2.808 1.00 0.00 H new ATOM 0 HG21 VAL A 75 13.735 -0.004 -4.496 1.00 0.00 H new ATOM 0 HG22 VAL A 75 14.487 1.048 -3.274 1.00 0.00 H new ATOM 0 HG23 VAL A 75 14.826 -0.699 -3.275 1.00 0.00 H new ATOM 1112 N VAL A 76 15.436 0.801 -0.556 1.00 0.00 N ATOM 1113 CA VAL A 76 16.419 1.725 -0.032 1.00 0.00 C ATOM 1114 C VAL A 76 17.585 1.835 -1.015 1.00 0.00 C ATOM 1115 O VAL A 76 18.427 0.946 -1.176 1.00 0.00 O ATOM 1116 CB VAL A 76 16.812 1.314 1.397 1.00 0.00 C ATOM 1117 CG1 VAL A 76 15.773 1.859 2.382 1.00 0.00 C ATOM 1118 CG2 VAL A 76 16.937 -0.199 1.624 1.00 0.00 C ATOM 0 H VAL A 76 15.836 -0.090 -0.848 1.00 0.00 H new ATOM 0 HA VAL A 76 16.010 2.731 0.059 1.00 0.00 H new ATOM 0 HB VAL A 76 17.804 1.736 1.558 1.00 0.00 H new ATOM 0 HG11 VAL A 76 16.047 1.570 3.397 1.00 0.00 H new ATOM 0 HG12 VAL A 76 15.739 2.946 2.311 1.00 0.00 H new ATOM 0 HG13 VAL A 76 14.792 1.449 2.140 1.00 0.00 H new ATOM 0 HG21 VAL A 76 17.217 -0.390 2.660 1.00 0.00 H new ATOM 0 HG22 VAL A 76 15.981 -0.679 1.412 1.00 0.00 H new ATOM 0 HG23 VAL A 76 17.701 -0.604 0.961 1.00 0.00 H new ATOM 1128 N ILE A 77 17.595 2.957 -1.721 1.00 0.00 N ATOM 1129 CA ILE A 77 18.567 3.258 -2.744 1.00 0.00 C ATOM 1130 C ILE A 77 19.571 4.210 -2.138 1.00 0.00 C ATOM 1131 O ILE A 77 19.328 5.405 -1.989 1.00 0.00 O ATOM 1132 CB ILE A 77 17.877 3.822 -3.997 1.00 0.00 C ATOM 1133 CG1 ILE A 77 16.889 2.815 -4.624 1.00 0.00 C ATOM 1134 CG2 ILE A 77 18.920 4.261 -5.031 1.00 0.00 C ATOM 1135 CD1 ILE A 77 17.470 1.422 -4.904 1.00 0.00 C ATOM 0 H ILE A 77 16.906 3.698 -1.589 1.00 0.00 H new ATOM 0 HA ILE A 77 19.088 2.361 -3.080 1.00 0.00 H new ATOM 0 HB ILE A 77 17.298 4.690 -3.682 1.00 0.00 H new ATOM 0 HG12 ILE A 77 16.033 2.707 -3.958 1.00 0.00 H new ATOM 0 HG13 ILE A 77 16.515 3.231 -5.560 1.00 0.00 H new ATOM 0 HG21 ILE A 77 18.415 4.658 -5.912 1.00 0.00 H new ATOM 0 HG22 ILE A 77 19.557 5.033 -4.600 1.00 0.00 H new ATOM 0 HG23 ILE A 77 19.531 3.405 -5.318 1.00 0.00 H new ATOM 0 HD11 ILE A 77 16.700 0.788 -5.343 1.00 0.00 H new ATOM 0 HD12 ILE A 77 18.307 1.509 -5.597 1.00 0.00 H new ATOM 0 HD13 ILE A 77 17.816 0.978 -3.971 1.00 0.00 H new ATOM 1147 N SER A 78 20.693 3.659 -1.723 1.00 0.00 N ATOM 1148 CA SER A 78 21.822 4.477 -1.365 1.00 0.00 C ATOM 1149 C SER A 78 22.389 5.006 -2.680 1.00 0.00 C ATOM 1150 O SER A 78 22.198 4.445 -3.766 1.00 0.00 O ATOM 1151 CB SER A 78 22.831 3.612 -0.636 1.00 0.00 C ATOM 1152 OG SER A 78 23.964 4.327 -0.204 1.00 0.00 O ATOM 0 H SER A 78 20.842 2.655 -1.627 1.00 0.00 H new ATOM 0 HA SER A 78 21.558 5.305 -0.707 1.00 0.00 H new ATOM 0 HB2 SER A 78 22.349 3.151 0.226 1.00 0.00 H new ATOM 0 HB3 SER A 78 23.149 2.803 -1.294 1.00 0.00 H new ATOM 0 HG SER A 78 24.679 4.240 -0.869 1.00 0.00 H new ATOM 1158 N LEU A 79 23.076 6.127 -2.581 1.00 0.00 N ATOM 1159 CA LEU A 79 23.816 6.760 -3.647 1.00 0.00 C ATOM 1160 C LEU A 79 24.865 7.601 -2.924 1.00 0.00 C ATOM 1161 O LEU A 79 24.947 8.819 -3.081 1.00 0.00 O ATOM 1162 CB LEU A 79 22.901 7.487 -4.674 1.00 0.00 C ATOM 1163 CG LEU A 79 21.389 7.636 -4.370 1.00 0.00 C ATOM 1164 CD1 LEU A 79 21.180 8.889 -3.540 1.00 0.00 C ATOM 1165 CD2 LEU A 79 20.568 7.756 -5.658 1.00 0.00 C ATOM 0 H LEU A 79 23.134 6.646 -1.705 1.00 0.00 H new ATOM 0 HA LEU A 79 24.316 6.059 -4.315 1.00 0.00 H new ATOM 0 HB2 LEU A 79 23.306 8.488 -4.822 1.00 0.00 H new ATOM 0 HB3 LEU A 79 22.994 6.962 -5.625 1.00 0.00 H new ATOM 0 HG LEU A 79 21.057 6.748 -3.832 1.00 0.00 H new ATOM 0 HD11 LEU A 79 20.119 9.006 -3.319 1.00 0.00 H new ATOM 0 HD12 LEU A 79 21.738 8.805 -2.607 1.00 0.00 H new ATOM 0 HD13 LEU A 79 21.532 9.757 -4.097 1.00 0.00 H new ATOM 0 HD21 LEU A 79 19.512 7.859 -5.408 1.00 0.00 H new ATOM 0 HD22 LEU A 79 20.896 8.632 -6.218 1.00 0.00 H new ATOM 0 HD23 LEU A 79 20.712 6.862 -6.266 1.00 0.00 H new ATOM 1177 N CYS A 80 25.623 6.946 -2.036 1.00 0.00 N ATOM 1178 CA CYS A 80 26.762 7.539 -1.348 1.00 0.00 C ATOM 1179 C CYS A 80 27.914 7.726 -2.334 1.00 0.00 C ATOM 1180 O CYS A 80 28.606 8.742 -2.278 1.00 0.00 O ATOM 1181 CB CYS A 80 27.190 6.650 -0.176 1.00 0.00 C ATOM 1182 SG CYS A 80 25.889 6.641 1.085 1.00 0.00 S ATOM 0 H CYS A 80 25.454 5.974 -1.776 1.00 0.00 H new ATOM 0 HA CYS A 80 26.479 8.514 -0.951 1.00 0.00 H new ATOM 0 HB2 CYS A 80 27.379 5.635 -0.526 1.00 0.00 H new ATOM 0 HB3 CYS A 80 28.123 7.018 0.252 1.00 0.00 H new ATOM 0 HG CYS A 80 24.982 5.765 0.767 1.00 0.00 H new ATOM 1188 N GLY A 81 28.085 6.785 -3.265 1.00 0.00 N ATOM 1189 CA GLY A 81 28.977 6.896 -4.411 1.00 0.00 C ATOM 1190 C GLY A 81 30.033 5.804 -4.396 1.00 0.00 C ATOM 1191 O GLY A 81 30.066 4.963 -5.292 1.00 0.00 O ATOM 0 H GLY A 81 27.587 5.895 -3.237 1.00 0.00 H new ATOM 0 HA2 GLY A 81 28.398 6.833 -5.333 1.00 0.00 H new ATOM 0 HA3 GLY A 81 29.461 7.873 -4.405 1.00 0.00 H new ATOM 1195 N CYS A 82 30.877 5.774 -3.363 1.00 0.00 N ATOM 1196 CA CYS A 82 32.069 4.921 -3.319 1.00 0.00 C ATOM 1197 C CYS A 82 31.759 3.463 -2.933 1.00 0.00 C ATOM 1198 O CYS A 82 32.590 2.782 -2.330 1.00 0.00 O ATOM 1199 CB CYS A 82 33.116 5.557 -2.387 1.00 0.00 C ATOM 1200 SG CYS A 82 33.463 7.276 -2.876 1.00 0.00 S ATOM 0 H CYS A 82 30.753 6.345 -2.527 1.00 0.00 H new ATOM 0 HA CYS A 82 32.477 4.862 -4.328 1.00 0.00 H new ATOM 0 HB2 CYS A 82 32.755 5.533 -1.359 1.00 0.00 H new ATOM 0 HB3 CYS A 82 34.036 4.974 -2.416 1.00 0.00 H new ATOM 0 HG CYS A 82 34.347 7.786 -2.071 1.00 0.00 H new ATOM 1206 N GLY A 83 30.545 2.997 -3.230 1.00 0.00 N ATOM 1207 CA GLY A 83 30.044 1.675 -2.869 1.00 0.00 C ATOM 1208 C GLY A 83 29.846 1.496 -1.363 1.00 0.00 C ATOM 1209 O GLY A 83 29.714 0.367 -0.888 1.00 0.00 O ATOM 0 H GLY A 83 29.862 3.551 -3.747 1.00 0.00 H new ATOM 0 HA2 GLY A 83 29.095 1.502 -3.377 1.00 0.00 H new ATOM 0 HA3 GLY A 83 30.741 0.919 -3.230 1.00 0.00 H new ATOM 1213 N VAL A 84 29.847 2.595 -0.609 1.00 0.00 N ATOM 1214 CA VAL A 84 29.583 2.618 0.819 1.00 0.00 C ATOM 1215 C VAL A 84 28.104 2.306 1.014 1.00 0.00 C ATOM 1216 O VAL A 84 27.240 3.101 0.641 1.00 0.00 O ATOM 1217 CB VAL A 84 30.007 3.963 1.430 1.00 0.00 C ATOM 1218 CG1 VAL A 84 29.620 4.083 2.912 1.00 0.00 C ATOM 1219 CG2 VAL A 84 31.524 4.178 1.299 1.00 0.00 C ATOM 0 H VAL A 84 30.038 3.520 -0.993 1.00 0.00 H new ATOM 0 HA VAL A 84 30.172 1.866 1.345 1.00 0.00 H new ATOM 0 HB VAL A 84 29.472 4.729 0.868 1.00 0.00 H new ATOM 0 HG11 VAL A 84 29.942 5.051 3.295 