USER MOD reduce.3.24.130724 H: found=0, std=0, add=968, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 967 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 16 GLN : amide:sc= 2 X(o=1.6,f=1.1) USER MOD Set 1.2: A 60 GLN : amide:sc= -0.376 X(o=1.6,f=1.1) USER MOD Set 2.1: A 43 HIS : no HD1:sc= -0.408 K(o=-0.41,f=-2.7) USER MOD Set 2.2: A 45 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 11 ASN : amide:sc= -2.27! K(o=-1.4!,f=-3.4) USER MOD Set 3.2: A 34 SER OG : rot -125:sc= 0.85 USER MOD Set 4.1: A 8 SER OG : rot 93:sc= 2.46 USER MOD Set 4.2: A 15 SER OG : rot 79:sc= 0.994 USER MOD Set 5.1: A 12 SER OG : rot 148:sc= 0.704 USER MOD Set 5.2: A 40 SER OG : rot -162:sc= 1.64 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -148:sc= 0.386 (180deg=0.0581) USER MOD Single : A 2 LYS NZ :NH3+ -176:sc= 1.31 (180deg=1.3) USER MOD Single : A 3 LYS NZ :NH3+ 179:sc= 1.32 (180deg=1.24) USER MOD Single : A 5 MET CE :methyl -168:sc= -1.35 (180deg=-1.93) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot -57:sc= 1.49 USER MOD Single : A 17 MET CE :methyl 180:sc= -0.312 (180deg=-0.312) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot -77:sc= 0.0392 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 71:sc= 0.654 USER MOD Single : A 35 SER OG : rot 180:sc= -0.131 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 174:sc= -0.172 (180deg=-0.29) USER MOD Single : A 50 MET CE :methyl -163:sc= -1.16 (180deg=-2.44!) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= 0.909 K(o=0.91,f=0) USER MOD Single : A 69 ASN :FLIP amide:sc= 0 F(o=-0.93,f=0) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot -127:sc= 1.26 USER MOD Single : A 80 CYS SG : rot 180:sc= -0.142 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= 0.889 K(o=0.89,f=-0.15) USER MOD Single : A 100 GLN : amide:sc= 0.933 K(o=0.93,f=-0.00024) USER MOD Single : A 107 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 108 SER OG : rot 180:sc= 0.0067 USER MOD Single : A 114 THR OG1 : rot 68:sc= 1.2 USER MOD Single : A 118 GLN : amide:sc= -0.0628 X(o=-0.063,f=-0.26) USER MOD Single : A 120 LYS NZ :NH3+ -147:sc= 2.4 (180deg=0.596) USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 129 LYS NZ :NH3+ 160:sc= 1.19 (180deg=0.856) USER MOD Single : A 131 SER OG : rot 75:sc= 1.11 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.074 0.648 0.015 1.00 0.00 N ATOM 2 CA MET A 1 2.300 0.216 -1.406 1.00 0.00 C ATOM 3 C MET A 1 2.648 -1.281 -1.502 1.00 0.00 C ATOM 4 O MET A 1 3.354 -1.792 -0.637 1.00 0.00 O ATOM 5 CB MET A 1 3.343 1.093 -2.162 1.00 0.00 C ATOM 6 CG MET A 1 4.832 0.908 -1.799 1.00 0.00 C ATOM 7 SD MET A 1 5.355 1.389 -0.127 1.00 0.00 S ATOM 8 CE MET A 1 5.442 3.194 -0.300 1.00 0.00 C ATOM 0 H1 MET A 1 1.365 1.408 0.038 1.00 0.00 H new ATOM 0 H2 MET A 1 1.733 -0.160 0.574 1.00 0.00 H new ATOM 0 H3 MET A 1 2.967 0.996 0.418 1.00 0.00 H new ATOM 0 HA MET A 1 1.349 0.372 -1.915 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.232 0.902 -3.229 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.085 2.139 -1.997 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.085 -0.143 -1.941 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.426 1.478 -2.514 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.751 3.636 0.647 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.166 3.451 -1.074 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.461 3.581 -0.578 1.00 0.00 H new ATOM 20 N LYS A 2 2.231 -1.980 -2.573 1.00 0.00 N ATOM 21 CA LYS A 2 2.619 -3.389 -2.827 1.00 0.00 C ATOM 22 C LYS A 2 3.973 -3.442 -3.538 1.00 0.00 C ATOM 23 O LYS A 2 4.048 -3.194 -4.739 1.00 0.00 O ATOM 24 CB LYS A 2 1.520 -4.131 -3.616 1.00 0.00 C ATOM 25 CG LYS A 2 0.160 -4.051 -2.899 1.00 0.00 C ATOM 26 CD LYS A 2 -0.704 -5.314 -3.004 1.00 0.00 C ATOM 27 CE LYS A 2 -1.191 -5.600 -4.433 1.00 0.00 C ATOM 28 NZ LYS A 2 -2.265 -6.632 -4.438 1.00 0.00 N ATOM 0 H LYS A 2 1.617 -1.590 -3.288 1.00 0.00 H new ATOM 0 HA LYS A 2 2.725 -3.904 -1.872 1.00 0.00 H new ATOM 0 HB2 LYS A 2 1.433 -3.700 -4.613 1.00 0.00 H new ATOM 0 HB3 LYS A 2 1.804 -5.175 -3.744 1.00 0.00 H new ATOM 0 HG2 LYS A 2 0.334 -3.835 -1.845 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -0.401 -3.211 -3.308 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -0.131 -6.169 -2.645 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -1.568 -5.211 -2.347 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -1.564 -4.680 -4.884 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -0.355 -5.938 -5.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -2.528 -6.855 -5.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -1.921 -7.493 -3.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -3.097 -6.269 -3.931 1.00 0.00 H new ATOM 42 N LYS A 3 5.055 -3.699 -2.797 1.00 0.00 N ATOM 43 CA LYS A 3 6.426 -3.657 -3.344 1.00 0.00 C ATOM 44 C LYS A 3 6.734 -4.886 -4.207 1.00 0.00 C ATOM 45 O LYS A 3 6.257 -5.990 -3.927 1.00 0.00 O ATOM 46 CB LYS A 3 7.478 -3.480 -2.236 1.00 0.00 C ATOM 47 CG LYS A 3 7.193 -2.299 -1.302 1.00 0.00 C ATOM 48 CD LYS A 3 8.336 -2.074 -0.308 1.00 0.00 C ATOM 49 CE LYS A 3 7.975 -0.900 0.609 1.00 0.00 C ATOM 50 NZ LYS A 3 8.971 -0.733 1.702 1.00 0.00 N ATOM 0 H LYS A 3 5.013 -3.941 -1.807 1.00 0.00 H new ATOM 0 HA LYS A 3 6.479 -2.781 -3.991 1.00 0.00 H new ATOM 0 HB2 LYS A 3 7.529 -4.395 -1.646 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.457 -3.341 -2.695 1.00 0.00 H new ATOM 0 HG2 LYS A 3 7.042 -1.396 -1.893 1.00 0.00 H new ATOM 0 HG3 LYS A 3 6.267 -2.482 -0.757 1.00 0.00 H new ATOM 0 HD2 LYS A 3 8.505 -2.975 0.282 1.00 0.00 H new ATOM 0 HD3 LYS A 3 9.263 -1.864 -0.841 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.920 0.017 0.023 1.00 0.00 H new ATOM 0 HE3 LYS A 3 6.987 -1.063 1.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 8.705 0.080 2.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 8.993 -1.593 2.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 9.913 -0.569 1.292 1.00 0.00 H new ATOM 64 N VAL A 4 7.569 -4.688 -5.226 1.00 0.00 N ATOM 65 CA VAL A 4 8.045 -5.748 -6.132 1.00 0.00 C ATOM 66 C VAL A 4 9.489 -6.118 -5.814 1.00 0.00 C ATOM 67 O VAL A 4 10.301 -5.223 -5.595 1.00 0.00 O ATOM 68 CB VAL A 4 7.931 -5.327 -7.609 1.00 0.00 C ATOM 69 CG1 VAL A 4 8.387 -6.439 -8.563 1.00 0.00 C ATOM 70 CG2 VAL A 4 6.494 -4.962 -7.991 1.00 0.00 C ATOM 0 H VAL A 4 7.945 -3.768 -5.455 1.00 0.00 H new ATOM 0 HA VAL A 4 7.407 -6.618 -5.975 1.00 0.00 H new ATOM 0 HB VAL A 4 8.580 -4.457 -7.710 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.289 -6.097 -9.593 1.00 0.00 H new ATOM 0 HG12 VAL A 4 9.429 -6.688 -8.361 1.00 0.00 H new ATOM 0 HG13 VAL A 4 7.767 -7.323 -8.414 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.459 -4.671 -9.041 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.845 -5.823 -7.831 1.00 0.00 H new ATOM 0 HG23 VAL A 4 6.153 -4.131 -7.373 1.00 0.00 H new ATOM 80 N MET A 5 9.825 -7.407 -5.862 1.00 0.00 N ATOM 81 CA MET A 5 11.212 -7.888 -5.805 1.00 0.00 C ATOM 82 C MET A 5 11.501 -8.821 -6.986 1.00 0.00 C ATOM 83 O MET A 5 10.951 -9.917 -7.073 1.00 0.00 O ATOM 84 CB MET A 5 11.534 -8.582 -4.468 1.00 0.00 C ATOM 85 CG MET A 5 13.018 -9.010 -4.420 1.00 0.00 C ATOM 86 SD MET A 5 14.176 -7.624 -4.546 1.00 0.00 S ATOM 87 CE MET A 5 14.317 -7.139 -2.810 1.00 0.00 C ATOM 0 H MET A 5 9.138 -8.157 -5.942 1.00 0.00 H new ATOM 0 HA MET A 5 11.863 -7.016 -5.875 1.00 0.00 H new ATOM 0 HB2 MET A 5 11.318 -7.906 -3.640 1.00 0.00 H new ATOM 0 HB3 MET A 5 10.894 -9.455 -4.342 1.00 0.00 H new ATOM 0 HG2 MET A 5 13.204 -9.544 -3.488 1.00 0.00 H new ATOM 0 HG3 MET A 5 13.212 -9.710 -5.233 1.00 0.00 H new ATOM 0 HE1 MET A 5 14.821 -6.175 -2.741 1.00 0.00 H new ATOM 0 HE2 MET A 5 13.322 -7.060 -2.372 1.00 0.00 H new ATOM 0 HE3 MET A 5 14.893 -7.889 -2.268 1.00 0.00 H new ATOM 97 N PHE A 6 12.382 -8.406 -7.888 1.00 0.00 N ATOM 98 CA PHE A 6 12.926 -9.268 -8.939 1.00 0.00 C ATOM 99 C PHE A 6 14.073 -10.127 -8.384 1.00 0.00 C ATOM 100 O PHE A 6 14.836 -9.656 -7.543 1.00 0.00 O ATOM 101 CB PHE A 6 13.382 -8.400 -10.111 1.00 0.00 C ATOM 102 CG PHE A 6 12.293 -7.503 -10.658 1.00 0.00 C ATOM 103 CD1 PHE A 6 11.234 -8.029 -11.421 1.00 0.00 C ATOM 104 CD2 PHE A 6 12.313 -6.133 -10.351 1.00 0.00 C ATOM 105 CE1 PHE A 6 10.174 -7.203 -11.814 1.00 0.00 C ATOM 106 CE2 PHE A 6 11.250 -5.305 -10.736 1.00 0.00 C ATOM 107 CZ PHE A 6 10.173 -5.841 -11.465 1.00 0.00 C ATOM 0 H PHE A 6 12.745 -7.453 -7.914 1.00 0.00 H new ATOM 0 HA PHE A 6 12.156 -9.952 -9.296 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.222 -7.784 -9.791 1.00 0.00 H new ATOM 0 HB3 PHE A 6 13.746 -9.045 -10.911 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.239 -9.071 -11.704 1.00 0.00 H new ATOM 0 HD2 PHE A 6 13.152 -5.715 -9.815 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.355 -7.613 -12.387 1.00 0.00 H new ATOM 0 HE2 PHE A 6 11.258 -4.257 -10.474 1.00 0.00 H new ATOM 0 HZ PHE A 6 9.348 -5.208 -11.756 1.00 0.00 H new ATOM 117 N VAL A 7 14.190 -11.376 -8.836 1.00 0.00 N ATOM 118 CA VAL A 7 15.207 -12.351 -8.401 1.00 0.00 C ATOM 119 C VAL A 7 15.815 -13.070 -9.610 1.00 0.00 C ATOM 120 O VAL A 7 15.108 -13.708 -10.385 1.00 0.00 O ATOM 121 CB VAL A 7 14.601 -13.365 -7.398 1.00 0.00 C ATOM 122 CG1 VAL A 7 15.650 -14.376 -6.921 1.00 0.00 C ATOM 123 CG2 VAL A 7 14.032 -12.669 -6.153 1.00 0.00 C ATOM 0 H VAL A 7 13.559 -11.757 -9.541 1.00 0.00 H new ATOM 0 HA VAL A 7 16.005 -11.811 -7.891 1.00 0.00 H new ATOM 0 HB VAL A 7 13.801 -13.873 -7.937 1.00 0.00 H new ATOM 0 HG11 VAL A 7 15.191 -15.072 -6.219 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.039 -14.927 -7.777 1.00 0.00 H new ATOM 0 HG13 VAL A 7 16.466 -13.848 -6.428 1.00 0.00 H new ATOM 0 HG21 VAL A 7 13.617 -13.416 -5.476 1.00 0.00 H new ATOM 0 HG22 VAL A 7 14.827 -12.122 -5.646 1.00 0.00 H new ATOM 0 HG23 VAL A 7 13.247 -11.974 -6.451 1.00 0.00 H new ATOM 133 N SER A 8 17.144 -13.011 -9.749 1.00 0.00 N ATOM 134 CA SER A 8 17.920 -13.793 -10.743 1.00 0.00 C ATOM 135 C SER A 8 19.187 -14.388 -10.113 1.00 0.00 C ATOM 136 O SER A 8 19.523 -14.021 -8.991 1.00 0.00 O ATOM 137 CB SER A 8 18.188 -12.935 -11.998 1.00 0.00 C ATOM 138 OG SER A 8 18.562 -11.605 -11.671 1.00 0.00 O ATOM 0 H SER A 8 17.729 -12.411 -9.168 1.00 0.00 H new ATOM 0 HA SER A 8 17.333 -14.650 -11.073 1.00 0.00 H new ATOM 0 HB2 SER A 8 18.978 -13.397 -12.590 1.00 0.00 H new ATOM 0 HB3 SER A 8 17.293 -12.916 -12.620 1.00 0.00 H new ATOM 0 HG SER A 8 19.539 -11.541 -11.630 1.00 0.00 H new ATOM 144 N LYS A 9 19.933 -15.281 -10.796 1.00 0.00 N ATOM 145 CA LYS A 9 21.216 -15.817 -10.258 1.00 0.00 C ATOM 146 C LYS A 9 22.188 -14.677 -9.986 1.00 0.00 C ATOM 147 O LYS A 9 22.611 -14.503 -8.860 1.00 0.00 O ATOM 148 CB LYS A 9 21.790 -16.944 -11.148 1.00 0.00 C ATOM 149 CG LYS A 9 23.041 -17.576 -10.498 1.00 0.00 C ATOM 150 CD LYS A 9 23.523 -18.867 -11.178 1.00 0.00 C ATOM 151 CE LYS A 9 24.070 -18.637 -12.597 1.00 0.00 C ATOM 152 NZ LYS A 9 24.617 -19.898 -13.182 1.00 0.00 N ATOM 0 H LYS A 9 19.678 -15.648 -11.713 1.00 0.00 H new ATOM 0 HA LYS A 9 21.027 -16.298 -9.298 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.031 -17.710 -11.306 1.00 0.00 H new ATOM 0 HB3 LYS A 9 22.048 -16.543 -12.128 1.00 0.00 H new ATOM 0 HG2 LYS A 9 23.851 -16.847 -10.513 1.00 0.00 H new ATOM 0 HG3 LYS A 9 22.824 -17.790 -9.452 1.00 0.00 H new ATOM 0 HD2 LYS A 9 24.300 -19.324 -10.566 1.00 0.00 H new ATOM 0 HD3 LYS A 9 22.696 -19.576 -11.225 1.00 0.00 H new ATOM 0 HE2 LYS A 9 23.276 -18.252 -13.237 1.00 0.00 H new ATOM 0 HE3 LYS A 9 24.852 -17.878 -12.