USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=27 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 29 LYS NZ :NH3+ 161:sc= 2.05 (180deg=0.298) USER MOD Set 1.2: A 131 SER OG : rot 180:sc= 0.759 USER MOD Set 2.1: A 11 ASN : amide:sc= -1.37 K(o=-1.4,f=-4.4!) USER MOD Set 2.2: A 34 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 8 SER OG : rot 86:sc= 0.83 USER MOD Set 3.2: A 15 SER OG : rot 177:sc= 2.23 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 167:sc= 2.52 (180deg=2.35) USER MOD Single : A 3 LYS NZ :NH3+ 173:sc= 1.2 (180deg=1.16) USER MOD Single : A 5 MET CE :methyl -168:sc= -2.36 (180deg=-2.89!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 170:sc= -0.372 USER MOD Single : A 13 SER OG : rot -172:sc= 1.58 USER MOD Single : A 16 GLN : amide:sc= 0.404 K(o=0.4,f=-4!) USER MOD Single : A 17 MET CE :methyl 175:sc=-0.00924 (180deg=-0.0476) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot -74:sc= 0.257 USER MOD Single : A 33 THR OG1 : rot 167:sc= 1.04 USER MOD Single : A 35 SER OG : rot 180:sc= -0.0123 USER MOD Single : A 39 SER OG : rot 180:sc= 0.0454 USER MOD Single : A 40 SER OG : rot 180:sc= -0.0467 USER MOD Single : A 43 HIS : no HD1:sc= 1.02 K(o=1,f=-8.1!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 173:sc= -0.628 (180deg=-0.691) USER MOD Single : A 50 MET CE :methyl -156:sc= -0.694 (180deg=-2.97!) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 60 GLN : amide:sc= -0.666 K(o=-0.67,f=-1.6!) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot -150:sc= 1.27 USER MOD Single : A 67 ASN : amide:sc= 0.647 K(o=0.65,f=0) USER MOD Single : A 69 ASN : amide:sc= -0.0457 X(o=-0.046,f=-0.075) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot -129:sc= 1.17 USER MOD Single : A 85 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0.00226 USER MOD Single : A 93 GLN : amide:sc= -0.159 K(o=-0.16,f=-2.9) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 GLN : amide:sc= 0.524 K(o=0.52,f=-0.58) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 74:sc= 1.22 USER MOD Single : A 118 GLN : amide:sc= -0.135 X(o=-0.14,f=-0.38) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= -0.102 K(o=-0.1,f=-1.3) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.829 -0.505 0.290 1.00 0.00 N ATOM 2 CA MET A 1 1.628 -0.528 -0.983 1.00 0.00 C ATOM 3 C MET A 1 2.034 -1.967 -1.353 1.00 0.00 C ATOM 4 O MET A 1 2.644 -2.655 -0.541 1.00 0.00 O ATOM 5 CB MET A 1 2.878 0.390 -0.890 1.00 0.00 C ATOM 6 CG MET A 1 3.566 0.655 -2.237 1.00 0.00 C ATOM 7 SD MET A 1 5.129 1.570 -2.095 1.00 0.00 S ATOM 8 CE MET A 1 4.538 3.239 -1.686 1.00 0.00 C ATOM 0 H1 MET A 1 0.567 0.475 0.518 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.033 -1.074 0.169 1.00 0.00 H new ATOM 0 H3 MET A 1 1.399 -0.900 1.065 1.00 0.00 H new ATOM 0 HA MET A 1 0.990 -0.138 -1.776 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.583 1.343 -0.452 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.599 -0.064 -0.210 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.757 -0.298 -2.730 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.885 1.215 -2.878 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.390 3.908 -1.569 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.897 3.605 -2.488 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.972 3.207 -0.755 1.00 0.00 H new ATOM 20 N LYS A 2 1.773 -2.420 -2.591 1.00 0.00 N ATOM 21 CA LYS A 2 2.169 -3.759 -3.092 1.00 0.00 C ATOM 22 C LYS A 2 3.584 -3.705 -3.690 1.00 0.00 C ATOM 23 O LYS A 2 3.745 -3.500 -4.889 1.00 0.00 O ATOM 24 CB LYS A 2 1.123 -4.263 -4.121 1.00 0.00 C ATOM 25 CG LYS A 2 -0.326 -4.332 -3.601 1.00 0.00 C ATOM 26 CD LYS A 2 -0.651 -5.554 -2.724 1.00 0.00 C ATOM 27 CE LYS A 2 -1.005 -6.791 -3.571 1.00 0.00 C ATOM 28 NZ LYS A 2 -1.526 -7.898 -2.725 1.00 0.00 N ATOM 0 H LYS A 2 1.275 -1.864 -3.286 1.00 0.00 H new ATOM 0 HA LYS A 2 2.193 -4.468 -2.265 1.00 0.00 H new ATOM 0 HB2 LYS A 2 1.149 -3.608 -4.992 1.00 0.00 H new ATOM 0 HB3 LYS A 2 1.419 -5.256 -4.459 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -0.532 -3.428 -3.028 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -1.002 -4.328 -4.456 1.00 0.00 H new ATOM 0 HD2 LYS A 2 0.204 -5.782 -2.088 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -1.485 -5.315 -2.064 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -1.751 -6.521 -4.318 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -0.121 -7.129 -4.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -1.957 -8.625 -3.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -0.744 -8.318 -2.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.241 -7.526 -2.068 1.00 0.00 H new ATOM 42 N LYS A 3 4.618 -3.806 -2.848 1.00 0.00 N ATOM 43 CA LYS A 3 6.025 -3.679 -3.290 1.00 0.00 C ATOM 44 C LYS A 3 6.486 -4.918 -4.064 1.00 0.00 C ATOM 45 O LYS A 3 6.031 -6.029 -3.802 1.00 0.00 O ATOM 46 CB LYS A 3 6.984 -3.366 -2.128 1.00 0.00 C ATOM 47 CG LYS A 3 6.515 -2.211 -1.243 1.00 0.00 C ATOM 48 CD LYS A 3 7.521 -1.898 -0.133 1.00 0.00 C ATOM 49 CE LYS A 3 6.862 -0.932 0.861 1.00 0.00 C ATOM 50 NZ LYS A 3 7.770 -0.621 1.998 1.00 0.00 N ATOM 0 H LYS A 3 4.513 -3.977 -1.848 1.00 0.00 H new ATOM 0 HA LYS A 3 6.058 -2.826 -3.967 1.00 0.00 H new ATOM 0 HB2 LYS A 3 7.101 -4.259 -1.514 1.00 0.00 H new ATOM 0 HB3 LYS A 3 7.967 -3.126 -2.533 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.363 -1.323 -1.856 1.00 0.00 H new ATOM 0 HG3 LYS A 3 5.551 -2.461 -0.800 1.00 0.00 H new ATOM 0 HD2 LYS A 3 7.824 -2.814 0.373 1.00 0.00 H new ATOM 0 HD3 LYS A 3 8.423 -1.453 -0.553 1.00 0.00 H new ATOM 0 HE2 LYS A 3 6.589 -0.010 0.348 1.00 0.00 H new ATOM 0 HE3 LYS A 3 5.939 -1.371 1.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 7.345 0.122 2.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 7.915 -1.477 2.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 8.685 -0.291 1.631 1.00 0.00 H new ATOM 64 N VAL A 4 7.416 -4.717 -4.994 1.00 0.00 N ATOM 65 CA VAL A 4 7.917 -5.758 -5.906 1.00 0.00 C ATOM 66 C VAL A 4 9.353 -6.144 -5.564 1.00 0.00 C ATOM 67 O VAL A 4 10.122 -5.281 -5.155 1.00 0.00 O ATOM 68 CB VAL A 4 7.822 -5.290 -7.369 1.00 0.00 C ATOM 69 CG1 VAL A 4 8.251 -6.377 -8.363 1.00 0.00 C ATOM 70 CG2 VAL A 4 6.395 -4.876 -7.753 1.00 0.00 C ATOM 0 H VAL A 4 7.856 -3.809 -5.143 1.00 0.00 H new ATOM 0 HA VAL A 4 7.290 -6.641 -5.782 1.00 0.00 H new ATOM 0 HB VAL A 4 8.498 -4.437 -7.429 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.165 -5.994 -9.380 1.00 0.00 H new ATOM 0 HG12 VAL A 4 9.285 -6.660 -8.168 1.00 0.00 H new ATOM 0 HG13 VAL A 4 7.608 -7.250 -8.248 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.377 -4.553 -8.794 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.723 -5.725 -7.625 1.00 0.00 H new ATOM 0 HG23 VAL A 4 6.070 -4.056 -7.113 1.00 0.00 H new ATOM 80 N MET A 5 9.729 -7.408 -5.763 1.00 0.00 N ATOM 81 CA MET A 5 11.123 -7.863 -5.703 1.00 0.00 C ATOM 82 C MET A 5 11.467 -8.718 -6.932 1.00 0.00 C ATOM 83 O MET A 5 10.882 -9.783 -7.125 1.00 0.00 O ATOM 84 CB MET A 5 11.425 -8.623 -4.399 1.00 0.00 C ATOM 85 CG MET A 5 12.911 -9.023 -4.338 1.00 0.00 C ATOM 86 SD MET A 5 14.038 -7.614 -4.436 1.00 0.00 S ATOM 87 CE MET A 5 14.177 -7.140 -2.700 1.00 0.00 C ATOM 0 H MET A 5 9.068 -8.156 -5.973 1.00 0.00 H new ATOM 0 HA MET A 5 11.757 -6.977 -5.710 1.00 0.00 H new ATOM 0 HB2 MET A 5 11.175 -7.998 -3.541 1.00 0.00 H new ATOM 0 HB3 MET A 5 10.800 -9.514 -4.338 1.00 0.00 H new ATOM 0 HG2 MET A 5 13.096 -9.563 -3.410 1.00 0.00 H new ATOM 0 HG3 MET A 5 13.128 -9.710 -5.156 1.00 0.00 H new ATOM 0 HE1 MET A 5 14.662 -6.167 -2.626 1.00 0.00 H new ATOM 0 HE2 MET A 5 13.182 -7.084 -2.257 1.00 0.00 H new ATOM 0 HE3 MET A 5 14.770 -7.883 -2.166 1.00 0.00 H new ATOM 97 N PHE A 6 12.428 -8.283 -7.748 1.00 0.00 N ATOM 98 CA PHE A 6 13.017 -9.080 -8.832 1.00 0.00 C ATOM 99 C PHE A 6 14.201 -9.903 -8.331 1.00 0.00 C ATOM 100 O PHE A 6 15.096 -9.345 -7.703 1.00 0.00 O ATOM 101 CB PHE A 6 13.470 -8.171 -9.981 1.00 0.00 C ATOM 102 CG PHE A 6 12.359 -7.297 -10.501 1.00 0.00 C ATOM 103 CD1 PHE A 6 11.292 -7.857 -11.223 1.00 0.00 C ATOM 104 CD2 PHE A 6 12.324 -5.940 -10.148 1.00 0.00 C ATOM 105 CE1 PHE A 6 10.174 -7.083 -11.536 1.00 0.00 C ATOM 106 CE2 PHE A 6 11.202 -5.161 -10.454 1.00 0.00 C ATOM 107 CZ PHE A 6 10.118 -5.731 -11.152 1.00 0.00 C ATOM 0 H PHE A 6 12.829 -7.348 -7.675 1.00 0.00 H new ATOM 0 HA PHE A 6 12.249 -9.763 -9.195 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.292 -7.542 -9.639 1.00 0.00 H new ATOM 0 HB3 PHE A 6 13.855 -8.785 -10.795 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.337 -8.889 -11.537 1.00 0.00 H new ATOM 0 HD2 PHE A 6 13.166 -5.495 -9.638 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.348 -7.524 -12.075 1.00 0.00 H new ATOM 0 HE2 PHE A 6 11.167 -4.124 -10.155 1.00 0.00 H new ATOM 0 HZ PHE A 6 9.250 -5.134 -11.390 1.00 0.00 H new ATOM 117 N VAL A 7 14.239 -11.199 -8.647 1.00 0.00 N ATOM 118 CA VAL A 7 15.221 -12.164 -8.131 1.00 0.00 C ATOM 119 C VAL A 7 15.901 -12.911 -9.283 1.00 0.00 C ATOM 120 O VAL A 7 15.236 -13.516 -10.120 1.00 0.00 O ATOM 121 CB VAL A 7 14.571 -13.162 -7.147 1.00 0.00 C ATOM 122 CG1 VAL A 7 15.661 -13.890 -6.348 1.00 0.00 C ATOM 123 CG2 VAL A 7 13.643 -12.486 -6.128 1.00 0.00 C ATOM 0 H VAL A 7 13.568 -11.622 -9.288 1.00 0.00 H new ATOM 0 HA VAL A 7 15.979 -11.603 -7.584 1.00 0.00 H new ATOM 0 HB VAL A 7 13.983 -13.846 -7.759 1.00 0.00 H new ATOM 0 HG11 VAL A 7 15.197 -14.592 -5.656 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.313 -14.432 -7.033 1.00 0.00 H new ATOM 0 HG13 VAL A 7 16.248 -13.163 -5.787 1.00 0.00 H new ATOM 0 HG21 VAL A 7 13.218 -13.241 -5.466 1.00 0.00 H new ATOM 0 HG22 VAL A 7 14.212 -11.766 -5.540 1.00 0.00 H new ATOM 0 HG23 VAL A 7 12.839 -11.971 -6.654 1.00 0.00 H new ATOM 133 N SER A 8 17.237 -12.892 -9.300 1.00 0.00 N ATOM 134 CA SER A 8 18.073 -13.555 -10.331 1.00 0.00 C ATOM 135 C SER A 8 19.314 -14.200 -9.710 1.00 0.00 C ATOM 136 O SER A 8 19.630 -13.935 -8.554 1.00 0.00 O ATOM 137 CB SER A 8 18.544 -12.526 -11.370 1.00 0.00 C ATOM 138 OG SER A 8 17.473 -11.752 -11.846 1.00 0.00 O ATOM 0 H SER A 8 17.787 -12.410 -8.589 1.00 0.00 H new ATOM 0 HA SER A 8 17.460 -14.324 -10.801 1.00 0.00 H new ATOM 0 HB2 SER A 8 19.296 -11.875 -10.924 1.00 0.00 H new ATOM 0 HB3 SER A 8 19.022 -13.041 -12.204 1.00 0.00 H new ATOM 0 HG SER A 8 17.326 -10.992 -11.245 1.00 0.00 H new ATOM 144 N LYS A 9 20.097 -14.982 -10.476 1.00 0.00 N ATOM 145 CA LYS A 9 21.428 -15.438 -10.002 1.00 0.00 C ATOM 146 C LYS A 9 22.364 -14.236 -9.833 1.00 0.00 C ATOM 147 O LYS A 9 22.957 -14.075 -8.780 1.00 0.00 O ATOM 148 CB LYS A 9 21.993 -16.557 -10.905 1.00 0.00 C ATOM 149 CG LYS A 9 23.275 -17.172 -10.301 1.00 0.00 C ATOM 150 CD LYS A 9 23.730 -18.477 -10.975 1.00 0.00 C ATOM 151 CE LYS A 9 24.244 -18.281 -12.413 1.00 0.00 C ATOM 152 NZ LYS A 9 24.776 -19.557 -12.977 1.00 0.00 N ATOM 0 H LYS A 9 19.843 -15.309 -11.408 1.00 0.00 H new ATOM 0 HA LYS A 9 21.329 -15.894 -9.017 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.241 -17.335 -11.037 1.00 0.00 H new ATOM 0 HB3 LYS A 9 22.211 -16.154 -11.894 1.00 0.00 H new ATOM 0 HG2 LYS A 9 24.081 -16.442 -10.369 1.00 0.00 H new ATOM 0 HG3 LYS A 9 23.107 -17.364 -9.241 1.00 0.00 H new ATOM 0 HD2 LYS A 9 24.519 -18.930 -10.375 1.00 0.00 H new ATOM 0 HD3 LYS A 9 22.896 -19.179 -10.989 1.00 0.00 H new ATOM 0 HE2 LYS A 9 23.435 -17.911 -13.043 1.00 0.00 H new ATOM 0 HE3 LYS A 9 25.027 -17.523 -12.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 25.115 -19.393 -13.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 25.563 -19.896 -12.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 24.021 -20.272 -12.990 1.00 0.00 H new ATOM 166 N ARG A 10 22.400 -13.338 -10.824 1.00 0.00 N ATOM 167 CA ARG A 10 23.060 -12.015 -10.751 1.00 0.00 C ATOM 168 C ARG A 10 22.027 -10.939 -10.452 1.00 0.00 C ATOM 169 O ARG A 10 21.216 -10.646 -11.322 1.00 0.00 O ATOM 170 CB ARG A 10 23.729 -11.684 -12.105 1.00 0.00 C ATOM 171 CG ARG A 10 25.232 -11.960 -12.137 1.00 0.00 C ATOM 172 CD ARG A 10 25.550 -13.457 -12.120 1.00 0.00 C ATOM 173 NE ARG A 10 27.003 -13.648 -12.182 1.00 0.00 N ATOM 174 CZ ARG A 10 27.757 -13.583 -13.263 1.00 0.00 C ATOM 175 NH1 ARG A 10 27.280 -13.533 -14.474 1.00 0.00 N ATOM 176 NH2 ARG A 10 29.052 -13.543 -13.155 1.00 0.00 N ATOM 0 H ARG A 10 21.960 -13.510 -11.728 1.00 0.00 H new ATOM 0 HA ARG A 10 23.811 -12.045 -9.961 1.00 0.00 H new ATOM 0 HB2 ARG A 10 23.246 -12.266 -12.890 1.00 0.00 H new ATOM 0 HB3 ARG A 10 23.558 -10.633 -12.336 1.00 0.00 H new ATOM 0 HG2 ARG A 10 25.662 -11.510 -13.032 1.00 0.00 H new ATOM 0 HG3 ARG A 10 25.705 -11.481 -11.280 1.00 0.00 H new ATOM 0 HD2 ARG A 10 25.150 -13.914 -11.215 1.00 0.00 H new ATOM 0 HD3 ARG A 10 25.071 -13.951 -12.965 1.00 0.00 H new ATOM 0 HE ARG A 10 27.478 -13.851 -11.302 1.00 0.00 H new ATOM 0 HH11 ARG A 10 26.271 -13.543 -14.626 1.00 0.00 H new ATOM 0 HH12 ARG A 10 27.915 -13.484 -15.271 1.00 0.00 H new ATOM 0 HH21 ARG A 10 29.488 -13.562 -12.233 1.00 0.00 H new ATOM 0 HH22 ARG A 10 29.632 -13.493 -13.992 1.00 0.00 H new ATOM 190 N ASN A 11 22.076 -10.288 -9.291 1.00 0.00 N ATOM 191 CA ASN A 11 21.234 -9.097 -9.097 1.00 0.00 C ATOM 192 C ASN A 11 21.643 -8.005 -10.117 1.00 0.00 C ATOM 193 O ASN A 11 20.799 -7.430 -10.802 1.00 0.00 O ATOM 194 CB ASN A 11 21.324 -8.630 -7.635 1.00 0.00 C ATOM 195 CG ASN A 11 20.337 -7.518 -7.307 1.00 0.00 C ATOM 196 OD1 ASN A 11 19.711 -6.889 -8.139 1.00 0.00 O ATOM 197 ND2 ASN A 11 20.117 -7.255 -6.050 1.00 0.00 N ATOM 0 H ASN A 11 22.662 -10.546 -8.497 1.00 0.00 H new ATOM 0 HA ASN A 11 20.186 -9.330 -9.285 1.00 0.00 H new ATOM 0 HB2 ASN A 11 21.140 -9.478 -6.976 1.00 0.00 H new ATOM 0 HB3 ASN A 11 22.337 -8.282 -7.432 1.00 0.00 H new ATOM 0 HD21 ASN A 11 19.437 -6.540 -5.790 1.00 0.00 H new ATOM 0 HD22 ASN A 11 20.625 -7.764 -5.326 1.00 0.00 H new ATOM 204 N SER A 12 22.958 -7.852 -10.307 1.00 0.00 N ATOM 205 CA SER A 12 23.636 -6.978 -11.274 1.00 0.00 C ATOM 206 C SER A 12 23.109 -6.994 -12.708 1.00 0.00 C ATOM 207 O SER A 12 23.201 -5.979 -13.400 1.00 0.00 O ATOM 208 CB SER A 12 25.080 -7.446 -11.374 1.00 0.00 C ATOM 209 OG SER A 12 25.122 -8.834 -11.637 1.00 0.00 O ATOM 0 H SER A 12 23.629 -8.376 -9.746 1.00 0.00 H new ATOM 0 HA SER A 12 23.478 -5.970 -10.892 1.00 0.00 H new ATOM 0 HB2 SER A 12 25.593 -6.902 -12.167 1.00 0.00 H new ATOM 0 HB3 SER A 12 25.607 -7.228 -10.445 1.00 0.00 H new ATOM 0 HG SER A 12 26.039 -9.097 -11.859 1.00 0.00 H new ATOM 215 N SER A 13 22.615 -8.145 -13.177 1.00 0.00 N ATOM 216 CA SER A 13 22.110 -8.319 -14.535 1.00 0.00 C ATOM 217 C SER A 13 20.584 -8.217 -14.549 1.00 0.00 C ATOM 218 O SER A 13 20.034 -7.123 -14.532 1.00 0.00 O ATOM 219 