1.00 0.00 H new ATOM 0 HG12 VAL A 84 28.538 3.994 3.014 1.00 0.00 H new ATOM 0 HG13 VAL A 84 30.104 3.289 3.480 1.00 0.00 H new ATOM 0 HG21 VAL A 84 31.795 5.137 1.740 1.00 0.00 H new ATOM 0 HG22 VAL A 84 32.051 3.378 1.819 1.00 0.00 H new ATOM 0 HG23 VAL A 84 31.803 4.171 0.245 1.00 0.00 H new ATOM 1229 N ASN A 85 27.816 1.131 1.570 1.00 0.00 N ATOM 1230 CA ASN A 85 26.477 0.802 2.020 1.00 0.00 C ATOM 1231 C ASN A 85 26.242 1.471 3.365 1.00 0.00 C ATOM 1232 O ASN A 85 27.172 1.776 4.112 1.00 0.00 O ATOM 1233 CB ASN A 85 26.254 -0.717 2.064 1.00 0.00 C ATOM 1234 CG ASN A 85 26.982 -1.382 3.224 1.00 0.00 C ATOM 1235 OD1 ASN A 85 28.055 -1.953 3.058 1.00 0.00 O ATOM 1236 ND2 ASN A 85 26.428 -1.302 4.419 1.00 0.00 N ATOM 0 H ASN A 85 28.501 0.390 1.718 1.00 0.00 H new ATOM 0 HA ASN A 85 25.743 1.182 1.310 1.00 0.00 H new ATOM 0 HB2 ASN A 85 25.186 -0.922 2.145 1.00 0.00 H new ATOM 0 HB3 ASN A 85 26.593 -1.158 1.126 1.00 0.00 H new ATOM 0 HD21 ASN A 85 26.893 -1.719 5.225 1.00 0.00 H new ATOM 0 HD22 ASN A 85 25.535 -0.823 4.536 1.00 0.00 H new ATOM 1243 N LEU A 86 24.964 1.667 3.660 1.00 0.00 N ATOM 1244 CA LEU A 86 24.470 2.272 4.888 1.00 0.00 C ATOM 1245 C LEU A 86 24.729 1.273 6.017 1.00 0.00 C ATOM 1246 O LEU A 86 24.285 0.133 5.892 1.00 0.00 O ATOM 1247 CB LEU A 86 22.976 2.618 4.694 1.00 0.00 C ATOM 1248 CG LEU A 86 22.697 3.443 3.413 1.00 0.00 C ATOM 1249 CD1 LEU A 86 21.223 3.827 3.313 1.00 0.00 C ATOM 1250 CD2 LEU A 86 23.574 4.693 3.303 1.00 0.00 C ATOM 0 H LEU A 86 24.213 1.398 3.024 1.00 0.00 H new ATOM 0 HA LEU A 86 24.975 3.204 5.143 1.00 0.00 H new ATOM 0 HB2 LEU A 86 22.399 1.694 4.655 1.00 0.00 H new ATOM 0 HB3 LEU A 86 22.625 3.177 5.561 1.00 0.00 H new ATOM 0 HG LEU A 86 22.955 2.793 2.577 1.00 0.00 H new ATOM 0 HD11 LEU A 86 21.059 4.405 2.404 1.00 0.00 H new ATOM 0 HD12 LEU A 86 20.613 2.924 3.284 1.00 0.00 H new ATOM 0 HD13 LEU A 86 20.944 4.426 4.180 1.00 0.00 H new ATOM 0 HD21 LEU A 86 23.331 5.228 2.385 1.00 0.00 H new ATOM 0 HD22 LEU A 86 23.392 5.342 4.160 1.00 0.00 H new ATOM 0 HD23 LEU A 86 24.624 4.400 3.286 1.00 0.00 H new ATOM 1262 N PRO A 87 25.480 1.627 7.075 1.00 0.00 N ATOM 1263 CA PRO A 87 25.568 0.801 8.271 1.00 0.00 C ATOM 1264 C PRO A 87 24.200 0.465 8.907 1.00 0.00 C ATOM 1265 O PRO A 87 24.053 -0.674 9.363 1.00 0.00 O ATOM 1266 CB PRO A 87 26.466 1.566 9.251 1.00 0.00 C ATOM 1267 CG PRO A 87 27.288 2.487 8.352 1.00 0.00 C ATOM 1268 CD PRO A 87 26.327 2.806 7.210 1.00 0.00 C ATOM 0 HA PRO A 87 25.981 -0.173 8.008 1.00 0.00 H new ATOM 0 HB2 PRO A 87 25.878 2.133 9.973 1.00 0.00 H new ATOM 0 HB3 PRO A 87 27.104 0.890 9.820 1.00 0.00 H new ATOM 0 HG2 PRO A 87 27.602 3.389 8.878 1.00 0.00 H new ATOM 0 HG3 PRO A 87 28.193 1.997 7.992 1.00 0.00 H new ATOM 0 HD2 PRO A 87 25.733 3.693 7.432 1.00 0.00 H new ATOM 0 HD3 PRO A 87 26.869 3.008 6.286 1.00 0.00 H new ATOM 1276 N PRO A 88 23.215 1.392 8.999 1.00 0.00 N ATOM 1277 CA PRO A 88 21.973 1.124 9.731 1.00 0.00 C ATOM 1278 C PRO A 88 20.984 0.232 8.957 1.00 0.00 C ATOM 1279 O PRO A 88 21.240 -0.192 7.831 1.00 0.00 O ATOM 1280 CB PRO A 88 21.397 2.513 10.044 1.00 0.00 C ATOM 1281 CG PRO A 88 21.879 3.358 8.869 1.00 0.00 C ATOM 1282 CD PRO A 88 23.267 2.813 8.632 1.00 0.00 C ATOM 0 HA PRO A 88 22.166 0.548 10.636 1.00 0.00 H new ATOM 0 HB2 PRO A 88 20.309 2.494 10.108 1.00 0.00 H new ATOM 0 HB3 PRO A 88 21.765 2.897 10.995 1.00 0.00 H new ATOM 0 HG2 PRO A 88 21.240 3.240 7.994 1.00 0.00 H new ATOM 0 HG3 PRO A 88 21.895 4.421 9.111 1.00 0.00 H new ATOM 0 HD2 PRO A 88 23.561 2.936 7.590 1.00 0.00 H new ATOM 0 HD3 PRO A 88 24.003 3.345 9.235 1.00 0.00 H new ATOM 1290 N GLU A 89 19.807 0.010 9.558 1.00 0.00 N ATOM 1291 CA GLU A 89 18.641 -0.750 9.074 1.00 0.00 C ATOM 1292 C GLU A 89 18.196 -0.438 7.637 1.00 0.00 C ATOM 1293 O GLU A 89 17.483 -1.211 6.995 1.00 0.00 O ATOM 1294 CB GLU A 89 17.466 -0.506 10.040 1.00 0.00 C ATOM 1295 CG GLU A 89 17.211 0.979 10.375 1.00 0.00 C ATOM 1296 CD GLU A 89 15.913 1.205 11.172 1.00 0.00 C ATOM 1297 OE1 GLU A 89 15.749 0.610 12.263 1.00 0.00 O ATOM 1298 OE2 GLU A 89 15.069 2.016 10.729 1.00 0.00 O ATOM 0 H GLU A 89 19.628 0.395 10.486 1.00 0.00 H new ATOM 0 HA GLU A 89 18.952 -1.794 9.050 1.00 0.00 H new ATOM 0 HB2 GLU A 89 16.560 -0.928 9.604 1.00 0.00 H new ATOM 0 HB3 GLU A 89 17.656 -1.047 10.967 1.00 0.00 H new ATOM 0 HG2 GLU A 89 18.054 1.366 10.948 1.00 0.00 H new ATOM 0 HG3 GLU A 89 17.166 1.552 9.449 1.00 0.00 H new ATOM 1305 N TRP A 90 18.641 0.692 7.110 1.00 0.00 N ATOM 1306 CA TRP A 90 18.508 1.113 5.727 1.00 0.00 C ATOM 1307 C TRP A 90 19.295 0.232 4.742 1.00 0.00 C ATOM 1308 O TRP A 90 19.388 0.577 3.568 1.00 0.00 O ATOM 1309 CB TRP A 90 18.935 2.576 5.623 1.00 0.00 C ATOM 1310 CG TRP A 90 18.211 3.531 6.519 1.00 0.00 C ATOM 1311 CD1 TRP A 90 18.540 3.840 7.790 1.00 0.00 C ATOM 1312 CD2 TRP A 90 17.010 4.306 6.241 1.00 0.00 C ATOM 1313 NE1 TRP A 90 17.713 4.815 8.278 1.00 0.00 N ATOM 1314 CE2 TRP A 90 16.705 5.109 7.382 1.00 0.00 C ATOM 1315 CE3 TRP A 90 16.140 4.386 5.138 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 15.597 5.966 7.409 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 14.999 5.201 5.175 1.00 0.00 C ATOM 1318 CH2 TRP A 90 14.731 5.991 6.303 1.00 0.00 C ATOM 0 H TRP A 90 19.136 1.382 7.674 1.00 0.00 H new ATOM 0 HA TRP A 90 17.463 1.001 5.438 1.00 0.00 H new ATOM 0 HB2 TRP A 90 20.001 2.640 5.841 1.00 0.00 H new ATOM 0 HB3 TRP A 90 18.800 2.902 4.592 1.00 0.00 H new ATOM 0 HD1 TRP A 90 19.345 3.381 8.346 1.00 0.00 H new ATOM 0 HE1 TRP A 90 17.827 5.266 9.186 1.00 0.00 H new ATOM 0 HE3 TRP A 90 16.354 3.811 4.249 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 15.412 6.597 8.266 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 14.324 5.220 4.332 1.00 0.00 H new ATOM 0 HH2 TRP A 90 13.854 6.622 6.321 1.00 0.00 H new ATOM 1329 N VAL A 91 19.850 -0.897 5.189 1.00 0.00 N ATOM 1330 CA VAL A 91 20.473 -1.910 4.345 1.00 0.00 C ATOM 1331 C VAL A 91 19.775 -3.276 4.485 1.00 0.00 C ATOM 1332 O VAL A 91 20.178 -4.235 3.826 1.00 0.00 O ATOM 1333 CB VAL A 91 21.997 -1.906 4.603 1.00 0.00 C ATOM 1334 CG1 VAL A 91 22.409 -2.675 5.868 1.00 0.00 C ATOM 1335 CG2 VAL A 91 22.810 -2.423 3.408 1.00 0.00 C ATOM 0 H VAL A 91 19.877 -1.135 6.180 1.00 0.00 H new ATOM 0 HA VAL A 91 20.340 -1.671 3.290 1.00 0.00 H new ATOM 0 HB VAL A 91 