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 24.978 -19.709 -14.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 25.391 -20.251 -12.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 23.864 -20.613 -13.231 1.00 0.00 H new ATOM 166 N ARG A 10 22.447 -13.837 -10.985 1.00 0.00 N ATOM 167 CA ARG A 10 23.162 -12.561 -10.788 1.00 0.00 C ATOM 168 C ARG A 10 22.088 -11.515 -10.592 1.00 0.00 C ATOM 169 O ARG A 10 21.336 -11.320 -11.536 1.00 0.00 O ATOM 170 CB ARG A 10 24.024 -12.241 -12.031 1.00 0.00 C ATOM 171 CG ARG A 10 25.517 -12.507 -11.833 1.00 0.00 C ATOM 172 CD ARG A 10 25.822 -14.007 -11.874 1.00 0.00 C ATOM 173 NE ARG A 10 27.188 -14.260 -11.409 1.00 0.00 N ATOM 174 CZ ARG A 10 28.320 -14.137 -12.068 1.00 0.00 C ATOM 175 NH1 ARG A 10 28.396 -13.856 -13.340 1.00 0.00 N ATOM 176 NH2 ARG A 10 29.410 -14.300 -11.386 1.00 0.00 N ATOM 0 H ARG A 10 22.173 -14.012 -11.952 1.00 0.00 H new ATOM 0 HA ARG A 10 23.837 -12.597 -9.933 1.00 0.00 H new ATOM 0 HB2 ARG A 10 23.667 -12.836 -12.872 1.00 0.00 H new ATOM 0 HB3 ARG A 10 23.884 -11.194 -12.299 1.00 0.00 H new ATOM 0 HG2 ARG A 10 26.086 -11.996 -12.609 1.00 0.00 H new ATOM 0 HG3 ARG A 10 25.839 -12.094 -10.877 1.00 0.00 H new ATOM 0 HD2 ARG A 10 25.111 -14.547 -11.248 1.00 0.00 H new ATOM 0 HD3 ARG A 10 25.701 -14.382 -12.890 1.00 0.00 H new ATOM 0 HE ARG A 10 27.273 -14.574 -10.442 1.00 0.00 H new ATOM 0 HH11 ARG A 10 27.544 -13.718 -13.884 1.00 0.00 H new ATOM 0 HH12 ARG A 10 29.307 -13.775 -13.791 1.00 0.00 H new ATOM 0 HH21 ARG A 10 29.361 -14.512 -10.390 1.00 0.00 H new ATOM 0 HH22 ARG A 10 30.317 -14.216 -11.846 1.00 0.00 H new ATOM 190 N ASN A 11 22.036 -10.776 -9.493 1.00 0.00 N ATOM 191 CA ASN A 11 21.152 -9.601 -9.335 1.00 0.00 C ATOM 192 C ASN A 11 21.242 -8.683 -10.566 1.00 0.00 C ATOM 193 O ASN A 11 20.234 -8.259 -11.116 1.00 0.00 O ATOM 194 CB ASN A 11 21.623 -8.870 -8.062 1.00 0.00 C ATOM 195 CG ASN A 11 20.807 -7.643 -7.702 1.00 0.00 C ATOM 196 OD1 ASN A 11 20.719 -6.678 -8.441 1.00 0.00 O ATOM 197 ND2 ASN A 11 20.214 -7.610 -6.537 1.00 0.00 N ATOM 0 H ASN A 11 22.607 -10.967 -8.670 1.00 0.00 H new ATOM 0 HA ASN A 11 20.108 -9.901 -9.247 1.00 0.00 H new ATOM 0 HB2 ASN A 11 21.594 -9.568 -7.226 1.00 0.00 H new ATOM 0 HB3 ASN A 11 22.664 -8.573 -8.193 1.00 0.00 H new ATOM 0 HD21 ASN A 11 19.686 -6.784 -6.257 1.00 0.00 H new ATOM 0 HD22 ASN A 11 20.279 -8.411 -5.909 1.00 0.00 H new ATOM 204 N SER A 12 22.464 -8.496 -11.067 1.00 0.00 N ATOM 205 CA SER A 12 22.798 -7.679 -12.246 1.00 0.00 C ATOM 206 C SER A 12 22.258 -8.217 -13.578 1.00 0.00 C ATOM 207 O SER A 12 21.855 -7.437 -14.436 1.00 0.00 O ATOM 208 CB SER A 12 24.317 -7.602 -12.323 1.00 0.00 C ATOM 209 OG SER A 12 24.807 -8.930 -12.349 1.00 0.00 O ATOM 0 H SER A 12 23.288 -8.927 -10.647 1.00 0.00 H new ATOM 0 HA SER A 12 22.322 -6.708 -12.112 1.00 0.00 H new ATOM 0 HB2 SER A 12 24.629 -7.060 -13.216 1.00 0.00 H new ATOM 0 HB3 SER A 12 24.718 -7.062 -11.466 1.00 0.00 H new ATOM 0 HG SER A 12 25.629 -8.965 -12.882 1.00 0.00 H new ATOM 215 N SER A 13 22.227 -9.548 -13.744 1.00 0.00 N ATOM 216 CA SER A 13 21.951 -10.220 -15.033 1.00 0.00 C ATOM 217 C SER A 13 20.543 -10.000 -15.564 1.00 0.00 C ATOM 218 O SER A 13 20.354 -9.903 -16.769 1.00 0.00 O ATOM 219 CB SER A 13 22.230 -11.718 -14.929 1.00 0.00 C ATOM 220 OG SER A 13 21.320 -12.376 -14.049 1.00 0.00 O ATOM 0 H SER A 13 22.395 -10.201 -12.979 1.00 0.00 H new ATOM 0 HA SER A 13 22.628 -9.756 -15.750 1.00 0.00 H new ATOM 0 HB2 SER A 13 22.164 -12.168 -15.920 1.00 0.00 H new ATOM 0 HB3 SER A 13 23.250 -11.872 -14.576 1.00 0.00 H new ATOM 0 HG SER A 13 21.365 -11.962 -13.162 1.00 0.00 H new ATOM 226 N ARG A 14 19.546 -9.959 -14.672 1.00 0.00 N ATOM 227 CA ARG A 14 18.153 -9.626 -15.044 1.00 0.00 C ATOM 228 C ARG A 14 17.452 -8.743 -14.025 1.00 0.00 C ATOM 229 O ARG A 14 16.780 -7.808 -14.420 1.00 0.00 O ATOM 230 CB ARG A 14 17.302 -10.885 -15.316 1.00 0.00 C ATOM 231 CG ARG A 14 17.798 -11.879 -16.382 1.00 0.00 C ATOM 232 CD ARG A 14 18.923 -12.780 -15.864 1.00 0.00 C ATOM 233 NE ARG A 14 18.653 -14.217 -16.058 1.00 0.00 N ATOM 234 CZ ARG A 14 19.501 -15.203 -15.852 1.00 0.00 C ATOM 235 NH1 ARG A 14 20.627 -15.025 -15.214 1.00 0.00 N ATOM 236 NH2 ARG A 14 19.218 -16.398 -16.275 1.00 0.00 N ATOM 0 H ARG A 14 19.673 -10.153 -13.679 1.00 0.00 H new ATOM 0 HA ARG A 14 18.241 -9.056 -15.969 1.00 0.00 H new ATOM 0 HB2 ARG A 14 17.199 -11.428 -14.376 1.00 0.00 H new ATOM 0 HB3 ARG A 14 16.304 -10.557 -15.605 1.00 0.00 H new ATOM 0 HG2 ARG A 14 16.964 -12.498 -16.713 1.00 0.00 H new ATOM 0 HG3 ARG A 14 18.151 -11.327 -17.253 1.00 0.00 H new ATOM 0 HD2 ARG A 14 19.851 -12.520 -16.372 1.00 0.00 H new ATOM 0 HD3 ARG A 14 19.076 -12.586 -14.802 1.00 0.00 H new ATOM 0 HE ARG A 14 17.720 -14.471 -16.383 1.00 0.00 H new ATOM 0 HH11 ARG A 14 20.871 -14.101 -14.859 1.00 0.00 H new ATOM 0 HH12 ARG A 14 21.262 -15.810 -15.071 1.00 0.00 H new ATOM 0 HH21 ARG A 14 18.341 -16.571 -16.766 1.00 0.00 H new ATOM 0 HH22 ARG A 14 19.873 -17.164 -16.117 1.00 0.00 H new ATOM 250 N SER A 15 17.576 -9.007 -12.727 1.00 0.00 N ATOM 251 CA SER A 15 16.745 -8.322 -11.710 1.00 0.00 C ATOM 252 C SER A 15 16.986 -6.813 -11.659 1.00 0.00 C ATOM 253 O SER A 15 16.044 -6.036 -11.671 1.00 0.00 O ATOM 254 CB SER A 15 16.925 -8.987 -10.353 1.00 0.00 C ATOM 255 OG SER A 15 16.414 -10.288 -10.523 1.00 0.00 O ATOM 0 H SER A 15 18.236 -9.684 -12.345 1.00 0.00 H new ATOM 0 HA SER A 15 15.702 -8.431 -12.007 1.00 0.00 H new ATOM 0 HB2 SER A 15 17.974 -9.009 -10.059 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.386 -8.448 -9.573 1.00 0.00 H new ATOM 0 HG SER A 15 17.075 -10.841 -10.990 1.00 0.00 H new ATOM 261 N GLN A 16 18.241 -6.380 -11.728 1.00 0.00 N ATOM 262 CA GLN A 16 18.672 -4.987 -11.921 1.00 0.00 C ATOM 263 C GLN A 16 18.110 -4.374 -13.205 1.00 0.00 C ATOM 264 O GLN A 16 17.635 -3.242 -13.199 1.00 0.00 O ATOM 265 CB GLN A 16 20.203 -5.060 -11.980 1.00 0.00 C ATOM 266 CG GLN A 16 20.983 -3.752 -11.820 1.00 0.00 C ATOM 267 CD GLN A 16 21.148 -3.375 -10.354 1.00 0.00 C ATOM 268 OE1 GLN A 16 22.169 -3.637 -9.738 1.00 0.00 O ATOM 269 NE2 GLN A 16 20.156 -2.776 -9.744 1.00 0.00 N ATOM 0 H GLN A 16 19.031 -7.020 -11.647 1.00 0.00 H new ATOM 0 HA GLN A 16 18.308 -4.347 -11.117 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.537 -5.747 -11.202 1.00 0.00 H new ATOM 0 HB3 GLN A 16 20.481 -5.502 -12.937 1.00 0.00 H new ATOM 0 HG2 GLN A 16 21.965 -3.854 -12.283 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.464 -2.951 -12.346 1.00 0.00 H new ATOM 0 HE21 GLN A 16 19.301 -2.555 -10.255 1.00 0.00 H new ATOM 0 HE22 GLN A 16 20.238 -2.530 -8.758 1.00 0.00 H new ATOM 278 N MET A 17 18.089 -5.145 -14.295 1.00 0.00 N ATOM 279 CA MET A 17 17.501 -4.721 -15.569 1.00 0.00 C ATOM 280 C MET A 17 15.984 -4.516 -15.420 1.00 0.00 C ATOM 281 O MET A 17 15.442 -3.494 -15.832 1.00 0.00 O ATOM 282 CB MET A 17 17.894 -5.718 -16.683 1.00 0.00 C ATOM 283 CG MET A 17 19.422 -5.760 -16.875 1.00 0.00 C ATOM 284 SD MET A 17 20.032 -6.895 -18.152 1.00 0.00 S ATOM 285 CE MET A 17 19.500 -6.052 -19.661 1.00 0.00 C ATOM 0 H MET A 17 18.481 -6.086 -14.319 1.00 0.00 H new ATOM 0 HA MET A 17 17.902 -3.752 -15.866 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.529 -6.713 -16.430 1.00 0.00 H new ATOM 0 HB3 MET A 17 17.414 -5.430 -17.619 1.00 0.00 H new ATOM 0 HG2 MET A 17 19.766 -4.754 -17.117 1.00 0.00 H new ATOM 0 HG3 MET A 17 19.880 -6.034 -15.925 1.00 0.00 H new ATOM 0 HE1 MET A 17 19.806 -6.634 -20.530 1.00 0.00 H new ATOM 0 HE2 MET A 17 18.415 -5.949 -19.657 1.00 0.00 H new ATOM 0 HE3 MET A 17 19.958 -5.064 -19.707 1.00 0.00 H new ATOM 295 N ALA A 18 15.312 -5.433 -14.726 1.00 0.00 N ATOM 296 CA ALA A 18 13.904 -5.322 -14.365 1.00 0.00 C ATOM 297 C ALA A 18 13.626 -4.230 -13.326 1.00 0.00 C ATOM 298 O ALA A 18 12.570 -3.619 -13.412 1.00 0.00 O ATOM 299 CB ALA A 18 13.417 -6.695 -13.898 1.00 0.00 C ATOM 0 H ALA A 18 15.744 -6.294 -14.392 1.00 0.00 H new ATOM 0 HA ALA A 18 13.345 -5.009 -15.247 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.364 -6.633 -13.623 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.540 -7.418 -14.704 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.000 -7.013 -13.034 1.00 0.00 H new ATOM 305 N GLU A 19 14.544 -3.884 -12.412 1.00 0.00 N ATOM 306 CA GLU A 19 14.257 -2.817 -11.441 1.00 0.00 C ATOM 307 C GLU A 19 14.235 -1.490 -12.177 1.00 0.00 C ATOM 308 O GLU A 19 13.263 -0.757 -12.063 1.00 0.00 O ATOM 309 CB GLU A 19 15.229 -2.806 -10.249 1.00 0.00 C ATOM 310 CG GLU A 19 14.965 -1.603 -9.317 1.00 0.00 C ATOM 311 CD GLU A 19 15.939 -1.489 -8.126 1.00 0.00 C ATOM 312 OE1 GLU A 19 16.216 -2.514 -7.461 1.00 0.00 O ATOM 313 OE2 GLU A 19 16.381 -0.354 -7.832 1.00 0.00 O ATOM 0 H GLU A 19 15.466 -4.312 -12.324 1.00 0.00 H new ATOM 0 HA GLU A 19 13.280 -3.005 -10.996 1.00 0.00 H new ATOM 0 HB2 GLU A 19 15.127 -3.734 -9.686 1.00 0.00 H new ATOM 0 HB3 GLU A 19 16.255 -2.766 -10.615 1.00 0.00 H new ATOM 0 HG2 GLU A 19 15.020 -0.686 -9.904 1.00 0.00 H new ATOM 0 HG3 GLU A 19 13.948 -1.674 -8.932 1.00 0.00 H new ATOM 320 N GLY A 20 15.242 -1.214 -13.004 1.00 0.00 N ATOM 321 CA GLY A 20 15.272 0.004 -13.806 1.00 0.00 C ATOM 322 C GLY A 20 14.087 0.138 -14.764 1.00 0.00 C ATOM 323 O GLY A 20 13.441 1.181 -14.757 1.00 0.00 O ATOM 0 H GLY A 20 16.051 -1.822 -13.135 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.289 0.867 -13.140 1.00 0.00 H new ATOM 0 HA3 GLY A 20 16.198 0.027 -14.381 1.00 0.00 H new ATOM 327 N PHE A 21 13.720 -0.911 -15.511 1.00 0.00 N ATOM 328 CA PHE A 21 12.526 -0.846 -16.378 1.00 0.00 C ATOM 329 C PHE A 21 11.225 -0.740 -15.573 1.00 0.00 C ATOM 330 O PHE A 21 10.299 -0.056 -15.994 1.00 0.00 O ATOM 331 CB PHE A 21 12.492 -2.032 -17.374 1.00 0.00 C ATOM 332 CG PHE A 21 12.745 -1.647 -18.822 1.00 0.00 C ATOM 333 CD1 PHE A 21 11.945 -0.656 -19.424 1.00 0.00 C ATOM 334 CD2 PHE A 21 13.756 -2.273 -19.583 1.00 0.00 C ATOM 335 CE1 PHE A 21 12.184 -0.251 -20.749 1.00 0.00 C ATOM 336 CE2 PHE A 21 13.982 -1.881 -20.914 1.00 0.00 C ATOM 337 CZ PHE A 21 13.206 -0.863 -21.493 1.00 0.00 C ATOM 0 H PHE A 21 14.218 -1.801 -15.537 1.00 0.00 H new ATOM 0 HA PHE A 21 12.603 0.073 -16.960 1.00 0.00 H new ATOM 0 HB2 PHE A 21 13.239 -2.766 -17.071 1.00 0.00 H new ATOM 0 HB3 PHE A 21 11.520 -2.520 -17.306 1.00 0.00 H new ATOM 0 HD1 PHE A 21 11.141 -0.203 -18.863 1.00 0.00 H new ATOM 0 HD2 PHE A 21 14.357 -3.054 -19.142 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.583 0.529 -21.194 1.00 0.00 H new ATOM 0 HE2 PHE A 21 14.755 -2.364 -21.493 1.00 0.00 H new ATOM 0 HZ PHE A 21 13.395 -0.551 -22.510 1.00 0.00 H new ATOM 347 N ALA A 22 11.135 -1.367 -14.395 1.00 0.00 N ATOM 348 CA ALA A 22 9.905 -1.315 -13.593 1.00 0.00 C ATOM 349 C ALA A 22 9.759 0.052 -12.916 1.00 0.00 C ATOM 350 O ALA A 22 8.660 0.590 -12.818 1.00 0.00 O ATOM 351 CB ALA A 22 9.912 -2.493 -12.614 1.00 0.00 C ATOM 0 H ALA A 22 11.890 -1.911 -13.978 1.00 0.00 H new ATOM 0 HA ALA A 22 9.023 -1.418 -14.225 1.00 0.00 H new ATOM 0 HB1 ALA A 22 9.005 -2.470 -12.010 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.953 -3.429 -13.171 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.783 -2.420 -11.963 1.00 0.00 H new ATOM 357 N LYS A 23 10.892 0.654 -12.543 1.00 0.00 N ATOM 358 CA LYS A 23 11.006 2.026 -12.059 1.00 0.00 C ATOM 359 C LYS A 23 10.518 2.988 -13.139 1.00 0.00 C ATOM 360 O LYS A 23 9.536 3.683 -12.921 1.00 0.00 O ATOM 361 CB LYS A 23 12.469 2.238 -11.630 1.00 0.00 C ATOM 362 CG LYS A 23 12.718 3.505 -10.816 1.00 0.00 C ATOM 363 CD LYS A 23 14.207 3.521 -10.411 1.00 0.00 C ATOM 364 CE LYS A 23 14.708 4.897 -9.953 1.00 0.00 C ATOM 365 NZ LYS A 23 14.121 5.334 -8.650 1.00 0.00 N ATOM 0 H LYS A 23 11.792 0.175 -12.573 1.00 0.00 H new ATOM 0 HA LYS A 23 10.376 2.222 -11.192 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.790 1.377 -11.044 1.00 0.00 H new ATOM 0 HB3 LYS A 23 13.094 2.267 -12.522 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.472 4.390 -11.403 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.081 3.522 -9.931 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.363 2.802 -9.607 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.808 3.189 -11.257 1.00 0.00 H new ATOM 0 HE2 LYS A 23 15.794 4.870 -9.864 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.469 5.636 -10.