CB SER A 13 22.711 -9.573 -15.195 1.00 0.00 C ATOM 220 OG SER A 13 22.191 -10.747 -14.597 1.00 0.00 O ATOM 0 H SER A 13 22.556 -8.992 -12.612 1.00 0.00 H new ATOM 0 HA SER A 13 22.449 -7.504 -15.174 1.00 0.00 H new ATOM 0 HB2 SER A 13 22.488 -9.572 -16.262 1.00 0.00 H new ATOM 0 HB3 SER A 13 23.796 -9.558 -15.097 1.00 0.00 H new ATOM 0 HG SER A 13 22.678 -11.528 -14.932 1.00 0.00 H new ATOM 226 N ARG A 14 19.869 -9.341 -14.528 1.00 0.00 N ATOM 227 CA ARG A 14 18.419 -9.420 -14.766 1.00 0.00 C ATOM 228 C ARG A 14 17.584 -8.696 -13.718 1.00 0.00 C ATOM 229 O ARG A 14 16.699 -7.942 -14.109 1.00 0.00 O ATOM 230 CB ARG A 14 18.038 -10.893 -14.943 1.00 0.00 C ATOM 231 CG ARG A 14 18.536 -11.425 -16.299 1.00 0.00 C ATOM 232 CD ARG A 14 18.580 -12.949 -16.272 1.00 0.00 C ATOM 233 NE ARG A 14 19.711 -13.438 -15.448 1.00 0.00 N ATOM 234 CZ ARG A 14 19.843 -14.637 -14.920 1.00 0.00 C ATOM 235 NH1 ARG A 14 18.901 -15.524 -14.960 1.00 0.00 N ATOM 236 NH2 ARG A 14 20.956 -14.961 -14.337 1.00 0.00 N ATOM 0 H ARG A 14 20.290 -10.251 -14.340 1.00 0.00 H new ATOM 0 HA ARG A 14 18.184 -8.880 -15.683 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.468 -11.485 -14.135 1.00 0.00 H new ATOM 0 HB3 ARG A 14 16.956 -11.004 -14.879 1.00 0.00 H new ATOM 0 HG2 ARG A 14 17.876 -11.085 -17.098 1.00 0.00 H new ATOM 0 HG3 ARG A 14 19.528 -11.027 -16.514 1.00 0.00 H new ATOM 0 HD2 ARG A 14 17.642 -13.336 -15.873 1.00 0.00 H new ATOM 0 HD3 ARG A 14 18.675 -13.331 -17.288 1.00 0.00 H new ATOM 0 HE ARG A 14 20.467 -12.776 -15.271 1.00 0.00 H new ATOM 0 HH11 ARG A 14 18.014 -15.306 -15.414 1.00 0.00 H new ATOM 0 HH12 ARG A 14 19.046 -16.441 -14.538 1.00 0.00 H new ATOM 0 HH21 ARG A 14 21.722 -14.289 -14.290 1.00 0.00 H new ATOM 0 HH22 ARG A 14 21.065 -15.888 -13.926 1.00 0.00 H new ATOM 250 N SER A 15 17.880 -8.833 -12.424 1.00 0.00 N ATOM 251 CA SER A 15 17.103 -8.124 -11.391 1.00 0.00 C ATOM 252 C SER A 15 17.228 -6.608 -11.525 1.00 0.00 C ATOM 253 O SER A 15 16.213 -5.925 -11.527 1.00 0.00 O ATOM 254 CB SER A 15 17.495 -8.527 -9.983 1.00 0.00 C ATOM 255 OG SER A 15 17.396 -9.918 -9.809 1.00 0.00 O ATOM 0 H SER A 15 18.636 -9.416 -12.065 1.00 0.00 H new ATOM 0 HA SER A 15 16.067 -8.418 -11.559 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.516 -8.204 -9.780 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.851 -8.021 -9.264 1.00 0.00 H new ATOM 0 HG SER A 15 17.696 -10.157 -8.907 1.00 0.00 H new ATOM 261 N GLN A 16 18.437 -6.077 -11.726 1.00 0.00 N ATOM 262 CA GLN A 16 18.671 -4.666 -12.043 1.00 0.00 C ATOM 263 C GLN A 16 18.073 -4.216 -13.384 1.00 0.00 C ATOM 264 O GLN A 16 17.471 -3.144 -13.471 1.00 0.00 O ATOM 265 CB GLN A 16 20.177 -4.393 -11.979 1.00 0.00 C ATOM 266 CG GLN A 16 20.622 -4.139 -10.531 1.00 0.00 C ATOM 267 CD GLN A 16 22.006 -3.512 -10.429 1.00 0.00 C ATOM 268 OE1 GLN A 16 22.855 -3.589 -11.302 1.00 0.00 O ATOM 269 NE2 GLN A 16 22.289 -2.849 -9.335 1.00 0.00 N ATOM 0 H GLN A 16 19.295 -6.625 -11.672 1.00 0.00 H new ATOM 0 HA GLN A 16 18.145 -4.070 -11.297 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.723 -5.243 -12.389 1.00 0.00 H new ATOM 0 HB3 GLN A 16 20.422 -3.529 -12.597 1.00 0.00 H new ATOM 0 HG2 GLN A 16 19.898 -3.486 -10.045 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.617 -5.083 -9.985 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.595 -2.771 -8.592 1.00 0.00 H new ATOM 0 HE22 GLN A 16 23.204 -2.410 -9.227 1.00 0.00 H new ATOM 278 N MET A 17 18.144 -5.045 -14.426 1.00 0.00 N ATOM 279 CA MET A 17 17.508 -4.742 -15.712 1.00 0.00 C ATOM 280 C MET A 17 15.982 -4.609 -15.555 1.00 0.00 C ATOM 281 O MET A 17 15.387 -3.641 -16.027 1.00 0.00 O ATOM 282 CB MET A 17 17.883 -5.811 -16.752 1.00 0.00 C ATOM 283 CG MET A 17 19.338 -5.632 -17.212 1.00 0.00 C ATOM 284 SD MET A 17 19.909 -6.857 -18.418 1.00 0.00 S ATOM 285 CE MET A 17 19.419 -6.024 -19.953 1.00 0.00 C ATOM 0 H MET A 17 18.638 -5.937 -14.405 1.00 0.00 H new ATOM 0 HA MET A 17 17.878 -3.781 -16.069 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.751 -6.805 -16.324 1.00 0.00 H new ATOM 0 HB3 MET A 17 17.214 -5.742 -17.610 1.00 0.00 H new ATOM 0 HG2 MET A 17 19.448 -4.638 -17.645 1.00 0.00 H new ATOM 0 HG3 MET A 17 19.988 -5.673 -16.338 1.00 0.00 H new ATOM 0 HE1 MET A 17 19.775 -6.598 -20.808 1.00 0.00 H new ATOM 0 HE2 MET A 17 18.333 -5.947 -19.994 1.00 0.00 H new ATOM 0 HE3 MET A 17 19.855 -5.025 -19.980 1.00 0.00 H new ATOM 295 N ALA A 18 15.351 -5.527 -14.820 1.00 0.00 N ATOM 296 CA ALA A 18 13.936 -5.439 -14.473 1.00 0.00 C ATOM 297 C ALA A 18 13.632 -4.309 -13.478 1.00 0.00 C ATOM 298 O ALA A 18 12.578 -3.692 -13.579 1.00 0.00 O ATOM 299 CB ALA A 18 13.490 -6.798 -13.925 1.00 0.00 C ATOM 0 H ALA A 18 15.813 -6.357 -14.448 1.00 0.00 H new ATOM 0 HA ALA A 18 13.373 -5.191 -15.373 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.434 -6.754 -13.659 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.641 -7.564 -14.685 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.077 -7.044 -13.040 1.00 0.00 H new ATOM 305 N GLU A 19 14.552 -3.965 -12.573 1.00 0.00 N ATOM 306 CA GLU A 19 14.351 -2.918 -11.566 1.00 0.00 C ATOM 307 C GLU A 19 14.243 -1.578 -12.257 1.00 0.00 C ATOM 308 O GLU A 19 13.287 -0.840 -12.051 1.00 0.00 O ATOM 309 CB GLU A 19 15.540 -2.888 -10.590 1.00 0.00 C ATOM 310 CG GLU A 19 15.564 -1.732 -9.579 1.00 0.00 C ATOM 311 CD GLU A 19 14.609 -1.945 -8.399 1.00 0.00 C ATOM 312 OE1 GLU A 19 13.528 -2.544 -8.600 1.00 0.00 O ATOM 313 OE2 GLU A 19 14.933 -1.457 -7.288 1.00 0.00 O ATOM 0 H GLU A 19 15.468 -4.410 -12.518 1.00 0.00 H new ATOM 0 HA GLU A 19 13.437 -3.127 -11.011 1.00 0.00 H new ATOM 0 HB2 GLU A 19 15.551 -3.827 -10.036 1.00 0.00 H new ATOM 0 HB3 GLU A 19 16.460 -2.851 -11.173 1.00 0.00 H new ATOM 0 HG2 GLU A 19 16.579 -1.610 -9.200 1.00 0.00 H new ATOM 0 HG3 GLU A 19 15.301 -0.806 -10.089 1.00 0.00 H new ATOM 320 N GLY A 20 15.203 -1.285 -13.132 1.00 0.00 N ATOM 321 CA GLY A 20 15.239 -0.046 -13.886 1.00 0.00 C ATOM 322 C GLY A 20 14.008 0.141 -14.767 1.00 0.00 C ATOM 323 O GLY A 20 13.389 1.196 -14.702 1.00 0.00 O ATOM 0 H GLY A 20 15.982 -1.911 -13.335 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.317 0.793 -13.195 1.00 0.00 H new ATOM 0 HA3 GLY A 20 16.133 -0.030 -14.509 1.00 0.00 H new ATOM 327 N PHE A 21 13.583 -0.895 -15.499 1.00 0.00 N ATOM 328 CA PHE A 21 12.322 -0.837 -16.252 1.00 0.00 C ATOM 329 C PHE A 21 11.101 -0.697 -15.337 1.00 0.00 C ATOM 330 O PHE A 21 10.182 0.048 -15.655 1.00 0.00 O ATOM 331 CB PHE A 21 12.183 -2.079 -17.154 1.00 0.00 C ATOM 332 CG PHE A 21 12.684 -1.903 -18.570 1.00 0.00 C ATOM 333 CD1 PHE A 21 12.029 -1.001 -19.425 1.00 0.00 C ATOM 334 CD2 PHE A 21 13.759 -2.667 -19.053 1.00 0.00 C ATOM 335 CE1 PHE A 21 12.463 -0.842 -20.750 1.00 0.00 C ATOM 336 CE2 PHE A 21 14.197 -2.509 -20.379 1.00 0.00 C ATOM 337 CZ PHE A 21 13.546 -1.598 -21.230 1.00 0.00 C ATOM 0 H PHE A 21 14.088 -1.777 -15.587 1.00 0.00 H new ATOM 0 HA PHE A 21 12.357 0.057 -16.874 1.00 0.00 H new ATOM 0 HB2 PHE A 21 12.724 -2.906 -16.694 1.00 0.00 H new ATOM 0 HB3 PHE A 21 11.132 -2.367 -17.190 1.00 0.00 H new ATOM 0 HD1 PHE A 21 11.189 -0.428 -19.061 1.00 0.00 H new ATOM 0 HD2 PHE A 21 14.250 -3.377 -18.404 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.965 -0.139 -21.401 1.00 0.00 H new ATOM 0 HE2 PHE A 21 15.033 -3.087 -20.744 1.00 0.00 H new ATOM 0 HZ PHE A 21 13.878 -1.480 -22.251 1.00 0.00 H new ATOM 347 N ALA A 22 11.051 -1.385 -14.193 1.00 0.00 N ATOM 348 CA ALA A 22 9.869 -1.344 -13.325 1.00 0.00 C ATOM 349 C ALA A 22 9.758 0.007 -12.612 1.00 0.00 C ATOM 350 O ALA A 22 8.662 0.523 -12.418 1.00 0.00 O ATOM 351 CB ALA A 22 9.925 -2.534 -12.366 1.00 0.00 C ATOM 0 H ALA A 22 11.809 -1.973 -13.847 1.00 0.00 H new ATOM 0 HA ALA A 22 8.958 -1.434 -13.917 1.00 0.00 H new ATOM 0 HB1 ALA A 22 9.052 -2.517 -11.714 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.933 -3.462 -12.938 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.830 -2.472 -11.762 1.00 0.00 H new ATOM 357 N LYS A 23 10.905 0.614 -12.312 1.00 0.00 N ATOM 358 CA LYS A 23 11.057 1.983 -11.829 1.00 0.00 C ATOM 359 C LYS A 23 10.548 2.972 -12.879 1.00 0.00 C ATOM 360 O LYS A 23 9.595 3.692 -12.609 1.00 0.00 O ATOM 361 CB LYS A 23 12.539 2.151 -11.461 1.00 0.00 C ATOM 362 CG LYS A 23 12.860 3.406 -10.657 1.00 0.00 C ATOM 363 CD LYS A 23 14.364 3.380 -10.316 1.00 0.00 C ATOM 364 CE LYS A 23 14.916 4.740 -9.868 1.00 0.00 C ATOM 365 NZ LYS A 23 14.366 5.197 -8.554 1.00 0.00 N ATOM 0 H LYS A 23 11.802 0.137 -12.405 1.00 0.00 H new ATOM 0 HA LYS A 23 10.456 2.190 -10.943 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.858 1.279 -10.890 1.00 0.00 H new ATOM 0 HB3 LYS A 23 13.127 2.164 -12.378 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.614 4.300 -11.231 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.263 3.438 -9.746 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.536 2.649 -9.526 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.920 3.042 -11.190 1.00 0.00 H new ATOM 0 HE2 LYS A 23 16.002 4.679 -9.798 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.687 5.486 -10.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 14.777 6.120 -8.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 13.332 5.286 -8.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 14.606 4.503 -7.817 1.00 0.00 H new ATOM 379 N THR A 24 11.060 2.939 -14.111 1.00 0.00 N ATOM 380 CA THR A 24 10.608 3.860 -15.172 1.00 0.00 C ATOM 381 C THR A 24 9.189 3.591 -15.696 1.00 0.00 C ATOM 382 O THR A 24 8.601 4.495 -16.293 1.00 0.00 O ATOM 383 CB THR A 24 11.611 3.931 -16.326 1.00 0.00 C ATOM 384 OG1 THR A 24 11.802 2.659 -16.902 1.00 0.00 O ATOM 385 CG2 THR A 24 12.945 4.466 -15.824 1.00 0.00 C ATOM 0 H THR A 24 11.788 2.287 -14.405 1.00 0.00 H new ATOM 0 HA THR A 24 10.559 4.834 -14.685 1.00 0.00 H new ATOM 0 HB THR A 24 11.210 4.603 -17.085 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.348 2.108 -16.303 1.00 0.00 H new ATOM 0 HG21 THR A 24 13.653 4.513 -16.652 1.00 0.00 H new ATOM 0 HG22 THR A 24 12.804 5.464 -15.410 1.00 0.00 H new ATOM 0 HG23 THR A 24 13.335 3.804 -15.051 1.00 0.00 H new ATOM 393 N LEU A 25 8.592 2.421 -15.413 1.00 0.00 N ATOM 394 CA LEU A 25 7.196 2.099 -15.755 1.00 0.00 C ATOM 395 C LEU A 25 6.219 2.229 -14.561 1.00 0.00 C ATOM 396 O LEU A 25 5.013 2.066 -14.751 1.00 0.00 O ATOM 397 CB LEU A 25 7.126 0.694 -16.400 1.00 0.00 C ATOM 398 CG LEU A 25 7.796 0.580 -17.786 1.00 0.00 C ATOM 399 CD1 LEU A 25 8.029 -0.888 -18.144 1.00 0.00 C ATOM 400 CD2 LEU A 25 6.928 1.211 -18.876 1.00 0.00 C ATOM 0 H LEU A 25 9.073 1.661 -14.933 1.00 0.00 H new ATOM 0 HA LEU A 25 6.862 2.844 -16.477 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.595 -0.023 -15.726 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.079 0.405 -16.494 1.00 0.00 H new ATOM 0 HG LEU A 25 8.747 1.110 -17.731 1.00 0.00 H new ATOM 0 HD11 LEU A 25 8.502 -0.953 -19.124 1.00 0.00 H new ATOM 0 HD12 LEU A 25 8.677 -1.346 -17.397 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.074 -1.413 -18.167 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.427 1.115 -19.840 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.965 0.702 -18.914 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.773 2.266 -18.652 1.00 0.00 H new ATOM 412 N GLY A 26 6.710 2.516 -13.345 1.00 0.00 N ATOM 413 CA GLY A 26 5.919 2.454 -12.102 1.00 0.00 C ATOM 414 C GLY A 26 6.259 3.470 -11.004 1.00 0.00 C ATOM 415 O GLY A 26 5.683 3.387 -9.918 1.00 0.00 O ATOM 0 H GLY A 26 7.678 2.801 -13.194 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.868 2.578 -12.364 1.00 0.00 H new ATOM 0 HA3 GLY A 26 6.027 1.454 -11.682 1.00 0.00 H new ATOM 419 N ALA A 27 7.164 4.424 -11.250 1.00 0.00 N ATOM 420 CA ALA A 27 7.584 5.425 -10.265 1.00 0.00 C ATOM 421 C ALA A 27 6.390 6.192 -9.654 1.00 0.00 C ATOM 422 O ALA A 27 5.547 6.739 -10.369 1.00 0.00 O ATOM 423 CB ALA A 27 8.592 6.381 -10.918 1.00 0.00 C ATOM 0 H ALA A 27 7.631 4.523 -12.151 1.00 0.00 H new ATOM 0 HA ALA A 27 8.061 4.908 -9.433 1.00 0.00 H new ATOM 0 HB1 ALA A 27 8.909 7.128 -10.190 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.460 5.817 -11.260 1.00 0.00 H new ATOM 0 HB3 ALA A 27 8.124 6.878 -11.768 1.00 0.00 H new ATOM 429 N GLY A 28 6.315 6.213 -8.318 1.00 0.00 N ATOM 430 CA GLY A 28 5.236 6.853 -7.548 1.00 0.00 C ATOM 431 C GLY A 28 3.921 6.058 -7.445 1.00 0.00 C ATOM 432 O GLY A 28 3.015 6.494 -6.731 1.00 0.00 O ATOM 0 H GLY A 28 7.020 5.775 -7.725 1.00 0.00 H new ATOM 0 HA2 GLY A 28 5.601 7.046 -6.539 1.00 0.00 H new ATOM 0 HA3 GLY A 28 5.019 7.821 -7.999 1.00 0.00 H new ATOM 436 N LYS A 29 3.802 4.894 -8.111 1.00 0.00 N ATOM 437 CA LYS A 29 2.610 4.014 -8.037 1.00 0.00 C ATOM 438 C LYS A 29 2.732 3.040 -6.865 1.00 0.00 C ATOM 439 O LYS A 29 1.934 3.062 -5.930 1.00 0.00 O ATOM 440 CB LYS A 29 2.384 3.274 -9.375 1.00 0.00 C ATOM 441 CG LYS A 29 2.365 4.184 -10.616 1.00 0.00 C ATOM 442 CD LYS A 29 1.419 5.387 -10.494 1.00 0.00 C ATOM 443 CE LYS A 29 -0.048 5.001 -10.239 1.00 0.00 C ATOM 444 NZ LYS A 29 -0.701 4.408 -11.438 1.00 0.00 N ATOM 0 H LYS A 29 4.534 4.531 -8.722 1.00 0.00 H new ATOM 0 HA LYS A 29 1.733 4.636 -7.860 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.169 2.528 -9.500 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.438 2.735 -9.322 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.376 4.547 -10.803 1.00 0.00 H new ATOM 0 HG3 LYS A 29 2.073 3.592 -11.484 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.763 6.027 -9.681 1.00 0.00 H new ATOM 0 HD3 LYS A 29 1.476 5.976 -11.409 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -0.094 4.289 -9.415 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.604 5.885 -9.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -1.549 3.881 -11.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -0.974 5.166 -12.