22.233 -0.853 4.756 1.00 0.00 H new ATOM 0 HG11 VAL A 91 23.492 -2.629 5.985 1.00 0.00 H new ATOM 0 HG12 VAL A 91 21.931 -2.226 6.739 1.00 0.00 H new ATOM 0 HG13 VAL A 91 22.097 -3.716 5.779 1.00 0.00 H new ATOM 0 HG21 VAL A 91 23.872 -2.395 3.651 1.00 0.00 H new ATOM 0 HG22 VAL A 91 22.516 -3.448 3.184 1.00 0.00 H new ATOM 0 HG23 VAL A 91 22.620 -1.793 2.539 1.00 0.00 H new ATOM 1345 N THR A 92 18.712 -3.385 5.294 1.00 0.00 N ATOM 1346 CA THR A 92 18.067 -4.655 5.631 1.00 0.00 C ATOM 1347 C THR A 92 16.561 -4.639 5.326 1.00 0.00 C ATOM 1348 O THR A 92 15.784 -5.383 5.929 1.00 0.00 O ATOM 1349 CB THR A 92 18.425 -5.042 7.085 1.00 0.00 C ATOM 1350 OG1 THR A 92 18.184 -3.975 7.984 1.00 0.00 O ATOM 1351 CG2 THR A 92 19.908 -5.399 7.229 1.00 0.00 C ATOM 0 H THR A 92 18.272 -2.579 5.738 1.00 0.00 H new ATOM 0 HA THR A 92 18.454 -5.445 4.988 1.00 0.00 H new ATOM 0 HB THR A 92 17.795 -5.900 7.320 1.00 0.00 H new ATOM 0 HG1 THR A 92 17.821 -3.209 7.493 1.00 0.00 H new ATOM 0 HG21 THR A 92 20.119 -5.665 8.265 1.00 0.00 H new ATOM 0 HG22 THR A 92 20.143 -6.244 6.582 1.00 0.00 H new ATOM 0 HG23 THR A 92 20.518 -4.542 6.943 1.00 0.00 H new ATOM 1359 N GLN A 93 16.146 -3.791 4.379 1.00 0.00 N ATOM 1360 CA GLN A 93 14.792 -3.801 3.824 1.00 0.00 C ATOM 1361 C GLN A 93 14.754 -4.709 2.583 1.00 0.00 C ATOM 1362 O GLN A 93 15.721 -5.420 2.295 1.00 0.00 O ATOM 1363 CB GLN A 93 14.300 -2.370 3.538 1.00 0.00 C ATOM 1364 CG GLN A 93 14.484 -1.394 4.712 1.00 0.00 C ATOM 1365 CD GLN A 93 13.919 -1.939 6.029 1.00 0.00 C ATOM 1366 OE1 GLN A 93 12.776 -2.384 6.114 1.00 0.00 O ATOM 1367 NE2 GLN A 93 14.724 -1.968 7.079 1.00 0.00 N ATOM 0 H GLN A 93 16.747 -3.073 3.974 1.00 0.00 H new ATOM 0 HA GLN A 93 14.098 -4.214 4.556 1.00 0.00 H new ATOM 0 HB2 GLN A 93 14.833 -1.981 2.670 1.00 0.00 H new ATOM 0 HB3 GLN A 93 13.243 -2.407 3.273 1.00 0.00 H new ATOM 0 HG2 GLN A 93 15.545 -1.180 4.838 1.00 0.00 H new ATOM 0 HG3 GLN A 93 13.994 -0.450 4.474 1.00 0.00 H new ATOM 0 HE21 GLN A 93 15.672 -1.598 7.005 1.00 0.00 H new ATOM 0 HE22 GLN A 93 14.397 -2.360 7.962 1.00 0.00 H new ATOM 1376 N GLU A 94 13.630 -4.718 1.863 1.00 0.00 N ATOM 1377 CA GLU A 94 13.372 -5.683 0.798 1.00 0.00 C ATOM 1378 C GLU A 94 14.311 -5.528 -0.398 1.00 0.00 C ATOM 1379 O GLU A 94 14.682 -6.536 -1.004 1.00 0.00 O ATOM 1380 CB GLU A 94 11.903 -5.623 0.348 1.00 0.00 C ATOM 1381 CG GLU A 94 10.896 -5.915 1.474 1.00 0.00 C ATOM 1382 CD GLU A 94 11.090 -7.307 2.103 1.00 0.00 C ATOM 1383 OE1 GLU A 94 10.746 -8.326 1.461 1.00 0.00 O ATOM 1384 OE2 GLU A 94 11.568 -7.399 3.257 1.00 0.00 O ATOM 0 H GLU A 94 12.871 -4.052 2.005 1.00 0.00 H new ATOM 0 HA GLU A 94 13.574 -6.667 1.222 1.00 0.00 H new ATOM 0 HB2 GLU A 94 11.699 -4.634 -0.062 1.00 0.00 H new ATOM 0 HB3 GLU A 94 11.750 -6.340 -0.458 1.00 0.00 H new ATOM 0 HG2 GLU A 94 10.994 -5.155 2.249 1.00 0.00 H new ATOM 0 HG3 GLU A 94 9.883 -5.838 1.078 1.00 0.00 H new ATOM 1391 N ILE A 95 14.723 -4.301 -0.726 1.00 0.00 N ATOM 1392 CA ILE A 95 15.594 -4.019 -1.866 1.00 0.00 C ATOM 1393 C ILE A 95 16.629 -3.007 -1.377 1.00 0.00 C ATOM 1394 O ILE A 95 16.239 -2.015 -0.758 1.00 0.00 O ATOM 1395 CB ILE A 95 14.748 -3.483 -3.033 1.00 0.00 C ATOM 1396 CG1 ILE A 95 13.739 -4.568 -3.480 1.00 0.00 C ATOM 1397 CG2 ILE A 95 15.645 -3.022 -4.206 1.00 0.00 C ATOM 1398 CD1 ILE A 95 13.051 -4.294 -4.812 1.00 0.00 C ATOM 0 H ILE A 95 14.458 -3.468 -0.201 1.00 0.00 H new ATOM 0 HA ILE A 95 16.103 -4.909 -2.237 1.00 0.00 H new ATOM 0 HB ILE A 95 14.191 -2.608 -2.697 1.00 0.00 H new ATOM 0 HG12 ILE A 95 14.260 -5.523 -3.546 1.00 0.00 H new ATOM 0 HG13 ILE A 95 12.976 -4.674 -2.709 1.00 0.00 H new ATOM 0 HG21 ILE A 95 15.020 -2.648 -5.017 1.00 0.00 H new ATOM 0 HG22 ILE A 95 16.310 -2.229 -3.865 1.00 0.00 H new ATOM 0 HG23 ILE A 95 16.238 -3.864 -4.564 1.00 0.00 H new ATOM 0 HD11 ILE A 95 12.363 -5.108 -5.041 1.00 0.00 H new ATOM 0 HD12 ILE A 95 12.496 -3.358 -4.749 1.00 0.00 H new ATOM 0 HD13 ILE A 95 13.800 -4.220 -5.600 1.00 0.00 H new ATOM 1410 N PHE A 96 17.913 -3.212 -1.691 1.00 0.00 N ATOM 1411 CA PHE A 96 18.980 -2.269 -1.420 1.00 0.00 C ATOM 1412 C PHE A 96 19.919 -2.239 -2.620 1.00 0.00 C ATOM 1413 O PHE A 96 20.242 -3.290 -3.179 1.00 0.00 O ATOM 1414 CB PHE A 96 19.780 -2.638 -0.155 1.00 0.00 C ATOM 1415 CG PHE A 96 20.963 -1.702 0.060 1.00 0.00 C ATOM 1416 CD1 PHE A 96 20.775 -0.483 0.735 1.00 0.00 C ATOM 1417 CD2 PHE A 96 22.209 -1.965 -0.552 1.00 0.00 C ATOM 1418 CE1 PHE A 96 21.806 0.466 0.792 1.00 0.00 C ATOM 1419 CE2 PHE A 96 23.227 -0.992 -0.537 1.00 0.00 C ATOM 1420 CZ PHE A 96 23.029 0.220 0.147 1.00 0.00 C ATOM 0 H PHE A 96 18.237 -4.062 -2.152 1.00 0.00 H new ATOM 0 HA PHE A 96 18.531 -1.291 -1.247 1.00 0.00 H new ATOM 0 HB2 PHE A 96 19.123 -2.599 0.714 1.00 0.00 H new ATOM 0 HB3 PHE A 96 20.139 -3.664 -0.238 1.00 0.00 H new ATOM 0 HD1 PHE A 96 19.829 -0.276 1.213 1.00 0.00 H new ATOM 0 HD2 PHE A 96 22.381 -2.916 -1.033 1.00 0.00 H new ATOM 0 HE1 PHE A 96 21.659 1.389 1.334 1.00 0.00 H new ATOM 0 HE2 PHE A 96 24.159 -1.177 -1.051 1.00 0.00 H new ATOM 0 HZ PHE A 96 23.815 0.960 0.176 1.00 0.00 H new ATOM 1430 N GLU A 97 20.387 -1.044 -2.969 1.00 0.00 N ATOM 1431 CA GLU A 97 21.464 -0.805 -3.921 1.00 0.00 C ATOM 1432 C GLU A 97 22.197 0.467 -3.493 1.00 0.00 C ATOM 1433 O GLU A 97 21.628 1.293 -2.783 1.00 0.00 O ATOM 1434 CB GLU A 97 20.926 -0.589 -5.346 1.00 0.00 C ATOM 1435 CG GLU A 97 20.567 -1.887 -6.069 1.00 0.00 C ATOM 1436 CD GLU A 97 20.224 -1.642 -7.549 1.00 0.00 C ATOM 1437 OE1 GLU A 97 19.399 -0.750 -7.849 1.00 0.00 O ATOM 1438 OE2 GLU A 97 20.774 -2.353 -8.422 1.00 0.00 O ATOM 0 H GLU A 97 20.009 -0.180 -2.579 1.00 0.00 H new ATOM 0 HA GLU A 97 22.120 -1.675 -3.928 1.00 0.00 H new ATOM 0 HB2 GLU A 97 20.042 0.047 -5.299 1.00 0.00 H new ATOM 0 HB3 GLU A 97 21.674 -0.053 -5.930 1.00 0.00 H new ATOM 0 HG2 GLU A 97 21.402 -2.584 -6.000 1.00 0.00 H new ATOM 0 HG3 GLU A 97 19.718 -2.357 -5.572 1.00 0.00 H new ATOM 1445 N ASP A 98 23.428 0.639 -3.975 1.00 0.00 N ATOM 1446 CA ASP A 98 24.208 1.876 -3.882 1.00 0.00 C ATOM 1447 C ASP A 98 24.576 2.332 -5.294 1.00 0.00 C ATOM 1448 O ASP A 98 25.430 1.724 -5.943 1.00 0.00 O ATOM 1449 CB ASP A 98 25.451 1.796 -2.985 1.00 0.00 C ATOM 1450 CG ASP A 98 26.103 3.192 -2.894 1.00 0.00 C ATOM 1451 OD1 ASP A 98 25.492 4.096 -2.279 1.00 0.00 O ATOM 1452 OD2 