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 14.498 6.269 -8.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 13.086 5.390 -8.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 14.370 4.647 -7.910 1.00 0.00 H new ATOM 379 N THR A 24 11.071 2.958 -14.348 1.00 0.00 N ATOM 380 CA THR A 24 10.641 3.884 -15.408 1.00 0.00 C ATOM 381 C THR A 24 9.238 3.609 -15.965 1.00 0.00 C ATOM 382 O THR A 24 8.680 4.485 -16.629 1.00 0.00 O ATOM 383 CB THR A 24 11.675 3.972 -16.523 1.00 0.00 C ATOM 384 OG1 THR A 24 11.867 2.711 -17.124 1.00 0.00 O ATOM 385 CG2 THR A 24 13.001 4.484 -15.976 1.00 0.00 C ATOM 0 H THR A 24 11.811 2.312 -14.623 1.00 0.00 H new ATOM 0 HA THR A 24 10.568 4.857 -14.922 1.00 0.00 H new ATOM 0 HB THR A 24 11.304 4.669 -17.275 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.429 2.155 -16.545 1.00 0.00 H new ATOM 0 HG21 THR A 24 13.730 4.542 -16.784 1.00 0.00 H new ATOM 0 HG22 THR A 24 12.858 5.475 -15.545 1.00 0.00 H new ATOM 0 HG23 THR A 24 13.365 3.803 -15.207 1.00 0.00 H new ATOM 393 N LEU A 25 8.619 2.463 -15.634 1.00 0.00 N ATOM 394 CA LEU A 25 7.212 2.166 -15.943 1.00 0.00 C ATOM 395 C LEU A 25 6.233 2.420 -14.771 1.00 0.00 C ATOM 396 O LEU A 25 5.024 2.300 -14.978 1.00 0.00 O ATOM 397 CB LEU A 25 7.104 0.728 -16.500 1.00 0.00 C ATOM 398 CG LEU A 25 7.717 0.558 -17.906 1.00 0.00 C ATOM 399 CD1 LEU A 25 7.935 -0.924 -18.207 1.00 0.00 C ATOM 400 CD2 LEU A 25 6.797 1.134 -18.983 1.00 0.00 C ATOM 0 H LEU A 25 9.090 1.707 -15.137 1.00 0.00 H new ATOM 0 HA LEU A 25 6.892 2.876 -16.706 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.600 0.043 -15.812 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.053 0.439 -16.534 1.00 0.00 H new ATOM 0 HG LEU A 25 8.666 1.094 -17.917 1.00 0.00 H new ATOM 0 HD11 LEU A 25 8.368 -1.033 -19.201 1.00 0.00 H new ATOM 0 HD12 LEU A 25 8.613 -1.350 -17.467 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.980 -1.448 -18.167 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.255 1.000 -19.963 1.00 0.00 H new ATOM 0 HD22 LEU A 25 5.838 0.617 -18.957 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.641 2.197 -18.798 1.00 0.00 H new ATOM 412 N GLY A 26 6.705 2.769 -13.562 1.00 0.00 N ATOM 413 CA GLY A 26 5.834 2.874 -12.375 1.00 0.00 C ATOM 414 C GLY A 26 6.380 3.571 -11.120 1.00 0.00 C ATOM 415 O GLY A 26 5.796 3.403 -10.050 1.00 0.00 O ATOM 0 H GLY A 26 7.685 2.984 -13.379 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.927 3.398 -12.676 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.539 1.864 -12.091 1.00 0.00 H new ATOM 419 N ALA A 27 7.454 4.361 -11.212 1.00 0.00 N ATOM 420 CA ALA A 27 8.157 4.971 -10.069 1.00 0.00 C ATOM 421 C ALA A 27 7.260 5.825 -9.147 1.00 0.00 C ATOM 422 O ALA A 27 7.472 5.858 -7.933 1.00 0.00 O ATOM 423 CB ALA A 27 9.309 5.827 -10.628 1.00 0.00 C ATOM 0 H ALA A 27 7.874 4.604 -12.109 1.00 0.00 H new ATOM 0 HA ALA A 27 8.519 4.160 -9.437 1.00 0.00 H new ATOM 0 HB1 ALA A 27 9.849 6.293 -9.804 1.00 0.00 H new ATOM 0 HB2 ALA A 27 9.990 5.194 -11.197 1.00 0.00 H new ATOM 0 HB3 ALA A 27 8.904 6.601 -11.280 1.00 0.00 H new ATOM 429 N GLY A 28 6.246 6.494 -9.709 1.00 0.00 N ATOM 430 CA GLY A 28 5.276 7.306 -8.959 1.00 0.00 C ATOM 431 C GLY A 28 4.121 6.516 -8.321 1.00 0.00 C ATOM 432 O GLY A 28 3.307 7.108 -7.610 1.00 0.00 O ATOM 0 H GLY A 28 6.072 6.487 -10.714 1.00 0.00 H new ATOM 0 HA2 GLY A 28 5.806 7.844 -8.173 1.00 0.00 H new ATOM 0 HA3 GLY A 28 4.856 8.055 -9.630 1.00 0.00 H new ATOM 436 N LYS A 29 4.015 5.203 -8.595 1.00 0.00 N ATOM 437 CA LYS A 29 2.867 4.350 -8.222 1.00 0.00 C ATOM 438 C LYS A 29 3.162 3.501 -6.982 1.00 0.00 C ATOM 439 O LYS A 29 2.467 3.589 -5.972 1.00 0.00 O ATOM 440 CB LYS A 29 2.440 3.455 -9.412 1.00 0.00 C ATOM 441 CG LYS A 29 2.364 4.154 -10.781 1.00 0.00 C ATOM 442 CD LYS A 29 1.484 5.408 -10.802 1.00 0.00 C ATOM 443 CE LYS A 29 -0.002 5.083 -10.571 1.00 0.00 C ATOM 444 NZ LYS A 29 -0.853 6.306 -10.639 1.00 0.00 N ATOM 0 H LYS A 29 4.742 4.691 -9.094 1.00 0.00 H new ATOM 0 HA LYS A 29 2.039 5.013 -7.970 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.142 2.624 -9.488 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.463 3.027 -9.188 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.372 4.427 -11.093 1.00 0.00 H new ATOM 0 HG3 LYS A 29 1.984 3.445 -11.517 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.826 6.102 -10.034 1.00 0.00 H new ATOM 0 HD3 LYS A 29 1.598 5.913 -11.761 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -0.338 4.365 -11.319 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.123 4.609 -9.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -1.847 6.046 -10.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -0.549 6.981 -9.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -0.757 6.744 -11.577 1.00 0.00 H new ATOM 458 N ILE A 30 4.204 2.678 -7.100 1.00 0.00 N ATOM 459 CA ILE A 30 4.657 1.658 -6.128 1.00 0.00 C ATOM 460 C ILE A 30 6.198 1.572 -6.112 1.00 0.00 C ATOM 461 O ILE A 30 6.854 2.147 -6.980 1.00 0.00 O ATOM 462 CB ILE A 30 3.990 0.283 -6.420 1.00 0.00 C ATOM 463 CG1 ILE A 30 4.345 -0.339 -7.790 1.00 0.00 C ATOM 464 CG2 ILE A 30 2.456 0.373 -6.319 1.00 0.00 C ATOM 465 CD1 ILE A 30 5.648 -1.152 -7.786 1.00 0.00 C ATOM 0 H ILE A 30 4.799 2.700 -7.928 1.00 0.00 H new ATOM 0 HA ILE A 30 4.341 1.958 -5.129 1.00 0.00 H new ATOM 0 HB ILE A 30 4.400 -0.372 -5.652 1.00 0.00 H new ATOM 0 HG12 ILE A 30 3.526 -0.985 -8.108 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.428 0.458 -8.529 1.00 0.00 H new ATOM 0 HG21 ILE A 30 2.020 -0.604 -6.528 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.175 0.688 -5.314 1.00 0.00 H new ATOM 0 HG23 ILE A 30 2.086 1.099 -7.043 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.828 -1.556 -8.782 1.00 0.00 H new ATOM 0 HD12 ILE A 30 6.479 -0.507 -7.500 1.00 0.00 H new ATOM 0 HD13 ILE A 30 5.563 -1.972 -7.072 1.00 0.00 H new ATOM 477 N ALA A 31 6.791 0.816 -5.171 1.00 0.00 N ATOM 478 CA ALA A 31 8.246 0.600 -5.141 1.00 0.00 C ATOM 479 C ALA A 31 8.668 -0.711 -5.812 1.00 0.00 C ATOM 480 O ALA A 31 8.140 -1.785 -5.521 1.00 0.00 O ATOM 481 CB ALA A 31 8.792 0.659 -3.715 1.00 0.00 C ATOM 0 H ALA A 31 6.284 0.345 -4.422 1.00 0.00 H new ATOM 0 HA ALA A 31 8.680 1.416 -5.719 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.870 0.495 -3.731 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.580 1.638 -3.284 1.00 0.00 H new ATOM 0 HB3 ALA A 31 8.316 -0.114 -3.111 1.00 0.00 H new ATOM 487 N VAL A 32 9.672 -0.620 -6.677 1.00 0.00 N ATOM 488 CA VAL A 32 10.350 -1.757 -7.302 1.00 0.00 C ATOM 489 C VAL A 32 11.732 -2.044 -6.700 1.00 0.00 C ATOM 490 O VAL A 32 12.426 -1.126 -6.256 1.00 0.00 O ATOM 491 CB VAL A 32 10.460 -1.515 -8.804 1.00 0.00 C ATOM 492 CG1 VAL A 32 9.064 -1.508 -9.432 1.00 0.00 C ATOM 493 CG2 VAL A 32 11.200 -0.225 -9.189 1.00 0.00 C ATOM 0 H VAL A 32 10.052 0.278 -6.975 1.00 0.00 H new ATOM 0 HA VAL A 32 9.746 -2.643 -7.106 1.00 0.00 H new ATOM 0 HB VAL A 32 11.062 -2.337 -9.192 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.149 -1.335 -10.505 1.00 0.00 H new ATOM 0 HG12 VAL A 32 8.581 -2.469 -9.257 1.00 0.00 H new ATOM 0 HG13 VAL A 32 8.467 -0.715 -8.982 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.231 -0.134 -10.275 1.00 0.00 H new ATOM 0 HG22 VAL A 32 10.678 0.634 -8.767 1.00 0.00 H new ATOM 0 HG23 VAL A 32 12.217 -0.259 -8.798 1.00 0.00 H new ATOM 503 N THR A 33 12.138 -3.321 -6.710 1.00 0.00 N ATOM 504 CA THR A 33 13.369 -3.786 -6.048 1.00 0.00 C ATOM 505 C THR A 33 14.009 -4.969 -6.774 1.00 0.00 C ATOM 506 O THR A 33 13.305 -5.819 -7.310 1.00 0.00 O ATOM 507 CB THR A 33 13.120 -4.165 -4.573 1.00 0.00 C ATOM 508 OG1 THR A 33 11.978 -3.544 -4.019 1.00 0.00 O ATOM 509 CG2 THR A 33 14.304 -3.764 -3.695 1.00 0.00 C ATOM 0 H THR A 33 11.621 -4.065 -7.179 1.00 0.00 H new ATOM 0 HA THR A 33 14.061 -2.944 -6.086 1.00 0.00 H new ATOM 0 HB THR A 33 12.974 -5.245 -4.586 1.00 0.00 H new ATOM 0 HG1 THR A 33 11.170 -3.933 -4.415 1.00 0.00 H new ATOM 0 HG21 THR A 33 14.101 -4.043 -2.661 1.00 0.00 H new ATOM 0 HG22 THR A 33 15.202 -4.276 -4.039 1.00 0.00 H new ATOM 0 HG23 THR A 33 14.454 -2.686 -3.757 1.00 0.00 H new ATOM 517 N SER A 34 15.336 -5.032 -6.783 1.00 0.00 N ATOM 518 CA SER A 34 16.165 -6.112 -7.332 1.00 0.00 C ATOM 519 C SER A 34 16.971 -6.876 -6.270 1.00 0.00 C ATOM 520 O SER A 34 17.756 -6.288 -5.517 1.00 0.00 O ATOM 521 CB SER A 34 17.160 -5.527 -8.331 1.00 0.00 C ATOM 522 OG SER A 34 17.975 -6.579 -8.797 1.00 0.00 O ATOM 0 H SER A 34 15.903 -4.285 -6.382 1.00 0.00 H new ATOM 0 HA SER A 34 15.473 -6.815 -7.796 1.00 0.00 H new ATOM 0 HB2 SER A 34 16.634 -5.055 -9.161 1.00 0.00 H new ATOM 0 HB3 SER A 34 17.767 -4.755 -7.858 1.00 0.00 H new ATOM 0 HG SER A 34 18.917 -6.349 -8.658 1.00 0.00 H new ATOM 528 N SER A 35 16.876 -8.207 -6.294 1.00 0.00 N ATOM 529 CA SER A 35 17.671 -9.150 -5.509 1.00 0.00 C ATOM 530 C SER A 35 18.214 -10.275 -6.398 1.00 0.00 C ATOM 531 O SER A 35 17.960 -10.323 -7.601 1.00 0.00 O ATOM 532 CB SER A 35 16.871 -9.662 -4.309 1.00 0.00 C ATOM 533 OG SER A 35 17.708 -10.419 -3.456 1.00 0.00 O ATOM 0 H SER A 35 16.203 -8.681 -6.897 1.00 0.00 H new ATOM 0 HA SER A 35 18.541 -8.633 -5.103 1.00 0.00 H new ATOM 0 HB2 SER A 35 16.444 -8.822 -3.761 1.00 0.00 H new ATOM 0 HB3 SER A 35 16.038 -10.275 -4.652 1.00 0.00 H new ATOM 0 HG SER A 35 17.189 -10.741 -2.690 1.00 0.00 H new ATOM 539 N GLY A 36 19.008 -11.180 -5.839 1.00 0.00 N ATOM 540 CA GLY A 36 19.430 -12.382 -6.549 1.00 0.00 C ATOM 541 C GLY A 36 20.348 -13.294 -5.746 1.00 0.00 C ATOM 542 O GLY A 36 20.747 -12.961 -4.633 1.00 0.00 O ATOM 0 H GLY A 36 19.375 -11.104 -4.890 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.545 -12.945 -6.844 1.00 0.00 H new ATOM 0 HA3 GLY A 36 19.941 -12.088 -7.466 1.00 0.00 H new ATOM 546 N LEU A 37 20.686 -14.459 -6.306 1.00 0.00 N ATOM 547 CA LEU A 37 21.515 -15.465 -5.614 1.00 0.00 C ATOM 548 C LEU A 37 22.959 -14.971 -5.404 1.00 0.00 C ATOM 549 O LEU A 37 23.613 -15.349 -4.433 1.00 0.00 O ATOM 550 CB LEU A 37 21.472 -16.814 -6.362 1.00 0.00 C ATOM 551 CG LEU A 37 20.068 -17.352 -6.712 1.00 0.00 C ATOM 552 CD1 LEU A 37 20.174 -18.748 -7.324 1.00 0.00 C ATOM 553 CD2 LEU A 37 