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -0.037 3.762 -11.911 1.00 0.00 H new ATOM 458 N ILE A 30 3.793 2.238 -6.927 1.00 0.00 N ATOM 459 CA ILE A 30 4.296 1.334 -5.871 1.00 0.00 C ATOM 460 C ILE A 30 5.838 1.374 -5.849 1.00 0.00 C ATOM 461 O ILE A 30 6.451 2.003 -6.713 1.00 0.00 O ATOM 462 CB ILE A 30 3.720 -0.108 -6.018 1.00 0.00 C ATOM 463 CG1 ILE A 30 4.002 -0.823 -7.361 1.00 0.00 C ATOM 464 CG2 ILE A 30 2.193 -0.104 -5.831 1.00 0.00 C ATOM 465 CD1 ILE A 30 5.456 -1.242 -7.608 1.00 0.00 C ATOM 0 H ILE A 30 4.369 2.192 -7.768 1.00 0.00 H new ATOM 0 HA ILE A 30 3.942 1.684 -4.901 1.00 0.00 H new ATOM 0 HB ILE A 30 4.246 -0.662 -5.241 1.00 0.00 H new ATOM 0 HG12 ILE A 30 3.374 -1.713 -7.415 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.692 -0.165 -8.172 1.00 0.00 H new ATOM 0 HG21 ILE A 30 1.811 -1.119 -5.937 1.00 0.00 H new ATOM 0 HG22 ILE A 30 1.949 0.273 -4.838 1.00 0.00 H new ATOM 0 HG23 ILE A 30 1.736 0.537 -6.585 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.533 -1.733 -8.578 1.00 0.00 H new ATOM 0 HD12 ILE A 30 6.096 -0.360 -7.595 1.00 0.00 H new ATOM 0 HD13 ILE A 30 5.774 -1.932 -6.826 1.00 0.00 H new ATOM 477 N ALA A 31 6.483 0.688 -4.898 1.00 0.00 N ATOM 478 CA ALA A 31 7.942 0.580 -4.845 1.00 0.00 C ATOM 479 C ALA A 31 8.430 -0.727 -5.463 1.00 0.00 C ATOM 480 O ALA A 31 8.024 -1.825 -5.075 1.00 0.00 O ATOM 481 CB ALA A 31 8.462 0.717 -3.416 1.00 0.00 C ATOM 0 H ALA A 31 6.006 0.193 -4.144 1.00 0.00 H new ATOM 0 HA ALA A 31 8.342 1.405 -5.434 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.549 0.632 -3.415 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.174 1.689 -3.015 1.00 0.00 H new ATOM 0 HB3 ALA A 31 8.035 -0.072 -2.796 1.00 0.00 H new ATOM 487 N VAL A 32 9.340 -0.599 -6.418 1.00 0.00 N ATOM 488 CA VAL A 32 10.088 -1.707 -6.990 1.00 0.00 C ATOM 489 C VAL A 32 11.399 -1.976 -6.236 1.00 0.00 C ATOM 490 O VAL A 32 11.969 -1.068 -5.619 1.00 0.00 O ATOM 491 CB VAL A 32 10.318 -1.433 -8.469 1.00 0.00 C ATOM 492 CG1 VAL A 32 8.958 -1.402 -9.184 1.00 0.00 C ATOM 493 CG2 VAL A 32 11.100 -0.147 -8.782 1.00 0.00 C ATOM 0 H VAL A 32 9.584 0.303 -6.827 1.00 0.00 H new ATOM 0 HA VAL A 32 9.504 -2.621 -6.885 1.00 0.00 H new ATOM 0 HB VAL A 32 10.950 -2.244 -8.832 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.109 -1.206 -10.246 1.00 0.00 H new ATOM 0 HG12 VAL A 32 8.460 -2.363 -9.060 1.00 0.00 H new ATOM 0 HG13 VAL A 32 8.339 -0.614 -8.755 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.211 -0.042 -9.861 1.00 0.00 H new ATOM 0 HG22 VAL A 32 10.559 0.713 -8.388 1.00 0.00 H new ATOM 0 HG23 VAL A 32 12.086 -0.199 -8.319 1.00 0.00 H new ATOM 503 N THR A 33 11.841 -3.235 -6.254 1.00 0.00 N ATOM 504 CA THR A 33 13.083 -3.689 -5.613 1.00 0.00 C ATOM 505 C THR A 33 13.743 -4.827 -6.402 1.00 0.00 C ATOM 506 O THR A 33 13.059 -5.614 -7.059 1.00 0.00 O ATOM 507 CB THR A 33 12.866 -4.123 -4.151 1.00 0.00 C ATOM 508 OG1 THR A 33 11.693 -3.587 -3.581 1.00 0.00 O ATOM 509 CG2 THR A 33 14.030 -3.676 -3.267 1.00 0.00 C ATOM 0 H THR A 33 11.336 -3.986 -6.724 1.00 0.00 H new ATOM 0 HA THR A 33 13.752 -2.829 -5.611 1.00 0.00 H new ATOM 0 HB THR A 33 12.786 -5.209 -4.189 1.00 0.00 H new ATOM 0 HG1 THR A 33 11.497 -4.050 -2.740 1.00 0.00 H new ATOM 0 HG21 THR A 33 13.851 -3.995 -2.240 1.00 0.00 H new ATOM 0 HG22 THR A 33 14.955 -4.123 -3.630 1.00 0.00 H new ATOM 0 HG23 THR A 33 14.115 -2.590 -3.299 1.00 0.00 H new ATOM 517 N SER A 34 15.066 -4.960 -6.296 1.00 0.00 N ATOM 518 CA SER A 34 15.864 -6.057 -6.880 1.00 0.00 C ATOM 519 C SER A 34 16.837 -6.742 -5.904 1.00 0.00 C ATOM 520 O SER A 34 17.610 -6.077 -5.210 1.00 0.00 O ATOM 521 CB SER A 34 16.621 -5.567 -8.115 1.00 0.00 C ATOM 522 OG SER A 34 17.240 -4.296 -7.929 1.00 0.00 O ATOM 0 H SER A 34 15.638 -4.288 -5.785 1.00 0.00 H new ATOM 0 HA SER A 34 15.138 -6.822 -7.155 1.00 0.00 H new ATOM 0 HB2 SER A 34 17.383 -6.300 -8.380 1.00 0.00 H new ATOM 0 HB3 SER A 34 15.930 -5.508 -8.956 1.00 0.00 H new ATOM 0 HG SER A 34 17.709 -4.037 -8.750 1.00 0.00 H new ATOM 528 N SER A 35 16.843 -8.081 -5.897 1.00 0.00 N ATOM 529 CA SER A 35 17.695 -8.971 -5.093 1.00 0.00 C ATOM 530 C SER A 35 18.264 -10.096 -5.964 1.00 0.00 C ATOM 531 O SER A 35 17.926 -10.232 -7.142 1.00 0.00 O ATOM 532 CB SER A 35 16.949 -9.523 -3.872 1.00 0.00 C ATOM 533 OG SER A 35 15.988 -10.482 -4.268 1.00 0.00 O ATOM 0 H SER A 35 16.208 -8.610 -6.495 1.00 0.00 H new ATOM 0 HA SER A 35 18.529 -8.383 -4.710 1.00 0.00 H new ATOM 0 HB2 SER A 35 17.659 -9.976 -3.179 1.00 0.00 H new ATOM 0 HB3 SER A 35 16.459 -8.708 -3.339 1.00 0.00 H new ATOM 0 HG SER A 35 15.523 -10.825 -3.477 1.00 0.00 H new ATOM 539 N GLY A 36 19.166 -10.915 -5.426 1.00 0.00 N ATOM 540 CA GLY A 36 19.577 -12.132 -6.131 1.00 0.00 C ATOM 541 C GLY A 36 20.612 -12.976 -5.395 1.00 0.00 C ATOM 542 O GLY A 36 21.064 -12.601 -4.314 1.00 0.00 O ATOM 0 H GLY A 36 19.619 -10.765 -4.524 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.694 -12.744 -6.316 1.00 0.00 H new ATOM 0 HA3 GLY A 36 19.981 -11.853 -7.104 1.00 0.00 H new ATOM 546 N LEU A 37 20.972 -14.129 -5.967 1.00 0.00 N ATOM 547 CA LEU A 37 21.885 -15.094 -5.326 1.00 0.00 C ATOM 548 C LEU A 37 23.308 -14.519 -5.170 1.00 0.00 C ATOM 549 O LEU A 37 23.984 -14.782 -4.177 1.00 0.00 O ATOM 550 CB LEU A 37 21.912 -16.427 -6.105 1.00 0.00 C ATOM 551 CG LEU A 37 20.558 -17.105 -6.419 1.00 0.00 C ATOM 552 CD1 LEU A 37 20.792 -18.489 -7.019 1.00 0.00 C ATOM 553 CD2 LEU A 37 19.668 -17.264 -5.187 1.00 0.00 C ATOM 0 H LEU A 37 20.642 -14.424 -6.886 1.00 0.00 H new ATOM 0 HA LEU A 37 21.501 -15.290 -4.325 1.00 0.00 H new ATOM 0 HB2 LEU A 37 22.427 -16.253 -7.050 1.00 0.00 H new ATOM 0 HB3 LEU A 37 22.517 -17.134 -5.538 1.00 0.00 H new ATOM 0 HG LEU A 37 20.047 -16.450 -7.124 1.00 0.00 H new ATOM 0 HD11 LEU A 37 19.833 -18.958 -7.237 1.00 0.00 H new ATOM 0 HD12 LEU A 37 21.367 -18.394 -7.940 1.00 0.00 H new ATOM 0 HD13 LEU A 37 21.344 -19.105 -6.309 1.00 0.00 H new ATOM 0 HD21 LEU A 37 18.733 -17.746 -5.473 1.00 0.00 H new ATOM 0 HD22 LEU A 37 20.180 -17.877 -4.445 1.00 0.00 H new ATOM 0 HD23 LEU A 37 19.455 -16.283 -4.763 1.00 0.00 H new ATOM 565 N GLU A 38 23.734 -13.696 -6.130 1.00 0.00 N ATOM 566 CA GLU A 38 24.984 -12.936 -6.147 1.00 0.00 C ATOM 567 C GLU A 38 24.673 -11.431 -6.166 1.00 0.00 C ATOM 568 O GLU A 38 24.099 -10.899 -7.122 1.00 0.00 O ATOM 569 CB GLU A 38 25.832 -13.410 -7.346 1.00 0.00 C ATOM 570 CG GLU A 38 27.304 -13.004 -7.222 1.00 0.00 C ATOM 571 CD GLU A 38 28.155 -13.632 -8.350 1.00 0.00 C ATOM 572 OE1 GLU A 38 27.969 -13.282 -9.541 1.00 0.00 O ATOM 573 OE2 GLU A 38 29.025 -14.488 -8.049 1.00 0.00 O ATOM 0 H GLU A 38 23.179 -13.533 -6.970 1.00 0.00 H new ATOM 0 HA GLU A 38 25.572 -13.113 -5.246 1.00 0.00 H new ATOM 0 HB2 GLU A 38 25.764 -14.495 -7.429 1.00 0.00 H new ATOM 0 HB3 GLU A 38 25.420 -12.994 -8.265 1.00 0.00 H new ATOM 0 HG2 GLU A 38 27.389 -11.918 -7.261 1.00 0.00 H new ATOM 0 HG3 GLU A 38 27.690 -13.320 -6.253 1.00 0.00 H new ATOM 580 N SER A 39 25.080 -10.734 -5.103 1.00 0.00 N ATOM 581 CA SER A 39 24.985 -9.278 -4.901 1.00 0.00 C ATOM 582 C SER A 39 26.066 -8.519 -5.684 1.00 0.00 C ATOM 583 O SER A 39 26.824 -7.695 -5.163 1.00 0.00 O ATOM 584 CB SER A 39 25.029 -8.981 -3.401 1.00 0.00 C ATOM 585 OG SER A 39 26.100 -9.680 -2.773 1.00 0.00 O ATOM 0 H SER A 39 25.514 -11.198 -4.305 1.00 0.00 H new ATOM 0 HA SER A 39 24.035 -8.921 -5.298 1.00 0.00 H new ATOM 0 HB2 SER A 39 25.147 -7.909 -3.242 1.00 0.00 H new ATOM 0 HB3 SER A 39 24.083 -9.269 -2.942 1.00 0.00 H new ATOM 0 HG SER A 39 26.109 -9.473 -1.815 1.00 0.00 H new ATOM 591 N SER A 40 26.165 -8.881 -6.963 1.00 0.00 N ATOM 592 CA SER A 40 27.250 -8.461 -7.862 1.00 0.00 C ATOM 593 C SER A 40 27.167 -6.964 -8.237 1.00 0.00 C ATOM 594 O SER A 40 26.139 -6.319 -8.026 1.00 0.00 O ATOM 595 CB SER A 40 27.299 -9.378 -9.088 1.00 0.00 C ATOM 596 OG SER A 40 28.408 -9.053 -9.909 1.00 0.00 O ATOM 0 H SER A 40 25.481 -9.487 -7.416 1.00 0.00 H new ATOM 0 HA SER A 40 28.193 -8.566 -7.326 1.00 0.00 H new ATOM 0 HB2 SER A 40 27.368 -10.418 -8.769 1.00 0.00 H new ATOM 0 HB3 SER A 40 26.376 -9.281 -9.659 1.00 0.00 H new ATOM 0 HG SER A 40 28.425 -9.649 -10.687 1.00 0.00 H new ATOM 602 N ARG A 41 28.241 -6.397 -8.802 1.00 0.00 N ATOM 603 CA ARG A 41 28.366 -4.956 -9.139 1.00 0.00 C ATOM 604 C ARG A 41 27.374 -4.519 -10.222 1.00 0.00 C ATOM 605 O ARG A 41 26.964 -5.344 -11.024 1.00 0.00 O ATOM 606 CB ARG A 41 29.818 -4.644 -9.569 1.00 0.00 C ATOM 607 CG ARG A 41 30.166 -5.158 -10.984 1.00 0.00 C ATOM 608 CD ARG A 41 31.629 -4.890 -11.361 1.00 0.00 C ATOM 609 NE ARG A 41 32.571 -5.694 -10.552 1.00 0.00 N ATOM 610 CZ ARG A 41 33.890 -5.579 -10.532 1.00 0.00 C ATOM 611 NH1 ARG A 41 34.523 -4.712 -11.269 1.00 0.00 N ATOM 612 NH2 ARG A 41 34.605 -6.346 -9.761 1.00 0.00 N ATOM 0 H ARG A 41 29.073 -6.934 -9.047 1.00 0.00 H new ATOM 0 HA ARG A 41 28.121 -4.385 -8.243 1.00 0.00 H new ATOM 0 HB2 ARG A 41 29.975 -3.566 -9.534 1.00 0.00 H new ATOM 0 HB3 ARG A 41 30.505 -5.090 -8.850 1.00 0.00 H new ATOM 0 HG2 ARG A 41 29.971 -6.229 -11.037 1.00 0.00 H new ATOM 0 HG3 ARG A 41 29.512 -4.679 -11.713 1.00 0.00 H new ATOM 0 HD2 ARG A 41 31.777 -5.114 -12.417 1.00 0.00 H new ATOM 0 HD3 ARG A 41 31.849 -3.831 -11.226 1.00 0.00 H new ATOM 0 HE ARG A 41 32.164 -6.409 -9.949 1.00 0.00 H new ATOM 0 HH11 ARG A 41 34.001 -4.092 -11.889 1.00 0.00 H new ATOM 0 HH12 ARG A 41 35.540 -4.653 -11.226 1.00 0.00 H new ATOM 0 HH21 ARG A 41 34.150 -7.040 -9.168 1.00 0.00 H new ATOM 0 HH22 ARG A 41 35.621 -6.253 -9.750 1.00 0.00 H new ATOM 626 N VAL A 42 27.061 -3.224 -10.342 1.00 0.00 N ATOM 627 CA VAL A 42 26.297 -2.693 -11.489 1.00 0.00 C ATOM 628 C VAL A 42 27.001 -3.100 -12.796 1.00 0.00 C ATOM 629 O VAL A 42 28.147 -2.725 -13.038 1.00 0.00 O ATOM 630 CB VAL A 42 26.096 -1.171 -11.344 1.00 0.00 C ATOM 631 CG1 VAL A 42 25.072 -0.911 -10.235 1.00 0.00 C ATOM 632 CG2 VAL A 42 27.371 -0.381 -10.999 1.00 0.00 C ATOM 0 H VAL A 42 27.325 -2.516 -9.657 1.00 0.00 H new ATOM 0 HA VAL A 42 25.296 -3.123 -11.515 1.00 0.00 H new ATOM 0 HB VAL A 42 25.764 -0.823 -12.322 1.00 0.00 H new ATOM 0 HG11 VAL A 42 24.922 0.163 -10.123 1.00 0.00 H new ATOM 0 HG12 VAL A 42 24.126 -1.385 -10.495 1.00 0.00 H new ATOM 0 HG13 VAL A 42 25.439 -1.326 -9.296 1.00 0.00 H new ATOM 0 HG21 VAL A 42 27.131 0.679 -10.918 1.00 0.00 H new ATOM 0 HG22 VAL A 42 27.773 -0.736 -10.050 1.00 0.00 H new ATOM 0 HG23 VAL A 42 28.113 -0.526 -11.785 1.00 0.00 H new ATOM 642 N HIS A 43 26.352 -3.941 -13.612 1.00 0.00 N ATOM 643 CA HIS A 43 27.015 -4.593 -14.751 1.00 0.00 C ATOM 644 C HIS A 43 27.447 -3.614 -15.861 1.00 0.00 C ATOM 645 O HIS A 43 26.611 -2.835 -16.321 1.00 0.00 O ATOM 646 CB HIS A 43 26.138 -5.736 -15.279 1.00 0.00 C ATOM 647 CG HIS A 43 26.855 -6.588 -16.284 1.00 0.00 C ATOM 648 ND1 HIS A 43 27.134 -6.229 -17.605 1.00 0.00 N ATOM 649 CD2 HIS A 43 27.462 -7.773 -16.002 1.00 0.00 C ATOM 650 CE1 HIS A 43 27.899 -7.225 -18.088 1.00 0.00 C ATOM 651 NE2 HIS A 43 28.112 -8.155 -17.146 1.00 0.00 N ATOM 0 H HIS A 43 25.368 -4.187 -13.505 1.00 0.00 H new ATOM 0 HA HIS A 43 27.952 -5.014 -14.386 1.00 0.00 H new ATOM 0 HB2 HIS A 43 25.814 -6.358 -14.444 1.00 0.00 H new ATOM 0 HB3 HIS A 43 25.239 -5.320 -15.734 1.00 0.00 H new ATOM 0 HD2 HIS A 43 27.436 -8.306 -15.063 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.288 -7.269 -19.095 1.00 0.00 H new ATOM 0 HE2 HIS A 43 28.665 -9.004 -17.262 1.00 0.00 H new ATOM 659 N PRO A 44 28.711 -3.650 -16.335 1.00 0.00 N ATOM 660 CA PRO A 44 29.257 -2.651 -17.261 1.00 0.00 C ATOM 661 C PRO A 44 28.498 -2.564 -18.591 1.00 0.00 C ATOM 662 O PRO A 44 28.250 -1.464 -19.092 1.00 0.00 O ATOM 663 CB PRO A 44 30.722 -3.052 -17.479 1.00 0.00 C ATOM 664 CG PRO A 44 30.745 -4.544 -17.149 1.00 0.00 C ATOM 665 CD PRO A 44 29.745 -4.622 -16.004 1.00 0.00 C ATOM 0 HA PRO A 44 29.158 -1.653 -16.835 1.00 0.00 H new ATOM 0 HB2 PRO A 44 31.040 -2.864 -18.505 1.00 0.00 H new ATOM 0 HB3 PRO A 44 31.392 -2.488 -16.830 1.00 0.00 H new ATOM 0 HG2 PRO A 44 30.443 -5.156 -17.999 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.737 -4.882 -16.850 1.00 0.00 H new ATOM 0 HD2 PRO A 44 29.328 -5.625 -15.912 1.00 0.00 H new ATOM 0 HD3 PRO A 44 30.218 -4.385 -15.051 1.00 0.00 H new ATOM 673 N THR A 45 28.078 -3.702 -19.147 1.00 0.00 N ATOM 674 CA THR A 45 27.311 -3.738 -20.403 1.00 0.00 C ATOM 675 C THR A 45 25.845 -3.403 -20.157 1.00 0.00 C ATOM 676 O THR A 45 25.233 -2.727 -20.979 1.00 0.00 O ATOM 677 CB THR A 45 27.484 -5.083 -21.129 1.00 0.00 C ATOM 678 OG1 THR A 45 28.864 -5.366 -21.276 1.00 0.00 O ATOM 679 CG2 THR A 45 26.872 -5.087 -22.531 1.00 0.00 C ATOM 0 H THR A 45 28.256 -4.622 -18.745 1.00 0.00 H new ATOM 0 HA THR A 45 27.712 -2.970 -21.065 1.00 0.00 H new ATOM 0 HB THR A 45 26.972 -5.828 -20.521 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.975 -6.224 -21.737 1.00 0.00 H new ATOM 0 HG21 THR A 45 27.026 -6.062 -22.992 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.804 -4.883 -22.462 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.350 -4.319 -23.139 1.00 0.00 H new ATOM 687 N ALA A 46 25.277 -3.752 -18.997 1.00 0.00 N ATOM 688 CA ALA A 46 23.918 -3.322 -18.660 1.00 0.00 C ATOM 689 C ALA A 46 23.815 -1.801 -18.449 1.00 0.00 C ATOM 690 O ALA A 46 22.887 -1.203 -18.980 1.00 0.00 O ATOM 691 CB ALA A 46 23.402 -4.119 -17.463 1.00 0.00 C ATOM 0 H ALA A 46 25.731 -4.324 -18.285 1.00 0.00 H new ATOM 0 HA ALA A 46 23.272 -3.536 -19.512 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.391 -3.794 -17.218 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.392 -5.181 -17.710 1.00 0.00 H new ATOM 0 HB3 ALA A 46 24.054 -3.952 -16.606 1.00 0.00 H new ATOM 697 N ILE A 47 24.777 -1.135 -17.787 1.00 0.00 N ATOM 698 CA ILE A 47 24.814 0.340 -17.699 1.00 0.00 C ATOM 699 C ILE A 47 24.736 0.971 -19.107 1.00 0.00 C ATOM 700 O ILE A 47 23.988 1.927 -19.301 1.00 0.00 O ATOM 701 CB ILE A 47 26.067 0.825 -16.923 1.00 0.00 C ATOM 702 CG1 ILE A 47 26.120 0.300 -15.467 1.00 0.00 C ATOM 703 CG2 ILE A 47 26.100 2.362 -16.846 1.00 0.00 C ATOM 704 CD1 ILE A 47 27.529 0.330 -14.863 1.00 0.00 C ATOM 0 H ILE A 47 25.546 -1.597 -17.301 1.00 0.00 H new ATOM 0 HA ILE A 47 23.940 0.670 -17.137 1.00 0.00 H new ATOM 0 HB ILE A 47 26.919 0.432 -17.478 1.00 0.00 H new ATOM 0 HG12 ILE A 47 25.454 0.900 -14.847 1.00 0.00 H new ATOM 0 HG13 ILE A 47 25.743 -0.723 -15.443 1.00 0.00 H new ATOM 0 HG21 ILE A 47 26.987 2.680 -16.298 1.00 0.00 H new ATOM 0 HG22 ILE A 47 26.129 2.776 -17.854 1.00 0.00 H new ATOM 0 HG23 ILE A 47 25.208 2.720 -16.332 1.00 0.00 H new ATOM 0 HD11 ILE A 47 27.495 -0.051 -13.842 1.00 0.00 H new ATOM 0 HD12 ILE A 47 28.194 -0.293 -15.461 1.00 0.00 H new ATOM 0 HD13 ILE A 47 27.900 1.355 -14.856 1.00 0.00 H new ATOM 716 N ALA A 48 25.416 0.389 -20.106 1.00 0.00 N ATOM 717 CA ALA A 48 25.299 0.798 -21.507 1.00 0.00 C ATOM 718 C ALA A 48 23.898 0.535 -22.090 1.00 0.00 C ATOM 719 O ALA A 48 23.187 1.478 -22.438 1.00 0.00 O ATOM 720 CB ALA A 48 26.396 0.117 -22.338 1.00 0.00 C ATOM 0 H ALA A 48 26.066 -0.383 -19.960 1.00 0.00 H new ATOM 0 HA ALA A 48 25.438 1.878 -21.552 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.306 0.423 -23.380 1.00 0.00 H new ATOM 0 HB2 ALA A 48 27.375 0.409 -21.957 1.00 0.00 H new ATOM 0 HB3 ALA A 48 26.287 -0.965 -22.267 1.00 0.00 H new ATOM 726 N MET A 49 23.481 -0.734 -22.189 1.00 0.00 N ATOM 727 CA MET A 49 22.251 -1.127 -22.897 1.00 0.00 C ATOM 728 C MET A 49 20.970 -0.593 -22.251 1.00 0.00 C ATOM 729 O MET A 49 19.948 -0.491 -22.923 1.00 0.00 O ATOM 730 CB MET A 49 22.120 -2.653 -22.991 1.00 0.00 C