ASP A 98 27.207 3.397 -3.445 1.00 0.00 O ATOM 0 H ASP A 98 23.929 -0.106 -4.459 1.00 0.00 H new ATOM 0 HA ASP A 98 23.572 2.610 -3.388 1.00 0.00 H new ATOM 0 HB2 ASP A 98 25.174 1.445 -1.991 1.00 0.00 H new ATOM 0 HB3 ASP A 98 26.161 1.076 -3.391 1.00 0.00 H new ATOM 1457 N TRP A 99 23.868 3.337 -5.815 1.00 0.00 N ATOM 1458 CA TRP A 99 24.041 3.843 -7.174 1.00 0.00 C ATOM 1459 C TRP A 99 25.283 4.737 -7.235 1.00 0.00 C ATOM 1460 O TRP A 99 25.253 5.908 -6.849 1.00 0.00 O ATOM 1461 CB TRP A 99 22.759 4.530 -7.670 1.00 0.00 C ATOM 1462 CG TRP A 99 21.503 3.707 -7.754 1.00 0.00 C ATOM 1463 CD1 TRP A 99 21.353 2.378 -7.540 1.00 0.00 C ATOM 1464 CD2 TRP A 99 20.178 4.187 -8.118 1.00 0.00 C ATOM 1465 NE1 TRP A 99 20.040 2.009 -7.760 1.00 0.00 N ATOM 1466 CE2 TRP A 99 19.254 3.096 -8.076 1.00 0.00 C ATOM 1467 CE3 TRP A 99 19.678 5.457 -8.467 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 17.883 3.271 -8.341 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 18.312 5.645 -8.725 1.00 0.00 C ATOM 1470 CH2 TRP A 99 17.427 4.560 -8.659 1.00 0.00 C ATOM 0 H TRP A 99 23.145 3.830 -5.291 1.00 0.00 H new ATOM 0 HA TRP A 99 24.213 3.015 -7.861 1.00 0.00 H new ATOM 0 HB2 TRP A 99 22.559 5.377 -7.014 1.00 0.00 H new ATOM 0 HB3 TRP A 99 22.960 4.935 -8.662 1.00 0.00 H new ATOM 0 HD1 TRP A 99 22.144 1.706 -7.241 1.00 0.00 H new ATOM 0 HE1 TRP A 99 19.695 1.051 -7.696 1.00 0.00 H new ATOM 0 HE3 TRP A 99 20.355 6.296 -8.537 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 17.200 2.436 -8.301 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 17.941 6.628 -8.975 1.00 0.00 H new ATOM 0 HH2 TRP A 99 16.377 4.718 -8.856 1.00 0.00 H new ATOM 1481 N GLN A 100 26.389 4.155 -7.701 1.00 0.00 N ATOM 1482 CA GLN A 100 27.646 4.842 -7.951 1.00 0.00 C ATOM 1483 C GLN A 100 27.477 5.784 -9.148 1.00 0.00 C ATOM 1484 O GLN A 100 27.444 5.338 -10.298 1.00 0.00 O ATOM 1485 CB GLN A 100 28.746 3.791 -8.164 1.00 0.00 C ATOM 1486 CG GLN A 100 30.121 4.407 -8.471 1.00 0.00 C ATOM 1487 CD GLN A 100 31.243 3.405 -8.199 1.00 0.00 C ATOM 1488 OE1 GLN A 100 31.850 2.848 -9.112 1.00 0.00 O ATOM 1489 NE2 GLN A 100 31.527 3.144 -6.933 1.00 0.00 N ATOM 0 H GLN A 100 26.430 3.160 -7.920 1.00 0.00 H new ATOM 0 HA GLN A 100 27.940 5.458 -7.101 1.00 0.00 H new ATOM 0 HB2 GLN A 100 28.824 3.170 -7.271 1.00 0.00 H new ATOM 0 HB3 GLN A 100 28.458 3.134 -8.985 1.00 0.00 H new ATOM 0 HG2 GLN A 100 30.157 4.724 -9.513 1.00 0.00 H new ATOM 0 HG3 GLN A 100 30.269 5.298 -7.861 1.00 0.00 H new ATOM 0 HE21 GLN A 100 31.014 3.615 -6.188 1.00 0.00 H new ATOM 0 HE22 GLN A 100 32.259 2.472 -6.703 1.00 0.00 H new ATOM 1498 N LEU A 101 27.372 7.083 -8.872 1.00 0.00 N ATOM 1499 CA LEU A 101 27.218 8.165 -9.831 1.00 0.00 C ATOM 1500 C LEU A 101 28.113 9.310 -9.395 1.00 0.00 C ATOM 1501 O LEU A 101 28.619 9.316 -8.272 1.00 0.00 O ATOM 1502 CB LEU A 101 25.765 8.694 -9.755 1.00 0.00 C ATOM 1503 CG LEU A 101 24.711 8.032 -10.645 1.00 0.00 C ATOM 1504 CD1 LEU A 101 25.163 7.840 -12.093 1.00 0.00 C ATOM 1505 CD2 LEU A 101 24.175 6.722 -10.082 1.00 0.00 C ATOM 0 H LEU A 101 27.394 7.425 -7.911 1.00 0.00 H new ATOM 0 HA LEU A 101 27.462 7.811 -10.833 1.00 0.00 H new ATOM 0 HB2 LEU A 101 25.432 8.606 -8.721 1.00 0.00 H new ATOM 0 HB3 LEU A 101 25.784 9.757 -9.995 1.00 0.00 H new ATOM 0 HG LEU A 101 23.890 8.749 -10.650 1.00 0.00 H new ATOM 0 HD11 LEU A 101 24.365 7.365 -12.664 1.00 0.00 H new ATOM 0 HD12 LEU A 101 25.396 8.810 -12.533 1.00 0.00 H new ATOM 0 HD13 LEU A 101 26.051 7.208 -12.116 1.00 0.00 H new ATOM 0 HD21 LEU A 101 23.432 6.309 -10.765 1.00 0.00 H new ATOM 0 HD22 LEU A 101 24.995 6.013 -9.966 1.00 0.00 H new ATOM 0 HD23 LEU A 101 23.713 6.905 -9.112 1.00 0.00 H new ATOM 1517 N GLU A 102 28.291 10.302 -10.261 1.00 0.00 N ATOM 1518 CA GLU A 102 28.877 11.556 -9.857 1.00 0.00 C ATOM 1519 C GLU A 102 27.848 12.192 -8.918 1.00 0.00 C ATOM 1520 O GLU A 102 26.677 11.799 -8.893 1.00 0.00 O ATOM 1521 CB GLU A 102 29.196 12.424 -11.084 1.00 0.00 C ATOM 1522 CG GLU A 102 30.410 11.902 -11.868 1.00 0.00 C ATOM 1523 CD GLU A 102 31.723 12.000 -11.069 1.00 0.00 C ATOM 1524 OE1 GLU A 102 32.270 13.115 -10.918 1.00 0.00 O ATOM 1525 OE2 GLU A 102 32.233 10.957 -10.600 1.00 0.00 O ATOM 0 H GLU A 102 28.034 10.253 -11.247 1.00 0.00 H new ATOM 0 HA GLU A 102 29.832 11.435 -9.346 1.00 0.00 H new ATOM 0 HB2 GLU A 102 28.327 12.453 -11.741 1.00 0.00 H new ATOM 0 HB3 GLU A 102 29.387 13.448 -10.762 1.00 0.00 H new ATOM 0 HG2 GLU A 102 30.237 10.863 -12.148 1.00 0.00 H new ATOM 0 HG3 GLU A 102 30.510 12.469 -12.794 1.00 0.00 H new ATOM 1532 N ASP A 103 28.261 13.167 -8.126 1.00 0.00 N ATOM 1533 CA ASP A 103 27.328 13.959 -7.334 1.00 0.00 C ATOM 1534 C ASP A 103 27.446 15.396 -7.838 1.00 0.00 C ATOM 1535 O ASP A 103 28.497 16.017 -7.657 1.00 0.00 O ATOM 1536 CB ASP A 103 27.515 13.782 -5.842 1.00 0.00 C ATOM 1537 CG ASP A 103 26.521 14.687 -5.101 1.00 0.00 C ATOM 1538 OD1 ASP A 103 25.314 14.351 -5.072 1.00 0.00 O ATOM 1539 OD2 ASP A 103 26.966 15.724 -4.567 1.00 0.00 O ATOM 0 H ASP A 103 29.239 13.432 -8.012 1.00 0.00 H new ATOM 0 HA ASP A 103 26.302 13.617 -7.471 1.00 0.00 H new ATOM 0 HB2 ASP A 103 27.355 12.740 -5.564 1.00 0.00 H new ATOM 0 HB3 ASP A 103 28.537 14.034 -5.558 1.00 0.00 H new ATOM 1544 N PRO A 104 26.444 15.864 -8.607 1.00 0.00 N ATOM 1545 CA PRO A 104 26.454 17.118 -9.357 1.00 0.00 C ATOM 1546 C PRO A 104 26.755 18.424 -8.605 1.00 0.00 C ATOM 1547 O PRO A 104 26.847 19.471 -9.239 1.00 0.00 O ATOM 1548 CB PRO A 104 25.112 17.188 -10.067 1.00 0.00 C ATOM 1549 CG PRO A 104 24.733 15.733 -10.276 1.00 0.00 C ATOM 1550 CD PRO A 104 25.370 15.012 -9.099 1.00 0.00 C ATOM 0 HA PRO A 104 27.316 17.071 -10.022 1.00 0.00 H new ATOM 0 HB2 PRO A 104 24.369 17.712 -9.466 1.00 0.00 H new ATOM 0 HB3 PRO A 104 25.189 17.721 -11.015 1.00 0.00 H new ATOM 0 HG2 PRO A 104 23.651 15.600 -10.287 1.00 0.00 H new ATOM 0 HG3 PRO A 104 25.110 15.355 -11.226 1.00 0.00 H new ATOM 0 HD2 PRO A 104 24.635 14.828 -8.316 1.00 0.00 H new ATOM 0 HD3 PRO A 104 25.758 14.041 -9.406 1.00 0.00 H new ATOM 1558 N ASP A 105 26.960 18.387 -7.295 1.00 0.00 N ATOM 1559 CA ASP A 105 27.402 19.499 -6.455 1.00 0.00 C ATOM 1560 C ASP A 105 28.655 20.198 -7.010 1.00 0.00 C ATOM 1561 O ASP A 105 29.792 19.807 -6.735 1.00 0.00 O ATOM 1562 CB ASP A 105 27.622 18.967 -5.037 1.00 0.00 