19.137 -17.423 -5.503 1.00 0.00 C ATOM 0 H LEU A 37 20.398 -14.735 -7.245 1.00 0.00 H new ATOM 0 HA LEU A 37 21.093 -15.621 -4.621 1.00 0.00 H new ATOM 0 HB2 LEU A 37 22.041 -16.712 -7.286 1.00 0.00 H new ATOM 0 HB3 LEU A 37 21.983 -17.560 -5.754 1.00 0.00 H new ATOM 0 HG LEU A 37 19.642 -16.646 -7.425 1.00 0.00 H new ATOM 0 HD11 LEU A 37 19.177 -19.116 -7.566 1.00 0.00 H new ATOM 0 HD12 LEU A 37 20.775 -18.702 -8.233 1.00 0.00 H new ATOM 0 HD13 LEU A 37 20.646 -19.423 -6.610 1.00 0.00 H new ATOM 0 HD21 LEU A 37 18.166 -17.809 -5.814 1.00 0.00 H new ATOM 0 HD22 LEU A 37 19.567 -18.085 -4.751 1.00 0.00 H new ATOM 0 HD23 LEU A 37 19.013 -16.426 -5.080 1.00 0.00 H new ATOM 565 N GLU A 38 23.427 -14.079 -6.281 1.00 0.00 N ATOM 566 CA GLU A 38 24.659 -13.311 -6.181 1.00 0.00 C ATOM 567 C GLU A 38 24.241 -11.838 -6.278 1.00 0.00 C ATOM 568 O GLU A 38 23.732 -11.407 -7.313 1.00 0.00 O ATOM 569 CB GLU A 38 25.629 -13.741 -7.304 1.00 0.00 C ATOM 570 CG GLU A 38 27.017 -13.097 -7.110 1.00 0.00 C ATOM 571 CD GLU A 38 27.996 -13.337 -8.280 1.00 0.00 C ATOM 572 OE1 GLU A 38 28.107 -14.478 -8.792 1.00 0.00 O ATOM 573 OE2 GLU A 38 28.680 -12.372 -8.703 1.00 0.00 O ATOM 0 H GLU A 38 22.916 -13.864 -7.137 1.00 0.00 H new ATOM 0 HA GLU A 38 25.194 -13.479 -5.246 1.00 0.00 H new ATOM 0 HB2 GLU A 38 25.725 -14.827 -7.311 1.00 0.00 H new ATOM 0 HB3 GLU A 38 25.222 -13.451 -8.273 1.00 0.00 H new ATOM 0 HG2 GLU A 38 26.891 -12.023 -6.971 1.00 0.00 H new ATOM 0 HG3 GLU A 38 27.461 -13.487 -6.194 1.00 0.00 H new ATOM 580 N SER A 39 24.442 -11.046 -5.221 1.00 0.00 N ATOM 581 CA SER A 39 24.083 -9.611 -5.197 1.00 0.00 C ATOM 582 C SER A 39 24.847 -8.784 -6.234 1.00 0.00 C ATOM 583 O SER A 39 24.374 -7.732 -6.661 1.00 0.00 O ATOM 584 CB SER A 39 24.310 -9.045 -3.803 1.00 0.00 C ATOM 585 OG SER A 39 25.668 -9.216 -3.423 1.00 0.00 O ATOM 0 H SER A 39 24.859 -11.376 -4.351 1.00 0.00 H new ATOM 0 HA SER A 39 23.028 -9.543 -5.461 1.00 0.00 H new ATOM 0 HB2 SER A 39 24.049 -7.987 -3.785 1.00 0.00 H new ATOM 0 HB3 SER A 39 23.658 -9.546 -3.088 1.00 0.00 H new ATOM 0 HG SER A 39 25.805 -8.847 -2.525 1.00 0.00 H new ATOM 591 N SER A 40 25.977 -9.323 -6.696 1.00 0.00 N ATOM 592 CA SER A 40 26.750 -8.840 -7.844 1.00 0.00 C ATOM 593 C SER A 40 27.153 -7.350 -7.746 1.00 0.00 C ATOM 594 O SER A 40 27.389 -6.822 -6.654 1.00 0.00 O ATOM 595 CB SER A 40 25.941 -9.213 -9.095 1.00 0.00 C ATOM 596 OG SER A 40 26.721 -9.053 -10.265 1.00 0.00 O ATOM 0 H SER A 40 26.398 -10.144 -6.262 1.00 0.00 H new ATOM 0 HA SER A 40 27.727 -9.321 -7.883 1.00 0.00 H new ATOM 0 HB2 SER A 40 25.600 -10.245 -9.018 1.00 0.00 H new ATOM 0 HB3 SER A 40 25.051 -8.587 -9.158 1.00 0.00 H new ATOM 0 HG SER A 40 26.133 -9.018 -11.048 1.00 0.00 H new ATOM 602 N ARG A 41 27.279 -6.682 -8.900 1.00 0.00 N ATOM 603 CA ARG A 41 27.656 -5.273 -9.101 1.00 0.00 C ATOM 604 C ARG A 41 26.840 -4.670 -10.245 1.00 0.00 C ATOM 605 O ARG A 41 26.287 -5.410 -11.052 1.00 0.00 O ATOM 606 CB ARG A 41 29.178 -5.176 -9.367 1.00 0.00 C ATOM 607 CG ARG A 41 29.681 -5.698 -10.736 1.00 0.00 C ATOM 608 CD ARG A 41 29.632 -7.223 -10.948 1.00 0.00 C ATOM 609 NE ARG A 41 30.443 -7.954 -9.944 1.00 0.00 N ATOM 610 CZ ARG A 41 30.310 -9.210 -9.541 1.00 0.00 C ATOM 611 NH1 ARG A 41 29.339 -9.981 -9.927 1.00 0.00 N ATOM 612 NH2 ARG A 41 31.157 -9.738 -8.709 1.00 0.00 N ATOM 0 H ARG A 41 27.106 -7.149 -9.790 1.00 0.00 H new ATOM 0 HA ARG A 41 27.434 -4.699 -8.201 1.00 0.00 H new ATOM 0 HB2 ARG A 41 29.474 -4.131 -9.272 1.00 0.00 H new ATOM 0 HB3 ARG A 41 29.696 -5.727 -8.582 1.00 0.00 H new ATOM 0 HG2 ARG A 41 29.090 -5.225 -11.520 1.00 0.00 H new ATOM 0 HG3 ARG A 41 30.711 -5.367 -10.870 1.00 0.00 H new ATOM 0 HD2 ARG A 41 28.598 -7.563 -10.894 1.00 0.00 H new ATOM 0 HD3 ARG A 41 29.994 -7.461 -11.948 1.00 0.00 H new ATOM 0 HE ARG A 41 31.198 -7.424 -9.509 1.00 0.00 H new ATOM 0 HH11 ARG A 41 28.632 -9.627 -10.571 1.00 0.00 H new ATOM 0 HH12 ARG A 41 29.284 -10.941 -9.586 1.00 0.00 H new ATOM 0 HH21 ARG A 41 31.938 -9.185 -8.356 1.00 0.00 H new ATOM 0 HH22 ARG A 41 31.041 -10.706 -8.408 1.00 0.00 H new ATOM 626 N VAL A 42 26.813 -3.347 -10.386 1.00 0.00 N ATOM 627 CA VAL A 42 26.249 -2.684 -11.569 1.00 0.00 C ATOM 628 C VAL A 42 27.145 -3.006 -12.780 1.00 0.00 C ATOM 629 O VAL A 42 28.258 -2.506 -12.909 1.00 0.00 O ATOM 630 CB VAL A 42 26.037 -1.181 -11.293 1.00 0.00 C ATOM 631 CG1 VAL A 42 24.883 -1.013 -10.296 1.00 0.00 C ATOM 632 CG2 VAL A 42 27.252 -0.444 -10.709 1.00 0.00 C ATOM 0 H VAL A 42 27.180 -2.701 -9.687 1.00 0.00 H new ATOM 0 HA VAL A 42 25.254 -3.061 -11.807 1.00 0.00 H new ATOM 0 HB VAL A 42 25.835 -0.739 -12.269 1.00 0.00 H new ATOM 0 HG11 VAL A 42 24.727 0.047 -10.096 1.00 0.00 H new ATOM 0 HG12 VAL A 42 23.973 -1.441 -10.717 1.00 0.00 H new ATOM 0 HG13 VAL A 42 25.128 -1.526 -9.366 1.00 0.00 H new ATOM 0 HG21 VAL A 42 27.000 0.605 -10.552 1.00 0.00 H new ATOM 0 HG22 VAL A 42 27.530 -0.897 -9.757 1.00 0.00 H new ATOM 0 HG23 VAL A 42 28.089 -0.516 -11.403 1.00 0.00 H new ATOM 642 N HIS A 43 26.695 -3.945 -13.622 1.00 0.00 N ATOM 643 CA HIS A 43 27.515 -4.533 -14.699 1.00 0.00 C ATOM 644 C HIS A 43 27.785 -3.526 -15.831 1.00 0.00 C ATOM 645 O HIS A 43 26.842 -2.856 -16.253 1.00 0.00 O ATOM 646 CB HIS A 43 26.816 -5.806 -15.205 1.00 0.00 C ATOM 647 CG HIS A 43 27.604 -6.575 -16.228 1.00 0.00 C ATOM 648 ND1 HIS A 43 27.646 -6.291 -17.593 1.00 0.00 N ATOM 649 CD2 HIS A 43 28.396 -7.652 -15.969 1.00 0.00 C ATOM 650 CE1 HIS A 43 28.456 -7.224 -18.128 1.00 0.00 C ATOM 651 NE2 HIS A 43 28.922 -8.047 -17.177 1.00 0.00 N ATOM 0 H HIS A 43 25.748 -4.323 -13.579 1.00 0.00 H new ATOM 0 HA HIS A 43 28.496 -4.798 -14.305 1.00 0.00 H new ATOM 0 HB2 HIS A 43 26.612 -6.457 -14.355 1.00 0.00 H new ATOM 0 HB3 HIS A 43 25.853 -5.532 -15.635 1.00 0.00 H new ATOM 0 HD2 HIS A 43 28.576 -8.106 -15.006 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.697 -7.299 -19.178 1.00 0.00 H new ATOM 0 HE2 HIS A 43 29.557 -8.831 -17.324 1.00 0.00 H new ATOM 659 N PRO A 44 29.022 -3.407 -16.363 1.00 0.00 N ATOM 660 CA PRO A 44 29.383 -2.348 -17.314 1.00 0.00 C ATOM 661 C PRO A 44 28.558 -2.374 -18.603 1.00 0.00 C ATOM 662 O PRO A 44 28.168 -1.320 -19.110 1.00 0.00 O ATOM 663 CB PRO A 44 30.881 -2.535 -17.585 1.00 0.00 C ATOM 664 CG PRO A 44 31.142 -4.001 -17.245 1.00 0.00 C ATOM 665 CD PRO A 44 30.192 -4.232 -16.075 1.00 0.00 C ATOM 0 HA PRO A 44 29.164 -1.368 -16.891 1.00 0.00 H new ATOM 0 HB2 PRO A 44 31.128 -2.317 -18.624 1.00 0.00 H new ATOM 0 HB3 PRO A 44 31.484 -1.869 -16.967 1.00 0.00 H new ATOM 0 HG2 PRO A 44 30.922 -4.660 -18.085 1.00 0.00 H new ATOM 0 HG3 PRO A 44 32.181 -4.176 -16.967 1.00 0.00 H new ATOM 0 HD2 PRO A 44 29.921 -5.284 -15.990 1.00 0.00 H new ATOM 0 HD3 PRO A 44 30.654 -3.945 -15.130 1.00 0.00 H new ATOM 673 N THR A 45 28.218 -3.563 -19.112 1.00 0.00 N ATOM 674 CA THR A 45 27.411 -3.695 -20.336 1.00 0.00 C ATOM 675 C THR A 45 25.930 -3.434 -20.053 1.00 0.00 C ATOM 676 O THR A 45 25.264 -2.810 -20.875 1.00 0.00 O ATOM 677 CB THR A 45 27.629 -5.062 -21.000 1.00 0.00 C ATOM 678 OG1 THR A 45 28.989 -5.449 -20.959 1.00 0.00 O ATOM 679 CG2 THR A 45 27.208 -5.055 -22.469 1.00 0.00 C ATOM 0 H THR A 45 28.489 -4.453 -18.695 1.00 0.00 H new ATOM 0 HA THR A 45 27.746 -2.934 -21.041 1.00 0.00 H new ATOM 0 HB THR A 45 27.015 -5.764 -20.436 1.00 0.00 H new ATOM 0 HG1 THR A 45 29.093 -6.324 -21.388 1.00 0.00 H new ATOM 0 HG21 THR A 45 27.379 -6.041 -22.901 1.00 0.00 H new ATOM 0 HG22 THR A 45 26.150 -4.805 -22.543 1.00 0.00 H new ATOM 0 HG23 THR A 45 27.795 -4.314 -23.012 1.00 0.00 H new ATOM 687 N ALA A 46 25.421 -3.792 -18.865 1.00 0.00 N ATOM 688 CA ALA A 46 24.075 -3.385 -18.447 1.00 0.00 C ATOM 689 C ALA A 46 23.980 -1.866 -18.232 1.00 0.00 C ATOM 690 O ALA A 46 23.048 -1.263 -18.748 1.00 0.00 O ATOM 691 CB ALA A 46 23.624 -4.185 -17.216 1.00 0.00 C ATOM 0 H ALA A 46 25.920 -4.360 -18.181 1.00 0.00 H new ATOM 0 HA ALA A 46 23.383 -3.619 -19.256 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.623 -3.868 -16.922 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.611 -5.248 -17.457 1.00 0.00 H new ATOM 0 HB3 ALA A 46 24.317 -4.008 -16.393 1.00 0.00 H new ATOM 697 N ILE A 47 24.948 -1.213 -17.570 1.00 0.00 N ATOM 698 CA ILE A 47 24.999 0.258 -17.450 1.00 0.00 C ATOM 699 C ILE A 47 24.860 0.912 -18.834 1.00 0.00 C ATOM 700 O ILE A 47 24.014 1.786 -19.003 1.00 0.00 O ATOM 701 CB ILE A 47 26.290 0.713 -16.720 1.00 0.00 C ATOM 702 CG1 ILE A 47 26.319 0.242 -15.247 1.00 0.00 C ATOM 703 CG2 ILE A 47 26.413 2.247 -16.730 1.00 0.00 C ATOM 704 CD1 ILE A 47 27.711 0.291 -14.606 1.00 0.00 C ATOM 0 H ILE A 47 25.720 -1.688 -17.101 1.00 0.00 H new ATOM 0 HA ILE A 47 24.157 0.588 -16.842 1.00 0.00 H new ATOM 0 HB ILE A 47 27.122 0.260 -17.259 1.00 0.00 H new ATOM 0 HG12 ILE A 47 25.639 0.863 -14.664 1.00 0.00 H new ATOM 0 HG13 ILE A 47 25.942 -0.779 -15.195 1.00 0.00 H new ATOM 0 HG21 ILE A 47 27.326 2.542 -16.212 1.00 0.00 H new ATOM 0 HG22 ILE A 47 26.449 2.602 -17.760 1.00 0.00 H new ATOM 0 HG23 ILE A 47 25.552 2.684 -16.225 1.00 0.00 H new ATOM 0 HD11 ILE A 47 27.649 -0.054 -13.574 1.00 0.00 H new ATOM 0 HD12 ILE A 47 28.391 -0.353 -15.164 1.00 0.00 H new ATOM 0 HD13 ILE A 47 28.084 1.315 -14.624 1.00 0.00 H new ATOM 716 N ALA A 48 25.604 0.433 -19.838 1.00 0.00 N ATOM 717 CA ALA A 48 25.504 0.917 -21.217 1.00 0.00 C ATOM 718 C ALA A 48 24.124 0.678 -21.849 1.00 0.00 C ATOM 719 O ALA A 48 23.424 1.624 -22.202 1.00 0.00 O ATOM 720 CB ALA A 48 26.607 0.259 -22.056 1.00 0.00 C ATOM 0 H ALA A 48 26.296 -0.306 -19.714 1.00 0.00 H new ATOM 0 HA ALA A 48 25.635 1.999 -21.197 1.00 0.00 H new ATOM 0 HB1 ALA A 48 26.541 0.613 -23.085 1.00 0.00 H new ATOM 0 HB2 ALA A 48 27.582 0.520 -21.644 1.00 0.00 H new ATOM 0 HB3 ALA A 48 26.482 -0.824 -22.036 1.00 0.00 H new ATOM 726 N MET A 49 23.724 -0.588 -22.018 1.00 0.00 N ATOM 727 CA MET A 49 22.525 -0.940 -22.794 1.00 0.00 C ATOM 728 C MET A 49 21.225 -0.504 -22.114 1.00 0.00 C ATOM 729 O MET A 49 20.227 -0.298 -22.797 1.00 0.00 O ATOM 730 CB MET A 49 22.488 -2.444 -23.081 1.00 0.00 C ATOM 731 CG MET A 49 23.728 -2.998 -23.806 1.00 0.00 C ATOM 732 SD MET A 49 24.101 -2.336 -25.444 1.00 0.00 S ATOM 733 CE MET A 49 25.224 -0.963 -25.073 1.00 0.00 C ATOM 0 H MET A 49 24.215 -1.391 -21.626 1.00 0.00 H new ATOM 0 HA MET A 49 22.595 -0.392 -23.733 1.00 0.00 H new ATOM 0 HB2 MET A 49 22.370 -2.976 -22.137 1.00 0.00 H new ATOM 0 HB3 MET A 49 21.606 -2.662 -23.683 1.00 0.00 H new ATOM 0 HG2 MET A 49 24.595 -2.826 -23.168 1.00 0.00 H new ATOM 0 HG3 MET A 49 23.609 -4.078 -23.899 1.00 0.00 H new ATOM 0 HE1 MET A 49 25.607 -0.544 -26.004 1.00 0.00 H new ATOM 0 HE2 MET A 49 24.686 -0.191 -24.522 1.00 0.00 H new ATOM 0 HE3 MET A 49 26.056 -1.326 -24.469 1.00 0.00 H new ATOM 743 N MET A 50 21.217 -0.342 -20.791 1.00 0.00 N ATOM 744 CA MET A 50 20.067 0.200 -20.062 1.00 0.00 C ATOM 745 C MET A 50 20.024 1.738 -20.172 1.00 0.00 C ATOM 746 O MET A 50 18.955 2.309 -20.369 1.00 0.00 O ATOM 747 CB MET A 50 20.102 -0.302 -18.610 1.00 0.00 C ATOM 748 CG MET A 50 20.088 -1.835 -18.494 1.00 0.00 C ATOM 749 SD MET A 50 18.524 -2.648 -18.934 1.00 0.00 S ATOM 750 CE MET A 50 17.388 -1.895 -17.740 1.00 0.00 C ATOM 0 H MET A 50 22.007 -0.583 -20.193 1.00 0.00 H new ATOM 0 HA MET A 50 19.140 -0.158 -20.509 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.997 0.084 -18.121 1.00 0.00 H new