ATOM 731 CG MET A 49 23.300 -3.412 -23.618 1.00 0.00 C ATOM 732 SD MET A 49 23.734 -3.027 -25.333 1.00 0.00 S ATOM 733 CE MET A 49 24.871 -1.628 -25.134 1.00 0.00 C ATOM 0 H MET A 49 23.987 -1.520 -21.780 1.00 0.00 H new ATOM 0 HA MET A 49 22.353 -0.682 -23.887 1.00 0.00 H new ATOM 0 HB2 MET A 49 21.961 -3.043 -21.986 1.00 0.00 H new ATOM 0 HB3 MET A 49 21.224 -2.882 -23.567 1.00 0.00 H new ATOM 0 HG2 MET A 49 24.180 -3.232 -23.001 1.00 0.00 H new ATOM 0 HG3 MET A 49 23.082 -4.478 -23.559 1.00 0.00 H new ATOM 0 HE1 MET A 49 25.308 -1.374 -26.100 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.325 -0.768 -24.745 1.00 0.00 H new ATOM 0 HE3 MET A 49 25.664 -1.900 -24.437 1.00 0.00 H new ATOM 743 N MET A 50 21.000 -0.284 -20.957 1.00 0.00 N ATOM 744 CA MET A 50 19.854 0.259 -20.228 1.00 0.00 C ATOM 745 C MET A 50 19.789 1.790 -20.377 1.00 0.00 C ATOM 746 O MET A 50 18.700 2.334 -20.552 1.00 0.00 O ATOM 747 CB MET A 50 19.912 -0.225 -18.771 1.00 0.00 C ATOM 748 CG MET A 50 19.898 -1.758 -18.656 1.00 0.00 C ATOM 749 SD MET A 50 18.364 -2.583 -19.170 1.00 0.00 S ATOM 750 CE MET A 50 17.194 -1.878 -17.981 1.00 0.00 C ATOM 0 H MET A 50 21.830 -0.405 -20.377 1.00 0.00 H new ATOM 0 HA MET A 50 18.920 -0.110 -20.651 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.815 0.163 -18.299 1.00 0.00 H new ATOM 0 HB3 MET A 50 19.064 0.185 -18.222 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.718 -2.155 -19.255 1.00 0.00 H new ATOM 0 HG3 MET A 50 20.101 -2.026 -17.619 1.00 0.00 H new ATOM 0 HE1 MET A 50 16.345 -2.552 -17.862 1.00 0.00 H new ATOM 0 HE2 MET A 50 17.689 -1.745 -17.019 1.00 0.00 H new ATOM 0 HE3 MET A 50 16.843 -0.912 -18.345 1.00 0.00 H new ATOM 760 N GLU A 51 20.924 2.495 -20.448 1.00 0.00 N ATOM 761 CA GLU A 51 20.948 3.932 -20.777 1.00 0.00 C ATOM 762 C GLU A 51 20.387 4.211 -22.190 1.00 0.00 C ATOM 763 O GLU A 51 19.731 5.233 -22.399 1.00 0.00 O ATOM 764 CB GLU A 51 22.382 4.467 -20.624 1.00 0.00 C ATOM 765 CG GLU A 51 22.546 5.982 -20.819 1.00 0.00 C ATOM 766 CD GLU A 51 21.947 6.794 -19.650 1.00 0.00 C ATOM 767 OE1 GLU A 51 20.708 6.987 -19.598 1.00 0.00 O ATOM 768 OE2 GLU A 51 22.726 7.269 -18.785 1.00 0.00 O ATOM 0 H GLU A 51 21.847 2.093 -20.281 1.00 0.00 H new ATOM 0 HA GLU A 51 20.296 4.458 -20.080 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.745 4.205 -19.630 1.00 0.00 H new ATOM 0 HB3 GLU A 51 23.021 3.954 -21.343 1.00 0.00 H new ATOM 0 HG2 GLU A 51 23.605 6.220 -20.918 1.00 0.00 H new ATOM 0 HG3 GLU A 51 22.064 6.280 -21.750 1.00 0.00 H new ATOM 775 N GLU A 52 20.547 3.274 -23.140 1.00 0.00 N ATOM 776 CA GLU A 52 19.927 3.349 -24.481 1.00 0.00 C ATOM 777 C GLU A 52 18.394 3.518 -24.425 1.00 0.00 C ATOM 778 O GLU A 52 17.815 4.160 -25.303 1.00 0.00 O ATOM 779 CB GLU A 52 20.242 2.079 -25.295 1.00 0.00 C ATOM 780 CG GLU A 52 21.732 1.937 -25.626 1.00 0.00 C ATOM 781 CD GLU A 52 22.069 0.638 -26.380 1.00 0.00 C ATOM 782 OE1 GLU A 52 21.349 -0.384 -26.255 1.00 0.00 O ATOM 783 OE2 GLU A 52 23.091 0.625 -27.106 1.00 0.00 O ATOM 0 H GLU A 52 21.113 2.437 -23.002 1.00 0.00 H new ATOM 0 HA GLU A 52 20.353 4.231 -24.959 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.915 1.204 -24.734 1.00 0.00 H new ATOM 0 HB3 GLU A 52 19.669 2.096 -26.222 1.00 0.00 H new ATOM 0 HG2 GLU A 52 22.046 2.790 -26.228 1.00 0.00 H new ATOM 0 HG3 GLU A 52 22.307 1.971 -24.701 1.00 0.00 H new ATOM 790 N VAL A 53 17.744 2.978 -23.385 1.00 0.00 N ATOM 791 CA VAL A 53 16.289 3.119 -23.127 1.00 0.00 C ATOM 792 C VAL A 53 15.934 4.070 -21.962 1.00 0.00 C ATOM 793 O VAL A 53 14.804 4.054 -21.469 1.00 0.00 O ATOM 794 CB VAL A 53 15.605 1.744 -22.997 1.00 0.00 C ATOM 795 CG1 VAL A 53 15.627 1.000 -24.336 1.00 0.00 C ATOM 796 CG2 VAL A 53 16.271 0.875 -21.923 1.00 0.00 C ATOM 0 H VAL A 53 18.219 2.416 -22.678 1.00 0.00 H new ATOM 0 HA VAL A 53 15.882 3.613 -24.009 1.00 0.00 H new ATOM 0 HB VAL A 53 14.573 1.929 -22.699 1.00 0.00 H new ATOM 0 HG11 VAL A 53 15.139 0.032 -24.222 1.00 0.00 H new ATOM 0 HG12 VAL A 53 15.098 1.587 -25.087 1.00 0.00 H new ATOM 0 HG13 VAL A 53 16.659 0.851 -24.653 1.00 0.00 H new ATOM 0 HG21 VAL A 53 15.759 -0.085 -21.863 1.00 0.00 H new ATOM 0 HG22 VAL A 53 17.317 0.713 -22.183 1.00 0.00 H new ATOM 0 HG23 VAL A 53 16.211 1.379 -20.958 1.00 0.00 H new ATOM 806 N GLY A 54 16.865 4.931 -21.530 1.00 0.00 N ATOM 807 CA GLY A 54 16.624 5.939 -20.481 1.00 0.00 C ATOM 808 C GLY A 54 16.820 5.444 -19.040 1.00 0.00 C ATOM 809 O GLY A 54 16.381 6.113 -18.102 1.00 0.00 O ATOM 0 H GLY A 54 17.815 4.950 -21.900 1.00 0.00 H new ATOM 0 HA2 GLY A 54 17.291 6.784 -20.652 1.00 0.00 H new ATOM 0 HA3 GLY A 54 15.605 6.311 -20.585 1.00 0.00 H new ATOM 813 N ILE A 55 17.435 4.271 -18.856 1.00 0.00 N ATOM 814 CA ILE A 55 17.518 3.551 -17.577 1.00 0.00 C ATOM 815 C ILE A 55 18.983 3.430 -17.135 1.00 0.00 C ATOM 816 O ILE A 55 19.676 2.474 -17.468 1.00 0.00 O ATOM 817 CB ILE A 55 16.798 2.184 -17.713 1.00 0.00 C ATOM 818 CG1 ILE A 55 15.309 2.358 -18.094 1.00 0.00 C ATOM 819 CG2 ILE A 55 16.893 1.393 -16.395 1.00 0.00 C ATOM 820 CD1 ILE A 55 14.585 1.063 -18.480 1.00 0.00 C ATOM 0 H ILE A 55 17.904 3.779 -19.616 1.00 0.00 H new ATOM 0 HA ILE A 55 17.008 4.105 -16.789 1.00 0.00 H new ATOM 0 HB ILE A 55 17.298 1.634 -18.511 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.785 2.813 -17.254 1.00 0.00 H new ATOM 0 HG13 ILE A 55 15.242 3.057 -18.928 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.383 0.436 -16.507 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.941 1.219 -16.150 1.00 0.00 H new ATOM 0 HG23 ILE A 55 16.423 1.963 -15.594 1.00 0.00 H new ATOM 0 HD11 ILE A 55 13.548 1.287 -18.730 1.00 0.00 H new ATOM 0 HD12 ILE A 55 15.078 0.614 -19.342 1.00 0.00 H new ATOM 0 HD13 ILE A 55 14.614 0.366 -17.642 1.00 0.00 H new ATOM 832 N ASP A 56 19.472 4.384 -16.350 1.00 0.00 N ATOM 833 CA ASP A 56 20.792 4.255 -15.726 1.00 0.00 C ATOM 834 C ASP A 56 20.727 3.312 -14.509 1.00 0.00 C ATOM 835 O ASP A 56 20.093 3.640 -13.501 1.00 0.00 O ATOM 836 CB ASP A 56 21.342 5.637 -15.347 1.00 0.00 C ATOM 837 CG ASP A 56 22.700 5.522 -14.636 1.00 0.00 C ATOM 838 OD1 ASP A 56 23.443 4.552 -14.918 1.00 0.00 O ATOM 839 OD2 ASP A 56 23.009 6.380 -13.775 1.00 0.00 O ATOM 0 H ASP A 56 18.981 5.251 -16.129 1.00 0.00 H new ATOM 0 HA ASP A 56 21.480 3.812 -16.446 1.00 0.00 H new ATOM 0 HB2 ASP A 56 21.449 6.247 -16.244 1.00 0.00 H new ATOM 0 HB3 ASP A 56 20.631 6.148 -14.698 1.00 0.00 H new ATOM 844 N ILE A 57 21.400 2.153 -14.576 1.00 0.00 N ATOM 845 CA ILE A 57 21.545 1.242 -13.427 1.00 0.00 C ATOM 846 C ILE A 57 22.808 1.517 -12.597 1.00 0.00 C ATOM 847 O ILE A 57 22.980 0.890 -11.559 1.00 0.00 O ATOM 848 CB ILE A 57 21.458 -0.250 -13.832 1.00 0.00 C ATOM 849 CG1 ILE A 57 22.640 -0.705 -14.714 1.00 0.00 C ATOM 850 CG2 ILE A 57 20.123 -0.581 -14.524 1.00 0.00 C ATOM 851 CD1 ILE A 57 23.115 -2.120 -14.363 1.00 0.00 C ATOM 0 H ILE A 57 21.858 1.821 -15.425 1.00 0.00 H new ATOM 0 HA ILE A 57 20.690 1.455 -12.785 1.00 0.00 H new ATOM 0 HB ILE A 57 21.513 -0.808 -12.898 1.00 0.00 H new ATOM 0 HG12 ILE A 57 22.342 -0.673 -15.762 1.00 0.00 H new ATOM 0 HG13 ILE A 57 23.468 -0.006 -14.597 1.00 0.00 H new ATOM 0 HG21 ILE A 57 20.104 -1.638 -14.791 1.00 0.00 H new ATOM 0 HG22 ILE A 57 19.298 -0.363 -13.846 1.00 0.00 H new ATOM 0 HG23 ILE A 57 20.021 0.023 -15.425 1.00 0.00 H new ATOM 0 HD11 ILE A 57 23.948 -2.395 -15.010 1.00 0.00 H new ATOM 0 HD12 ILE A 57 23.440 -2.147 -13.323 1.00 0.00 H new ATOM 0 HD13 ILE A 57 22.296 -2.825 -14.506 1.00 0.00 H new ATOM 863 N SER A 58 23.699 2.431 -13.003 1.00 0.00 N ATOM 864 CA SER A 58 25.029 2.599 -12.385 1.00 0.00 C ATOM 865 C SER A 58 24.971 3.030 -10.901 1.00 0.00 C ATOM 866 O SER A 58 25.849 2.682 -10.110 1.00 0.00 O ATOM 867 CB SER A 58 25.862 3.575 -13.221 1.00 0.00 C ATOM 868 OG SER A 58 27.215 3.579 -12.792 1.00 0.00 O ATOM 0 H SER A 58 23.521 3.078 -13.771 1.00 0.00 H new ATOM 0 HA SER A 58 25.510 1.621 -12.379 1.00 0.00 H new ATOM 0 HB2 SER A 58 25.810 3.295 -14.273 1.00 0.00 H new ATOM 0 HB3 SER A 58 25.446 4.579 -13.137 1.00 0.00 H new ATOM 0 HG SER A 58 27.730 4.208 -13.340 1.00 0.00 H new ATOM 874 N GLY A 59 23.903 3.731 -10.490 1.00 0.00 N ATOM 875 CA GLY A 59 23.625 4.105 -9.092 1.00 0.00 C ATOM 876 C GLY A 59 22.605 3.211 -8.360 1.00 0.00 C ATOM 877 O GLY A 59 22.142 3.572 -7.277 1.00 0.00 O ATOM 0 H GLY A 59 23.188 4.063 -11.138 1.00 0.00 H new ATOM 0 HA2 GLY A 59 24.562 4.089 -8.536 1.00 0.00 H new ATOM 0 HA3 GLY A 59 23.261 5.132 -9.074 1.00 0.00 H new ATOM 881 N GLN A 60 22.205 2.075 -8.945 1.00 0.00 N ATOM 882 CA GLN A 60 21.089 1.234 -8.479 1.00 0.00 C ATOM 883 C GLN A 60 21.522 0.160 -7.457 1.00 0.00 C ATOM 884 O GLN A 60 22.634 -0.366 -7.526 1.00 0.00 O ATOM 885 CB GLN A 60 20.423 0.631 -9.728 1.00 0.00 C ATOM 886 CG GLN A 60 19.035 0.016 -9.509 1.00 0.00 C ATOM 887 CD GLN A 60 18.464 -0.451 -10.841 1.00 0.00 C ATOM 888 OE1 GLN A 60 18.877 -1.457 -11.385 1.00 0.00 O ATOM 889 NE2 GLN A 60 17.539 0.268 -11.448 1.00 0.00 N ATOM 0 H GLN A 60 22.660 1.703 -9.779 1.00 0.00 H new ATOM 0 HA GLN A 60 20.374 1.844 -7.928 1.00 0.00 H new ATOM 0 HB2 GLN A 60 20.340 1.411 -10.485 1.00 0.00 H new ATOM 0 HB3 GLN A 60 21.081 -0.138 -10.133 1.00 0.00 H new ATOM 0 HG2 GLN A 60 19.104 -0.824 -8.818 1.00 0.00 H new ATOM 0 HG3 GLN A 60 18.369 0.750 -9.054 1.00 0.00 H new ATOM 0 HE21 GLN A 60 17.180 1.115 -11.007 1.00 0.00 H new ATOM 0 HE22 GLN A 60 17.182 -0.023 -12.358 1.00 0.00 H new ATOM 898 N THR A 61 20.628 -0.206 -6.522 1.00 0.00 N ATOM 899 CA THR A 61 20.888 -1.253 -5.504 1.00 0.00 C ATOM 900 C THR A 61 21.153 -2.630 -6.111 1.00 0.00 C ATOM 901 O THR A 61 20.570 -2.981 -7.139 1.00 0.00 O ATOM 902 CB THR A 61 19.754 -1.356 -4.471 1.00 0.00 C ATOM 903 OG1 THR A 61 20.135 -2.257 -3.456 1.00 0.00 O ATOM 904 CG2 THR A 61 18.408 -1.836 -5.021 1.00 0.00 C ATOM 0 H THR A 61 19.701 0.213 -6.446 1.00 0.00 H new ATOM 0 HA THR A 61 21.798 -0.930 -4.998 1.00 0.00 H new ATOM 0 HB THR A 61 19.606 -0.337 -4.113 1.00 0.00 H new ATOM 0 HG1 THR A 61 19.417 -2.326 -2.793 1.00 0.00 H new ATOM 0 HG21 THR A 61 17.677 -1.874 -4.213 1.00 0.00 H new ATOM 0 HG22 THR A 61 18.063 -1.146 -5.791 1.00 0.00 H new ATOM 0 HG23 THR A 61 18.525 -2.831 -5.451 1.00 0.00 H new ATOM 912 N SER A 62 22.012 -3.426 -5.465 1.00 0.00 N ATOM 913 CA SER A 62 22.297 -4.812 -5.854 1.00 0.00 C ATOM 914 C SER A 62 22.357 -5.764 -4.639 1.00 0.00 C ATOM 915 O SER A 62 23.312 -6.511 -4.442 1.00 0.00 O ATOM 916 CB SER A 62 23.565 -4.864 -6.710 1.00 0.00 C ATOM 917 OG SER A 62 23.524 -5.999 -7.551 1.00 0.00 O ATOM 0 H SER A 62 22.537 -3.121 -4.645 1.00 0.00 H new ATOM 0 HA SER A 62 21.467 -5.175 -6.461 1.00 0.00 H new ATOM 0 HB2 SER A 62 23.648 -3.958 -7.310 1.00 0.00 H new ATOM 0 HB3 SER A 62 24.446 -4.905 -6.070 1.00 0.00 H new ATOM 0 HG SER A 62 24.437 -6.310 -7.726 1.00 0.00 H new ATOM 923 N ASP A 63 21.339 -5.710 -3.777 1.00 0.00 N ATOM 924 CA ASP A 63 21.277 -6.423 -2.488 1.00 0.00 C ATOM 925 C ASP A 63 21.254 -7.972 -2.635 1.00 0.00 C ATOM 926 O ASP A 63 20.659 -8.485 -3.591 1.00 0.00 O ATOM 927 CB ASP A 63 20.035 -5.910 -1.733 1.00 0.00 C ATOM 928 CG ASP A 63 20.190 -5.996 -0.207 1.00 0.00 C ATOM 929 OD1 ASP A 63 21.040 -5.265 0.351 1.00 0.00 O ATOM 930 OD2 ASP A 63 19.454 -6.768 0.447 1.00 0.00 O ATOM 0 H ASP A 63 20.505 -5.152 -3.958 1.00 0.00 H new ATOM 0 HA ASP A 63 22.188 -6.214 -1.928 1.00 0.00 H new ATOM 0 HB2 ASP A 63 19.844 -4.875 -2.017 1.00 0.00 H new ATOM 0 HB3 ASP A 63 19.164 -6.490 -2.039 1.00 0.00 H new ATOM 935 N PRO A 64 21.872 -8.754 -1.726 1.00 0.00 N ATOM 936 CA PRO A 64 21.826 -10.220 -1.776 1.00 0.00 C ATOM 937 C PRO A 64 20.479 -10.775 -1.265 1.00 0.00 C ATOM 938 O PRO A 64 19.835 -10.205 -0.382 1.00 0.00 O ATOM 939 CB PRO A 64 22.961 -10.702 -0.863 1.00 0.00 C ATOM 940 CG PRO A 64 23.042 -9.585 0.170 1.00 0.00 C ATOM 941 CD PRO A 64 22.722 -8.322 -0.622 1.00 0.00 C ATOM 0 HA PRO A 64 21.934 -10.568 -2.803 1.00 0.00 H new ATOM 0 HB2 PRO A 64 22.733 -11.664 -0.405 1.00 0.00 H new ATOM 0 HB3 PRO A 64 23.898 -10.822 -1.407 1.00 0.00 H new ATOM 0 HG2 PRO A 64 22.329 -9.739 0.980 1.00 0.00 H new ATOM 0 HG3 PRO A 64 24.032 -9.532 0.623 1.00 0.00 H new ATOM 0 HD2 PRO A 64 22.212 -7.588 0.001 1.00 0.00 H new ATOM 0 HD3 PRO A 64 23.633 -7.849 -0.990 1.00 0.00 H new ATOM 949 N ILE A 65 20.106 -11.971 -1.727 1.00 0.00 N ATOM 950 CA ILE A 65 18.861 -12.670 -1.343 1.00 0.00 C ATOM 951 C ILE A 65 18.768 -13.040 0.155 1.00 0.00 C ATOM 952 O ILE A 65 17.670 -13.226 0.673 1.00 0.00 O ATOM 953 CB ILE A 65 18.675 -13.901 -2.258 1.00 0.00 C ATOM 954 CG1 ILE A 65 17.252 -14.479 -2.162 1.00 0.00 C ATOM 955 CG2 ILE A 65 19.736 -14.984 -1.969 1.00 0.00 C ATOM 956 CD1 ILE A 65 16.927 -15.501 -3.259 1.00 0.00 C ATOM 0 H ILE A 65 20.669 -12.499 -2.394 1.00 0.00 H new ATOM 0 HA ILE A 65 18.039 -11.970 -1.489 1.00 0.00 H new ATOM 0 HB ILE A 65 18.817 -13.559 -3.283 1.00 0.00 H new ATOM 0 HG12 ILE A 65 17.126 -14.952 -1.188 1.00 0.00 H new ATOM 0 HG13 ILE A 65 16.533 -13.662 -2.214 1.00 0.00 H new ATOM 0 HG21 ILE A 65 19.576 -15.836 -2.630 1.00 0.00 H new ATOM 0 HG22 ILE A 65 20.731 -14.573 -2.141 1.00 0.00 H new ATOM 0 HG23 ILE A 65 19.651 -15.309 -0.932 1.00 0.00 H new ATOM 0 HD11 ILE A 65 15.908 -15.865 -3.127 1.00 0.00 H new ATOM 0 HD12 ILE A 65 17.020 -15.027 -4.236 1.00 0.00 H new ATOM 0 HD13 ILE A 65 17.622 -16.338 -3.194 1.00 0.00 H new ATOM 968 N GLU A 66 19.896 -13.134 0.868 1.00 0.00 N ATOM 969 CA GLU A 66 19.923 -13.492 2.299 1.00 0.00 C ATOM 970 C GLU A 66 19.895 -12.275 3.248 1.00 0.00 C ATOM 971 O GLU A 66 19.687 -12.444 4.452 1.00 0.00 O ATOM 972 CB GLU A 66 21.130 -14.400 2.586 1.00 0.00 C ATOM 973 CG GLU A 66 21.051 -15.729 1.819 1.00 0.00 C ATOM 974 CD GLU A 66 22.147 -16.704 2.297 1.00 0.00 C ATOM 975 OE1 GLU A 66 23.287 -16.656 1.770 1.00 0.00 O ATOM 976 OE2 GLU A 66 21.880 -17.531 3.203 1.00 0.00 O ATOM 0 H GLU A 66 20.821 -12.964 0.472 1.00 0.00 H new ATOM 0 HA GLU A 66 19.001 -14.035 2.507 1.00 0.00 H new ATOM 0 HB2 GLU A 66 22.048 -13.879 2.313 1.00 0.00 H new ATOM 0 HB3 GLU A 66 21.184 -14.602 3.656 1.00 0.00 H new ATOM 0 HG2 GLU A 66 20.069 -16.180 1.964 1.00 0.00 H new ATOM 0 HG3 GLU A 66 21.163 -15.545 0.751 1.00 0.00 H new ATOM 983 N ASN A 67 20.072 -11.048 2.730 1.00 0.00 N ATOM 984 CA ASN A 67 19.892 -9.809 3.500 1.00 0.00 C ATOM 985 C ASN A 67 18.456 -9.268 3.392 1.00 0.00 C ATOM 986 O ASN A 67 17.927 -8.724 4.365 1.00 0.00 O ATOM 987 CB ASN A 67 20.910 -8.768 3.021 1.00 0.00 C ATOM 988 CG ASN A 67 20.787 -7.457 3.775 1.00 0.00 C ATOM 989 OD1 ASN A 67 21.087 -7.354 4.957 1.00 0.00 O ATOM 990 ND2 ASN A 67 20.335 -6.420 3.112 1.00 0.00 N ATOM 0 H ASN A 67 20.345 -10.889 1.760 1.00 0.00 H new ATOM 0 HA ASN A 67 20.063 -10.027 4.554 1.00 0.00 H new