C ATOM 1563 CG ASP A 105 28.397 19.926 -4.122 1.00 0.00 C ATOM 1564 OD1 ASP A 105 28.084 21.136 -4.071 1.00 0.00 O ATOM 1565 OD2 ASP A 105 29.299 19.437 -3.402 1.00 0.00 O ATOM 0 H ASP A 105 26.815 17.533 -6.757 1.00 0.00 H new ATOM 0 HA ASP A 105 26.630 20.268 -6.445 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.653 18.755 -4.586 1.00 0.00 H new ATOM 0 HB3 ASP A 105 28.161 18.021 -5.095 1.00 0.00 H new ATOM 1570 N GLY A 106 28.426 21.233 -7.819 1.00 0.00 N ATOM 1571 CA GLY A 106 29.427 22.156 -8.337 1.00 0.00 C ATOM 1572 C GLY A 106 30.002 21.727 -9.689 1.00 0.00 C ATOM 1573 O GLY A 106 31.075 22.209 -10.059 1.00 0.00 O ATOM 0 H GLY A 106 27.486 21.459 -8.146 1.00 0.00 H new ATOM 0 HA2 GLY A 106 28.982 23.146 -8.437 1.00 0.00 H new ATOM 0 HA3 GLY A 106 30.239 22.243 -7.615 1.00 0.00 H new ATOM 1577 N GLN A 107 29.344 20.810 -10.409 1.00 0.00 N ATOM 1578 CA GLN A 107 29.924 20.183 -11.598 1.00 0.00 C ATOM 1579 C GLN A 107 29.515 20.905 -12.888 1.00 0.00 C ATOM 1580 O GLN A 107 28.775 21.892 -12.874 1.00 0.00 O ATOM 1581 CB GLN A 107 29.536 18.698 -11.671 1.00 0.00 C ATOM 1582 CG GLN A 107 29.653 17.917 -10.358 1.00 0.00 C ATOM 1583 CD GLN A 107 31.044 17.720 -9.764 1.00 0.00 C ATOM 1584 OE1 GLN A 107 32.068 18.133 -10.304 1.00 0.00 O ATOM 1585 NE2 GLN A 107 31.087 17.054 -8.622 1.00 0.00 N ATOM 0 H GLN A 107 28.403 20.486 -10.185 1.00 0.00 H new ATOM 0 HA GLN A 107 31.007 20.263 -11.508 1.00 0.00 H new ATOM 0 HB2 GLN A 107 28.507 18.627 -12.025 1.00 0.00 H new ATOM 0 HB3 GLN A 107 30.164 18.213 -12.418 1.00 0.00 H new ATOM 0 HG2 GLN A 107 29.040 18.423 -9.612 1.00 0.00 H new ATOM 0 HG3 GLN A 107 29.214 16.932 -10.515 1.00 0.00 H new ATOM 0 HE21 GLN A 107 30.224 16.721 -8.193 1.00 0.00 H new ATOM 0 HE22 GLN A 107 31.984 16.873 -8.170 1.00 0.00 H new ATOM 1594 N SER A 108 30.007 20.387 -14.014 1.00 0.00 N ATOM 1595 CA SER A 108 29.685 20.846 -15.356 1.00 0.00 C ATOM 1596 C SER A 108 28.307 20.323 -15.770 1.00 0.00 C ATOM 1597 O SER A 108 27.881 19.267 -15.294 1.00 0.00 O ATOM 1598 CB SER A 108 30.760 20.286 -16.294 1.00 0.00 C ATOM 1599 OG SER A 108 32.053 20.717 -15.894 1.00 0.00 O ATOM 0 H SER A 108 30.665 19.607 -14.011 1.00 0.00 H new ATOM 0 HA SER A 108 29.661 21.935 -15.399 1.00 0.00 H new ATOM 0 HB2 SER A 108 30.718 19.197 -16.293 1.00 0.00 H new ATOM 0 HB3 SER A 108 30.563 20.611 -17.315 1.00 0.00 H new ATOM 0 HG SER A 108 32.724 20.347 -16.505 1.00 0.00 H new ATOM 1605 N LEU A 109 27.632 21.004 -16.706 1.00 0.00 N ATOM 1606 CA LEU A 109 26.307 20.590 -17.180 1.00 0.00 C ATOM 1607 C LEU A 109 26.336 19.185 -17.763 1.00 0.00 C ATOM 1608 O LEU A 109 25.353 18.465 -17.645 1.00 0.00 O ATOM 1609 CB LEU A 109 25.748 21.542 -18.250 1.00 0.00 C ATOM 1610 CG LEU A 109 25.434 22.960 -17.742 1.00 0.00 C ATOM 1611 CD1 LEU A 109 24.979 23.835 -18.915 1.00 0.00 C ATOM 1612 CD2 LEU A 109 24.349 22.971 -16.657 1.00 0.00 C ATOM 0 H LEU A 109 27.986 21.850 -17.152 1.00 0.00 H new ATOM 0 HA LEU A 109 25.659 20.616 -16.304 1.00 0.00 H new ATOM 0 HB2 LEU A 109 26.467 21.613 -19.066 1.00 0.00 H new ATOM 0 HB3 LEU A 109 24.838 21.108 -18.664 1.00 0.00 H new ATOM 0 HG LEU A 109 26.349 23.353 -17.298 1.00 0.00 H new ATOM 0 HD11 LEU A 109 24.757 24.839 -18.555 1.00 0.00 H new ATOM 0 HD12 LEU A 109 25.772 23.884 -19.661 1.00 0.00 H new ATOM 0 HD13 LEU A 109 24.084 23.404 -19.365 1.00 0.00 H new ATOM 0 HD21 LEU A 109 24.167 23.996 -16.335 1.00 0.00 H new ATOM 0 HD22 LEU A 109 23.428 22.548 -17.059 1.00 0.00 H new ATOM 0 HD23 LEU A 109 24.680 22.376 -15.806 1.00 0.00 H new ATOM 1624 N GLU A 110 27.450 18.780 -18.372 1.00 0.00 N ATOM 1625 CA GLU A 110 27.607 17.434 -18.904 1.00 0.00 C ATOM 1626 C GLU A 110 27.511 16.391 -17.781 1.00 0.00 C ATOM 1627 O GLU A 110 26.875 15.352 -17.962 1.00 0.00 O ATOM 1628 CB GLU A 110 28.941 17.363 -19.660 1.00 0.00 C ATOM 1629 CG GLU A 110 29.140 16.021 -20.378 1.00 0.00 C ATOM 1630 CD GLU A 110 30.433 16.015 -21.212 1.00 0.00 C ATOM 1631 OE1 GLU A 110 31.510 15.666 -20.677 1.00 0.00 O ATOM 1632 OE2 GLU A 110 30.386 16.341 -22.421 1.00 0.00 O ATOM 0 H GLU A 110 28.266 19.377 -18.508 1.00 0.00 H new ATOM 0 HA GLU A 110 26.801 17.204 -19.601 1.00 0.00 H new ATOM 0 HB2 GLU A 110 28.985 18.172 -20.390 1.00 0.00 H new ATOM 0 HB3 GLU A 110 29.761 17.521 -18.959 1.00 0.00 H new ATOM 0 HG2 GLU A 110 29.175 15.216 -19.644 1.00 0.00 H new ATOM 0 HG3 GLU A 110 28.286 15.824 -21.026 1.00 0.00 H new ATOM 1639 N VAL A 111 28.081 16.671 -16.604 1.00 0.00 N ATOM 1640 CA VAL A 111 27.995 15.775 -15.454 1.00 0.00 C ATOM 1641 C VAL A 111 26.546 15.739 -14.972 1.00 0.00 C ATOM 1642 O VAL A 111 25.993 14.656 -14.781 1.00 0.00 O ATOM 1643 CB VAL A 111 28.963 16.216 -14.339 1.00 0.00 C ATOM 1644 CG1 VAL A 111 28.848 15.317 -13.100 1.00 0.00 C ATOM 1645 CG2 VAL A 111 30.419 16.199 -14.832 1.00 0.00 C ATOM 0 H VAL A 111 28.612 17.523 -16.426 1.00 0.00 H new ATOM 0 HA VAL A 111 28.296 14.768 -15.743 1.00 0.00 H new ATOM 0 HB VAL A 111 28.682 17.233 -14.066 1.00 0.00 H new ATOM 0 HG11 VAL A 111 29.546 15.659 -12.336 1.00 0.00 H new ATOM 0 HG12 VAL A 111 27.831 15.363 -12.710 1.00 0.00 H new ATOM 0 HG13 VAL A 111 29.085 14.289 -13.373 1.00 0.00 H new ATOM 0 HG21 VAL A 111 31.080 16.515 -14.025 1.00 0.00 H new ATOM 0 HG22 VAL A 111 30.685 15.190 -15.146 1.00 0.00 H new ATOM 0 HG23 VAL A 111 30.525 16.881 -15.676 1.00 0.00 H new ATOM 1655 N PHE A 112 25.913 16.909 -14.837 1.00 0.00 N ATOM 1656 CA PHE A 112 24.511 17.010 -14.460 1.00 0.00 C ATOM 1657 C PHE A 112 23.633 16.176 -15.395 1.00 0.00 C ATOM 1658 O PHE A 112 22.869 15.341 -14.922 1.00 0.00 O ATOM 1659 CB PHE A 112 24.064 18.473 -14.485 1.00 0.00 C ATOM 1660 CG PHE A 112 24.271 19.240 -13.202 1.00 0.00 C ATOM 1661 CD1 PHE A 112 23.315 19.160 -12.169 1.00 0.00 C ATOM 1662 CD2 PHE A 112 25.414 20.041 -13.041 1.00 0.00 C ATOM 1663 CE1 PHE A 112 23.522 19.852 -10.966 1.00 0.00 C ATOM 1664 CE2 PHE A 112 25.631 20.714 -11.833 1.00 0.00 C ATOM 1665 CZ PHE A 112 24.700 20.593 -10.792 1.00 0.00 C ATOM 0 H PHE A 112 26.365 17.811 -14.988 1.00 0.00 H new ATOM 0 HA PHE A 112 24.400 16.620 -13.448 1.00 0.00 H new ATOM 0 HB2 PHE A 112 24.601 18.985 -15.284 1.00 0.00 H new ATOM 0 HB3 PHE A 112 23.005 18.506 -14.740 1.00 0.00 H new ATOM 0 HD1 PHE A 112 22.423 18.566 -12.304 1.00 0.00 H new ATOM 0 HD2 PHE A 112 26.125 20.137 -13.849 1.00 0.00 