ATOM 0 HB3 MET A 50 19.245 0.104 -18.072 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.876 -2.236 -19.132 1.00 0.00 H new ATOM 0 HG3 MET A 50 20.340 -2.105 -17.468 1.00 0.00 H new ATOM 0 HE1 MET A 50 16.479 -2.493 -17.675 1.00 0.00 H new ATOM 0 HE2 MET A 50 17.865 -1.853 -16.761 1.00 0.00 H new ATOM 0 HE3 MET A 50 17.136 -0.885 -18.065 1.00 0.00 H new ATOM 760 N GLU A 51 21.174 2.421 -20.185 1.00 0.00 N ATOM 761 CA GLU A 51 21.254 3.864 -20.464 1.00 0.00 C ATOM 762 C GLU A 51 20.732 4.229 -21.873 1.00 0.00 C ATOM 763 O GLU A 51 20.115 5.284 -22.031 1.00 0.00 O ATOM 764 CB GLU A 51 22.695 4.346 -20.215 1.00 0.00 C ATOM 765 CG GLU A 51 22.960 5.799 -20.615 1.00 0.00 C ATOM 766 CD GLU A 51 24.349 6.261 -20.134 1.00 0.00 C ATOM 767 OE1 GLU A 51 25.366 5.938 -20.797 1.00 0.00 O ATOM 768 OE2 GLU A 51 24.434 6.976 -19.104 1.00 0.00 O ATOM 0 H GLU A 51 22.080 1.989 -20.002 1.00 0.00 H new ATOM 0 HA GLU A 51 20.589 4.391 -19.780 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.926 4.227 -19.156 1.00 0.00 H new ATOM 0 HB3 GLU A 51 23.380 3.701 -20.765 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.895 5.899 -21.698 1.00 0.00 H new ATOM 0 HG3 GLU A 51 22.191 6.443 -20.189 1.00 0.00 H new ATOM 775 N GLU A 52 20.863 3.339 -22.872 1.00 0.00 N ATOM 776 CA GLU A 52 20.261 3.517 -24.214 1.00 0.00 C ATOM 777 C GLU A 52 18.744 3.772 -24.157 1.00 0.00 C ATOM 778 O GLU A 52 18.218 4.570 -24.937 1.00 0.00 O ATOM 779 CB GLU A 52 20.464 2.272 -25.094 1.00 0.00 C ATOM 780 CG GLU A 52 21.926 1.952 -25.407 1.00 0.00 C ATOM 781 CD GLU A 52 22.070 0.706 -26.296 1.00 0.00 C ATOM 782 OE1 GLU A 52 21.306 -0.278 -26.130 1.00 0.00 O ATOM 783 OE2 GLU A 52 22.971 0.708 -27.165 1.00 0.00 O ATOM 0 H GLU A 52 21.390 2.471 -22.776 1.00 0.00 H new ATOM 0 HA GLU A 52 20.769 4.385 -24.635 1.00 0.00 H new ATOM 0 HB2 GLU A 52 20.015 1.413 -24.596 1.00 0.00 H new ATOM 0 HB3 GLU A 52 19.927 2.413 -26.032 1.00 0.00 H new ATOM 0 HG2 GLU A 52 22.385 2.806 -25.905 1.00 0.00 H new ATOM 0 HG3 GLU A 52 22.470 1.796 -24.475 1.00 0.00 H new ATOM 790 N VAL A 53 18.047 3.104 -23.228 1.00 0.00 N ATOM 791 CA VAL A 53 16.587 3.226 -23.025 1.00 0.00 C ATOM 792 C VAL A 53 16.193 4.183 -21.884 1.00 0.00 C ATOM 793 O VAL A 53 15.044 4.181 -21.439 1.00 0.00 O ATOM 794 CB VAL A 53 15.912 1.840 -22.911 1.00 0.00 C ATOM 795 CG1 VAL A 53 16.018 1.074 -24.235 1.00 0.00 C ATOM 796 CG2 VAL A 53 16.533 0.973 -21.813 1.00 0.00 C ATOM 0 H VAL A 53 18.486 2.449 -22.581 1.00 0.00 H new ATOM 0 HA VAL A 53 16.196 3.701 -23.924 1.00 0.00 H new ATOM 0 HB VAL A 53 14.869 2.034 -22.659 1.00 0.00 H new ATOM 0 HG11 VAL A 53 15.537 0.102 -24.132 1.00 0.00 H new ATOM 0 HG12 VAL A 53 15.525 1.642 -25.024 1.00 0.00 H new ATOM 0 HG13 VAL A 53 17.068 0.934 -24.491 1.00 0.00 H new ATOM 0 HG21 VAL A 53 16.022 0.011 -21.776 1.00 0.00 H new ATOM 0 HG22 VAL A 53 17.590 0.814 -22.029 1.00 0.00 H new ATOM 0 HG23 VAL A 53 16.431 1.475 -20.851 1.00 0.00 H new ATOM 806 N GLY A 54 17.123 5.025 -21.410 1.00 0.00 N ATOM 807 CA GLY A 54 16.878 6.011 -20.344 1.00 0.00 C ATOM 808 C GLY A 54 17.067 5.483 -18.915 1.00 0.00 C ATOM 809 O GLY A 54 16.645 6.136 -17.959 1.00 0.00 O ATOM 0 H GLY A 54 18.081 5.041 -21.761 1.00 0.00 H new ATOM 0 HA2 GLY A 54 17.547 6.859 -20.493 1.00 0.00 H new ATOM 0 HA3 GLY A 54 15.860 6.387 -20.445 1.00 0.00 H new ATOM 813 N ILE A 55 17.678 4.303 -18.758 1.00 0.00 N ATOM 814 CA ILE A 55 17.759 3.541 -17.504 1.00 0.00 C ATOM 815 C ILE A 55 19.231 3.358 -17.103 1.00 0.00 C ATOM 816 O ILE A 55 19.782 2.267 -17.166 1.00 0.00 O ATOM 817 CB ILE A 55 16.985 2.201 -17.641 1.00 0.00 C ATOM 818 CG1 ILE A 55 15.546 2.415 -18.168 1.00 0.00 C ATOM 819 CG2 ILE A 55 16.915 1.474 -16.284 1.00 0.00 C ATOM 820 CD1 ILE A 55 14.800 1.123 -18.505 1.00 0.00 C ATOM 0 H ILE A 55 18.149 3.833 -19.531 1.00 0.00 H new ATOM 0 HA ILE A 55 17.278 4.091 -16.695 1.00 0.00 H new ATOM 0 HB ILE A 55 17.533 1.594 -18.362 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.976 2.965 -17.420 1.00 0.00 H new ATOM 0 HG13 ILE A 55 15.588 3.040 -19.060 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.369 0.538 -16.401 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.925 1.264 -15.931 1.00 0.00 H new ATOM 0 HG23 ILE A 55 16.402 2.106 -15.559 1.00 0.00 H new ATOM 0 HD11 ILE A 55 13.800 1.364 -18.867 1.00 0.00 H new ATOM 0 HD12 ILE A 55 15.344 0.579 -19.277 1.00 0.00 H new ATOM 0 HD13 ILE A 55 14.723 0.504 -17.611 1.00 0.00 H new ATOM 832 N ASP A 56 19.910 4.423 -16.684 1.00 0.00 N ATOM 833 CA ASP A 56 21.253 4.282 -16.109 1.00 0.00 C ATOM 834 C ASP A 56 21.192 3.515 -14.771 1.00 0.00 C ATOM 835 O ASP A 56 20.718 4.047 -13.763 1.00 0.00 O ATOM 836 CB ASP A 56 21.897 5.668 -15.944 1.00 0.00 C ATOM 837 CG ASP A 56 23.241 5.601 -15.191 1.00 0.00 C ATOM 838 OD1 ASP A 56 23.889 4.528 -15.200 1.00 0.00 O ATOM 839 OD2 ASP A 56 23.631 6.619 -14.570 1.00 0.00 O ATOM 0 H ASP A 56 19.563 5.381 -16.729 1.00 0.00 H new ATOM 0 HA ASP A 56 21.876 3.699 -16.787 1.00 0.00 H new ATOM 0 HB2 ASP A 56 22.055 6.112 -16.927 1.00 0.00 H new ATOM 0 HB3 ASP A 56 21.213 6.323 -15.404 1.00 0.00 H new ATOM 844 N ILE A 57 21.685 2.265 -14.745 1.00 0.00 N ATOM 845 CA ILE A 57 21.713 1.442 -13.524 1.00 0.00 C ATOM 846 C ILE A 57 22.941 1.716 -12.643 1.00 0.00 C ATOM 847 O ILE A 57 23.028 1.142 -11.566 1.00 0.00 O ATOM 848 CB ILE A 57 21.571 -0.073 -13.818 1.00 0.00 C ATOM 849 CG1 ILE A 57 22.745 -0.638 -14.649 1.00 0.00 C ATOM 850 CG2 ILE A 57 20.225 -0.395 -14.487 1.00 0.00 C ATOM 851 CD1 ILE A 57 23.146 -2.061 -14.243 1.00 0.00 C ATOM 0 H ILE A 57 22.073 1.799 -15.565 1.00 0.00 H new ATOM 0 HA ILE A 57 20.834 1.749 -12.956 1.00 0.00 H new ATOM 0 HB ILE A 57 21.601 -0.571 -12.849 1.00 0.00 H new ATOM 0 HG12 ILE A 57 22.470 -0.632 -15.704 1.00 0.00 H new ATOM 0 HG13 ILE A 57 23.607 0.020 -14.541 1.00 0.00 H new ATOM 0 HG21 ILE A 57 20.161 -1.466 -14.678 1.00 0.00 H new ATOM 0 HG22 ILE A 57 19.410 -0.094 -13.828 1.00 0.00 H new ATOM 0 HG23 ILE A 57 20.148 0.147 -15.430 1.00 0.00 H new ATOM 0 HD11 ILE A 57 23.975 -2.397 -14.865 1.00 0.00 H new ATOM 0 HD12 ILE A 57 23.451 -2.068 -13.197 1.00 0.00 H new ATOM 0 HD13 ILE A 57 22.297 -2.731 -14.378 1.00 0.00 H new ATOM 863 N SER A 58 23.899 2.556 -13.058 1.00 0.00 N ATOM 864 CA SER A 58 25.190 2.706 -12.364 1.00 0.00 C ATOM 865 C SER A 58 25.038 3.219 -10.917 1.00 0.00 C ATOM 866 O SER A 58 25.779 2.810 -10.024 1.00 0.00 O ATOM 867 CB SER A 58 26.103 3.619 -13.181 1.00 0.00 C ATOM 868 OG SER A 58 27.408 3.656 -12.624 1.00 0.00 O ATOM 0 H SER A 58 23.804 3.150 -13.882 1.00 0.00 H new ATOM 0 HA SER A 58 25.641 1.717 -12.283 1.00 0.00 H new ATOM 0 HB2 SER A 58 26.152 3.265 -14.211 1.00 0.00 H new ATOM 0 HB3 SER A 58 25.686 4.626 -13.210 1.00 0.00 H new ATOM 0 HG SER A 58 27.977 4.245 -13.163 1.00 0.00 H new ATOM 874 N GLY A 59 24.026 4.061 -10.658 1.00 0.00 N ATOM 875 CA GLY A 59 23.648 4.541 -9.319 1.00 0.00 C ATOM 876 C GLY A 59 22.593 3.693 -8.588 1.00 0.00 C ATOM 877 O GLY A 59 22.133 4.093 -7.516 1.00 0.00 O ATOM 0 H GLY A 59 23.431 4.438 -11.395 1.00 0.00 H new ATOM 0 HA2 GLY A 59 24.545 4.586 -8.701 1.00 0.00 H new ATOM 0 HA3 GLY A 59 23.272 5.560 -9.410 1.00 0.00 H new ATOM 881 N GLN A 60 22.166 2.556 -9.155 1.00 0.00 N ATOM 882 CA GLN A 60 21.054 1.739 -8.645 1.00 0.00 C ATOM 883 C GLN A 60 21.518 0.704 -7.596 1.00 0.00 C ATOM 884 O GLN A 60 22.643 0.205 -7.658 1.00 0.00 O ATOM 885 CB GLN A 60 20.328 1.099 -9.845 1.00 0.00 C ATOM 886 CG GLN A 60 18.934 0.560 -9.487 1.00 0.00 C ATOM 887 CD GLN A 60 18.197 -0.005 -10.695 1.00 0.00 C ATOM 888 OE1 GLN A 60 18.260 -1.187 -10.993 1.00 0.00 O ATOM 889 NE2 GLN A 60 17.493 0.797 -11.462 1.00 0.00 N ATOM 0 H GLN A 60 22.592 2.170 -9.998 1.00 0.00 H new ATOM 0 HA GLN A 60 20.350 2.376 -8.109 1.00 0.00 H new ATOM 0 HB2 GLN A 60 20.232 1.838 -10.641 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.936 0.284 -10.238 1.00 0.00 H new ATOM 0 HG2 GLN A 60 19.033 -0.218 -8.730 1.00 0.00 H new ATOM 0 HG3 GLN A 60 18.341 1.361 -9.046 1.00 0.00 H new ATOM 0 HE21 GLN A 60 17.424 1.789 -11.235 1.00 0.00 H new ATOM 0 HE22 GLN A 60 17.015 0.427 -12.284 1.00 0.00 H new ATOM 898 N THR A 61 20.651 0.364 -6.630 1.00 0.00 N ATOM 899 CA THR A 61 20.967 -0.608 -5.562 1.00 0.00 C ATOM 900 C THR A 61 20.931 -2.062 -6.039 1.00 0.00 C ATOM 901 O THR A 61 20.244 -2.395 -7.005 1.00 0.00 O ATOM 902 CB THR A 61 20.052 -0.418 -4.344 1.00 0.00 C ATOM 903 OG1 THR A 61 20.612 -1.083 -3.230 1.00 0.00 O ATOM 904 CG2 THR A 61 18.617 -0.920 -4.527 1.00 0.00 C ATOM 0 H THR A 61 19.710 0.753 -6.564 1.00 0.00 H new ATOM 0 HA THR A 61 21.995 -0.400 -5.265 1.00 0.00 H new ATOM 0 HB THR A 61 19.988 0.660 -4.198 1.00 0.00 H new ATOM 0 HG1 THR A 61 20.031 -0.962 -2.450 1.00 0.00 H new ATOM 0 HG21 THR A 61 18.050 -0.742 -3.613 1.00 0.00 H new ATOM 0 HG22 THR A 61 18.148 -0.388 -5.355 1.00 0.00 H new ATOM 0 HG23 THR A 61 18.630 -1.988 -4.743 1.00 0.00 H new ATOM 912 N SER A 62 21.630 -2.947 -5.332 1.00 0.00 N ATOM 913 CA SER A 62 21.557 -4.400 -5.491 1.00 0.00 C ATOM 914 C SER A 62 21.580 -5.079 -4.109 1.00 0.00 C ATOM 915 O SER A 62 22.083 -4.514 -3.134 1.00 0.00 O ATOM 916 CB SER A 62 22.706 -4.916 -6.363 1.00 0.00 C ATOM 917 OG SER A 62 23.969 -4.641 -5.772 1.00 0.00 O ATOM 0 H SER A 62 22.287 -2.663 -4.606 1.00 0.00 H new ATOM 0 HA SER A 62 20.621 -4.647 -5.993 1.00 0.00 H new ATOM 0 HB2 SER A 62 22.598 -5.990 -6.511 1.00 0.00 H new ATOM 0 HB3 SER A 62 22.654 -4.452 -7.348 1.00 0.00 H new ATOM 0 HG SER A 62 24.682 -4.983 -6.350 1.00 0.00 H new ATOM 923 N ASP A 63 21.022 -6.287 -4.005 1.00 0.00 N ATOM 924 CA ASP A 63 20.868 -7.025 -2.742 1.00 0.00 C ATOM 925 C ASP A 63 20.987 -8.551 -2.956 1.00 0.00 C ATOM 926 O ASP A 63 20.662 -9.025 -4.054 1.00 0.00 O ATOM 927 CB ASP A 63 19.516 -6.656 -2.096 1.00 0.00 C ATOM 928 CG ASP A 63 19.625 -6.571 -0.564 1.00 0.00 C ATOM 929 OD1 ASP A 63 20.272 -5.626 -0.056 1.00 0.00 O ATOM 930 OD2 ASP A 63 19.062 -7.432 0.148 1.00 0.00 O ATOM 0 H ASP A 63 20.656 -6.793 -4.811 1.00 0.00 H new ATOM 0 HA ASP A 63 21.676 -6.738 -2.069 1.00 0.00 H new ATOM 0 HB2 ASP A 63 19.173 -5.700 -2.491 1.00 0.00 H new ATOM 0 HB3 ASP A 63 18.767 -7.400 -2.367 1.00 0.00 H new ATOM 935 N PRO A 64 21.472 -9.328 -1.965 1.00 0.00 N ATOM 936 CA PRO A 64 21.506 -10.791 -2.024 1.00 0.00 C ATOM 937 C PRO A 64 20.201 -11.405 -1.478 1.00 0.00 C ATOM 938 O PRO A 64 19.570 -10.879 -0.556 1.00 0.00 O ATOM 939 CB PRO A 64 22.699 -11.213 -1.157 1.00 0.00 C ATOM 940 CG PRO A 64 22.718 -10.128 -0.084 1.00 0.00 C ATOM 941 CD PRO A 64 22.231 -8.868 -0.806 1.00 0.00 C ATOM 0 HA PRO A 64 21.604 -11.140 -3.052 1.00 0.00 H new ATOM 0 HB2 PRO A 64 22.560 -12.206 -0.729 1.00 0.00 H new ATOM 0 HB3 PRO A 64 23.628 -11.238 -1.727 1.00 0.00 H new ATOM 0 HG2 PRO A 64 22.066 -10.384 0.751 1.00 0.00 H new ATOM 0 HG3 PRO A 64 23.719 -9.990 0.324 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.608 -8.260 -0.150 1.00 0.00 H new ATOM 0 HD3 PRO A 64 23.072 -8.246 -1.114 1.00 0.00 H new ATOM 949 N ILE A 65 19.860 -12.598 -1.966 1.00 0.00 N ATOM 950 CA ILE A 65 18.628 -13.341 -1.624 1.00 0.00 C ATOM 951 C ILE A 65 18.477 -13.695 -0.127 1.00 0.00 C ATOM 952 O ILE A 65 17.364 -13.926 0.334 1.00 0.00 O ATOM 953 CB ILE A 65 18.548 -14.591 -2.532 1.00 0.00 C ATOM 954 CG1 ILE A 65 17.167 -15.269 -2.612 1.00 0.00 C ATOM 955 CG2 ILE A 65 19.587 -15.655 -2.133 1.00 0.00 C ATOM 956 CD1 