ATOM 0 HB2 ASN A 67 21.918 -9.164 3.146 1.00 0.00 H new ATOM 0 HB3 ASN A 67 20.768 -8.587 1.956 1.00 0.00 H new ATOM 0 HD21 ASN A 67 20.232 -5.520 3.581 1.00 0.00 H new ATOM 0 HD22 ASN A 67 20.087 -6.513 2.127 1.00 0.00 H new ATOM 997 N PHE A 68 17.819 -9.425 2.226 1.00 0.00 N ATOM 998 CA PHE A 68 16.417 -9.060 2.014 1.00 0.00 C ATOM 999 C PHE A 68 15.451 -10.022 2.741 1.00 0.00 C ATOM 1000 O PHE A 68 15.838 -11.116 3.159 1.00 0.00 O ATOM 1001 CB PHE A 68 16.156 -8.928 0.499 1.00 0.00 C ATOM 1002 CG PHE A 68 14.955 -9.668 -0.054 1.00 0.00 C ATOM 1003 CD1 PHE A 68 15.090 -10.996 -0.492 1.00 0.00 C ATOM 1004 CD2 PHE A 68 13.705 -9.028 -0.141 1.00 0.00 C ATOM 1005 CE1 PHE A 68 13.993 -11.666 -1.057 1.00 0.00 C ATOM 1006 CE2 PHE A 68 12.613 -9.695 -0.714 1.00 0.00 C ATOM 1007 CZ PHE A 68 12.754 -11.013 -1.184 1.00 0.00 C ATOM 0 H PHE A 68 18.268 -9.813 1.396 1.00 0.00 H new ATOM 0 HA PHE A 68 16.216 -8.089 2.467 1.00 0.00 H new ATOM 0 HB2 PHE A 68 16.040 -7.870 0.265 1.00 0.00 H new ATOM 0 HB3 PHE A 68 17.043 -9.276 -0.030 1.00 0.00 H new ATOM 0 HD1 PHE A 68 16.039 -11.502 -0.394 1.00 0.00 H new ATOM 0 HD2 PHE A 68 13.587 -8.022 0.234 1.00 0.00 H new ATOM 0 HE1 PHE A 68 14.101 -12.686 -1.395 1.00 0.00 H new ATOM 0 HE2 PHE A 68 11.659 -9.194 -0.795 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.916 -11.520 -1.639 1.00 0.00 H new ATOM 1017 N ASN A 69 14.184 -9.608 2.884 1.00 0.00 N ATOM 1018 CA ASN A 69 13.090 -10.468 3.347 1.00 0.00 C ATOM 1019 C ASN A 69 11.797 -10.177 2.570 1.00 0.00 C ATOM 1020 O ASN A 69 11.398 -9.026 2.454 1.00 0.00 O ATOM 1021 CB ASN A 69 12.907 -10.316 4.871 1.00 0.00 C ATOM 1022 CG ASN A 69 12.295 -8.986 5.290 1.00 0.00 C ATOM 1023 OD1 ASN A 69 11.140 -8.910 5.681 1.00 0.00 O ATOM 1024 ND2 ASN A 69 13.033 -7.899 5.215 1.00 0.00 N ATOM 0 H ASN A 69 13.888 -8.654 2.678 1.00 0.00 H new ATOM 0 HA ASN A 69 13.345 -11.509 3.149 1.00 0.00 H new ATOM 0 HB2 ASN A 69 12.274 -11.126 5.234 1.00 0.00 H new ATOM 0 HB3 ASN A 69 13.877 -10.427 5.356 1.00 0.00 H new ATOM 0 HD21 ASN A 69 12.640 -6.997 5.483 1.00 0.00 H new ATOM 0 HD22 ASN A 69 13.998 -7.959 4.889 1.00 0.00 H new ATOM 1031 N ALA A 70 11.114 -11.205 2.061 1.00 0.00 N ATOM 1032 CA ALA A 70 9.935 -11.056 1.193 1.00 0.00 C ATOM 1033 C ALA A 70 8.629 -10.645 1.908 1.00 0.00 C ATOM 1034 O ALA A 70 7.570 -10.602 1.280 1.00 0.00 O ATOM 1035 CB ALA A 70 9.742 -12.354 0.406 1.00 0.00 C ATOM 0 H ALA A 70 11.364 -12.178 2.240 1.00 0.00 H new ATOM 0 HA ALA A 70 10.145 -10.216 0.531 1.00 0.00 H new ATOM 0 HB1 ALA A 70 8.871 -12.260 -0.243 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.627 -12.547 -0.200 1.00 0.00 H new ATOM 0 HB3 ALA A 70 9.590 -13.181 1.100 1.00 0.00 H new ATOM 1041 N ASP A 71 8.672 -10.335 3.207 1.00 0.00 N ATOM 1042 CA ASP A 71 7.460 -10.058 3.997 1.00 0.00 C ATOM 1043 C ASP A 71 6.821 -8.706 3.627 1.00 0.00 C ATOM 1044 O ASP A 71 5.598 -8.552 3.675 1.00 0.00 O ATOM 1045 CB ASP A 71 7.802 -10.116 5.489 1.00 0.00 C ATOM 1046 CG ASP A 71 6.542 -10.013 6.364 1.00 0.00 C ATOM 1047 OD1 ASP A 71 5.737 -10.975 6.377 1.00 0.00 O ATOM 1048 OD2 ASP A 71 6.364 -8.985 7.060 1.00 0.00 O ATOM 0 H ASP A 71 9.539 -10.268 3.741 1.00 0.00 H new ATOM 0 HA ASP A 71 6.719 -10.823 3.765 1.00 0.00 H new ATOM 0 HB2 ASP A 71 8.322 -11.049 5.707 1.00 0.00 H new ATOM 0 HB3 ASP A 71 8.486 -9.304 5.738 1.00 0.00 H new ATOM 1053 N ASP A 72 7.649 -7.747 3.199 1.00 0.00 N ATOM 1054 CA ASP A 72 7.232 -6.403 2.777 1.00 0.00 C ATOM 1055 C ASP A 72 6.989 -6.282 1.254 1.00 0.00 C ATOM 1056 O ASP A 72 6.534 -5.240 0.783 1.00 0.00 O ATOM 1057 CB ASP A 72 8.292 -5.411 3.284 1.00 0.00 C ATOM 1058 CG ASP A 72 7.805 -3.952 3.329 1.00 0.00 C ATOM 1059 OD1 ASP A 72 6.645 -3.688 3.731 1.00 0.00 O ATOM 1060 OD2 ASP A 72 8.612 -3.037 3.037 1.00 0.00 O ATOM 0 H ASP A 72 8.657 -7.887 3.134 1.00 0.00 H new ATOM 0 HA ASP A 72 6.260 -6.175 3.215 1.00 0.00 H new ATOM 0 HB2 ASP A 72 8.608 -5.710 4.284 1.00 0.00 H new ATOM 0 HB3 ASP A 72 9.170 -5.472 2.641 1.00 0.00 H new ATOM 1065 N TYR A 73 7.270 -7.341 0.477 1.00 0.00 N ATOM 1066 CA TYR A 73 7.271 -7.346 -0.992 1.00 0.00 C ATOM 1067 C TYR A 73 6.350 -8.450 -1.524 1.00 0.00 C ATOM 1068 O TYR A 73 6.799 -9.525 -1.914 1.00 0.00 O ATOM 1069 CB TYR A 73 8.707 -7.475 -1.538 1.00 0.00 C ATOM 1070 CG TYR A 73 9.704 -6.555 -0.866 1.00 0.00 C ATOM 1071 CD1 TYR A 73 9.931 -5.252 -1.340 1.00 0.00 C ATOM 1072 CD2 TYR A 73 10.369 -7.009 0.283 1.00 0.00 C ATOM 1073 CE1 TYR A 73 10.772 -4.385 -0.619 1.00 0.00 C ATOM 1074 CE2 TYR A 73 11.257 -6.174 0.977 1.00 0.00 C ATOM 1075 CZ TYR A 73 11.455 -4.844 0.531 1.00 0.00 C ATOM 1076 OH TYR A 73 12.296 -4.007 1.199 1.00 0.00 O ATOM 0 H TYR A 73 7.511 -8.250 0.871 1.00 0.00 H new ATOM 0 HA TYR A 73 6.878 -6.393 -1.348 1.00 0.00 H new ATOM 0 HB2 TYR A 73 9.040 -8.506 -1.417 1.00 0.00 H new ATOM 0 HB3 TYR A 73 8.699 -7.266 -2.608 1.00 0.00 H new ATOM 0 HD1 TYR A 73 9.462 -4.918 -2.254 1.00 0.00 H new ATOM 0 HD2 TYR A 73 10.195 -8.014 0.638 1.00 0.00 H new ATOM 0 HE1 TYR A 73 10.897 -3.363 -0.946 1.00 0.00 H new ATOM 0 HE2 TYR A 73 11.785 -6.542 1.844 1.00 0.00 H new ATOM 0 HH TYR A 73 12.684 -4.477 1.966 1.00 0.00 H new ATOM 1086 N ASP A 74 5.038 -8.192 -1.533 1.00 0.00 N ATOM 1087 CA ASP A 74 4.005 -9.201 -1.829 1.00 0.00 C ATOM 1088 C ASP A 74 3.978 -9.687 -3.299 1.00 0.00 C ATOM 1089 O ASP A 74 3.139 -10.504 -3.691 1.00 0.00 O ATOM 1090 CB ASP A 74 2.649 -8.623 -1.408 1.00 0.00 C ATOM 1091 CG ASP A 74 1.569 -9.695 -1.183 1.00 0.00 C ATOM 1092 OD1 ASP A 74 1.891 -10.842 -0.787 1.00 0.00 O ATOM 1093 OD2 ASP A 74 0.379 -9.339 -1.357 1.00 0.00 O ATOM 0 H ASP A 74 4.655 -7.268 -1.333 1.00 0.00 H new ATOM 0 HA ASP A 74 4.247 -10.099 -1.260 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.777 -8.049 -0.490 1.00 0.00 H new ATOM 0 HB3 ASP A 74 2.306 -7.928 -2.174 1.00 0.00 H new ATOM 1098 N VAL A 75 4.887 -9.163 -4.125 1.00 0.00 N ATOM 1099 CA VAL A 75 5.025 -9.464 -5.548 1.00 0.00 C ATOM 1100 C VAL A 75 6.484 -9.828 -5.837 1.00 0.00 C ATOM 1101 O VAL A 75 7.315 -8.946 -6.050 1.00 0.00 O ATOM 1102 CB VAL A 75 4.543 -8.254 -6.374 1.00 0.00 C ATOM 1103 CG1 VAL A 75 4.589 -8.559 -7.870 1.00 0.00 C ATOM 1104 CG2 VAL A 75 3.105 -7.841 -6.020 1.00 0.00 C ATOM 0 H VAL A 75 5.578 -8.486 -3.802 1.00 0.00 H new ATOM 0 HA VAL A 75 4.407 -10.316 -5.831 1.00 0.00 H new ATOM 0 HB VAL A 75 5.221 -7.436 -6.130 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.244 -7.689 -8.429 1.00 0.00 H new ATOM 0 HG12 VAL A 75 5.612 -8.796 -8.162 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.944 -9.410 -8.088 1.00 0.00 H new ATOM 0 HG21 VAL A 75 2.812 -6.985 -6.628 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.429 -8.673 -6.215 1.00 0.00 H new ATOM 0 HG23 VAL A 75 3.053 -7.571 -4.965 1.00 0.00 H new ATOM 1114 N VAL A 76 6.827 -11.118 -5.833 1.00 0.00 N ATOM 1115 CA VAL A 76 8.212 -11.583 -6.024 1.00 0.00 C ATOM 1116 C VAL A 76 8.347 -12.324 -7.348 1.00 0.00 C ATOM 1117 O VAL A 76 7.713 -13.353 -7.559 1.00 0.00 O ATOM 1118 CB VAL A 76 8.721 -12.453 -4.862 1.00 0.00 C ATOM 1119 CG1 VAL A 76 10.211 -12.757 -5.060 1.00 0.00 C ATOM 1120 CG2 VAL A 76 8.552 -11.768 -3.504 1.00 0.00 C ATOM 0 H VAL A 76 6.156 -11.874 -5.698 1.00 0.00 H new ATOM 0 HA VAL A 76 8.841 -10.693 -6.043 1.00 0.00 H new ATOM 0 HB VAL A 76 8.127 -13.367 -4.865 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.569 -13.373 -4.236 1.00 0.00 H new ATOM 0 HG12 VAL A 76 10.352 -13.291 -6.000 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.773 -11.823 -5.085 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.926 -12.423 -2.717 1.00 0.00 H new ATOM 0 HG22 VAL A 76 9.113 -10.833 -3.496 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.496 -11.559 -3.331 1.00 0.00 H new ATOM 1130 N ILE A 77 9.191 -11.818 -8.241 1.00 0.00 N ATOM 1131 CA ILE A 77 9.418 -12.382 -9.574 1.00 0.00 C ATOM 1132 C ILE A 77 10.812 -12.997 -9.653 1.00 0.00 C ATOM 1133 O ILE A 77 11.799 -12.380 -9.260 1.00 0.00 O ATOM 1134 CB ILE A 77 9.152 -11.303 -10.648 1.00 0.00 C ATOM 1135 CG1 ILE A 77 7.719 -11.395 -11.218 1.00 0.00 C ATOM 1136 CG2 ILE A 77 10.096 -11.379 -11.859 1.00 0.00 C ATOM 1137 CD1 ILE A 77 6.581 -11.372 -10.191 1.00 0.00 C ATOM 0 H ILE A 77 9.751 -10.985 -8.057 1.00 0.00 H new ATOM 0 HA ILE A 77 8.717 -13.194 -9.769 1.00 0.00 H new ATOM 0 HB ILE A 77 9.316 -10.368 -10.113 1.00 0.00 H new ATOM 0 HG12 ILE A 77 7.572 -10.567 -11.911 1.00 0.00 H new ATOM 0 HG13 ILE A 77 7.639 -12.314 -11.798 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.844 -10.589 -12.567 1.00 0.00 H new ATOM 0 HG22 ILE A 77 11.126 -11.253 -11.526 1.00 0.00 H new ATOM 0 HG23 ILE A 77 9.988 -12.349 -12.345 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.624 -11.442 -10.707 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.689 -12.216 -9.510 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.621 -10.441 -9.625 1.00 0.00 H new ATOM 1149 N SER A 78 10.881 -14.198 -10.214 1.00 0.00 N ATOM 1150 CA SER A 78 12.108 -14.892 -10.593 1.00 0.00 C ATOM 1151 C SER A 78 12.429 -14.615 -12.066 1.00 0.00 C ATOM 1152 O SER A 78 11.529 -14.461 -12.888 1.00 0.00 O ATOM 1153 CB SER A 78 11.927 -16.378 -10.287 1.00 0.00 C ATOM 1154 OG SER A 78 13.093 -17.090 -10.616 1.00 0.00 O ATOM 0 H SER A 78 10.044 -14.741 -10.428 1.00 0.00 H new ATOM 0 HA SER A 78 12.963 -14.531 -10.021 1.00 0.00 H new ATOM 0 HB2 SER A 78 11.696 -16.513 -9.230 1.00 0.00 H new ATOM 0 HB3 SER A 78 11.081 -16.772 -10.851 1.00 0.00 H new ATOM 0 HG SER A 78 12.860 -17.854 -11.184 1.00 0.00 H new ATOM 1160 N LEU A 79 13.707 -14.516 -12.421 1.00 0.00 N ATOM 1161 CA LEU A 79 14.166 -14.117 -13.757 1.00 0.00 C ATOM 1162 C LEU A 79 15.117 -15.167 -14.361 1.00 0.00 C ATOM 1163 O LEU A 79 16.168 -14.822 -14.889 1.00 0.00 O ATOM 1164 CB LEU A 79 14.759 -12.686 -13.665 1.00 0.00 C ATOM 1165 CG LEU A 79 13.806 -11.567 -13.185 1.00 0.00 C ATOM 1166 CD1 LEU A 79 14.560 -10.246 -13.178 1.00 0.00 C ATOM 1167 CD2 LEU A 79 12.643 -11.385 -14.140 1.00 0.00 C ATOM 0 H LEU A 79 14.473 -14.714 -11.777 1.00 0.00 H new ATOM 0 HA LEU A 79 13.332 -14.079 -14.458 1.00 0.00 H new ATOM 0 HB2 LEU A 79 15.615 -12.716 -12.991 1.00 0.00 H new ATOM 0 HB3 LEU A 79 15.138 -12.411 -14.649 1.00 0.00 H new ATOM 0 HG LEU A 79 13.442 -11.847 -12.196 1.00 0.00 H new ATOM 0 HD11 LEU A 79 13.896 -9.450 -12.841 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.413 -10.317 -12.503 1.00 0.00 H new ATOM 0 HD13 LEU A 79 14.912 -10.023 -14.185 1.00 0.00 H new ATOM 0 HD21 LEU A 79 11.992 -10.591 -13.774 1.00 0.00 H new ATOM 0 HD22 LEU A 79 13.021 -11.118 -15.127 1.00 0.00 H new ATOM 0 HD23 LEU A 79 12.078 -12.315 -14.207 1.00 0.00 H new ATOM 1179 N CYS A 80 14.802 -16.465 -14.264 1.00 0.00 N ATOM 1180 CA CYS A 80 15.752 -17.540 -14.624 1.00 0.00 C ATOM 1181 C CYS A 80 15.161 -18.851 -15.181 1.00 0.00 C ATOM 1182 O CYS A 80 15.916 -19.717 -15.628 1.00 0.00 O ATOM 1183 CB CYS A 80 16.582 -17.871 -13.372 1.00 0.00 C ATOM 1184 SG CYS A 80 15.602 -18.427 -11.954 1.00 0.00 S ATOM 0 H CYS A 80 13.896 -16.803 -13.939 1.00 0.00 H new ATOM 0 HA CYS A 80 16.331 -17.136 -15.454 1.00 0.00 H new ATOM 0 HB2 CYS A 80 17.306 -18.646 -13.625 1.00 0.00 H new ATOM 0 HB3 CYS A 80 17.150 -16.987 -13.082 1.00 0.00 H new ATOM 1189 N GLY A 81 13.838 -19.039 -15.145 1.00 0.00 N ATOM 1190 CA GLY A 81 13.193 -20.331 -15.427 1.00 0.00 C ATOM 1191 C GLY A 81 13.543 -21.369 -14.349 1.00 0.00 C ATOM 1192 O GLY A 81 13.647 -22.563 -14.639 1.00 0.00 O ATOM 0 H GLY A 81 13.178 -18.295 -14.918 1.00 0.00 H new ATOM 0 HA2 GLY A 81 12.112 -20.199 -15.473 1.00 0.00 H new ATOM 0 HA3 GLY A 81 13.511 -20.695 -16.404 1.00 0.00 H new ATOM 1196 N CYS A 82 13.788 -20.893 -13.121 1.00 0.00 N ATOM 1197 CA CYS A 82 14.345 -21.661 -12.003 1.00 0.00 C ATOM 1198 C CYS A 82 13.737 -21.309 -10.629 1.00 0.00 C ATOM 1199 O CYS A 82 14.251 -21.760 -9.608 1.00 0.00 O ATOM 1200 CB CYS A 82 15.881 -21.504 -12.021 1.00 0.00 C ATOM 1201 SG CYS A 82 16.594 -20.040 -11.201 1.00 0.00 S ATOM 0 H CYS A 82 13.595 -19.923 -12.871 1.00 0.00 H new ATOM 0 HA CYS A 82 14.074 -22.707 -12.145 1.00 0.00 H new ATOM 0 HB2 CYS A 82 16.314 -22.391 -11.559 1.00 0.00 H new ATOM 0 HB3 CYS A 82 16.205 -21.496 -13.062 1.00 0.00 H new ATOM 1206 N GLY A 83 12.659 -20.514 -10.577 1.00 0.00 N ATOM 1207 CA GLY A 83 12.109 -19.929 -9.340 1.00 0.00 C ATOM 1208 C GLY A 83 11.828 -20.893 -8.178 1.00 0.00 C ATOM 1209 O GLY A 83 11.948 -20.495 -7.022 1.00 0.00 O ATOM 0 H GLY A 83 12.132 -20.252 -11.410 1.00 0.00 H new ATOM 0 HA2 GLY A 83 12.804 -19.167 -8.987 1.00 0.00 H new ATOM 0 HA3 GLY A 83 11.178 -19.420 -9.591 1.00 0.00 H new ATOM 1213 N VAL A 84 11.558 -22.176 -8.450 1.00 0.00 N ATOM 1214 CA VAL A 84 11.408 -23.222 -7.410 1.00 0.00 C ATOM 1215 C VAL A 84 12.696 -23.505 -6.611 1.00 0.00 C ATOM 1216 O VAL A 84 12.629 -24.094 -5.531 1.00 0.00 O ATOM 1217 CB VAL A 84 10.855 -24.536 -8.003 1.00 0.00 C ATOM 1218 CG1 VAL A 84 9.447 -24.334 -8.576 1.00 0.00 C ATOM 1219 CG2 VAL A 84 11.755 -25.142 -9.090 1.00 0.00 C ATOM 0 H VAL A 84 11.435 -22.527 -9.400 1.00 0.00 H new ATOM 0 HA VAL A 84 10.687 -22.812 -6.703 1.00 0.00 H new ATOM 0 HB VAL A 84 10.824 -25.238 -7.170 1.00 0.00 H new ATOM 0 HG11 VAL A 84 9.083 -25.276 -8.987 1.00 0.00 H new ATOM 0 HG12 VAL A 84 8.776 -24.000 -7.784 1.00 0.00 H new ATOM 0 HG13 VAL A 84 9.480 -23.583 -9.365 1.00 0.00 H new ATOM 0 HG21 VAL A 84 11.306 -26.063 -9.462 1.00 0.00 H new ATOM 0 HG22 VAL A 84 11.862 -24.433 -9.911 1.00 0.00 H new ATOM 0 HG23 VAL A 84 12.736 -25.361 -8.669 1.00 0.00 H new ATOM 1229 N ASN A 85 13.864 -23.067 -7.101 1.00 0.00 N ATOM 1230 CA ASN A 85 15.161 -23.174 -6.421 1.00 0.00 C ATOM 1231 C ASN A 85 15.402 -22.058 -5.376 1.00 0.00 C ATOM 1232 O ASN A 85 16.359 -22.129 -4.603 1.00 0.00 O ATOM 1233 CB ASN A 85 16.259 -23.183 -7.505 1.00 0.00 C ATOM 1234 CG ASN A 85 17.614 -23.664 -6.999 1.00 0.00 C ATOM 1235 OD1 ASN A 85 17.728 -24.530 -6.142 1.00 0.00 O ATOM 1236 ND2 ASN A 85 18.694 -23.145 -7.541 1.00 0.00 N ATOM 0 H ASN A 85 13.934 -22.613 -8.012 1.00 0.00 H new ATOM 0 HA ASN A 85 15.180 -24.099 -5.845 1.00 0.00 H new ATOM 0 HB2 ASN A 85 15.940 -23.823 -8.328 1.00 0.00 H new ATOM 0 HB3 ASN A 85 16.368 -22.176 -7.908 1.00 0.00 H new ATOM 0 HD21 ASN A 85 19.617 -23.465 -7.246 1.00 0.00 H new ATOM 0 HD22 ASN A 85 18.609 -22.423 -8.256 1.00 0.00 H new ATOM 1243 N LEU A 86 14.556 -21.017 -5.344 1.00 0.00 N ATOM 1244 CA LEU A 86 14.622 -19.939 -4.349 1.00 0.00 C ATOM 1245 C LEU A 86 14.153 -20.430 -2.956 1.00 0.00 C ATOM 1246 O LEU A 86 13.412 -21.421 -2.881 1.00 0.00 O ATOM 1247 CB LEU A 86 13.776 -18.741 -4.827 1.00 0.00 C ATOM 1248 CG LEU A 86 14.176 -18.139 -6.189 1.00 0.00 C ATOM 1249 CD1 LEU A 86 13.262 -16.955 -6.496 1.00 0.00 C ATOM 1250 CD2 LEU