H new ATOM 0 HE1 PHE A 112 22.781 19.814 -10.181 1.00 0.00 H new ATOM 0 HE2 PHE A 112 26.513 21.324 -11.703 1.00 0.00 H new ATOM 0 HZ PHE A 112 24.892 21.076 -9.845 1.00 0.00 H new ATOM 1675 N ARG A 113 23.751 16.366 -16.711 1.00 0.00 N ATOM 1676 CA ARG A 113 22.998 15.627 -17.722 1.00 0.00 C ATOM 1677 C ARG A 113 23.257 14.129 -17.631 1.00 0.00 C ATOM 1678 O ARG A 113 22.297 13.360 -17.712 1.00 0.00 O ATOM 1679 CB ARG A 113 23.340 16.178 -19.121 1.00 0.00 C ATOM 1680 CG ARG A 113 22.449 17.386 -19.452 1.00 0.00 C ATOM 1681 CD ARG A 113 23.138 18.509 -20.223 1.00 0.00 C ATOM 1682 NE ARG A 113 22.143 19.528 -20.576 1.00 0.00 N ATOM 1683 CZ ARG A 113 22.342 20.707 -21.163 1.00 0.00 C ATOM 1684 NH1 ARG A 113 23.553 21.097 -21.556 1.00 0.00 N ATOM 1685 NH2 ARG A 113 21.278 21.478 -21.338 1.00 0.00 N ATOM 0 H ARG A 113 24.388 17.055 -17.111 1.00 0.00 H new ATOM 0 HA ARG A 113 21.933 15.769 -17.539 1.00 0.00 H new ATOM 0 HB2 ARG A 113 24.389 16.471 -19.157 1.00 0.00 H new ATOM 0 HB3 ARG A 113 23.201 15.399 -19.870 1.00 0.00 H new ATOM 0 HG2 ARG A 113 21.595 17.039 -20.033 1.00 0.00 H new ATOM 0 HG3 ARG A 113 22.056 17.794 -18.521 1.00 0.00 H new ATOM 0 HD2 ARG A 113 23.930 18.950 -19.618 1.00 0.00 H new ATOM 0 HD3 ARG A 113 23.608 18.114 -21.124 1.00 0.00 H new ATOM 0 HE ARG A 113 21.176 19.305 -20.342 1.00 0.00 H new ATOM 0 HH11 ARG A 113 24.358 20.487 -21.410 1.00 0.00 H new ATOM 0 HH12 ARG A 113 23.676 22.005 -22.003 1.00 0.00 H new ATOM 0 HH21 ARG A 113 20.360 21.159 -21.028 1.00 0.00 H new ATOM 0 HH22 ARG A 113 21.377 22.391 -21.783 1.00 0.00 H new ATOM 1699 N THR A 114 24.506 13.707 -17.427 1.00 0.00 N ATOM 1700 CA THR A 114 24.841 12.308 -17.296 1.00 0.00 C ATOM 1701 C THR A 114 24.099 11.728 -16.088 1.00 0.00 C ATOM 1702 O THR A 114 23.366 10.750 -16.233 1.00 0.00 O ATOM 1703 CB THR A 114 26.372 12.195 -17.198 1.00 0.00 C ATOM 1704 OG1 THR A 114 26.982 12.722 -18.361 1.00 0.00 O ATOM 1705 CG2 THR A 114 26.821 10.748 -17.054 1.00 0.00 C ATOM 0 H THR A 114 25.307 14.334 -17.350 1.00 0.00 H new ATOM 0 HA THR A 114 24.525 11.723 -18.159 1.00 0.00 H new ATOM 0 HB THR A 114 26.673 12.759 -16.315 1.00 0.00 H new ATOM 0 HG1 THR A 114 27.208 13.664 -18.214 1.00 0.00 H new ATOM 0 HG21 THR A 114 27.908 10.709 -16.988 1.00 0.00 H new ATOM 0 HG22 THR A 114 26.387 10.321 -16.150 1.00 0.00 H new ATOM 0 HG23 THR A 114 26.490 10.176 -17.921 1.00 0.00 H new ATOM 1713 N VAL A 115 24.220 12.349 -14.912 1.00 0.00 N ATOM 1714 CA VAL A 115 23.582 11.845 -13.703 1.00 0.00 C ATOM 1715 C VAL A 115 22.057 11.893 -13.853 1.00 0.00 C ATOM 1716 O VAL A 115 21.399 10.910 -13.524 1.00 0.00 O ATOM 1717 CB VAL A 115 24.113 12.599 -12.472 1.00 0.00 C ATOM 1718 CG1 VAL A 115 23.423 12.200 -11.159 1.00 0.00 C ATOM 1719 CG2 VAL A 115 25.620 12.357 -12.290 1.00 0.00 C ATOM 0 H VAL A 115 24.757 13.205 -14.776 1.00 0.00 H new ATOM 0 HA VAL A 115 23.838 10.797 -13.549 1.00 0.00 H new ATOM 0 HB VAL A 115 23.898 13.649 -12.672 1.00 0.00 H new ATOM 0 HG11 VAL A 115 23.849 12.773 -10.335 1.00 0.00 H new ATOM 0 HG12 VAL A 115 22.355 12.408 -11.231 1.00 0.00 H new ATOM 0 HG13 VAL A 115 23.574 11.136 -10.977 1.00 0.00 H new ATOM 0 HG21 VAL A 115 25.972 12.900 -11.413 1.00 0.00 H new ATOM 0 HG22 VAL A 115 25.804 11.291 -12.154 1.00 0.00 H new ATOM 0 HG23 VAL A 115 26.154 12.708 -13.173 1.00 0.00 H new ATOM 1729 N ARG A 116 21.485 12.973 -14.401 1.00 0.00 N ATOM 1730 CA ARG A 116 20.041 13.133 -14.582 1.00 0.00 C ATOM 1731 C ARG A 116 19.489 11.957 -15.374 1.00 0.00 C ATOM 1732 O ARG A 116 18.500 11.355 -14.963 1.00 0.00 O ATOM 1733 CB ARG A 116 19.761 14.498 -15.251 1.00 0.00 C ATOM 1734 CG ARG A 116 18.273 14.896 -15.354 1.00 0.00 C ATOM 1735 CD ARG A 116 17.571 14.735 -16.704 1.00 0.00 C ATOM 1736 NE ARG A 116 18.304 15.351 -17.829 1.00 0.00 N ATOM 1737 CZ ARG A 116 18.743 14.739 -18.936 1.00 0.00 C ATOM 1738 NH1 ARG A 116 18.577 13.432 -19.128 1.00 0.00 N ATOM 1739 NH2 ARG A 116 19.353 15.472 -19.855 1.00 0.00 N ATOM 0 H ARG A 116 22.024 13.772 -14.736 1.00 0.00 H new ATOM 0 HA ARG A 116 19.528 13.132 -13.620 1.00 0.00 H new ATOM 0 HB2 ARG A 116 20.288 15.271 -14.692 1.00 0.00 H new ATOM 0 HB3 ARG A 116 20.186 14.485 -16.255 1.00 0.00 H new ATOM 0 HG2 ARG A 116 17.720 14.310 -14.620 1.00 0.00 H new ATOM 0 HG3 ARG A 116 18.187 15.941 -15.057 1.00 0.00 H new ATOM 0 HD2 ARG A 116 17.434 13.673 -16.909 1.00 0.00 H new ATOM 0 HD3 ARG A 116 16.577 15.179 -16.642 1.00 0.00 H new ATOM 0 HE ARG A 116 18.496 16.350 -17.754 1.00 0.00 H new ATOM 0 HH11 ARG A 116 18.104 12.869 -18.421 1.00 0.00 H new ATOM 0 HH12 ARG A 116 18.923 12.994 -19.982 1.00 0.00 H new ATOM 0 HH21 ARG A 116 19.477 16.474 -19.709 1.00 0.00 H new ATOM 0 HH22 ARG A 116 19.699 15.035 -20.709 1.00 0.00 H new ATOM 1753 N GLY A 117 20.151 11.592 -16.473 1.00 0.00 N ATOM 1754 CA GLY A 117 19.725 10.463 -17.284 1.00 0.00 C ATOM 1755 C GLY A 117 19.936 9.136 -16.565 1.00 0.00 C ATOM 1756 O GLY A 117 19.001 8.340 -16.487 1.00 0.00 O ATOM 0 H GLY A 117 20.985 12.066 -16.818 1.00 0.00 H new ATOM 0 HA2 GLY A 117 18.671 10.575 -17.537 1.00 0.00 H new ATOM 0 HA3 GLY A 117 20.280 10.460 -18.222 1.00 0.00 H new ATOM 1760 N GLN A 118 21.124 8.892 -16.007 1.00 0.00 N ATOM 1761 CA GLN A 118 21.460 7.607 -15.406 1.00 0.00 C ATOM 1762 C GLN A 118 20.577 7.296 -14.193 1.00 0.00 C ATOM 1763 O GLN A 118 20.074 6.179 -14.056 1.00 0.00 O ATOM 1764 CB GLN A 118 22.947 7.584 -15.017 1.00 0.00 C ATOM 1765 CG GLN A 118 23.910 7.509 -16.216 1.00 0.00 C ATOM 1766 CD GLN A 118 24.989 6.439 -16.025 1.00 0.00 C ATOM 1767 OE1 GLN A 118 24.802 5.274 -16.371 1.00 0.00 O ATOM 1768 NE2 GLN A 118 26.130 6.793 -15.454 1.00 0.00 N ATOM 0 H GLN A 118 21.876 9.580 -15.961 1.00 0.00 H new ATOM 0 HA GLN A 118 21.272 6.830 -16.147 1.00 0.00 H new ATOM 0 HB2 GLN A 118 23.174 8.479 -14.438 1.00 0.00 H new ATOM 0 HB3 GLN A 118 23.128 6.729 -14.366 1.00 0.00 H new ATOM 0 HG2 GLN A 118 23.343 7.294 -17.122 1.00 0.00 H new ATOM 0 HG3 GLN A 118 24.385 8.480 -16.360 1.00 0.00 H new ATOM 0 HE21 GLN A 118 26.279 7.761 -15.169 1.00 0.00 H new ATOM 0 HE22 GLN A 118 26.860 6.098 -15.299 1.00 0.00 H new ATOM 1777 N VAL A 119 20.378 8.273 -13.315 1.00 0.00 N ATOM 1778 CA VAL A 119 19.509 8.164 -12.152 1.00 0.00 C ATOM 1779 C VAL A 119 18.064 7.964 -12.615 1.00 0.00 C ATOM 1780 O VAL A 119 17.403 7.084 -12.070 1.00 0.00 