A 86 15.626 -17.657 -6.225 1.00 0.00 C ATOM 0 H LEU A 86 13.798 -20.900 -6.017 1.00 0.00 H new ATOM 0 HA LEU A 86 15.660 -19.621 -4.246 1.00 0.00 H new ATOM 0 HB2 LEU A 86 12.734 -19.055 -4.882 1.00 0.00 H new ATOM 0 HB3 LEU A 86 13.833 -17.956 -4.073 1.00 0.00 H new ATOM 0 HG LEU A 86 14.074 -18.929 -6.932 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.537 -16.523 -7.458 1.00 0.00 H new ATOM 0 HD12 LEU A 86 12.227 -17.295 -6.534 1.00 0.00 H new ATOM 0 HD13 LEU A 86 13.368 -16.201 -5.716 1.00 0.00 H new ATOM 0 HD21 LEU A 86 15.848 -17.244 -7.209 1.00 0.00 H new ATOM 0 HD22 LEU A 86 15.773 -16.888 -5.467 1.00 0.00 H new ATOM 0 HD23 LEU A 86 16.293 -18.495 -6.025 1.00 0.00 H new ATOM 1262 N PRO A 87 14.531 -19.750 -1.851 1.00 0.00 N ATOM 1263 CA PRO A 87 14.036 -20.079 -0.513 1.00 0.00 C ATOM 1264 C PRO A 87 12.498 -20.007 -0.467 1.00 0.00 C ATOM 1265 O PRO A 87 11.942 -19.018 -0.953 1.00 0.00 O ATOM 1266 CB PRO A 87 14.679 -19.057 0.438 1.00 0.00 C ATOM 1267 CG PRO A 87 15.918 -18.589 -0.324 1.00 0.00 C ATOM 1268 CD PRO A 87 15.445 -18.621 -1.774 1.00 0.00 C ATOM 0 HA PRO A 87 14.299 -21.097 -0.225 1.00 0.00 H new ATOM 0 HB2 PRO A 87 14.004 -18.229 0.653 1.00 0.00 H new ATOM 0 HB3 PRO A 87 14.943 -19.509 1.394 1.00 0.00 H new ATOM 0 HG2 PRO A 87 16.228 -17.589 -0.020 1.00 0.00 H new ATOM 0 HG3 PRO A 87 16.769 -19.250 -0.160 1.00 0.00 H new ATOM 0 HD2 PRO A 87 14.946 -17.691 -2.046 1.00 0.00 H new ATOM 0 HD3 PRO A 87 16.283 -18.745 -2.459 1.00 0.00 H new ATOM 1276 N PRO A 88 11.782 -21.008 0.085 1.00 0.00 N ATOM 1277 CA PRO A 88 10.318 -21.053 0.031 1.00 0.00 C ATOM 1278 C PRO A 88 9.640 -19.852 0.713 1.00 0.00 C ATOM 1279 O PRO A 88 8.599 -19.391 0.244 1.00 0.00 O ATOM 1280 CB PRO A 88 9.917 -22.390 0.667 1.00 0.00 C ATOM 1281 CG PRO A 88 11.120 -22.769 1.532 1.00 0.00 C ATOM 1282 CD PRO A 88 12.296 -22.205 0.735 1.00 0.00 C ATOM 0 HA PRO A 88 9.976 -20.983 -1.001 1.00 0.00 H new ATOM 0 HB2 PRO A 88 9.011 -22.291 1.266 1.00 0.00 H new ATOM 0 HB3 PRO A 88 9.717 -23.147 -0.091 1.00 0.00 H new ATOM 0 HG2 PRO A 88 11.058 -22.330 2.528 1.00 0.00 H new ATOM 0 HG3 PRO A 88 11.200 -23.848 1.664 1.00 0.00 H new ATOM 0 HD2 PRO A 88 13.136 -21.968 1.388 1.00 0.00 H new ATOM 0 HD3 PRO A 88 12.656 -22.927 0.002 1.00 0.00 H new ATOM 1290 N GLU A 89 10.245 -19.266 1.751 1.00 0.00 N ATOM 1291 CA GLU A 89 9.751 -18.013 2.333 1.00 0.00 C ATOM 1292 C GLU A 89 9.735 -16.850 1.324 1.00 0.00 C ATOM 1293 O GLU A 89 8.844 -16.008 1.405 1.00 0.00 O ATOM 1294 CB GLU A 89 10.520 -17.615 3.605 1.00 0.00 C ATOM 1295 CG GLU A 89 12.054 -17.617 3.499 1.00 0.00 C ATOM 1296 CD GLU A 89 12.649 -18.970 3.934 1.00 0.00 C ATOM 1297 OE1 GLU A 89 12.658 -19.914 3.111 1.00 0.00 O ATOM 1298 OE2 GLU A 89 13.094 -19.103 5.103 1.00 0.00 O ATOM 0 H GLU A 89 11.078 -19.639 2.206 1.00 0.00 H new ATOM 0 HA GLU A 89 8.717 -18.213 2.615 1.00 0.00 H new ATOM 0 HB2 GLU A 89 10.198 -16.617 3.902 1.00 0.00 H new ATOM 0 HB3 GLU A 89 10.231 -18.294 4.407 1.00 0.00 H new ATOM 0 HG2 GLU A 89 12.349 -17.402 2.472 1.00 0.00 H new ATOM 0 HG3 GLU A 89 12.464 -16.821 4.121 1.00 0.00 H new ATOM 1305 N TRP A 90 10.658 -16.805 0.354 1.00 0.00 N ATOM 1306 CA TRP A 90 10.693 -15.807 -0.722 1.00 0.00 C ATOM 1307 C TRP A 90 9.860 -16.205 -1.965 1.00 0.00 C ATOM 1308 O TRP A 90 10.003 -15.602 -3.031 1.00 0.00 O ATOM 1309 CB TRP A 90 12.151 -15.470 -1.074 1.00 0.00 C ATOM 1310 CG TRP A 90 13.112 -15.108 0.028 1.00 0.00 C ATOM 1311 CD1 TRP A 90 14.449 -15.135 -0.155 1.00 0.00 C ATOM 1312 CD2 TRP A 90 12.924 -14.650 1.416 1.00 0.00 C ATOM 1313 NE1 TRP A 90 15.096 -14.703 0.979 1.00 0.00 N ATOM 1314 CE2 TRP A 90 14.213 -14.427 1.991 1.00 0.00 C ATOM 1315 CE3 TRP A 90 11.823 -14.401 2.270 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 14.400 -14.005 3.311 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 11.994 -14.014 3.615 1.00 0.00 C ATOM 1318 CH2 TRP A 90 13.282 -13.831 4.143 1.00 0.00 C ATOM 0 H TRP A 90 11.421 -17.480 0.295 1.00 0.00 H new ATOM 0 HA TRP A 90 10.208 -14.906 -0.347 1.00 0.00 H new ATOM 0 HB2 TRP A 90 12.567 -16.328 -1.602 1.00 0.00 H new ATOM 0 HB3 TRP A 90 12.134 -14.639 -1.779 1.00 0.00 H new ATOM 0 HD1 TRP A 90 14.941 -15.451 -1.063 1.00 0.00 H new ATOM 0 HE1 TRP A 90 16.108 -14.601 1.058 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.822 -14.511 1.880 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 15.394 -13.815 3.687 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 11.129 -13.857 4.243 1.00 0.00 H new ATOM 0 HH2 TRP A 90 13.412 -13.559 5.180 1.00 0.00 H new ATOM 1329 N VAL A 91 9.004 -17.229 -1.847 1.00 0.00 N ATOM 1330 CA VAL A 91 8.137 -17.772 -2.903 1.00 0.00 C ATOM 1331 C VAL A 91 6.647 -17.659 -2.545 1.00 0.00 C ATOM 1332 O VAL A 91 5.825 -17.424 -3.427 1.00 0.00 O ATOM 1333 CB VAL A 91 8.525 -19.242 -3.184 1.00 0.00 C ATOM 1334 CG1 VAL A 91 7.506 -20.002 -4.039 1.00 0.00 C ATOM 1335 CG2 VAL A 91 9.897 -19.337 -3.866 1.00 0.00 C ATOM 0 H VAL A 91 8.891 -17.728 -0.965 1.00 0.00 H new ATOM 0 HA VAL A 91 8.288 -17.177 -3.804 1.00 0.00 H new ATOM 0 HB VAL A 91 8.552 -19.712 -2.201 1.00 0.00 H new ATOM 0 HG11 VAL A 91 7.850 -21.025 -4.192 1.00 0.00 H new ATOM 0 HG12 VAL A 91 6.542 -20.015 -3.530 1.00 0.00 H new ATOM 0 HG13 VAL A 91 7.400 -19.507 -5.004 1.00 0.00 H new ATOM 0 HG21 VAL A 91 10.140 -20.383 -4.050 1.00 0.00 H new ATOM 0 HG22 VAL A 91 9.870 -18.799 -4.814 1.00 0.00 H new ATOM 0 HG23 VAL A 91 10.656 -18.896 -3.220 1.00 0.00 H new ATOM 1345 N THR A 92 6.265 -17.798 -1.272 1.00 0.00 N ATOM 1346 CA THR A 92 4.856 -17.929 -0.840 1.00 0.00 C ATOM 1347 C THR A 92 4.044 -16.622 -0.726 1.00 0.00 C ATOM 1348 O THR A 92 2.933 -16.622 -0.187 1.00 0.00 O ATOM 1349 CB THR A 92 4.770 -18.781 0.437 1.00 0.00 C ATOM 1350 OG1 THR A 92 5.640 -18.265 1.426 1.00 0.00 O ATOM 1351 CG2 THR A 92 5.168 -20.231 0.139 1.00 0.00 C ATOM 0 H THR A 92 6.928 -17.824 -0.497 1.00 0.00 H new ATOM 0 HA THR A 92 4.359 -18.442 -1.663 1.00 0.00 H new ATOM 0 HB THR A 92 3.742 -18.751 0.797 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.577 -18.813 2.236 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.102 -20.822 1.053 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.495 -20.646 -0.611 1.00 0.00 H new ATOM 0 HG23 THR A 92 6.191 -20.258 -0.237 1.00 0.00 H new ATOM 1359 N GLN A 93 4.556 -15.507 -1.257 1.00 0.00 N ATOM 1360 CA GLN A 93 3.836 -14.230 -1.418 1.00 0.00 C ATOM 1361 C GLN A 93 2.688 -14.335 -2.442 1.00 0.00 C ATOM 1362 O GLN A 93 2.638 -15.268 -3.249 1.00 0.00 O ATOM 1363 CB GLN A 93 4.832 -13.118 -1.802 1.00 0.00 C ATOM 1364 CG GLN A 93 5.753 -12.704 -0.647 1.00 0.00 C ATOM 1365 CD GLN A 93 6.724 -13.809 -0.240 1.00 0.00 C ATOM 1366 OE1 GLN A 93 7.374 -14.442 -1.064 1.00 0.00 O ATOM 1367 NE2 GLN A 93 6.828 -14.115 1.035 1.00 0.00 N ATOM 0 H GLN A 93 5.516 -15.462 -1.600 1.00 0.00 H new ATOM 0 HA GLN A 93 3.373 -13.978 -0.464 1.00 0.00 H new ATOM 0 HB2 GLN A 93 5.441 -13.459 -2.639 1.00 0.00 H new ATOM 0 HB3 GLN A 93 4.277 -12.245 -2.146 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.318 -11.819 -0.939 1.00 0.00 H new ATOM 0 HG3 GLN A 93 5.146 -12.425 0.214 1.00 0.00 H new ATOM 0 HE21 GLN A 93 6.292 -13.595 1.730 1.00 0.00 H new ATOM 0 HE22 GLN A 93 7.445 -14.872 1.329 1.00 0.00 H new ATOM 1376 N GLU A 94 1.749 -13.383 -2.404 1.00 0.00 N ATOM 1377 CA GLU A 94 0.492 -13.464 -3.162 1.00 0.00 C ATOM 1378 C GLU A 94 0.696 -13.559 -4.687 1.00 0.00 C ATOM 1379 O GLU A 94 -0.019 -14.312 -5.356 1.00 0.00 O ATOM 1380 CB GLU A 94 -0.388 -12.259 -2.809 1.00 0.00 C ATOM 1381 CG GLU A 94 -1.833 -12.475 -3.259 1.00 0.00 C ATOM 1382 CD GLU A 94 -2.706 -11.246 -2.943 1.00 0.00 C ATOM 1383 OE1 GLU A 94 -2.626 -10.235 -3.684 1.00 0.00 O ATOM 1384 OE2 GLU A 94 -3.478 -11.278 -1.954 1.00 0.00 O ATOM 0 H GLU A 94 1.838 -12.533 -1.847 1.00 0.00 H new ATOM 0 HA GLU A 94 -0.000 -14.392 -2.872 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -0.362 -12.090 -1.733 1.00 0.00 H new ATOM 0 HB3 GLU A 94 0.012 -11.363 -3.282 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -1.857 -12.675 -4.330 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -2.244 -13.353 -2.761 1.00 0.00 H new ATOM 1391 N ILE A 95 1.703 -12.858 -5.229 1.00 0.00 N ATOM 1392 CA ILE A 95 2.153 -13.016 -6.616 1.00 0.00 C ATOM 1393 C ILE A 95 3.586 -13.558 -6.625 1.00 0.00 C ATOM 1394 O ILE A 95 4.517 -12.883 -6.175 1.00 0.00 O ATOM 1395 CB ILE A 95 2.011 -11.704 -7.425 1.00 0.00 C ATOM 1396 CG1 ILE A 95 0.537 -11.231 -7.453 1.00 0.00 C ATOM 1397 CG2 ILE A 95 2.553 -11.903 -8.856 1.00 0.00 C ATOM 1398 CD1 ILE A 95 0.283 -9.935 -8.238 1.00 0.00 C ATOM 0 H ILE A 95 2.232 -12.158 -4.709 1.00 0.00 H new ATOM 0 HA ILE A 95 1.508 -13.738 -7.117 1.00 0.00 H new ATOM 0 HB ILE A 95 2.600 -10.928 -6.936 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -0.075 -12.024 -7.883 1.00 0.00 H new ATOM 0 HG13 ILE A 95 0.198 -11.088 -6.427 1.00 0.00 H new ATOM 0 HG21 ILE A 95 2.449 -10.974 -9.417 1.00 0.00 H new ATOM 0 HG22 ILE A 95 3.605 -12.183 -8.811 1.00 0.00 H new ATOM 0 HG23 ILE A 95 1.988 -12.692 -9.352 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -0.778 -9.688 -8.198 1.00 0.00 H new ATOM 0 HD12 ILE A 95 0.862 -9.123 -7.797 1.00 0.00 H new ATOM 0 HD13 ILE A 95 0.585 -10.073 -9.276 1.00 0.00 H new ATOM 1410 N PHE A 96 3.753 -14.761 -7.184 1.00 0.00 N ATOM 1411 CA PHE A 96 5.054 -15.355 -7.492 1.00 0.00 C ATOM 1412 C PHE A 96 5.044 -15.962 -8.902 1.00 0.00 C ATOM 1413 O PHE A 96 4.164 -16.758 -9.239 1.00 0.00 O ATOM 1414 CB PHE A 96 5.497 -16.359 -6.422 1.00 0.00 C ATOM 1415 CG PHE A 96 6.862 -16.949 -6.727 1.00 0.00 C ATOM 1416 CD1 PHE A 96 8.020 -16.257 -6.330 1.00 0.00 C ATOM 1417 CD2 PHE A 96 6.983 -18.145 -7.461 1.00 0.00 C ATOM 1418 CE1 PHE A 96 9.293 -16.736 -6.679 1.00 0.00 C ATOM 1419 CE2 PHE A 96 8.258 -18.633 -7.805 1.00 0.00 C ATOM 1420 CZ PHE A 96 9.412 -17.925 -7.418 1.00 0.00 C ATOM 0 H PHE A 96 2.969 -15.361 -7.440 1.00 0.00 H new ATOM 0 HA PHE A 96 5.801 -14.561 -7.480 1.00 0.00 H new ATOM 0 HB2 PHE A 96 5.524 -15.865 -5.451 1.00 0.00 H new ATOM 0 HB3 PHE A 96 4.763 -17.161 -6.351 1.00 0.00 H new ATOM 0 HD1 PHE A 96 7.930 -15.349 -5.752 1.00 0.00 H new ATOM 0 HD2 PHE A 96 6.098 -18.687 -7.760 1.00 0.00 H new ATOM 0 HE1 PHE A 96 10.177 -16.193 -6.380 1.00 0.00 H new ATOM 0 HE2 PHE A 96 8.351 -19.551 -8.366 1.00 0.00 H new ATOM 0 HZ PHE A 96 10.389 -18.296 -7.689 1.00 0.00 H new ATOM 1430 N GLU A 97 6.011 -15.567 -9.732 1.00 0.00 N ATOM 1431 CA GLU A 97 6.116 -15.914 -11.162 1.00 0.00 C ATOM 1432 C GLU A 97 7.592 -16.028 -11.592 1.00 0.00 C ATOM 1433 O GLU A 97 8.463 -15.455 -10.937 1.00 0.00 O ATOM 1434 CB GLU A 97 5.453 -14.814 -12.023 1.00 0.00 C ATOM 1435 CG GLU A 97 3.954 -14.560 -11.788 1.00 0.00 C ATOM 1436 CD GLU A 97 3.044 -15.763 -12.130 1.00 0.00 C ATOM 1437 OE1 GLU A 97 3.455 -16.670 -12.897 1.00 0.00 O ATOM 1438 OE2 GLU A 97 1.876 -15.777 -11.672 1.00 0.00 O ATOM 0 H GLU A 97 6.778 -14.971 -9.419 1.00 0.00 H new ATOM 0 HA GLU A 97 5.614 -16.871 -11.308 1.00 0.00 H new ATOM 0 HB2 GLU A 97 5.987 -13.880 -11.851 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.593 -15.073 -13.072 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.803 -14.290 -10.743 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.644 -13.703 -12.386 1.00 0.00 H new ATOM 1445 N ASP A 98 7.881 -16.707 -12.712 1.00 0.00 N ATOM 1446 CA ASP A 98 9.212 -16.696 -13.345 1.00 0.00 C ATOM 1447 C ASP A 98 9.133 -16.289 -14.831 1.00 0.00 C ATOM 1448 O ASP A 98 8.291 -16.790 -15.581 1.00 0.00 O ATOM 1449 CB ASP A 98 9.953 -18.032 -13.132 1.00 0.00 C ATOM 1450 CG ASP A 98 11.457 -17.935 -13.389 1.00 0.00 C ATOM 1451 OD1 ASP A 98 11.890 -17.263 -14.346 1.00 0.00 O ATOM 1452 OD2 ASP A 98 12.244 -18.542 -12.630 1.00 0.00 O ATOM 0 H ASP A 98 7.198 -17.281 -13.207 1.00 0.00 H new ATOM 0 HA ASP A 98 9.807 -15.930 -12.848 1.00 0.00 H new ATOM 0 HB2 ASP A 98 9.787 -18.373 -12.110 1.00 0.00 H new ATOM 0 HB3 ASP A 98 9.526 -18.786 -13.793 1.00 0.00 H new ATOM 1457 N TRP A 99 10.011 -15.369 -15.257 1.00 0.00 N ATOM 1458 CA TRP A 99 10.056 -14.819 -16.626 1.00 0.00 C ATOM 1459 C TRP A 99 10.953 -15.587 -17.607 1.00 0.00 C ATOM 1460 O TRP A 99 11.003 -15.208 -18.776 1.00 0.00 O ATOM 1461 CB TRP A 99 10.437 -13.338 -16.571 1.00 0.00 C ATOM 1462 CG TRP A 99 9.475 -12.409 -15.899 1.00 0.00 C ATOM 1463 CD1 TRP A 99 8.271 -12.708 -15.353 1.00 0.00 C ATOM 1464 CD2 TRP A 99 9.662 -10.987 -15.675 1.00 0.00 C ATOM 1465 NE1 TRP A 99 7.726 -11.572 -14.783 1.00 0.00 N ATOM 1466 CE2 TRP A 99 8.578 -10.496 -14.898 1.00 0.00 C ATOM 1467 CE3 TRP A 99 10.658 -10.068 -16.056 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 8.545 -9.181 -14.423 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 10.662 -8.761 -15.544 1.00 0.00 C ATOM 1470 CH2 TRP A 99 9.623 -8.328 -14.705 1.00 0.00 C ATOM 0 H TRP A 99 10.728 -14.975 -14.647 1.00 0.00 H new ATOM 0 HA TRP A 99 9.051 -14.938 -17.032 1.00 0.00 H new ATOM 0 HB2 TRP A 99 11.398 -13.255 -16.063 1.00 0.00 H new ATOM 0 HB3 TRP A 99 10.586 -12.989 -17.593 1.00 0.00 H new ATOM 0 HD1 TRP A 99 7.808 -13.684 -15.362 1.00 0.00 H new ATOM 0 HE1 TRP A 99 6.810 -11.536 -14.335 1.00 0.00 H new ATOM 0 HE3 TRP A 99 11.428 -10.372 -16.750 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.702 -8.827 -13.848 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 11.467 -8.086 -15.796 1.00 0.00 H new ATOM 0 HH2 TRP A 99 9.653 -7.337 -14.276 1.00 0.00 H new ATOM 1481 N GLN A 100 11.625 -16.666 -17.179 1.00 0.00 N ATOM 1482 CA GLN A 100 12.339 -17.611 -18.065 1.00 0.00 C ATOM 1483 C GLN A 100 13.530 -16.994 -18.841 1.00 0.00 C ATOM 1484 O GLN A 100 13.728 -17.273 -20.026 1.00 0.00 O ATOM 1485 CB GLN A 100 11.325 -18.336 -18.981 1.00 0.00 C ATOM 1486 CG GLN A 100 10.117 -18.937 -18.241 1.00 0.00 C ATOM 1487 CD GLN A 100 9.040 -19.405 -19.219 1.00 0.00 C ATOM 1488 OE1 GLN A 100 8.937 -20.576 -19.562 1.00 0.00 O ATOM 1489 NE2 GLN A 100 8.207 -18.510 -19.719 1.00 0.00 N ATOM 0 H GLN A 100 11.692 -16.915 -16.192 1.00 0.00 H new ATOM 0 HA GLN A 100 12.819 -18.350 -17.423 1.00 0.00 H new ATOM 0 HB2 GLN A 100 10.963 -17.632 -19.731 1.00 0.00 H new ATOM 0 HB3 GLN A 100 11.842 -19.133 -19.515 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.445 -19.777 -17.629 1.00 0.00 H new ATOM 0 HG3 GLN A 100 9.697 -18.194 -17.563 1.00 0.00 H new ATOM 0 HE21 GLN A 100 8.283 -17.532 -19.441 1.00 0.00 H new ATOM 0 HE22 GLN A 100 7.488 -18.797 -20.383 1.00 0.00 H new ATOM 1498 N LEU A 101 14.308 -16.119 -18.188 1.00 0.00 N ATOM 1499 CA LEU A 101 15.381 -15.328 -18.823 1.00 0.00 C ATOM 1500 C LEU A 101 16.779 -15.981 -18.754 1.00 0.00 C ATOM 1501 O LEU A 101 17.071 -16.784 -17.868 1.00 0.00 O ATOM 1502 CB LEU A 101 15.405 -13.904 -18.232 1.00 0.00 C ATOM 1503 CG LEU A 101 14.073 -13.138 -18.246 1.00 0.00 C ATOM 1504 CD1 LEU A 101 14.332 -11.709 -17.791 1.00 0.00 C ATOM 1505 CD2 LEU A 101 13.452 -13.051 -19.632 1.00 0.00 C ATOM 0 H LEU A 101 14.211 -15.936 -17.189 1.00 0.00 H new ATOM 0 HA LEU A 101 15.141 -15.285 -19.885 1.00 0.00 H new ATOM 0 HB2 LEU A 101 15.752 -13.968 -17.201 1.00 0.00 H new ATOM 0 HB3 LEU A 101 16.142 -13.318 -18.781 1.00 0.00 H new ATOM 0 HG LEU A 101 13.390 -13.679 -17.591 1.00 0.00 H new ATOM 0 HD11 LEU A 101 13.396 -11.151 -17.795 1.00 0.00 H new ATOM 0 HD12 LEU A 101 14.745 -11.718 -16.782 1.00 0.00 H new ATOM 0 HD13 LEU A 101 15.041 -11.234 -18.469 1.00 0.00 H new ATOM 0 HD21 LEU A 101 12.514 -12.499 -19.576 1.00 0.00 H new ATOM 0 HD22 LEU A 101 14.137 -12.536 -20.306 1.00 0.00 H new ATOM 0 HD23 LEU A 101 13.260 -14.056 -20.008 1.00 0.00 H new ATOM 1517 N GLU A 102 17.656 -15.570 -19.676 1.00 0.00 N ATOM 1518 CA GLU A 102 19.063 -15.996 -19.802 1.00 0.00 C ATOM 1519 C GLU A 102 20.023 -14.920 -19.256 1.00 0.00 C ATOM 1520 O GLU A 102 19.755 -13.731 -19.420 1.00 0.00 O ATOM 1521 CB GLU A 102 19.328 -16.285 -21.288 1.00 0.00 C ATOM 1522 CG GLU A 102 20.736 -16.832 -21.568 1.00 0.00 C ATOM 1523 CD GLU A 102 20.862 -17.315 -23.028 1.00 0.00 C ATOM 1524 OE1 GLU A 102 21.147 -16.487 -23.926 1.00 0.00 O ATOM 1525 OE2 GLU A 102 20.678 -18.532 -23.283 1.00 0.00 O ATOM 0 H GLU A 102 17.394 -14.895 -20.395 1.00 0.00 H new ATOM 0 HA GLU A 102 19.241 -16.893 -19.209 1.00 0.00 H new ATOM 0 HB2 GLU A 102 18.591 -17.003 -21.647 1.00 0.00 H new ATOM 0 HB3 GLU A 102 19.184 -15.368 -21.859 1.00 0.00 H new ATOM 0 HG2 GLU A 102 21.477 -16.057 -21.373 1.00 0.00 H new ATOM 0 HG3 GLU A 102 20.951 -17.657 -20.889 1.00 0.00 H new ATOM 1532 N ASP A 103 21.145 -15.296 -18.625 1.00 0.00 N ATOM 1533 CA ASP A 103 22.097 -14.313 -18.075 1.00 0.00 C ATOM 1534 C ASP A 103 22.911 -13.615 -19.188 1.00 0.00 C ATOM 1535 O ASP A 103 23.602 -14.300 -19.956 1.00 0.00 O ATOM 1536 CB ASP A 103 23.012 -14.951 -17.013 1.00 0.00 C ATOM 1537 CG ASP A 103 23.544 -13.910 -16.022 1.00 0.00 C ATOM 1538 OD1 ASP A 103 22.680 -13.172 -15.492 1.00 0.00 O ATOM 1539 OD2 ASP A 103 24.752 -13.881 -15.706 1.00 0.00 O ATOM 0 H ASP A 103 21.417 -16.269 -18.482 1.00 0.00 H new ATOM 0 HA ASP A 103 21.512 -13.539 -17.578 1.00 0.00 H new ATOM 0 HB2 ASP A 103 22.460 -15.720 -16.472 1.00 0.00 H new ATOM 0 HB3 ASP A 103 23.849 -15.446 -17.505 1.00 0.00 H new ATOM 1544 N PRO A 104 22.857 -12.268 -19.298 1.00 0.00 N ATOM 1545 CA PRO A 104 23.471 -11.539 -20.412 1.00 0.00 C ATOM 1546 C PRO A 104 24.969 -11.240 -20.241 1.00 0.00 C ATOM 1547 O PRO A 104 25.636 -10.915 -21.221 1.00 0.00 O ATOM 1548 CB PRO A 104 22.649 -10.262 -20.524 1.00 0.00 C ATOM 1549 CG PRO A 104 22.280 -9.965 -19.074 1.00 0.00 C ATOM 1550 CD PRO A 104 21.997 -11.365 -18.537 1.00 0.00 C ATOM 0 HA PRO A 104 23.453 -12.147 -21.317 1.00 0.00 H new ATOM 0 HB2 PRO A 104 23.224 -9.450 -20.969 1.00 0.00 H new ATOM 0 HB3 PRO A 104 21.764 -10.404 -21.145 1.00 0.00 H new ATOM 0 HG2 PRO A 104 23.092 -9.476 -18.536 1.00 0.00 H new ATOM 0 HG3 PRO A 104 21.410 -9.313 -18.998 1.00 0.00 H new ATOM 0 HD2 PRO A 104 22.214 -11.425 -17.471 1.00 0.00 H new ATOM 0 HD3 PRO A 104 20.947 -11.627 -18.664 1.00 0.00 H new ATOM 1558 N ASP A 105 25.514 -11.364 -19.028 1.00 0.00 N ATOM 1559 CA ASP A 105 26.944 -11.205 -18.744 1.00 0.00 C ATOM 1560 C ASP A 105 27.828 -12.067 -19.670 1.00 0.00 C ATOM 1561 O ASP A 105 27.855 -13.295 -19.562 1.00 0.00 O ATOM 1562 CB ASP A 105 27.198 -11.557 -17.272 1.00 0.00 C ATOM 1563 CG ASP A 105 28.699 -11.591 -16.932 1.00 0.00 C ATOM 1564 OD1 ASP A 105 29.422 -10.639 -17.308 1.00 0.00 O ATOM 1565 OD2 ASP A 105 29.141 -12.562 -16.269 1.00 0.00 O ATOM 0 H ASP A 105 24.963 -11.582 -18.198 1.00 0.00 H new ATOM 0 HA ASP A 105 27.218 -10.168 -18.936 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.699 -10.827 -16.635 1.00 0.00 H new ATOM 0 HB3 ASP A 105 26.755 -12.528 -17.051 1.00 0.00 H new ATOM 1570 N GLY A 106 28.557 -11.412 -20.583 1.00 0.00 N ATOM 1571 CA GLY A 106 29.501 -12.067 -21.498 1.00 0.00 C ATOM 1572 C GLY A 106 28.875 -12.563 -22.808 1.00 0.00 C ATOM 1573 O GLY A 106 29.590 -13.104 -23.655 1.00 0.00 O ATOM 0 H GLY A 106 28.507 -10.401 -20.708 1.00 0.00 H new ATOM 0 HA2 GLY A 106 30.303 -11.368 -21.735 1.00 0.00 H new ATOM 0 HA3 GLY A 106 29.958 -12.913 -20.985 1.00 0.00 H new ATOM 1577 N GLN A 107 27.564 -12.377 -22.998 1.00 0.00 N ATOM 1578 CA GLN A 107 26.901 -12.598 -24.289 1.00 0.00 C ATOM 1579 C GLN A 107 27.214 -11.424 -25.249 1.00 0.00 C ATOM 1580 O GLN A 107 27.767 -10.397 -24.837 1.00 0.00 O ATOM 1581 CB GLN A 107 25.377 -12.753 -24.105 1.00 0.00 C ATOM 1582 CG GLN A 107 24.902 -13.686 -22.977 1.00 0.00 C ATOM 1583 CD GLN A 107 25.285 -15.159 -23.090 1.00 0.00 C ATOM 1584 OE1 GLN A 107 25.838 -15.642 -24.070 1.00 0.00 O ATOM 1585 NE2 GLN A 107 24.982 -15.924 -22.061 1.00 0.00 N ATOM 0 H GLN A 107 26.931 -12.068 -22.260 1.00 0.00 H new ATOM 0 HA GLN A 107 27.283 -13.522 -24.722 1.00 0.00 H new ATOM 0 HB2 GLN A 107 24.955 -11.764 -23.927 1.00 0.00 H new ATOM 0 HB3 GLN A 107 24.957 -13.115 -25.044 1.00 0.00 H new ATOM 0 HG2 GLN A 107 25.295 -13.305 -22.034 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.815 -13.622 -22.919 1.00 0.00 H new ATOM 0 HE21 GLN A 107 24.521 -15.522 -21.245 1.00 0.00 H new ATOM 0 HE22 GLN A 107 25.208 -16.918 -22.081 1.00 0.00 H new ATOM 1594 N SER A 108 26.839 -11.540 -26.527 1.00 0.00 N ATOM 1595 CA SER A 108 26.893 -10.404 -27.465 1.00 0.00 C ATOM 1596 C SER A 108 25.904 -9.299 -27.075 1.00 0.00 C ATOM 1597 O SER A 108 24.890 -9.547 -26.415 1.00 0.00 O ATOM 1598 CB SER A 108 26.642 -10.881 -28.901 1.00 0.00 C ATOM 1599 OG SER A 108 25.319 -11.372 -29.035 1.00 0.00 O ATOM 0 H SER A 108 26.494 -12.407 -26.940 1.00 0.00 H new ATOM 0 HA SER A 108 27.894 -9.976 -27.411 1.00 0.00 H new ATOM 0 HB2 SER A 108 26.804 -10.058 -29.598 1.00 0.00 H new ATOM 0 HB3 SER A 108 27.355 -11.663 -29.161 1.00 0.00 H new ATOM 0 HG SER A 108 25.173 -11.671 -29.957 1.00 0.00 H new ATOM 1605 N LEU A 109 26.164 -8.057 -27.504 1.00 0.00 N ATOM 1606 CA LEU A 109 25.295 -6.919 -27.172 1.00 0.00 C ATOM 1607 C LEU A 109 23.896 -7.074 -27.786 1.00 0.00 C ATOM 1608 O LEU A 109 22.927 -6.660 -27.170 1.00 0.00 O ATOM 1609 CB LEU A 109 25.977 -5.588 -27.548 1.00 0.00 C ATOM 1610 CG LEU A 109 26.899 -5.042 -26.438 1.00 0.00 C ATOM 1611 CD1 LEU A 109 28.132 -5.908 -26.177 1.00 0.00 C ATOM 1612 CD2 LEU A 109 27.381 -3.636 -26.797 1.00 0.00 C ATOM 0 H LEU A 109 26.969 -7.814 -28.082 1.00 0.00 H new ATOM 0 HA LEU A 109 25.143 -6.904 -26.093 1.00 0.00 H new ATOM 0 HB2 LEU A 109 26.560 -5.730 -28.458 1.00 0.00 H new ATOM 0 HB3 LEU A 109 25.211 -4.846 -27.773 1.00 0.00 H new ATOM 0 HG LEU A 109 26.293 -5.041 -25.532 1.00 0.00 H new ATOM 0 HD11 LEU A 109 28.731 -5.459 -25.384 1.00 0.00 H new ATOM 0 HD12 LEU A 109 27.818 -6.907 -25.873 1.00 0.00 H new ATOM 0 HD13 LEU A 109 28.728 -5.976 -27.087 1.00 0.00 H new ATOM 0 HD21 LEU A 109 28.031 -3.261 -26.006 1.00 0.00 H new ATOM 0 HD22 LEU A 109 27.934 -3.670 -27.736 1.00 0.00 H new ATOM 0 HD23 LEU A 109 26.522 -2.974 -26.905 1.00 0.00 H new ATOM 1624 N GLU A 110 23.748 -7.773 -28.911 1.00 0.00 N ATOM 1625 CA GLU A 110 22.436 -8.153 -29.464 1.00 0.00 C ATOM 1626 C GLU A 110 21.616 -9.016 -28.488 1.00 0.00 C ATOM 1627 O GLU A 110 20.423 -8.786 -28.298 1.00 0.00 O ATOM 1628 CB GLU A 110 22.640 -8.941 -30.763 1.00 0.00 C ATOM 1629 CG GLU A 110 23.218 -8.076 -31.892 1.00 0.00 C ATOM 1630 CD GLU A 110 23.346 -8.885 -33.197 1.00 0.00 C ATOM 1631 OE1 GLU A 110 22.371 -8.937 -33.988 1.00 0.00 O ATOM 1632 OE2 GLU A 110 24.427 -9.472 -33.453 1.00 0.00 O ATOM 0 H GLU A 110 24.536 -8.096 -29.472 1.00 0.00 H new ATOM 0 HA GLU A 110 21.883 -7.232 -29.647 1.00 0.00 H new ATOM 0 HB2 GLU A 110 23.310 -9.780 -30.574 1.00 0.00 H new ATOM 0 HB3 GLU A 110 21.686 -9.360 -31.083 1.00 0.00 H new ATOM 0 HG2 GLU A 110 22.576 -7.211 -32.058 1.00 0.00 H new ATOM 0 HG3 GLU A 110 24.196 -7.695 -31.599 1.00 0.00 H new ATOM 1639 N VAL A 111 22.257 -9.966 -27.800 1.00 0.00 N ATOM 1640 CA VAL A 111 21.612 -10.803 -26.770 1.00 0.00 C ATOM 1641 C VAL A 111 21.372 -9.988 -25.501 1.00 0.00 C ATOM 1642 O VAL A 111 20.316 -10.110 -24.882 1.00 0.00 O ATOM 1643 CB VAL A 111 22.443 -12.073 -26.487 1.00 0.00 C ATOM 1644 CG1 VAL A 111 21.873 -12.899 -25.325 1.00 0.00 C ATOM 1645 CG2 VAL A 111 22.470 -12.984 -27.721 1.00 0.00 C ATOM 0 H VAL A 111 23.244 -10.181 -27.939 1.00 0.00 H new ATOM 0 HA VAL A 111 20.643 -11.133 -27.145 1.00 0.00 H new ATOM 0 HB VAL A 111 23.443 -11.726 -26.228 1.00 0.00 H new ATOM 0 HG11 VAL A 111 22.494 -13.781 -25.167 1.00 0.00 H new ATOM 0 HG12 VAL A 111 21.864 -12.294 -24.418 1.00 0.00 H new ATOM 0 HG13 VAL A 111 20.856 -13.209 -25.564 1.00 0.00 H new ATOM 0 HG21 VAL A 111 23.060 -13.874 -27.503 1.00 0.00 H new ATOM 0 HG22 VAL A 111 21.452 -13.277 -27.979 1.00 0.00 H new ATOM 0 HG23 VAL A 111 22.917 -12.449 -28.559 1.00 0.00 H new ATOM 1655 N PHE A 112 22.294 -9.087 -25.154 1.00 0.00 N ATOM 1656 CA PHE A 112 22.147 -8.185 -24.003 1.00 0.00 C ATOM 1657 C PHE A 112 20.941 -7.238 -24.191 1.00 0.00 C ATOM 1658 O PHE A 112 20.134 -7.061 -23.278 1.00 0.00 O ATOM 1659 CB PHE A 112 23.490 -7.460 -23.743 1.00 0.00 C ATOM 1660 CG PHE A 112 23.837 -7.257 -22.287 1.00 0.00 C ATOM 1661 CD1 PHE A 112 22.957 -6.587 -21.419 1.00 0.00 C ATOM 1662 CD2 PHE A 112 25.021 -7.823 -21.777 1.00 0.00 C ATOM 1663 CE1 PHE A 112 23.248 -6.514 -20.046 1.00 0.00 C ATOM 1664 CE2 PHE A 112 25.308 -7.748 -20.405 1.00 0.00 C ATOM 1665 CZ PHE A 112 24.430 -7.084 -19.537 1.00 0.00 C ATOM 0 H PHE A 112 23.168 -8.960 -25.664 1.00 0.00 H new ATOM 0 HA PHE A 112 21.919 -8.756 -23.103 1.00 0.00 H new ATOM 0 HB2 PHE A 112 24.290 -8.030 -24.215 1.00 0.00 H new ATOM 0 HB3 PHE A 112 23.460 -6.487 -24.233 1.00 0.00 H new ATOM 0 HD1 PHE A 112 22.059 -6.129 -21.807 1.00 0.00 H new ATOM 0 HD2 PHE A 112 25.712 -8.317 -22.444 1.00 0.00 H new ATOM 0 HE1 PHE A 112 22.560 -6.017 -19.377 1.00 0.00 H new ATOM 0 HE2 PHE A 112 26.207 -8.203 -20.017 1.00 0.00 H new ATOM 0 HZ PHE A 112 24.659 -7.010 -18.484 1.00 0.00 H new ATOM 1675 N ARG A 113 20.725 -6.718 -25.408 1.00 0.00 N ATOM 1676 CA ARG A 113 19.516 -5.955 -25.793 1.00 0.00 C ATOM 1677 C ARG A 113 18.269 -6.839 -25.887 1.00 0.00 C ATOM 1678 O ARG A 113 17.207 -6.421 -25.439 1.00 0.00 O ATOM 1679 CB ARG A 113 19.770 -5.204 -27.116 1.00 0.00 C ATOM 1680 CG ARG A 113 20.864 -4.137 -26.962 1.00 0.00 C ATOM 1681 CD ARG A 113 21.090 -3.371 -28.271 1.00 0.00 C ATOM 1682 NE ARG A 113 22.201 -2.402 -28.134 1.00 0.00 N ATOM 1683 CZ ARG A 113 23.286 -2.309 -28.885 1.00 0.00 C ATOM 1684 NH1 ARG A 113 23.566 -3.156 -29.837 1.00 0.00 N ATOM 1685 NH2 ARG A 113 24.118 -1.333 -28.687 1.00 0.00 N ATOM 0 H ARG A 113 21.395 -6.815 -26.171 1.00 0.00 H new ATOM 0 HA ARG A 113 19.316 -5.230 -25.004 1.00 0.00 H new ATOM 0 HB2 ARG A 113 20.062 -5.916 -27.888 1.00 0.00 H new ATOM 0 HB3 ARG A 113 18.846 -4.732 -27.450 1.00 0.00 H new ATOM 0 HG2 ARG A 113 20.584 -3.438 -26.174 1.00 0.00 H new ATOM 0 HG3 ARG A 113 21.795 -4.611 -26.651 1.00 0.00 H new ATOM 0 HD2 ARG A 113 21.313 -4.074 -29.074 1.00 0.00 H new ATOM 0 HD3 ARG A 113 20.177 -2.846 -28.551 1.00 0.00 H new ATOM 0 HE ARG A 113 22.120 -1.728 -27.372 1.00 0.00 H new ATOM 0 HH11 ARG A 113 22.935 -3.934 -30.030 1.00 0.00 H new ATOM 0 HH12 ARG A 113 24.416 -3.041 -30.389 1.00 0.00 H new ATOM 0 HH21 ARG A 113 23.933 -0.645 -27.957 1.00 0.00 H new ATOM 0 HH22 ARG A 113 24.957 -1.254 -29.261 1.00 0.00 H new ATOM 1699 N THR A 114 18.397 -8.082 -26.357 1.00 0.00 N ATOM 1700 CA THR A 114 17.287 -9.062 -26.413 1.00 0.00 C ATOM 1701 C THR A 114 16.702 -9.331 -25.028 1.00 0.00 C ATOM 1702 O THR A 114 15.487 -9.227 -24.862 1.00 0.00 O ATOM 1703 CB THR A 114 17.717 -10.384 -27.076 1.00 0.00 C ATOM 1704 OG1 THR A 114 18.032 -10.158 -28.434 1.00 0.00 O ATOM 1705 CG2 THR A 114 16.629 -11.463 -27.056 1.00 0.00 C ATOM 0 H THR A 114 19.279 -8.449 -26.715 1.00 0.00 H new ATOM 0 HA THR A 114 16.510 -8.613 -27.032 1.00 0.00 H new ATOM 0 HB THR A 114 18.572 -10.735 -26.498 1.00 0.00 H new ATOM 0 HG1 THR A 114 18.894 -9.695 -28.497 1.00 0.00 H new ATOM 0 HG21 THR A 114 17.003 -12.365 -27.540 1.00 0.00 H new ATOM 0 HG22 THR A 114 16.360 -11.689 -26.024 1.00 0.00 H new ATOM 0 HG23 THR A 114 15.749 -11.103 -27.590 1.00 0.00 H new ATOM 1713 N VAL A 115 17.521 -9.587 -23.997 1.00 0.00 N ATOM 1714 CA VAL A 115 16.979 -9.768 -22.645 1.00 0.00 C ATOM 1715 C VAL A 115 16.388 -8.464 -22.092 1.00 0.00 C ATOM 1716 O VAL A 115 15.401 -8.538 -21.369 1.00 0.00 O ATOM 1717 CB VAL A 115 17.951 -10.463 -21.684 1.00 0.00 C ATOM 1718 CG1 VAL A 115 18.461 -11.792 -22.262 1.00 0.00 C ATOM 1719 CG2 VAL A 115 19.131 -9.601 -21.249 1.00 0.00 C ATOM 0 H VAL A 115 18.535 -9.671 -24.070 1.00 0.00 H new ATOM 0 HA VAL A 115 16.148 -10.467 -22.734 1.00 0.00 H new ATOM 0 HB VAL A 115 17.361 -10.655 -20.788 1.00 0.00 H new ATOM 0 HG11 VAL A 115 19.147 -12.257 -21.554 1.00 0.00 H new ATOM 0 HG12 VAL A 115 17.617 -12.459 -22.441 1.00 0.00 H new ATOM 0 HG13 VAL A 115 18.981 -11.605 -23.202 1.00 0.00 H new ATOM 0 HG21 VAL A 115 19.767 -10.170 -20.571 1.00 0.00 H new ATOM 0 HG22 VAL A 115 19.708 -9.305 -22.125 1.00 0.00 H new ATOM 0 HG23 VAL A 115 18.763 -8.711 -20.739 1.00 0.00 H new ATOM 1729 N ARG A 116 16.883 -7.277 -22.494 1.00 0.00 N ATOM 1730 CA ARG A 116 16.235 -5.970 -22.199 1.00 0.00 C ATOM 1731 C ARG A 116 14.823 -5.908 -22.804 1.00 0.00 C ATOM 1732 O ARG A 116 13.888 -5.541 -22.102 1.00 0.00 O ATOM 1733 CB ARG A 116 17.174 -4.779 -22.579 1.00 0.00 C ATOM 1734 CG ARG A 116 16.516 -3.651 -23.404 1.00 0.00 C ATOM 1735 CD ARG A 116 17.248 -2.297 -23.385 1.00 0.00 C ATOM 1736 NE ARG A 116 18.173 -2.046 -24.519 1.00 0.00 N ATOM 1737 CZ ARG A 116 17.874 -1.754 -25.776 1.00 0.00 C ATOM 1738 NH1 ARG A 116 16.681 -1.918 -26.273 1.00 0.00 N ATOM 1739 NH2 ARG A 116 18.771 -1.264 -26.578 1.00 0.00 N ATOM 0 H ARG A 116 17.744 -7.190 -23.034 1.00 0.00 H new ATOM 0 HA ARG A 116 16.084 -5.872 -21.124 1.00 0.00 H new ATOM 0 HB2 ARG A 116 17.575 -4.348 -21.662 1.00 0.00 H new ATOM 0 HB3 ARG A 116 18.020 -5.172 -23.143 1.00 0.00 H new ATOM 0 HG2 ARG A 116 16.433 -3.984 -24.439 1.00 0.00 H new ATOM 0 HG3 ARG A 116 15.502 -3.500 -23.035 1.00 0.00 H new ATOM 0 HD2 ARG A 116 16.502 -1.502 -23.367 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.814 -2.224 -22.456 1.00 0.00 H new ATOM 0 HE ARG A 116 19.168 -2.106 -24.302 1.00 0.00 H new ATOM 0 HH11 ARG A 116 15.931 -2.285 -25.688 1.00 0.00 H new ATOM 0 HH12 ARG A 116 16.497 -1.679 -27.247 1.00 0.00 H new ATOM 0 HH21 ARG A 116 19.720 -1.099 -26.242 1.00 0.00 H new ATOM 0 HH22 ARG A 116 18.526 -1.044 -27.543 1.00 0.00 