O ATOM 1781 CB VAL A 119 19.694 9.395 -11.238 1.00 0.00 C ATOM 1782 CG1 VAL A 119 18.745 9.416 -10.034 1.00 0.00 C ATOM 1783 CG2 VAL A 119 21.120 9.439 -10.665 1.00 0.00 C ATOM 0 H VAL A 119 20.828 9.185 -13.396 1.00 0.00 H new ATOM 0 HA VAL A 119 19.776 7.293 -11.553 1.00 0.00 H new ATOM 0 HB VAL A 119 19.480 10.250 -11.879 1.00 0.00 H new ATOM 0 HG11 VAL A 119 18.933 10.309 -9.438 1.00 0.00 H new ATOM 0 HG12 VAL A 119 17.713 9.424 -10.384 1.00 0.00 H new ATOM 0 HG13 VAL A 119 18.913 8.530 -9.422 1.00 0.00 H new ATOM 0 HG21 VAL A 119 21.228 10.314 -10.024 1.00 0.00 H new ATOM 0 HG22 VAL A 119 21.306 8.537 -10.082 1.00 0.00 H new ATOM 0 HG23 VAL A 119 21.839 9.497 -11.482 1.00 0.00 H new ATOM 1793 N LYS A 120 17.567 8.691 -13.628 1.00 0.00 N ATOM 1794 CA LYS A 120 16.198 8.488 -14.115 1.00 0.00 C ATOM 1795 C LYS A 120 16.004 7.049 -14.579 1.00 0.00 C ATOM 1796 O LYS A 120 15.030 6.402 -14.201 1.00 0.00 O ATOM 1797 CB LYS A 120 15.890 9.505 -15.228 1.00 0.00 C ATOM 1798 CG LYS A 120 14.530 9.262 -15.898 1.00 0.00 C ATOM 1799 CD LYS A 120 14.230 10.348 -16.939 1.00 0.00 C ATOM 1800 CE LYS A 120 12.897 10.114 -17.668 1.00 0.00 C ATOM 1801 NZ LYS A 120 12.925 8.939 -18.576 1.00 0.00 N ATOM 0 H LYS A 120 18.088 9.417 -14.120 1.00 0.00 H new ATOM 0 HA LYS A 120 15.491 8.657 -13.303 1.00 0.00 H new ATOM 0 HB2 LYS A 120 15.909 10.511 -14.809 1.00 0.00 H new ATOM 0 HB3 LYS A 120 16.675 9.459 -15.983 1.00 0.00 H new ATOM 0 HG2 LYS A 120 14.526 8.283 -16.377 1.00 0.00 H new ATOM 0 HG3 LYS A 120 13.745 9.250 -15.142 1.00 0.00 H new ATOM 0 HD2 LYS A 120 14.206 11.321 -16.448 1.00 0.00 H new ATOM 0 HD3 LYS A 120 15.039 10.380 -17.669 1.00 0.00 H new ATOM 0 HE2 LYS A 120 12.106 9.976 -16.930 1.00 0.00 H new ATOM 0 HE3 LYS A 120 12.644 11.004 -18.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 12.090 8.960 -19.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 13.788 8.969 -19.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 12.916 8.065 -18.013 1.00 0.00 H new ATOM 1815 N GLU A 121 16.953 6.539 -15.355 1.00 0.00 N ATOM 1816 CA GLU A 121 16.979 5.169 -15.832 1.00 0.00 C ATOM 1817 C GLU A 121 16.919 4.199 -14.651 1.00 0.00 C ATOM 1818 O GLU A 121 16.170 3.225 -14.684 1.00 0.00 O ATOM 1819 CB GLU A 121 18.246 5.011 -16.701 1.00 0.00 C ATOM 1820 CG GLU A 121 19.083 3.749 -16.482 1.00 0.00 C ATOM 1821 CD GLU A 121 20.200 3.615 -17.533 1.00 0.00 C ATOM 1822 OE1 GLU A 121 19.951 3.046 -18.621 1.00 0.00 O ATOM 1823 OE2 GLU A 121 21.342 4.056 -17.266 1.00 0.00 O ATOM 0 H GLU A 121 17.749 7.088 -15.678 1.00 0.00 H new ATOM 0 HA GLU A 121 16.110 4.932 -16.445 1.00 0.00 H new ATOM 0 HB2 GLU A 121 17.945 5.041 -17.748 1.00 0.00 H new ATOM 0 HB3 GLU A 121 18.886 5.876 -16.528 1.00 0.00 H new ATOM 0 HG2 GLU A 121 19.523 3.773 -15.485 1.00 0.00 H new ATOM 0 HG3 GLU A 121 18.437 2.872 -16.524 1.00 0.00 H new ATOM 1830 N ARG A 122 17.687 4.462 -13.594 1.00 0.00 N ATOM 1831 CA ARG A 122 17.746 3.574 -12.438 1.00 0.00 C ATOM 1832 C ARG A 122 16.448 3.635 -11.632 1.00 0.00 C ATOM 1833 O ARG A 122 15.977 2.581 -11.221 1.00 0.00 O ATOM 1834 CB ARG A 122 18.999 3.874 -11.609 1.00 0.00 C ATOM 1835 CG ARG A 122 20.269 3.334 -12.277 1.00 0.00 C ATOM 1836 CD ARG A 122 21.521 4.104 -11.832 1.00 0.00 C ATOM 1837 NE ARG A 122 22.743 3.645 -12.524 1.00 0.00 N ATOM 1838 CZ ARG A 122 23.023 3.787 -13.829 1.00 0.00 C ATOM 1839 NH1 ARG A 122 22.140 4.334 -14.655 1.00 0.00 N ATOM 1840 NH2 ARG A 122 24.192 3.393 -14.316 1.00 0.00 N ATOM 0 H ARG A 122 18.280 5.289 -13.517 1.00 0.00 H new ATOM 0 HA ARG A 122 17.833 2.541 -12.775 1.00 0.00 H new ATOM 0 HB2 ARG A 122 19.092 4.951 -11.469 1.00 0.00 H new ATOM 0 HB3 ARG A 122 18.894 3.432 -10.618 1.00 0.00 H new ATOM 0 HG2 ARG A 122 20.386 2.278 -12.034 1.00 0.00 H new ATOM 0 HG3 ARG A 122 20.167 3.402 -13.360 1.00 0.00 H new ATOM 0 HD2 ARG A 122 21.377 5.167 -12.023 1.00 0.00 H new ATOM 0 HD3 ARG A 122 21.651 3.988 -10.756 1.00 0.00 H new ATOM 0 HE ARG A 122 23.444 3.173 -11.953 1.00 0.00 H new ATOM 0 HH11 ARG A 122 21.238 4.651 -14.300 1.00 0.00 H new ATOM 0 HH12 ARG A 122 22.363 4.437 -15.645 1.00 0.00 H new ATOM 0 HH21 ARG A 122 24.888 2.978 -13.697 1.00 0.00 H new ATOM 0 HH22 ARG A 122 24.395 3.505 -15.309 1.00 0.00 H new ATOM 1854 N VAL A 123 15.822 4.799 -11.442 1.00 0.00 N ATOM 1855 CA VAL A 123 14.483 4.910 -10.883 1.00 0.00 C ATOM 1856 C VAL A 123 13.507 4.055 -11.700 1.00 0.00 C ATOM 1857 O VAL A 123 12.770 3.269 -11.108 1.00 0.00 O ATOM 1858 CB VAL A 123 14.069 6.392 -10.811 1.00 0.00 C ATOM 1859 CG1 VAL A 123 12.622 6.543 -10.339 1.00 0.00 C ATOM 1860 CG2 VAL A 123 14.945 7.186 -9.831 1.00 0.00 C ATOM 0 H VAL A 123 16.241 5.699 -11.677 1.00 0.00 H new ATOM 0 HA VAL A 123 14.466 4.525 -9.863 1.00 0.00 H new ATOM 0 HB VAL A 123 14.189 6.781 -11.822 1.00 0.00 H new ATOM 0 HG11 VAL A 123 12.361 7.600 -10.299 1.00 0.00 H new ATOM 0 HG12 VAL A 123 11.957 6.031 -11.035 1.00 0.00 H new ATOM 0 HG13 VAL A 123 12.515 6.105 -9.347 1.00 0.00 H new ATOM 0 HG21 VAL A 123 14.618 8.226 -9.811 1.00 0.00 H new ATOM 0 HG22 VAL A 123 14.854 6.758 -8.833 1.00 0.00 H new ATOM 0 HG23 VAL A 123 15.985 7.138 -10.152 1.00 0.00 H new ATOM 1870 N GLU A 124 13.512 4.145 -13.037 1.00 0.00 N ATOM 1871 CA GLU A 124 12.632 3.320 -13.864 1.00 0.00 C ATOM 1872 C GLU A 124 12.916 1.833 -13.636 1.00 0.00 C ATOM 1873 O GLU A 124 11.993 1.023 -13.542 1.00 0.00 O ATOM 1874 CB GLU A 124 12.769 3.659 -15.361 1.00 0.00 C ATOM 1875 CG GLU A 124 12.217 5.043 -15.725 1.00 0.00 C ATOM 1876 CD GLU A 124 12.309 5.347 -17.230 1.00 0.00 C ATOM 1877 OE1 GLU A 124 11.707 4.614 -18.049 1.00 0.00 O ATOM 1878 OE2 GLU A 124 12.951 6.355 -17.604 1.00 0.00 O ATOM 0 H GLU A 124 14.114 4.779 -13.563 1.00 0.00 H new ATOM 0 HA GLU A 124 11.607 3.539 -13.563 1.00 0.00 H new ATOM 0 HB2 GLU A 124 13.821 3.610 -15.642 1.00 0.00 H new ATOM 0 HB3 GLU A 124 12.247 2.902 -15.947 1.00 0.00 H new ATOM 0 HG2 GLU A 124 11.176 5.108 -15.409 1.00 0.00 H new ATOM 0 HG3 GLU A 124 12.766 5.805 -15.171 1.00 0.00 H new ATOM 1885 N ASN A 125 14.194 1.482 -13.500 1.00 0.00 N ATOM 1886 CA ASN A 125 14.646 0.124 -13.248 1.00 0.00 C ATOM 1887 C ASN A 125 14.105 -0.380 -11.912 1.00 0.00 C ATOM 1888 O ASN A 125 13.588 -1.491 -11.831 1.00 0.00 O ATOM 1889 CB ASN A 125 16.183 0.070 -13.277 1.00 0.00 C ATOM 1890 CG ASN A 125 16.687 -1.284 -13.746 