H new ATOM 1753 N GLY A 117 14.641 -6.326 -24.055 1.00 0.00 N ATOM 1754 CA GLY A 117 13.314 -6.412 -24.692 1.00 0.00 C ATOM 1755 C GLY A 117 12.376 -7.366 -23.945 1.00 0.00 C ATOM 1756 O GLY A 117 11.216 -7.039 -23.686 1.00 0.00 O ATOM 0 H GLY A 117 15.407 -6.617 -24.663 1.00 0.00 H new ATOM 0 HA2 GLY A 117 12.866 -5.419 -24.730 1.00 0.00 H new ATOM 0 HA3 GLY A 117 13.428 -6.749 -25.722 1.00 0.00 H new ATOM 1760 N GLN A 118 12.908 -8.505 -23.493 1.00 0.00 N ATOM 1761 CA GLN A 118 12.159 -9.468 -22.678 1.00 0.00 C ATOM 1762 C GLN A 118 11.799 -8.941 -21.288 1.00 0.00 C ATOM 1763 O GLN A 118 10.659 -9.131 -20.862 1.00 0.00 O ATOM 1764 CB GLN A 118 12.934 -10.777 -22.537 1.00 0.00 C ATOM 1765 CG GLN A 118 12.970 -11.570 -23.853 1.00 0.00 C ATOM 1766 CD GLN A 118 13.650 -12.920 -23.666 1.00 0.00 C ATOM 1767 OE1 GLN A 118 14.609 -13.273 -24.339 1.00 0.00 O ATOM 1768 NE2 GLN A 118 13.176 -13.711 -22.726 1.00 0.00 N ATOM 0 H GLN A 118 13.870 -8.786 -23.681 1.00 0.00 H new ATOM 0 HA GLN A 118 11.224 -9.640 -23.211 1.00 0.00 H new ATOM 0 HB2 GLN A 118 13.953 -10.562 -22.215 1.00 0.00 H new ATOM 0 HB3 GLN A 118 12.476 -11.387 -21.759 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.954 -11.719 -24.218 1.00 0.00 H new ATOM 0 HG3 GLN A 118 13.500 -10.995 -24.612 1.00 0.00 H new ATOM 0 HE21 GLN A 118 12.377 -13.415 -22.166 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.608 -14.619 -22.558 1.00 0.00 H new ATOM 1777 N VAL A 119 12.711 -8.268 -20.566 1.00 0.00 N ATOM 1778 CA VAL A 119 12.329 -7.698 -19.276 1.00 0.00 C ATOM 1779 C VAL A 119 11.319 -6.572 -19.467 1.00 0.00 C ATOM 1780 O VAL A 119 10.357 -6.546 -18.721 1.00 0.00 O ATOM 1781 CB VAL A 119 13.487 -7.200 -18.387 1.00 0.00 C ATOM 1782 CG1 VAL A 119 14.211 -8.338 -17.666 1.00 0.00 C ATOM 1783 CG2 VAL A 119 14.550 -6.321 -19.022 1.00 0.00 C ATOM 0 H VAL A 119 13.680 -8.112 -20.844 1.00 0.00 H new ATOM 0 HA VAL A 119 11.892 -8.538 -18.736 1.00 0.00 H new ATOM 0 HB VAL A 119 12.933 -6.560 -17.701 1.00 0.00 H new ATOM 0 HG11 VAL A 119 15.016 -7.928 -17.056 1.00 0.00 H new ATOM 0 HG12 VAL A 119 13.506 -8.871 -17.027 1.00 0.00 H new ATOM 0 HG13 VAL A 119 14.628 -9.027 -18.400 1.00 0.00 H new ATOM 0 HG21 VAL A 119 15.295 -6.052 -18.273 1.00 0.00 H new ATOM 0 HG22 VAL A 119 15.032 -6.863 -19.835 1.00 0.00 H new ATOM 0 HG23 VAL A 119 14.087 -5.416 -19.414 1.00 0.00 H new ATOM 1793 N LYS A 120 11.454 -5.698 -20.475 1.00 0.00 N ATOM 1794 CA LYS A 120 10.457 -4.646 -20.777 1.00 0.00 C ATOM 1795 C LYS A 120 9.041 -5.230 -20.892 1.00 0.00 C ATOM 1796 O LYS A 120 8.148 -4.844 -20.144 1.00 0.00 O ATOM 1797 CB LYS A 120 10.864 -3.901 -22.059 1.00 0.00 C ATOM 1798 CG LYS A 120 9.923 -2.714 -22.333 1.00 0.00 C ATOM 1799 CD LYS A 120 10.339 -1.965 -23.605 1.00 0.00 C ATOM 1800 CE LYS A 120 9.359 -0.813 -23.885 1.00 0.00 C ATOM 1801 NZ LYS A 120 9.677 -0.106 -25.160 1.00 0.00 N ATOM 0 H LYS A 120 12.255 -5.696 -21.107 1.00 0.00 H new ATOM 0 HA LYS A 120 10.438 -3.935 -19.951 1.00 0.00 H new ATOM 0 HB2 LYS A 120 11.889 -3.542 -21.965 1.00 0.00 H new ATOM 0 HB3 LYS A 120 10.843 -4.588 -22.905 1.00 0.00 H new ATOM 0 HG2 LYS A 120 8.899 -3.073 -22.437 1.00 0.00 H new ATOM 0 HG3 LYS A 120 9.937 -2.031 -21.484 1.00 0.00 H new ATOM 0 HD2 LYS A 120 11.350 -1.573 -23.491 1.00 0.00 H new ATOM 0 HD3 LYS A 120 10.356 -2.652 -24.451 1.00 0.00 H new ATOM 0 HE2 LYS A 120 8.343 -1.205 -23.931 1.00 0.00 H new ATOM 0 HE3 LYS A 120 9.389 -0.102 -23.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 8.993 0.663 -25.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 10.637 0.290 -25.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 9.623 -0.778 -25.952 1.00 0.00 H new ATOM 1815 N GLU A 121 8.884 -6.227 -21.767 1.00 0.00 N ATOM 1816 CA GLU A 121 7.631 -6.962 -22.003 1.00 0.00 C ATOM 1817 C GLU A 121 6.998 -7.466 -20.695 1.00 0.00 C ATOM 1818 O GLU A 121 5.802 -7.277 -20.457 1.00 0.00 O ATOM 1819 CB GLU A 121 7.948 -8.142 -22.947 1.00 0.00 C ATOM 1820 CG GLU A 121 6.766 -9.070 -23.253 1.00 0.00 C ATOM 1821 CD GLU A 121 7.228 -10.285 -24.084 1.00 0.00 C ATOM 1822 OE1 GLU A 121 7.661 -11.301 -23.484 1.00 0.00 O ATOM 1823 OE2 GLU A 121 7.153 -10.235 -25.336 1.00 0.00 O ATOM 0 H GLU A 121 9.650 -6.559 -22.353 1.00 0.00 H new ATOM 0 HA GLU A 121 6.901 -6.291 -22.455 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.328 -7.742 -23.887 1.00 0.00 H new ATOM 0 HB3 GLU A 121 8.749 -8.734 -22.505 1.00 0.00 H new ATOM 0 HG2 GLU A 121 6.314 -9.411 -22.321 1.00 0.00 H new ATOM 0 HG3 GLU A 121 5.998 -8.521 -23.798 1.00 0.00 H new ATOM 1830 N ARG A 122 7.807 -8.090 -19.825 1.00 0.00 N ATOM 1831 CA ARG A 122 7.319 -8.811 -18.634 1.00 0.00 C ATOM 1832 C ARG A 122 7.214 -7.901 -17.400 1.00 0.00 C ATOM 1833 O ARG A 122 6.308 -8.079 -16.591 1.00 0.00 O ATOM 1834 CB ARG A 122 8.147 -10.103 -18.466 1.00 0.00 C ATOM 1835 CG ARG A 122 7.917 -11.044 -19.669 1.00 0.00 C ATOM 1836 CD ARG A 122 8.946 -12.157 -19.881 1.00 0.00 C ATOM 1837 NE ARG A 122 8.813 -12.608 -21.280 1.00 0.00 N ATOM 1838 CZ ARG A 122 9.294 -13.656 -21.911 1.00 0.00 C ATOM 1839 NH1 ARG A 122 10.028 -14.579 -21.354 1.00 0.00 N ATOM 1840 NH2 ARG A 122 9.029 -13.751 -23.177 1.00 0.00 N ATOM 0 H ARG A 122 8.822 -8.110 -19.926 1.00 0.00 H new ATOM 0 HA ARG A 122 6.285 -9.127 -18.769 1.00 0.00 H new ATOM 0 HB2 ARG A 122 9.206 -9.857 -18.385 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.865 -10.607 -17.542 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.936 -11.505 -19.557 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.882 -10.437 -20.574 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.955 -11.791 -19.688 1.00 0.00 H new ATOM 0 HD3 ARG A 122 8.769 -12.982 -19.191 1.00 0.00 H new ATOM 0 HE ARG A 122 8.244 -11.995 -21.864 1.00 0.00 H new ATOM 0 HH11 ARG A 122 10.264 -14.515 -20.364 1.00 0.00 H new ATOM 0 HH12 ARG A 122 10.366 -15.365 -21.909 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.471 -13.032 -23.637 1.00 0.00 H new ATOM 0 HH22 ARG A 122 9.379 -14.545 -23.713 1.00 0.00 H new ATOM 1854 N VAL A 123 8.031 -6.847 -17.323 1.00 0.00 N ATOM 1855 CA VAL A 123 7.914 -5.758 -16.341 1.00 0.00 C ATOM 1856 C VAL A 123 6.597 -5.027 -16.555 1.00 0.00 C ATOM 1857 O VAL A 123 5.886 -4.822 -15.579 1.00 0.00 O ATOM 1858 CB VAL A 123 9.047 -4.722 -16.462 1.00 0.00 C ATOM 1859 CG1 VAL A 123 8.713 -3.460 -15.667 1.00 0.00 C ATOM 1860 CG2 VAL A 123 10.375 -5.220 -15.888 1.00 0.00 C ATOM 0 H VAL A 123 8.817 -6.721 -17.961 1.00 0.00 H new ATOM 0 HA VAL A 123 7.970 -6.217 -15.354 1.00 0.00 H new ATOM 0 HB VAL A 123 9.142 -4.533 -17.531 1.00 0.00 H new ATOM 0 HG11 VAL A 123 9.527 -2.741 -15.766 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.792 -3.021 -16.051 1.00 0.00 H new ATOM 0 HG13 VAL A 123 8.582 -3.716 -14.616 1.00 0.00 H new ATOM 0 HG21 VAL A 123 11.134 -4.446 -16.003 1.00 0.00 H new ATOM 0 HG22 VAL A 123 10.250 -5.452 -14.830 1.00 0.00 H new ATOM 0 HG23 VAL A 123 10.688 -6.117 -16.422 1.00 0.00 H new ATOM 1870 N GLU A 124 6.269 -4.619 -17.793 1.00 0.00 N ATOM 1871 CA GLU A 124 5.004 -3.921 -18.087 1.00 0.00 C ATOM 1872 C GLU A 124 3.826 -4.756 -17.573 1.00 0.00 C ATOM 1873 O GLU A 124 3.063 -4.303 -16.727 1.00 0.00 O ATOM 1874 CB GLU A 124 4.830 -3.674 -19.600 1.00 0.00 C ATOM 1875 CG GLU A 124 5.656 -2.512 -20.156 1.00 0.00 C ATOM 1876 CD GLU A 124 5.335 -2.281 -21.646 1.00 0.00 C ATOM 1877 OE1 GLU A 124 5.969 -2.914 -22.526 1.00 0.00 O ATOM 1878 OE2 GLU A 124 4.442 -1.451 -21.951 1.00 0.00 O ATOM 0 H GLU A 124 6.864 -4.761 -18.609 1.00 0.00 H new ATOM 0 HA GLU A 124 5.030 -2.954 -17.585 1.00 0.00 H new ATOM 0 HB2 GLU A 124 5.100 -4.584 -20.136 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.776 -3.484 -19.805 1.00 0.00 H new ATOM 0 HG2 GLU A 124 5.446 -1.605 -19.589 1.00 0.00 H new ATOM 0 HG3 GLU A 124 6.718 -2.724 -20.036 1.00 0.00 H new ATOM 1885 N ASN A 125 3.759 -6.016 -18.010 1.00 0.00 N ATOM 1886 CA ASN A 125 2.764 -7.013 -17.602 1.00 0.00 C ATOM 1887 C ASN A 125 2.649 -7.147 -16.062 1.00 0.00 C ATOM 1888 O ASN A 125 1.547 -7.283 -15.537 1.00 0.00 O ATOM 1889 CB ASN A 125 3.172 -8.340 -18.284 1.00 0.00 C ATOM 1890 CG ASN A 125 2.133 -9.451 -18.232 1.00 0.00 C ATOM 1891 OD1 ASN A 125 0.987 -9.274 -17.850 1.00 0.00 O ATOM 1892 ND2 ASN A 125 2.508 -10.644 -18.642 1.00 0.00 N ATOM 0 H ASN A 125 4.426 -6.386 -18.688 1.00 0.00 H new ATOM 0 HA ASN A 125 1.766 -6.709 -17.917 1.00 0.00 H new ATOM 0 HB2 ASN A 125 3.406 -8.134 -19.328 1.00 0.00 H new ATOM 0 HB3 ASN A 125 4.088 -8.701 -17.817 1.00 0.00 H new ATOM 0 HD21 ASN A 125 1.842 -11.417 -18.640 1.00 0.00 H new ATOM 0 HD22 ASN A 125 3.465 -10.796 -18.962 1.00 0.00 H new ATOM 1899 N LEU A 126 3.765 -7.052 -15.328 1.00 0.00 N ATOM 1900 CA LEU A 126 3.795 -7.137 -13.863 1.00 0.00 C ATOM 1901 C LEU A 126 3.372 -5.826 -13.178 1.00 0.00 C ATOM 1902 O LEU A 126 2.383 -5.795 -12.448 1.00 0.00 O ATOM 1903 CB LEU A 126 5.204 -7.620 -13.458 1.00 0.00 C ATOM 1904 CG LEU A 126 5.440 -8.001 -11.986 1.00 0.00 C ATOM 1905 CD1 LEU A 126 5.675 -6.801 -11.069 1.00 0.00 C ATOM 1906 CD2 LEU A 126 4.315 -8.866 -11.426 1.00 0.00 C ATOM 0 H LEU A 126 4.687 -6.912 -15.742 1.00 0.00 H new ATOM 0 HA LEU A 126 3.053 -7.855 -13.514 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.449 -8.487 -14.071 1.00 0.00 H new ATOM 0 HB3 LEU A 126 5.914 -6.835 -13.718 1.00 0.00 H new ATOM 0 HG LEU A 126 6.361 -8.583 -11.999 1.00 0.00 H new ATOM 0 HD11 LEU A 126 5.834 -7.149 -10.048 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.554 -6.252 -11.406 1.00 0.00 H new ATOM 0 HD13 LEU A 126 4.805 -6.145 -11.098 1.00 0.00 H new ATOM 0 HD21 LEU A 126 4.527 -9.109 -10.385 1.00 0.00 H new ATOM 0 HD22 LEU A 126 3.373 -8.322 -11.487 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.241 -9.786 -12.005 1.00 0.00 H new ATOM 1918 N ILE A 127 4.108 -4.733 -13.408 1.00 0.00 N ATOM 1919 CA ILE A 127 3.922 -3.434 -12.753 1.00 0.00 C ATOM 1920 C ILE A 127 2.557 -2.808 -13.088 1.00 0.00 C ATOM 1921 O ILE A 127 1.930 -2.190 -12.232 1.00 0.00 O ATOM 1922 CB ILE A 127 5.139 -2.541 -13.127 1.00 0.00 C ATOM 1923 CG1 ILE A 127 5.729 -1.771 -11.933 1.00 0.00 C ATOM 1924 CG2 ILE A 127 4.918 -1.611 -14.330 1.00 0.00 C ATOM 1925 CD1 ILE A 127 4.737 -0.886 -11.170 1.00 0.00 C ATOM 0 H ILE A 127 4.876 -4.729 -14.079 1.00 0.00 H new ATOM 0 HA ILE A 127 3.895 -3.548 -11.669 1.00 0.00 H new ATOM 0 HB ILE A 127 5.883 -3.270 -13.447 1.00 0.00 H new ATOM 0 HG12 ILE A 127 6.160 -2.489 -11.236 1.00 0.00 H new ATOM 0 HG13 ILE A 127 6.546 -1.146 -12.293 1.00 0.00 H new ATOM 0 HG21 ILE A 127 5.822 -1.030 -14.512 1.00 0.00 H new ATOM 0 HG22 ILE A 127 4.686 -2.207 -15.213 1.00 0.00 H new ATOM 0 HG23 ILE A 127 4.089 -0.935 -14.120 1.00 0.00 H new ATOM 0 HD11 ILE A 127 5.251 -0.387 -10.349 1.00 0.00 H new ATOM 0 HD12 ILE A 127 4.322 -0.138 -11.846 1.00 0.00 H new ATOM 0 HD13 ILE A 127 3.931 -1.502 -10.772 1.00 0.00 H new ATOM 1937 N ALA A 128 2.045 -3.027 -14.302 1.00 0.00 N ATOM 1938 CA ALA A 128 0.809 -2.400 -14.775 1.00 0.00 C ATOM 1939 C ALA A 128 -0.470 -2.991 -14.135 1.00 0.00 C ATOM 1940 O ALA A 128 -1.509 -2.329 -14.124 1.00 0.00 O ATOM 1941 CB ALA A 128 0.792 -2.444 -16.309 1.00 0.00 C ATOM 0 H ALA A 128 2.478 -3.647 -14.987 1.00 0.00 H new ATOM 0 HA ALA A 128 0.801 -1.360 -14.449 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -0.124 -1.980 -16.676 1.00 0.00 H new ATOM 0 HB2 ALA A 128 1.654 -1.903 -16.698 1.00 0.00 H new ATOM 0 HB3 ALA A 128 0.833 -3.481 -16.644 1.00 0.00 H new ATOM 1947 N LYS A 129 -0.392 -4.195 -13.537 1.00 0.00 N ATOM 1948 CA LYS A 129 -1.477 -4.812 -12.738 1.00 0.00 C ATOM 1949 C LYS A 129 -1.610 -4.233 -11.320 1.00 0.00 C ATOM 1950 O LYS A 129 -2.640 -4.418 -10.672 1.00 0.00 O ATOM 1951 CB LYS A 129 -1.261 -6.334 -12.688 1.00 0.00 C ATOM 1952 CG LYS A 129 -1.511 -6.987 -14.054 1.00 0.00 C ATOM 1953 CD LYS A 129 -1.185 -8.486 -13.993 1.00 0.00 C ATOM 1954 CE LYS A 129 -1.053 -9.076 -15.400 1.00 0.00 C ATOM 1955 NZ LYS A 129 -2.364 -9.230 -16.095 1.00 0.00 N ATOM 0 H LYS A 129 0.441 -4.780 -13.595 1.00 0.00 H new ATOM 0 HA LYS A 129 -2.418 -4.577 -13.236 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -0.242 -6.547 -12.364 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.929 -6.772 -11.947 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -2.551 -6.845 -14.348 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -0.896 -6.504 -14.814 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -0.257 -8.638 -13.442 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.969 -9.011 -13.447 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -0.405 -8.435 -15.997 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -0.566 -10.049 -15.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -2.210 -9.633 -17.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -2.977 -9.864 -15.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -2.820 -8.300 -16.185 1.00 0.00 H new ATOM 1969 N ILE A 130 -0.582 -3.518 -10.854 1.00 0.00 N ATOM 1970 CA ILE A 130 -0.487 -2.852 -9.536 1.00 0.00 C ATOM 1971 C ILE A 130 -0.269 -1.326 -9.678 1.00 0.00 C ATOM 1972 O ILE A 130 0.261 -0.675 -8.774 1.00 0.00 O ATOM 1973 CB ILE A 130 0.545 -3.569 -8.630 1.00 0.00 C ATOM 1974 CG1 ILE A 130 1.941 -3.624 -9.288 1.00 0.00 C ATOM 1975 CG2 ILE A 130 0.034 -4.978 -8.274 1.00 0.00 C ATOM 1976 CD1 ILE A 130 3.002 -4.374 -8.477 1.00 0.00 C ATOM 0 H ILE A 130 0.259 -3.376 -11.413 1.00 0.00 H new ATOM 0 HA ILE A 130 -1.444 -2.946 -9.024 1.00 0.00 H new ATOM 0 HB ILE A 130 0.656 -2.994 -7.710 1.00 0.00 H new ATOM 0 HG12 ILE A 130 1.849 -4.098 -10.265 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.287 -2.605 -9.459 1.00 0.00 H new ATOM 0 HG21 ILE A 130 0.763 -5.479 -7.637 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.916 -4.898 -7.745 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -0.107 -5.556 -9.188 1.00 0.00 H new ATOM 0 HD11 ILE A 130 3.949 -4.361 -9.017 1.00 0.00 H new ATOM 0 HD12 ILE A 130 3.129 -3.890 -7.509 1.00 0.00 H new ATOM 0 HD13 ILE A 130 2.684 -5.406 -8.328 1.00 0.00 H new ATOM 1988 N SER A 131 -0.696 -0.768 -10.818 1.00 0.00 N ATOM 1989 CA SER A 131 -0.652 0.656 -11.200 1.00 0.00 C ATOM 1990 C SER A 131 -2.065 1.240 -11.358 1.00 0.00 C ATOM 1991 O SER A 131 -2.337 2.311 -10.764 1.00 0.00 O ATOM 1992 CB SER A 131 0.157 0.780 -12.489 1.00 0.00 C ATOM 1993 OG SER A 131 0.362 2.148 -12.803 1.00 0.00 O ATOM 1994 OXT SER A 131 -2.905 0.630 -12.060 1.00 0.00 O ATOM 0 H SER A 131 -1.112 -1.339 -11.554 1.00 0.00 H new ATOM 0 HA SER A 131 -0.171 1.234 -10.411 1.00 0.00 H new ATOM 0 HB2 SER A 131 1.117 0.277 -12.375 1.00 0.00 H new ATOM 0 HB3 SER A 131 -0.368 0.285 -13.306 1.00 0.00 H new ATOM 0 HG SER A 131 0.883 2.219 -13.630 1.00 0.00 H new TER 2000 SER A 131