1.00 0.00 C ATOM 1891 OD1 ASN A 125 16.647 -2.272 -13.018 1.00 0.00 O ATOM 1892 ND2 ASN A 125 17.175 -1.343 -14.974 1.00 0.00 N ATOM 0 H ASN A 125 14.959 2.154 -13.564 1.00 0.00 H new ATOM 0 HA ASN A 125 14.263 -0.529 -14.032 1.00 0.00 H new ATOM 0 HB2 ASN A 125 16.562 0.849 -13.938 1.00 0.00 H new ATOM 0 HB3 ASN A 125 16.574 0.279 -12.281 1.00 0.00 H new ATOM 0 HD21 ASN A 125 17.531 -2.226 -15.339 1.00 0.00 H new ATOM 0 HD22 ASN A 125 17.195 -0.505 -15.556 1.00 0.00 H new ATOM 1899 N LEU A 126 14.190 0.448 -10.868 1.00 0.00 N ATOM 1900 CA LEU A 126 13.719 0.122 -9.528 1.00 0.00 C ATOM 1901 C LEU A 126 12.206 -0.067 -9.537 1.00 0.00 C ATOM 1902 O LEU A 126 11.735 -1.088 -9.054 1.00 0.00 O ATOM 1903 CB LEU A 126 14.294 1.082 -8.457 1.00 0.00 C ATOM 1904 CG LEU A 126 13.316 2.114 -7.872 1.00 0.00 C ATOM 1905 CD1 LEU A 126 12.444 1.532 -6.755 1.00 0.00 C ATOM 1906 CD2 LEU A 126 14.033 3.320 -7.276 1.00 0.00 C ATOM 0 H LEU A 126 14.597 1.381 -10.936 1.00 0.00 H new ATOM 0 HA LEU A 126 14.118 -0.843 -9.214 1.00 0.00 H new ATOM 0 HB2 LEU A 126 14.690 0.482 -7.637 1.00 0.00 H new ATOM 0 HB3 LEU A 126 15.136 1.618 -8.895 1.00 0.00 H new ATOM 0 HG LEU A 126 12.700 2.412 -8.720 1.00 0.00 H new ATOM 0 HD11 LEU A 126 11.772 2.304 -6.378 1.00 0.00 H new ATOM 0 HD12 LEU A 126 11.858 0.701 -7.147 1.00 0.00 H new ATOM 0 HD13 LEU A 126 13.080 1.177 -5.944 1.00 0.00 H new ATOM 0 HD21 LEU A 126 13.298 4.019 -6.876 1.00 0.00 H new ATOM 0 HD22 LEU A 126 14.694 2.991 -6.474 1.00 0.00 H new ATOM 0 HD23 LEU A 126 14.620 3.814 -8.051 1.00 0.00 H new ATOM 1918 N ILE A 127 11.452 0.847 -10.147 1.00 0.00 N ATOM 1919 CA ILE A 127 10.007 0.750 -10.304 1.00 0.00 C ATOM 1920 C ILE A 127 9.636 -0.550 -11.025 1.00 0.00 C ATOM 1921 O ILE A 127 8.640 -1.173 -10.657 1.00 0.00 O ATOM 1922 CB ILE A 127 9.520 2.003 -11.066 1.00 0.00 C ATOM 1923 CG1 ILE A 127 9.596 3.266 -10.178 1.00 0.00 C ATOM 1924 CG2 ILE A 127 8.089 1.809 -11.584 1.00 0.00 C ATOM 1925 CD1 ILE A 127 9.517 4.570 -10.985 1.00 0.00 C ATOM 0 H ILE A 127 11.843 1.696 -10.555 1.00 0.00 H new ATOM 0 HA ILE A 127 9.514 0.717 -9.333 1.00 0.00 H new ATOM 0 HB ILE A 127 10.184 2.144 -11.919 1.00 0.00 H new ATOM 0 HG12 ILE A 127 8.782 3.244 -9.453 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.528 3.251 -9.612 1.00 0.00 H new ATOM 0 HG21 ILE A 127 7.770 2.705 -12.116 1.00 0.00 H new ATOM 0 HG22 ILE A 127 8.060 0.955 -12.261 1.00 0.00 H new ATOM 0 HG23 ILE A 127 7.419 1.629 -10.743 1.00 0.00 H new ATOM 0 HD11 ILE A 127 9.575 5.422 -10.307 1.00 0.00 H new ATOM 0 HD12 ILE A 127 10.346 4.611 -11.692 1.00 0.00 H new ATOM 0 HD13 ILE A 127 8.574 4.604 -11.530 1.00 0.00 H new ATOM 1937 N ALA A 128 10.401 -0.994 -12.023 1.00 0.00 N ATOM 1938 CA ALA A 128 10.034 -2.163 -12.823 1.00 0.00 C ATOM 1939 C ALA A 128 9.928 -3.427 -11.955 1.00 0.00 C ATOM 1940 O ALA A 128 9.154 -4.337 -12.256 1.00 0.00 O ATOM 1941 CB ALA A 128 11.043 -2.360 -13.960 1.00 0.00 C ATOM 0 H ALA A 128 11.282 -0.560 -12.297 1.00 0.00 H new ATOM 0 HA ALA A 128 9.050 -1.985 -13.256 1.00 0.00 H new ATOM 0 HB1 ALA A 128 10.761 -3.232 -14.550 1.00 0.00 H new ATOM 0 HB2 ALA A 128 11.048 -1.477 -14.599 1.00 0.00 H new ATOM 0 HB3 ALA A 128 12.038 -2.511 -13.541 1.00 0.00 H new ATOM 1947 N LYS A 129 10.698 -3.470 -10.865 1.00 0.00 N ATOM 1948 CA LYS A 129 10.775 -4.574 -9.920 1.00 0.00 C ATOM 1949 C LYS A 129 9.553 -4.649 -8.995 1.00 0.00 C ATOM 1950 O LYS A 129 9.306 -5.707 -8.416 1.00 0.00 O ATOM 1951 CB LYS A 129 12.043 -4.390 -9.080 1.00 0.00 C ATOM 1952 CG LYS A 129 13.316 -4.417 -9.943 1.00 0.00 C ATOM 1953 CD LYS A 129 14.549 -4.000 -9.134 1.00 0.00 C ATOM 1954 CE LYS A 129 15.655 -3.405 -10.023 1.00 0.00 C ATOM 1955 NZ LYS A 129 16.129 -4.318 -11.092 1.00 0.00 N ATOM 0 H LYS A 129 11.312 -2.696 -10.610 1.00 0.00 H new ATOM 0 HA LYS A 129 10.799 -5.507 -10.484 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.988 -3.442 -8.544 1.00 0.00 H new ATOM 0 HB3 LYS A 129 12.098 -5.178 -8.329 1.00 0.00 H new ATOM 0 HG2 LYS A 129 13.464 -5.420 -10.344 1.00 0.00 H new ATOM 0 HG3 LYS A 129 13.194 -3.748 -10.795 1.00 0.00 H new ATOM 0 HD2 LYS A 129 14.257 -3.267 -8.382 1.00 0.00 H new ATOM 0 HD3 LYS A 129 14.941 -4.866 -8.600 1.00 0.00 H new ATOM 0 HE2 LYS A 129 15.284 -2.488 -10.481 1.00 0.00 H new ATOM 0 HE3 LYS A 129 16.502 -3.128 -9.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 16.383 -3.764 -11.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 16.963 -4.841 -10.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 15.373 -4.990 -11.335 1.00 0.00 H new ATOM 1969 N ILE A 130 8.792 -3.557 -8.850 1.00 0.00 N ATOM 1970 CA ILE A 130 7.749 -3.376 -7.854 1.00 0.00 C ATOM 1971 C ILE A 130 6.373 -3.001 -8.409 1.00 0.00 C ATOM 1972 O ILE A 130 5.370 -3.190 -7.715 1.00 0.00 O ATOM 1973 CB ILE A 130 8.235 -2.312 -6.852 1.00 0.00 C ATOM 1974 CG1 ILE A 130 8.744 -1.009 -7.492 1.00 0.00 C ATOM 1975 CG2 ILE A 130 9.287 -2.955 -5.933 1.00 0.00 C ATOM 1976 CD1 ILE A 130 9.391 -0.036 -6.509 1.00 0.00 C ATOM 0 H ILE A 130 8.898 -2.743 -9.456 1.00 0.00 H new ATOM 0 HA ILE A 130 7.589 -4.344 -7.380 1.00 0.00 H new ATOM 0 HB ILE A 130 7.371 -1.988 -6.272 1.00 0.00 H new ATOM 0 HG12 ILE A 130 9.468 -1.258 -8.268 1.00 0.00 H new ATOM 0 HG13 ILE A 130 7.909 -0.509 -7.983 1.00 0.00 H new ATOM 0 HG21 ILE A 130 9.644 -2.216 -5.215 1.00 0.00 H new ATOM 0 HG22 ILE A 130 8.840 -3.793 -5.399 1.00 0.00 H new ATOM 0 HG23 ILE A 130 10.124 -3.312 -6.533 1.00 0.00 H new ATOM 0 HD11 ILE A 130 9.721 0.855 -7.043 1.00 0.00 H new ATOM 0 HD12 ILE A 130 8.666 0.246 -5.746 1.00 0.00 H new ATOM 0 HD13 ILE A 130 10.248 -0.514 -6.035 1.00 0.00 H new ATOM 1988 N SER A 131 6.344 -2.475 -9.629 1.00 0.00 N ATOM 1989 CA SER A 131 5.154 -2.187 -10.424 1.00 0.00 C ATOM 1990 C SER A 131 4.137 -3.329 -10.321 1.00 0.00 C ATOM 1991 O SER A 131 4.511 -4.500 -10.551 1.00 0.00 O ATOM 1992 CB SER A 131 5.548 -1.953 -11.885 1.00 0.00 C ATOM 1993 OG SER A 131 6.370 -0.813 -12.004 1.00 0.00 O ATOM 1994 OXT SER A 131 2.955 -3.050 -10.033 1.00 0.00 O ATOM 0 H SER A 131 7.202 -2.223 -10.119 1.00 0.00 H new ATOM 0 HA SER A 131 4.686 -1.284 -10.032 1.00 0.00 H new ATOM 0 HB2 SER A 131 6.073 -2.827 -12.270 1.00 0.00 H new ATOM 0 HB3 SER A 131 4.652 -1.826 -12.493 1.00 0.00 H new ATOM 0 HG SER A 131 7.287 -1.043 -11.748 1.00 0.00 H new TER 2000 SER A 131