ILE A 65 16.110 -14.360 -3.245 1.00 0.00 C ATOM 0 H ILE A 65 20.448 -13.098 -2.633 1.00 0.00 H new ATOM 0 HA ILE A 65 17.782 -12.679 -1.810 1.00 0.00 H new ATOM 0 HB ILE A 65 18.760 -14.188 -3.522 1.00 0.00 H new ATOM 0 HG12 ILE A 65 17.249 -16.187 -3.193 1.00 0.00 H new ATOM 0 HG13 ILE A 65 16.846 -15.553 -1.610 1.00 0.00 H new ATOM 0 HG21 ILE A 65 19.498 -16.517 -2.795 1.00 0.00 H new ATOM 0 HG22 ILE A 65 20.589 -15.235 -2.217 1.00 0.00 H new ATOM 0 HG23 ILE A 65 19.410 -15.968 -1.104 1.00 0.00 H new ATOM 0 HD11 ILE A 65 15.154 -14.883 -3.279 1.00 0.00 H new ATOM 0 HD12 ILE A 65 16.007 -13.453 -2.650 1.00 0.00 H new ATOM 0 HD13 ILE A 65 16.416 -14.097 -4.258 1.00 0.00 H new ATOM 968 N GLU A 66 19.576 -13.725 0.638 1.00 0.00 N ATOM 969 CA GLU A 66 19.565 -14.042 2.080 1.00 0.00 C ATOM 970 C GLU A 66 19.576 -12.801 2.997 1.00 0.00 C ATOM 971 O GLU A 66 19.371 -12.937 4.205 1.00 0.00 O ATOM 972 CB GLU A 66 20.723 -14.995 2.419 1.00 0.00 C ATOM 973 CG GLU A 66 20.631 -16.327 1.664 1.00 0.00 C ATOM 974 CD GLU A 66 21.662 -17.333 2.214 1.00 0.00 C ATOM 975 OE1 GLU A 66 22.833 -17.326 1.759 1.00 0.00 O ATOM 976 OE2 GLU A 66 21.314 -18.151 3.104 1.00 0.00 O ATOM 0 H GLU A 66 20.508 -13.529 0.274 1.00 0.00 H new ATOM 0 HA GLU A 66 18.614 -14.536 2.280 1.00 0.00 H new ATOM 0 HB2 GLU A 66 21.669 -14.510 2.179 1.00 0.00 H new ATOM 0 HB3 GLU A 66 20.727 -15.189 3.492 1.00 0.00 H new ATOM 0 HG2 GLU A 66 19.626 -16.738 1.761 1.00 0.00 H new ATOM 0 HG3 GLU A 66 20.807 -16.162 0.601 1.00 0.00 H new ATOM 983 N ASN A 67 19.780 -11.590 2.449 1.00 0.00 N ATOM 984 CA ASN A 67 19.646 -10.334 3.203 1.00 0.00 C ATOM 985 C ASN A 67 18.228 -9.755 3.090 1.00 0.00 C ATOM 986 O ASN A 67 17.695 -9.237 4.075 1.00 0.00 O ATOM 987 CB ASN A 67 20.681 -9.319 2.710 1.00 0.00 C ATOM 988 CG ASN A 67 20.562 -7.986 3.428 1.00 0.00 C ATOM 989 OD1 ASN A 67 20.947 -7.832 4.579 1.00 0.00 O ATOM 990 ND2 ASN A 67 20.013 -6.994 2.772 1.00 0.00 N ATOM 0 H ASN A 67 20.042 -11.456 1.472 1.00 0.00 H new ATOM 0 HA ASN A 67 19.827 -10.550 4.256 1.00 0.00 H new ATOM 0 HB2 ASN A 67 21.683 -9.722 2.859 1.00 0.00 H new ATOM 0 HB3 ASN A 67 20.555 -9.165 1.638 1.00 0.00 H new ATOM 0 HD21 ASN A 67 19.904 -6.084 3.221 1.00 0.00 H new ATOM 0 HD22 ASN A 67 19.695 -7.131 1.813 1.00 0.00 H new ATOM 997 N PHE A 68 17.613 -9.849 1.906 1.00 0.00 N ATOM 998 CA PHE A 68 16.234 -9.416 1.704 1.00 0.00 C ATOM 999 C PHE A 68 15.244 -10.354 2.424 1.00 0.00 C ATOM 1000 O PHE A 68 15.560 -11.505 2.735 1.00 0.00 O ATOM 1001 CB PHE A 68 15.949 -9.221 0.201 1.00 0.00 C ATOM 1002 CG PHE A 68 14.707 -9.902 -0.335 1.00 0.00 C ATOM 1003 CD1 PHE A 68 14.771 -11.238 -0.764 1.00 0.00 C ATOM 1004 CD2 PHE A 68 13.487 -9.204 -0.391 1.00 0.00 C ATOM 1005 CE1 PHE A 68 13.628 -11.861 -1.292 1.00 0.00 C ATOM 1006 CE2 PHE A 68 12.348 -9.825 -0.923 1.00 0.00 C ATOM 1007 CZ PHE A 68 12.420 -11.148 -1.390 1.00 0.00 C ATOM 0 H PHE A 68 18.057 -10.225 1.068 1.00 0.00 H new ATOM 0 HA PHE A 68 16.086 -8.440 2.167 1.00 0.00 H new ATOM 0 HB2 PHE A 68 15.867 -8.152 0.003 1.00 0.00 H new ATOM 0 HB3 PHE A 68 16.809 -9.584 -0.361 1.00 0.00 H new ATOM 0 HD1 PHE A 68 15.699 -11.786 -0.688 1.00 0.00 H new ATOM 0 HD2 PHE A 68 13.428 -8.190 -0.024 1.00 0.00 H new ATOM 0 HE1 PHE A 68 13.677 -12.888 -1.623 1.00 0.00 H new ATOM 0 HE2 PHE A 68 11.414 -9.285 -0.974 1.00 0.00 H new ATOM 0 HZ PHE A 68 11.549 -11.617 -1.824 1.00 0.00 H new ATOM 1017 N ASN A 69 14.042 -9.842 2.696 1.00 0.00 N ATOM 1018 CA ASN A 69 12.962 -10.562 3.364 1.00 0.00 C ATOM 1019 C ASN A 69 11.629 -10.249 2.666 1.00 0.00 C ATOM 1020 O ASN A 69 11.170 -9.110 2.712 1.00 0.00 O ATOM 1021 CB ASN A 69 13.020 -10.153 4.850 1.00 0.00 C ATOM 1022 CG ASN A 69 11.774 -10.517 5.634 1.00 0.00 C ATOM 1023 OD1 ASN A 69 10.759 -9.687 5.559 1.00 0.00 O flip ATOM 1024 ND2 ASN A 69 11.698 -11.529 6.314 1.00 0.00 N flip ATOM 0 H ASN A 69 13.788 -8.886 2.449 1.00 0.00 H new ATOM 0 HA ASN A 69 13.063 -11.646 3.306 1.00 0.00 H new ATOM 0 HB2 ASN A 69 13.883 -10.630 5.315 1.00 0.00 H new ATOM 0 HB3 ASN A 69 13.177 -9.076 4.915 1.00 0.00 H new ATOM 0 HD21 ASN A 69 12.491 -12.169 6.367 1.00 0.00 H new ATOM 0 HD22 ASN A 69 10.842 -11.734 6.829 1.00 0.00 H new ATOM 1031 N ALA A 70 10.979 -11.244 2.059 1.00 0.00 N ATOM 1032 CA ALA A 70 9.819 -11.039 1.178 1.00 0.00 C ATOM 1033 C ALA A 70 8.507 -10.569 1.845 1.00 0.00 C ATOM 1034 O ALA A 70 7.514 -10.373 1.149 1.00 0.00 O ATOM 1035 CB ALA A 70 9.583 -12.318 0.367 1.00 0.00 C ATOM 0 H ALA A 70 11.242 -12.224 2.164 1.00 0.00 H new ATOM 0 HA ALA A 70 10.090 -10.194 0.545 1.00 0.00 H new ATOM 0 HB1 ALA A 70 8.725 -12.179 -0.291 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.467 -12.538 -0.232 1.00 0.00 H new ATOM 0 HB3 ALA A 70 9.389 -13.149 1.046 1.00 0.00 H new ATOM 1041 N ASP A 71 8.471 -10.366 3.164 1.00 0.00 N ATOM 1042 CA ASP A 71 7.209 -10.083 3.876 1.00 0.00 C ATOM 1043 C ASP A 71 6.648 -8.687 3.541 1.00 0.00 C ATOM 1044 O ASP A 71 5.433 -8.482 3.528 1.00 0.00 O ATOM 1045 CB ASP A 71 7.419 -10.230 5.387 1.00 0.00 C ATOM 1046 CG ASP A 71 6.089 -10.161 6.156 1.00 0.00 C ATOM 1047 OD1 ASP A 71 5.266 -11.100 6.027 1.00 0.00 O ATOM 1048 OD2 ASP A 71 5.878 -9.190 6.921 1.00 0.00 O ATOM 0 H ASP A 71 9.295 -10.391 3.765 1.00 0.00 H new ATOM 0 HA ASP A 71 6.470 -10.810 3.539 1.00 0.00 H new ATOM 0 HB2 ASP A 71 7.911 -11.180 5.595 1.00 0.00 H new ATOM 0 HB3 ASP A 71 8.085 -9.442 5.740 1.00 0.00 H new ATOM 1053 N ASP A 72 7.537 -7.740 3.215 1.00 0.00 N ATOM 1054 CA ASP A 72 7.197 -6.380 2.778 1.00 0.00 C ATOM 1055 C ASP A 72 6.968 -6.273 1.248 1.00 0.00 C ATOM 1056 O ASP A 72 6.642 -5.200 0.740 1.00 0.00 O ATOM 1057 CB ASP A 72 8.309 -5.443 3.270 1.00 0.00 C ATOM 1058 CG ASP A 72 7.897 -3.960 3.338 1.00 0.00 C ATOM 1059 OD1 ASP A 72 6.746 -3.642 3.728 1.00 0.00 O ATOM 1060 OD2 ASP A 72 8.767 -3.095 3.079 1.00 0.00 O ATOM 0 H ASP A 72 8.543 -7.904 3.249 1.00 0.00 H new ATOM 0 HA ASP A 72 6.241 -6.088 3.214 1.00 0.00 H new ATOM 0 HB2 ASP A 72 8.630 -5.766 4.261 1.00 0.00 H new ATOM 0 HB3 ASP A 72 9.170 -5.540 2.609 1.00 0.00 H new ATOM 1065 N TYR A 73 7.156 -7.378 0.509 1.00 0.00 N ATOM 1066 CA TYR A 73 7.158 -7.448 -0.956 1.00 0.00 C ATOM 1067 C TYR A 73 6.131 -8.492 -1.421 1.00 0.00 C ATOM 1068 O TYR A 73 6.462 -9.643 -1.710 1.00 0.00 O ATOM 1069 CB TYR A 73 8.575 -7.744 -1.488 1.00 0.00 C ATOM 1070 CG TYR A 73 9.668 -6.864 -0.913 1.00 0.00 C ATOM 1071 CD1 TYR A 73 10.222 -7.209 0.332 1.00 0.00 C ATOM 1072 CD2 TYR A 73 10.121 -5.714 -1.587 1.00 0.00 C ATOM 1073 CE1 TYR A 73 11.216 -6.417 0.924 1.00 0.00 C ATOM 1074 CE2 TYR A 73 11.081 -4.884 -0.977 1.00 0.00 C ATOM 1075 CZ TYR A 73 11.638 -5.234 0.276 1.00 0.00 C ATOM 1076 OH TYR A 73 12.581 -4.431 0.843 1.00 0.00 O ATOM 0 H TYR A 73 7.318 -8.288 0.940 1.00 0.00 H new ATOM 0 HA TYR A 73 6.866 -6.482 -1.368 1.00 0.00 H new ATOM 0 HB2 TYR A 73 8.817 -8.785 -1.276 1.00 0.00 H new ATOM 0 HB3 TYR A 73 8.571 -7.632 -2.572 1.00 0.00 H new ATOM 0 HD1 TYR A 73 9.877 -8.097 0.840 1.00 0.00 H new ATOM 0 HD2 TYR A 73 9.735 -5.470 -2.566 1.00 0.00 H new ATOM 0 HE1 TYR A 73 11.655 -6.708 1.867 1.00 0.00 H new ATOM 0 HE2 TYR A 73 11.394 -3.975 -1.468 1.00 0.00 H new ATOM 0 HH TYR A 73 12.750 -3.663 0.259 1.00 0.00 H new ATOM 1086 N ASP A 74 4.861 -8.082 -1.510 1.00 0.00 N ATOM 1087 CA ASP A 74 3.739 -8.946 -1.915 1.00 0.00 C ATOM 1088 C ASP A 74 3.927 -9.582 -3.309 1.00 0.00 C ATOM 1089 O ASP A 74 3.274 -10.574 -3.635 1.00 0.00 O ATOM 1090 CB ASP A 74 2.442 -8.121 -1.913 1.00 0.00 C ATOM 1091 CG ASP A 74 2.140 -7.511 -0.535 1.00 0.00 C ATOM 1092 OD1 ASP A 74 1.548 -8.210 0.320 1.00 0.00 O ATOM 1093 OD2 ASP A 74 2.493 -6.328 -0.317 1.00 0.00 O ATOM 0 H ASP A 74 4.576 -7.125 -1.300 1.00 0.00 H new ATOM 0 HA ASP A 74 3.693 -9.763 -1.195 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.521 -7.323 -2.652 1.00 0.00 H new ATOM 0 HB3 ASP A 74 1.610 -8.756 -2.217 1.00 0.00 H new ATOM 1098 N VAL A 75 4.816 -9.012 -4.130 1.00 0.00 N ATOM 1099 CA VAL A 75 5.094 -9.432 -5.502 1.00 0.00 C ATOM 1100 C VAL A 75 6.571 -9.810 -5.643 1.00 0.00 C ATOM 1101 O VAL A 75 7.438 -8.941 -5.554 1.00 0.00 O ATOM 1102 CB VAL A 75 4.706 -8.297 -6.464 1.00 0.00 C ATOM 1103 CG1 VAL A 75 4.854 -8.744 -7.914 1.00 0.00 C ATOM 1104 CG2 VAL A 75 3.263 -7.808 -6.255 1.00 0.00 C ATOM 0 H VAL A 75 5.382 -8.214 -3.842 1.00 0.00 H new ATOM 0 HA VAL A 75 4.503 -10.313 -5.752 1.00 0.00 H new ATOM 0 HB VAL A 75 5.386 -7.474 -6.245 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.574 -7.926 -8.577 1.00 0.00 H new ATOM 0 HG12 VAL A 75 5.889 -9.027 -8.104 1.00 0.00 H new ATOM 0 HG13 VAL A 75 4.204 -9.599 -8.099 1.00 0.00 H new ATOM 0 HG21 VAL A 75 3.044 -7.007 -6.961 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.571 -8.635 -6.419 1.00 0.00 H new ATOM 0 HG23 VAL A 75 3.149 -7.436 -5.237 1.00 0.00 H new ATOM 1114 N VAL A 76 6.883 -11.084 -5.898 1.00 0.00 N ATOM 1115 CA VAL A 76 8.268 -11.563 -6.090 1.00 0.00 C ATOM 1116 C VAL A 76 8.380 -12.338 -7.396 1.00 0.00 C ATOM 1117 O VAL A 76 7.538 -13.179 -7.680 1.00 0.00 O ATOM 1118 CB VAL A 76 8.771 -12.415 -4.912 1.00 0.00 C ATOM 1119 CG1 VAL A 76 10.258 -12.760 -5.095 1.00 0.00 C ATOM 1120 CG2 VAL A 76 8.621 -11.691 -3.568 1.00 0.00 C ATOM 0 H VAL A 76 6.183 -11.821 -5.979 1.00 0.00 H new ATOM 0 HA VAL A 76 8.908 -10.682 -6.135 1.00 0.00 H new ATOM 0 HB VAL A 76 8.160 -13.318 -4.902 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.598 -13.363 -4.253 1.00 0.00 H new ATOM 0 HG12 VAL A 76 10.390 -13.321 -6.020 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.842 -11.841 -5.142 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.989 -12.332 -2.767 1.00 0.00 H new ATOM 0 HG22 VAL A 76 9.197 -10.766 -3.587 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.570 -11.460 -3.394 1.00 0.00 H new ATOM 1130 N ILE A 77 9.405 -12.075 -8.207 1.00 0.00 N ATOM 1131 CA ILE A 77 9.496 -12.595 -9.580 1.00 0.00 C ATOM 1132 C ILE A 77 10.842 -13.268 -9.827 1.00 0.00 C ATOM 1133 O ILE A 77 11.885 -12.689 -9.539 1.00 0.00 O ATOM 1134 CB ILE A 77 9.283 -11.440 -10.580 1.00 0.00 C ATOM 1135 CG1 ILE A 77 8.062 -10.542 -10.270 1.00 0.00 C ATOM 1136 CG2 ILE A 77 9.184 -11.967 -12.017 1.00 0.00 C ATOM 1137 CD1 ILE A 77 6.699 -11.254 -10.322 1.00 0.00 C ATOM 0 H ILE A 77 10.199 -11.495 -7.934 1.00 0.00 H new ATOM 0 HA ILE A 77 8.719 -13.347 -9.720 1.00 0.00 H new ATOM 0 HB ILE A 77 10.165 -10.809 -10.471 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.191 -10.110 -9.278 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.050 -9.714 -10.979 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.034 -11.132 -12.701 1.00 0.00 H new ATOM 0 HG22 ILE A 77 10.105 -12.489 -12.277 1.00 0.00 H new ATOM 0 HG23 ILE A 77 8.343 -12.656 -12.095 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.907 -10.541 -10.091 1.00 0.00 H new ATOM 0 HD12 ILE A 77 6.540 -11.662 -11.320 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.683 -12.063 -9.592 1.00 0.00 H new ATOM 1149 N SER A 78 10.820 -14.456 -10.422 1.00 0.00 N ATOM 1150 CA SER A 78 11.991 -15.209 -10.874 1.00 0.00 C ATOM 1151 C SER A 78 12.306 -14.898 -12.341 1.00 0.00 C ATOM 1152 O SER A 78 11.491 -15.138 -13.229 1.00 0.00 O ATOM 1153 CB SER A 78 11.680 -16.686 -10.660 1.00 0.00 C ATOM 1154 OG SER A 78 12.573 -17.524 -11.342 1.00 0.00 O ATOM 0 H SER A 78 9.946 -14.945 -10.612 1.00 0.00 H new ATOM 0 HA SER A 78 12.880 -14.929 -10.308 1.00 0.00 H new ATOM 0 HB2 SER A 78 11.716 -16.911 -9.594 1.00 0.00 H new ATOM 0 HB3 SER A 78 10.664 -16.893 -10.995 1.00 0.00 H new ATOM 0 HG SER A 78 12.070 -18.156 -11.896 1.00 0.00 H new ATOM 1160 N LEU A 79 13.498 -14.362 -12.618 1.00 0.00 N ATOM 1161 CA LEU A 79 13.990 -13.975 -13.953 1.00 0.00 C ATOM 1162 C LEU A 79 14.999 -15.008 -14.501 1.00 0.00 C ATOM 1163 O LEU A 79 15.881 -14.682 -15.287 1.00 0.00 O ATOM 1164 CB LEU A 79 14.509 -12.514 -13.916 1.00 0.00 C ATOM 1165 CG LEU A 79 13.484 -11.359 -13.878 1.00 0.00 C ATOM 1166 CD1 LEU A 79 12.230 -11.616 -13.070 1.00 0.00 C ATOM 1167 CD2 LEU A 79 14.148 -10.130 -13.293 1.00 0.00 C ATOM 0 H LEU A 79 14.183 -14.175 -11.885 1.00 0.00 H new ATOM 0 HA LEU A 79 13.171 -13.988 -14.672 1.00 0.00 H new ATOM 0 HB2 LEU A 79 15.151 -12.414 -13.041 1.00 0.00 H new ATOM 0 HB3 LEU A 79 15.140 -12.366 -14.792 1.00 0.00 H new ATOM 0 HG LEU A 79 13.168 -11.236 -14.914 1.00 0.00 H new ATOM 0 HD11 LEU A 79 11.583 -10.740 -13.113 1.00 0.00 H new ATOM 0 HD12 LEU A 79 11.703 -12.477 -13.481 1.00 0.00 H new ATOM 0 HD13 LEU A 79 12.500 -11.817 -12.033 1.00 0.00 H new ATOM 0 HD21 LEU A 79 13.432 -9.309 -13.262 1.00 0.00 H new ATOM 0 HD22 LEU A 79 14.493 -10.349 -12.282 1.00 0.00 H new ATOM 0 HD23 LEU A 79 14.999 -9.846 -13.913 1.00 0.00 H new ATOM 1179 N CYS A 80 14.872 -16.266 -14.080 1.00 0.00 N ATOM 1180 CA CYS A 80 15.571 -17.440 -14.616 1.00 0.00 C ATOM 1181 C CYS A 80 14.653 -18.678 -14.535 1.00 0.00 C ATOM 1182 O CYS A 80 13.572 -18.602 -13.962 1.00 0.00 O ATOM 1183 CB CYS A 80 16.915 -17.639 -13.872 1.00 0.00 C ATOM 1184 SG CYS A 80 17.056 -17.305 -12.084 1.00 0.00 S ATOM 0 H CYS A 80 14.245 -16.510 -13.314 1.00 0.00 H new ATOM 0 HA CYS A 80 15.809 -17.287 -15.669 1.00 0.00 H new ATOM 0 HB2 CYS A 80 17.216 -18.675 -14.028 1.00 0.00 H new ATOM 0 HB3 CYS A 80 17.653 -17.013 -14.373 1.00 0.00 H new ATOM 0 HG CYS A 80 18.272 -17.546 -11.692 1.00 0.00 H new ATOM 1243 N LEU A 86 14.413 -21.322 -5.278 1.00 0.00 N ATOM 1244 CA LEU A 86 14.375 -20.204 -4.324 1.00 0.00 C ATOM 1245 C LEU A 86 13.838 -20.657 -2.944 1.00 0.00 C ATOM 1246 O LEU A 86 13.118 -21.661 -2.876 1.00 0.00 O ATOM 1247 CB LEU A 86 13.512 -19.057 -4.896 1.00 0.00 C ATOM 1248 CG LEU A 86 13.957 -18.498 -6.261 1.00 0.00 C ATOM 1249 CD1 LEU A 86 13.070 -17.311 -6.630 1.00 0.00 C ATOM 1250 CD2 LEU A 86 15.412 -18.031 -6.262 1.00 0.00 C ATOM 0 HA LEU A 86 15.393 -19.844 -4.176 1.00 0.00 H new ATOM 0 HB2 LEU A 86 12.485 -19.411 -4.987 1.00 0.00 H new ATOM 0 HB3 LEU A 86 13.504 -18.239 -4.175 1.00 0.00 H new ATOM 0 HG LEU A 86 13.864 -19.308 -6.985 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.380 -16.911 -7.595 1.00 0.00 H new ATOM 0 HD12 LEU A 86 12.032 -17.637 -6.689 1.00 0.00 H new ATOM 0 HD13 LEU A 86 13.164 -16.536 -5.869 1.00 0.00 H new ATOM 0 HD21 LEU A 86 15.670 -17.647 -7.249 1.00 0.00 H new ATOM 0 HD22 LEU A 86 15.542 -17.242 -5.521 1.00 0.00 H new ATOM 0 HD23 LEU A 86 16.064 -18.870 -6.017 1.00 0.00 H new ATOM 1262 N PRO A 87 14.122 -19.919 -1.849 1.00 0.00 N ATOM 1263 CA PRO A 87 13.529 -20.188 -0.536 1.00 0.00 C ATOM 1264 C PRO A 87 11.990 -20.137 -0.590 1.00 0.00 C ATOM 1265 O PRO A 87 11.448 -19.235 -1.235 1.00 0.00 O ATOM 1266 CB PRO A 87 14.111 -19.130 0.413 1.00 0.00 C ATOM 1267 CG PRO A 87 15.426 -18.745 -0.263 1.00 0.00 C ATOM 1268 CD PRO A 87 15.064 -18.814 -1.745 1.00 0.00 C ATOM 0 HA PRO A 87 13.768 -21.193 -0.189 1.00 0.00 H new ATOM 0 HB2 PRO A 87 13.446 -18.273 0.518 1.00 0.00 H new ATOM 0 HB3 PRO A 87 14.274 -19.532 1.413 1.00 0.00 H new ATOM 0 HG2 PRO A 87 15.756 -17.748 0.029 1.00 0.00 H new ATOM 0 HG3 PRO A 87 16.231 -19.435 -0.009 1.00 0.00 H new ATOM 0 HD2 PRO A 87 14.617 -17.880 -2.086 1.00 0.00 H new ATOM 0 HD3 PRO A 87 15.947 -18.988 -2.360 1.00 0.00 H new ATOM 1276 N PRO A 88 11.265 -21.055 0.079 1.00 0.00 N ATOM 1277 CA PRO A 88 9.817 -21.197 -0.100 1.00 0.00 C ATOM 1278 C PRO A 88 9.045 -19.945 0.330 1.00 0.00 C ATOM 1279 O PRO A 88 8.140 -19.511 -0.376 1.00 0.00 O ATOM 1280 CB PRO A 88 9.424 -22.449 0.697 1.00 0.00 C ATOM 1281 CG PRO A 88 10.541 -22.598 1.731 1.00 0.00 C ATOM 1282 CD PRO A 88 11.767 -22.079 0.985 1.00 0.00 C ATOM 0 HA PRO A 88 9.557 -21.309 -1.152 1.00 0.00 H new ATOM 0 HB2 PRO A 88 8.452 -22.329 1.175 1.00 0.00 H new ATOM 0 HB3 PRO A 88 9.357 -23.326 0.054 1.00 0.00 H new ATOM 0 HG2 PRO A 88 10.339 -22.016 2.630 1.00 0.00 H new ATOM 0 HG3 PRO A 88 10.667 -23.635 2.043 1.00 0.00 H new ATOM 0 HD2 PRO A 88 12.502 -21.666 1.676 1.00 0.00 H new ATOM 0 HD3 PRO A 88 12.261 -22.881 0.436 1.00 0.00 H new ATOM 1290 N GLU A 89 9.453 -19.282 1.412 1.00 0.00 N ATOM 1291 CA GLU A 89 8.823 -18.034 1.868 1.00 0.00 C ATOM 1292 C GLU A 89 9.052 -16.843 0.915 1.00 0.00 C ATOM 1293 O GLU A 89 8.222 -15.931 0.869 1.00 0.00 O ATOM 1294 CB GLU A 89 9.213 -17.740 3.327 1.00 0.00 C ATOM 1295 CG GLU A 89 10.722 -17.773 3.627 1.00 0.00 C ATOM 1296 CD GLU A 89 11.007 -17.602 5.138 1.00 0.00 C ATOM 1297 OE1 GLU A 89 10.463 -16.674 5.786 1.00 0.00 O ATOM 1298 OE2 GLU A 89 11.778 -18.422 5.700 1.00 0.00 O ATOM 0 H GLU A 89 10.228 -19.591 1.999 1.00 0.00 H new ATOM 0 HA GLU A 89 7.744 -18.183 1.842 1.00 0.00 H new ATOM 0 HB2 GLU A 89 8.828 -16.757 3.597 1.00 0.00 H new ATOM 0 HB3 GLU A 89 8.716 -18.465 3.971 1.00 0.00 H new ATOM 0 HG2 GLU A 89 11.141 -18.718 3.282 1.00 0.00 H new ATOM 0 HG3 GLU A 89 11.222 -16.980 3.070 1.00 0.00 H new ATOM 1305 N TRP A 90 10.113 -16.846 0.093 1.00 0.00 N ATOM 1306 CA TRP A 90 10.292 -15.868 -0.993 1.00 0.00 C ATOM 1307 C TRP A 90 9.442 -16.194 -2.245 1.00 0.00 C ATOM 1308 O TRP A 90 9.316 -15.355 -3.133 1.00 0.00 O ATOM 1309 CB TRP A 90 11.786 -15.711 -1.327 1.00 0.00 C ATOM 1310 CG TRP A 90 12.740 -15.347 -0.216 1.00 0.00 C ATOM 1311 CD1 TRP A 90 14.078 -15.401 -0.377 1.00 0.00 C ATOM 1312 CD2 TRP A 90 12.537 -14.884 1.171 1.00 0.00 C ATOM 1313 NE1 TRP A 90 14.714 -15.006 0.775 1.00 0.00 N ATOM 1314 CE2 TRP A 90 13.821 -14.719 1.777 1.00 0.00 C ATOM 1315 CE3 TRP A 90 11.429 -14.587 2.002 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 13.997 -14.336 3.113 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 11.587 -14.208 3.351 1.00 0.00 C ATOM 1318 CH2 TRP A 90 12.869 -14.099 3.914 1.00 0.00 C ATOM 0 H TRP A 90 10.871 -17.526 0.162 1.00 0.00 H new ATOM 0 HA TRP A 90 9.919 -14.908 -0.635 1.00 0.00 H new ATOM 0 HB2 TRP A 90 12.128 -16.650 -1.763 1.00 0.00 H new ATOM 0 HB3 TRP A 90 11.874 -14.949 -2.102 1.00 0.00 H new ATOM 0 HD1 TRP A 90 14.578 -15.711 -1.283 1.00 0.00 H new ATOM 0 HE1 TRP A 90 15.727 -14.935 0.874 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.433 -14.653 1.590 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 14.990 -14.224 3.522 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 10.716 -14.000 3.955 1.00 0.00 H new ATOM 0 HH2 TRP A 90 12.986 -13.835 4.955 1.00 0.00 H new ATOM 1329 N VAL A 91 8.815 -17.377 -2.303 1.00 0.00 N ATOM 1330 CA VAL A 91 7.926 -17.846 -3.380 1.00 0.00 C ATOM 1331 C VAL A 91 6.449 -17.704 -2.991 1.00 0.00 C ATOM 1332 O VAL A 91 5.648 -17.257 -3.805 1.00 0.00 O ATOM 1333 CB VAL A 91 8.272 -19.305 -3.756 1.00 0.00 C ATOM 1334 CG1 VAL A 91 7.253 -19.944 -4.708 1.00 0.00 C ATOM 1335 CG2 VAL A 91 9.657 -19.384 -4.406 1.00 0.00 C ATOM 0 H VAL A 91 8.918 -18.070 -1.562 1.00 0.00 H new ATOM 0 HA VAL A 91 8.086 -17.217 -4.256 1.00 0.00 H new ATOM 0 HB VAL A 91 8.253 -19.861 -2.819 1.00 0.00 H new ATOM 0 HG11 VAL A 91 7.556 -20.967 -4.931 1.00 0.00 H new ATOM 0 HG12 VAL A 91 6.270 -19.951 -4.237 1.00 0.00 H new ATOM 0 HG13 VAL A 91 7.208 -19.369 -5.633 1.00 0.00 H new ATOM 0 HG21 VAL A 91 9.880 -20.420 -4.662 1.00 0.00 H new ATOM 0 HG22 VAL A 91 9.670 -18.775 -5.310 1.00 0.00 H new ATOM 0 HG23 VAL A 91 10.408 -19.013 -3.708 1.00 0.00 H new ATOM 1345 N THR A 92 6.064 -18.027 -1.753 1.00 0.00 N ATOM 1346 CA THR A 92 4.653 -18.089 -1.301 1.00 0.00 C ATOM 1347 C THR A 92 4.024 -16.726 -0.949 1.00 0.00 C ATOM 1348 O THR A 92 3.109 -16.634 -0.129 1.00 0.00 O ATOM 1349 CB THR A 92 4.480 -19.127 -0.176 1.00 0.00 C ATOM 1350 OG1 THR A 92 5.336 -18.831 0.910 1.00 0.00 O ATOM 1351 CG2 THR A 92 4.800 -20.541 -0.676 1.00 0.00 C ATOM 0 H THR A 92 6.730 -18.259 -1.016 1.00 0.00 H new ATOM 0 HA THR A 92 4.082 -18.423 -2.167 1.00 0.00 H new ATOM 0 HB THR A 92 3.440 -19.083 0.148 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.212 -19.499 1.616 1.00 0.00 H new ATOM 0 HG21 THR A 92 4.670 -21.253 0.139 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.127 -20.798 -1.494 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.831 -20.578 -1.028 1.00 0.00 H new ATOM 1359 N GLN A 93 4.493 -15.652 -1.595 1.00 0.00 N ATOM 1360 CA GLN A 93 3.892 -14.313 -1.548 1.00 0.00 C ATOM 1361 C GLN A 93 2.670 -14.197 -2.476 1.00 0.00 C ATOM 1362 O GLN A 93 2.373 -15.102 -3.261 1.00 0.00 O ATOM 1363 CB GLN A 93 4.970 -13.251 -1.853 1.00 0.00 C ATOM 1364 CG GLN A 93 6.149 -13.278 -0.863 1.00 0.00 C ATOM 1365 CD GLN A 93 5.718 -13.146 0.602 1.00 0.00 C ATOM 1366 OE1 GLN A 93 4.820 -12.396 0.961 1.00 0.00 O ATOM 1367 NE2 GLN A 93 6.311 -13.901 1.507 1.00 0.00 N ATOM 0 H GLN A 93 5.326 -15.691 -2.182 1.00 0.00 H new ATOM 0 HA GLN A 93 3.513 -14.134 -0.542 1.00 0.00 H new ATOM 0 HB2 GLN A 93 5.349 -13.408 -2.863 1.00 0.00 H new ATOM 0 HB3 GLN A 93 4.512 -12.262 -1.834 1.00 0.00 H new ATOM 0 HG2 GLN A 93 6.699 -14.211 -0.990 1.00 0.00 H new ATOM 0 HG3 GLN A 93 6.836 -12.468 -1.106 1.00 0.00 H new ATOM 0 HE21 GLN A 93 7.062 -14.534 1.231 1.00 0.00 H new ATOM 0 HE22 GLN A 93 6.019 -13.852 2.483 1.00 0.00 H new ATOM 1376 N GLU A 94 1.933 -13.086 -2.362 1.00 0.00 N ATOM 1377 CA GLU A 94 0.627 -12.893 -3.008 1.00 0.00 C ATOM 1378 C GLU A 94 0.672 -13.042 -4.543 1.00 0.00 C ATOM 1379 O GLU A 94 -0.245 -13.621 -5.133 1.00 0.00 O ATOM 1380 CB GLU A 94 0.083 -11.515 -2.604 1.00 0.00 C ATOM 1381 CG GLU A 94 -1.419 -11.417 -2.865 1.00 0.00 C ATOM 1382 CD GLU A 94 -1.967 -10.034 -2.465 1.00 0.00 C ATOM 1383 OE1 GLU A 94 -1.763 -9.057 -3.226 1.00 0.00 O ATOM 1384 OE2 GLU A 94 -2.621 -9.919 -1.399 1.00 0.00 O ATOM 0 H GLU A 94 2.231 -12.282 -1.810 1.00 0.00 H new ATOM 0 HA GLU A 94 -0.039 -13.684 -2.663 1.00 0.00 H new ATOM 0 HB2 GLU A 94 0.284 -11.337 -1.548 1.00 0.00 H new ATOM 0 HB3 GLU A 94 0.604 -10.737 -3.163 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -1.619 -11.599 -3.921 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.939 -12.193 -2.304 1.00 0.00 H new ATOM 1391 N ILE A 95 1.760 -12.586 -5.180 1.00 0.00 N ATOM 1392 CA ILE A 95 2.068 -12.827 -6.597 1.00 0.00 C ATOM 1393 C ILE A 95 3.489 -13.388 -6.726 1.00 0.00 C ATOM 1394 O ILE A 95 4.453 -12.759 -6.277 1.00 0.00 O ATOM 1395 CB ILE A 95 1.886 -11.538 -7.441 1.00 0.00 C ATOM 1396 CG1 ILE A 95 0.432 -11.010 -7.351 1.00 0.00 C ATOM 1397 CG2 ILE A 95 2.291 -11.779 -8.912 1.00 0.00 C ATOM 1398 CD1 ILE A 95 0.153 -9.732 -8.156 1.00 0.00 C ATOM 0 H ILE A 95 2.470 -12.024 -4.711 1.00 0.00 H new ATOM 0 HA ILE A 95 1.366 -13.563 -6.990 1.00 0.00 H new ATOM 0 HB ILE A 95 2.546 -10.775 -7.028 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -0.244 -11.793 -7.695 1.00 0.00 H new ATOM 0 HG13 ILE A 95 0.195 -10.821 -6.304 1.00 0.00 H new ATOM 0 HG21 ILE A 95 2.154 -10.860 -9.482 1.00 0.00 H new ATOM 0 HG22 ILE A 95 3.337 -12.081 -8.956 1.00 0.00 H new ATOM 0 HG23 ILE A 95 1.668 -12.566 -9.337 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -0.890 -9.442 -8.029 1.00 0.00 H new ATOM 0 HD12 ILE A 95 0.798 -8.929 -7.799 1.00 0.00 H new ATOM 0 HD13 ILE A 95 0.353 -9.916 -9.212 1.00 0.00 H new ATOM 1410 N PHE A 96 3.620 -14.541 -7.391 1.00 0.00 N ATOM 1411 CA PHE A 96 4.907 -15.109 -7.803 1.00 0.00 C ATOM 1412 C PHE A 96 4.855 -15.632 -9.250 1.00 0.00 C ATOM 1413 O PHE A 96 3.859 -16.229 -9.663 1.00 0.00 O ATOM 1414 CB PHE A 96 5.417 -16.152 -6.796 1.00 0.00 C ATOM 1415 CG PHE A 96 6.772 -16.726 -7.165 1.00 0.00 C ATOM 1416 CD1 PHE A 96 6.863 -17.864 -7.990 1.00 0.00 C ATOM 1417 CD2 PHE A 96 7.946 -16.096 -6.713 1.00 0.00 C ATOM 1418 CE1 PHE A 96 8.122 -18.353 -8.376 1.00 0.00 C ATOM 1419 CE2 PHE A 96 9.206 -16.576 -7.108 1.00 0.00 C ATOM 1420 CZ PHE A 96 9.291 -17.706 -7.939 1.00 0.00 C ATOM 0 H PHE A 96 2.821 -15.115 -7.662 1.00 0.00 H new ATOM 0 HA PHE A 96 5.645 -14.307 -7.798 1.00 0.00 H new ATOM 0 HB2 PHE A 96 5.480 -15.694 -5.809 1.00 0.00 H new ATOM 0 HB3 PHE A 96 4.693 -16.964 -6.725 1.00 0.00 H new ATOM 0 HD1 PHE A 96 5.965 -18.361 -8.326 1.00 0.00 H new ATOM 0 HD2 PHE A 96 7.878 -15.239 -6.059 1.00 0.00 H new ATOM 0 HE1 PHE A 96 8.192 -19.226 -9.008 1.00 0.00 H new ATOM 0 HE2 PHE A 96 10.105 -16.079 -6.775 1.00 0.00 H new ATOM 0 HZ PHE A 96 10.258 -18.079 -8.243 1.00 0.00 H new ATOM 1430 N GLU A 97 5.920 -15.391 -10.022 1.00 0.00 N ATOM 1431 CA GLU A 97 6.018 -15.714 -11.456 1.00 0.00 C ATOM 1432 C GLU A 97 7.434 -16.182 -11.848 1.00 0.00 C ATOM 1433 O GLU A 97 8.419 -15.661 -11.324 1.00 0.00 O ATOM 1434 CB GLU A 97 5.682 -14.477 -12.316 1.00 0.00 C ATOM 1435 CG GLU A 97 4.303 -13.840 -12.074 1.00 0.00 C ATOM 1436 CD GLU A 97 4.015 -12.624 -12.988 1.00 0.00 C ATOM 1437 OE1 GLU A 97 4.899 -12.199 -13.774 1.00 0.00 O ATOM 1438 OE2 GLU A 97 2.876 -12.095 -12.918 1.00 0.00 O ATOM 0 H GLU A 97 6.766 -14.952 -9.658 1.00 0.00 H new ATOM 0 HA GLU A 97 5.306 -16.519 -11.638 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.446 -13.719 -12.141 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.750 -14.760 -13.366 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.531 -14.593 -12.231 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.235 -13.526 -11.033 1.00 0.00 H new ATOM 1445 N ASP A 98 7.537 -17.100 -12.819 1.00 0.00 N ATOM 1446 CA ASP A 98 8.792 -17.502 -13.477 1.00 0.00 C ATOM 1447 C ASP A 98 8.807 -16.978 -14.922 1.00 0.00 C ATOM 1448 O ASP A 98 7.987 -17.381 -15.751 1.00 0.00 O ATOM 1449 CB ASP A 98 8.963 -19.032 -13.477 1.00 0.00 C ATOM 1450 CG ASP A 98 9.661 -19.573 -12.222 1.00 0.00 C ATOM 1451 OD1 ASP A 98 10.895 -19.374 -12.098 1.00 0.00 O ATOM 1452 OD2 ASP A 98 8.992 -20.239 -11.397 1.00 0.00 O ATOM 0 H ASP A 98 6.725 -17.600 -13.181 1.00 0.00 H new ATOM 0 HA ASP A 98 9.622 -17.071 -12.917 1.00 0.00 H new ATOM 0 HB2 ASP A 98 7.982 -19.499 -13.566 1.00 0.00 H new ATOM 0 HB3 ASP A 98 9.537 -19.325 -14.356 1.00 0.00 H new ATOM 1457 N TRP A 99 9.757 -16.093 -15.242 1.00 0.00 N ATOM 1458 CA TRP A 99 9.928 -15.498 -16.581 1.00 0.00 C ATOM 1459 C TRP A 99 10.933 -16.230 -17.486 1.00 0.00 C ATOM 1460 O TRP A 99 11.051 -15.868 -18.652 1.00 0.00 O ATOM 1461 CB TRP A 99 10.328 -14.025 -16.434 1.00 0.00 C ATOM 1462 CG TRP A 99 9.337 -13.065 -15.859 1.00 0.00 C ATOM 1463 CD1 TRP A 99 8.088 -13.320 -15.397 1.00 0.00 C ATOM 1464 CD2 TRP A 99 9.540 -11.636 -15.676 1.00 0.00 C ATOM 1465 NE1 TRP A 99 7.513 -12.144 -14.953 1.00 0.00 N ATOM 1466 CE2 TRP A 99 8.379 -11.078 -15.075 1.00 0.00 C ATOM 1467 CE3 TRP A 99 10.611 -10.761 -15.960 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 8.317 -9.730 -14.700 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 10.563 -9.407 -15.579 1.00 0.00 C ATOM 1470 CH2 TRP A 99 9.427 -8.901 -14.929 1.00 0.00 C ATOM 0 H TRP A 99 10.445 -15.760 -14.567 1.00 0.00 H new ATOM 0 HA TRP A 99 8.965 -15.596 -17.082 1.00 0.00 H new ATOM 0 HB2 TRP A 99 11.224 -13.986 -15.814 1.00 0.00 H new ATOM 0 HB3 TRP A 99 10.608 -13.659 -17.422 1.00 0.00 H new ATOM 0 HD1 TRP A 99 7.616 -14.291 -15.379 1.00 0.00 H new ATOM 0 HE1 TRP A 99 6.566 -12.074 -14.581 1.00 0.00 H new ATOM 0 HE3 TRP A 99 11.481 -11.137 -16.478 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.425 -9.332 -14.239 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 11.400 -8.757 -15.787 1.00 0.00 H new ATOM 0 HH2 TRP A 99 9.406 -7.871 -14.604 1.00 0.00 H new ATOM 1481 N GLN A 100 11.671 -17.231 -16.986 1.00 0.00 N ATOM 1482 CA GLN A 100 12.631 -18.072 -17.739 1.00 0.00 C ATOM 1483 C GLN A 100 13.677 -17.327 -18.609 1.00 0.00 C ATOM 1484 O GLN A 100 14.128 -17.847 -19.629 1.00 0.00 O ATOM 1485 CB GLN A 100 11.915 -19.270 -18.407 1.00 0.00 C ATOM 1486 CG GLN A 100 10.805 -18.995 -19.438 1.00 0.00 C ATOM 1487 CD GLN A 100 11.295 -18.519 -20.808 1.00 0.00 C ATOM 1488 OE1 GLN A 100 11.667 -19.306 -21.670 1.00 0.00 O ATOM 1489 NE2 GLN A 100 11.275 -17.230 -21.087 1.00 0.00 N ATOM 0 H GLN A 100 11.618 -17.494 -16.002 1.00 0.00 H new ATOM 0 HA GLN A 100 13.304 -18.494 -16.992 1.00 0.00 H new ATOM 0 HB2 GLN A 100 12.676 -19.877 -18.897 1.00 0.00 H new ATOM 0 HB3 GLN A 100 11.483 -19.880 -17.613 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.223 -19.907 -19.574 1.00 0.00 H new ATOM 0 HG3 GLN A 100 10.129 -18.243 -19.030 1.00 0.00 H new ATOM 0 HE21 GLN A 100 10.968 -16.560 -20.382 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.566 -16.903 -22.008 1.00 0.00 H new ATOM 1498 N LEU A 101 14.083 -16.112 -18.204 1.00 0.00 N ATOM 1499 CA LEU A 101 15.023 -15.266 -18.962 1.00 0.00 C ATOM 1500 C LEU A 101 16.483 -15.774 -18.911 1.00 0.00 C ATOM 1501 O LEU A 101 16.929 -16.339 -17.911 1.00 0.00 O ATOM 1502 CB LEU A 101 14.949 -13.801 -18.477 1.00 0.00 C ATOM 1503 CG LEU A 101 13.609 -13.051 -18.589 1.00 0.00 C ATOM 1504 CD1 LEU A 101 13.862 -11.585 -18.271 1.00 0.00 C ATOM 1505 CD2 LEU A 101 13.029 -13.110 -19.994 1.00 0.00 C ATOM 0 H LEU A 101 13.766 -15.685 -17.334 1.00 0.00 H new ATOM 0 HA LEU A 101 14.710 -15.322 -20.005 1.00 0.00 H new ATOM 0 HB2 LEU A 101 15.250 -13.784 -17.430 1.00 0.00 H new ATOM 0 HB3 LEU A 101 15.694 -13.231 -19.032 1.00 0.00 H new ATOM 0 HG LEU A 101 12.906 -13.520 -17.901 1.00 0.00 H new ATOM 0 HD11 LEU A 101 12.927 -11.030 -18.343 1.00 0.00 H new ATOM 0 HD12 LEU A 101 14.260 -11.495 -17.260 1.00 0.00 H new ATOM 0 HD13 LEU A 101 14.581 -11.178 -18.981 1.00 0.00 H new ATOM 0 HD21 LEU A 101 12.084 -12.567 -20.021 1.00 0.00 H new ATOM 0 HD22 LEU A 101 13.729 -12.656 -20.696 1.00 0.00 H new ATOM 0 HD23 LEU A 101 12.858 -14.150 -20.274 1.00 0.00 H new ATOM 1517 N GLU A 102 17.249 -15.508 -19.970 1.00 0.00 N ATOM 1518 CA GLU A 102 18.657 -15.911 -20.141 1.00 0.00 C ATOM 1519 C GLU A 102 19.655 -14.906 -19.514 1.00 0.00 C ATOM 1520 O GLU A 102 19.322 -13.743 -19.287 1.00 0.00 O ATOM 1521 CB GLU A 102 18.899 -16.132 -21.646 1.00 0.00 C ATOM 1522 CG GLU A 102 20.227 -16.819 -21.984 1.00 0.00 C ATOM 1523 CD GLU A 102 20.236 -17.287 -23.455 1.00 0.00 C ATOM 1524 OE1 GLU A 102 20.482 -16.456 -24.364 1.00 0.00 O ATOM 1525 OE2 GLU A 102 19.994 -18.492 -23.711 1.00 0.00 O ATOM 0 H GLU A 102 16.895 -14.983 -20.770 1.00 0.00 H new ATOM 0 HA GLU A 102 18.840 -16.838 -19.598 1.00 0.00 H new ATOM 0 HB2 GLU A 102 18.082 -16.731 -22.048 1.00 0.00 H new ATOM 0 HB3 GLU A 102 18.865 -15.167 -22.152 1.00 0.00 H new ATOM 0 HG2 GLU A 102 21.054 -16.130 -21.811 1.00 0.00 H new ATOM 0 HG3 GLU A 102 20.380 -17.673 -21.324 1.00 0.00 H new ATOM 1532 N ASP A 103 20.884 -15.343 -19.221 1.00 0.00 N ATOM 1533 CA ASP A 103 21.974 -14.502 -18.711 1.00 0.00 C ATOM 1534 C ASP A 103 22.710 -13.728 -19.830 1.00 0.00 C ATOM 1535 O ASP A 103 23.157 -14.345 -20.804 1.00 0.00 O ATOM 1536 CB ASP A 103 22.960 -15.366 -17.912 1.00 0.00 C ATOM 1537 CG ASP A 103 23.636 -16.472 -18.747 1.00 0.00 C ATOM 1538 OD1 ASP A 103 22.939 -17.442 -19.134 1.00 0.00 O ATOM 1539 OD2 ASP A 103 24.872 -16.407 -18.963 1.00 0.00 O ATOM 0 H ASP A 103 21.157 -16.319 -19.335 1.00 0.00 H new ATOM 0 HA ASP A 103 21.529 -13.750 -18.059 1.00 0.00 H new ATOM 0 HB2 ASP A 103 23.730 -14.723 -17.487 1.00 0.00 H new ATOM 0 HB3 ASP A 103 22.432 -15.826 -17.077 1.00 0.00 H new ATOM 1544 N PRO A 104 22.880 -12.393 -19.713 1.00 0.00 N ATOM 1545 CA PRO A 104 23.617 -11.604 -20.697 1.00 0.00 C ATOM 1546 C PRO A 104 25.130 -11.522 -20.414 1.00 0.00 C ATOM 1547 O PRO A 104 25.908 -11.554 -21.361 1.00 0.00 O ATOM 1548 CB PRO A 104 22.916 -10.252 -20.681 1.00 0.00 C ATOM 1549 CG PRO A 104 22.505 -10.081 -19.218 1.00 0.00 C ATOM 1550 CD PRO A 104 22.195 -11.511 -18.776 1.00 0.00 C ATOM 0 HA PRO A 104 23.598 -12.061 -21.686 1.00 0.00 H new ATOM 0 HB2 PRO A 104 23.580 -9.452 -21.008 1.00 0.00 H new ATOM 0 HB3 PRO A 104 22.052 -10.240 -21.345 1.00 0.00 H new ATOM 0 HG2 PRO A 104 23.305 -9.640 -18.623 1.00 0.00 H new ATOM 0 HG3 PRO A 104 21.636 -9.430 -19.117 1.00 0.00 H new ATOM 0 HD2 PRO A 104 22.540 -11.685 -17.757 1.00 0.00 H new ATOM 0 HD3 PRO A 104 21.121 -11.695 -18.785 1.00 0.00 H new ATOM 1558 N ASP A 105 25.539 -11.405 -19.142 1.00 0.00 N ATOM 1559 CA ASP A 105 26.883 -11.508 -18.527 1.00 0.00 C ATOM 1560 C ASP A 105 28.117 -11.341 -19.453 1.00 0.00 C ATOM 1561 O ASP A 105 29.041 -12.159 -19.455 1.00 0.00 O ATOM 1562 CB ASP A 105 26.948 -12.795 -17.676 1.00 0.00 C ATOM 1563 CG ASP A 105 26.044 -12.767 -16.426 1.00 0.00 C ATOM 1564 OD1 ASP A 105 24.885 -12.301 -16.526 1.00 0.00 O ATOM 1565 OD2 ASP A 105 26.508 -13.212 -15.344 1.00 0.00 O ATOM 0 H ASP A 105 24.846 -11.210 -18.420 1.00 0.00 H new ATOM 0 HA ASP A 105 26.978 -10.619 -17.903 1.00 0.00 H new ATOM 0 HB2 ASP A 105 26.665 -13.644 -18.298 1.00 0.00 H new ATOM 0 HB3 ASP A 105 27.979 -12.959 -17.363 1.00 0.00 H new ATOM 1570 N GLY A 106 28.156 -10.261 -20.243 1.00 0.00 N ATOM 1571 CA GLY A 106 29.302 -9.938 -21.113 1.00 0.00 C ATOM 1572 C GLY A 106 29.444 -10.828 -22.361 1.00 0.00 C ATOM 1573 O GLY A 106 30.480 -10.770 -23.028 1.00 0.00 O ATOM 0 H GLY A 106 27.395 -9.584 -20.300 1.00 0.00 H new ATOM 0 HA2 GLY A 106 29.214 -8.900 -21.434 1.00 0.00 H new ATOM 0 HA3 GLY A 106 30.217 -10.013 -20.526 1.00 0.00 H new ATOM 1577 N GLN A 107 28.428 -11.638 -22.687 1.00 0.00 N ATOM 1578 CA GLN A 107 28.409 -12.533 -23.854 1.00 0.00 C ATOM 1579 C GLN A 107 28.472 -11.732 -25.167 1.00 0.00 C ATOM 1580 O GLN A 107 29.342 -11.960 -26.008 1.00 0.00 O ATOM 1581 CB GLN A 107 27.137 -13.407 -23.817 1.00 0.00 C ATOM 1582 CG GLN A 107 27.016 -14.353 -22.603 1.00 0.00 C ATOM 1583 CD GLN A 107 27.994 -15.531 -22.591 1.00 0.00 C ATOM 1584 OE1 GLN A 107 28.836 -15.716 -23.461 1.00 0.00 O ATOM 1585 NE2 GLN A 107 27.914 -16.388 -21.593 1.00 0.00 N ATOM 0 H GLN A 107 27.574 -11.691 -22.132 1.00 0.00 H new ATOM 0 HA GLN A 107 29.288 -13.176 -23.813 1.00 0.00 H new ATOM 0 HB2 GLN A 107 26.266 -12.752 -23.833 1.00 0.00 H new ATOM 0 HB3 GLN A 107 27.102 -14.006 -24.727 1.00 0.00 H new ATOM 0 HG2 GLN A 107 27.163 -13.771 -21.693 1.00 0.00 H new ATOM 0 HG3 GLN A 107 26.000 -14.746 -22.569 1.00 0.00 H new ATOM 0 HE21 GLN A 107 27.220 -16.252 -20.858 1.00 0.00 H new ATOM 0 HE22 GLN A 107 28.546 -17.187 -21.555 1.00 0.00 H new ATOM 1594 N SER A 108 27.558 -10.764 -25.304 1.00 0.00 N ATOM 1595 CA SER A 108 27.523 -9.728 -26.348 1.00 0.00 C ATOM 1596 C SER A 108 26.492 -8.662 -25.979 1.00 0.00 C ATOM 1597 O SER A 108 25.494 -8.960 -25.317 1.00 0.00 O ATOM 1598 CB SER A 108 27.174 -10.343 -27.712 1.00 0.00 C ATOM 1599 OG SER A 108 27.038 -9.329 -28.697 1.00 0.00 O ATOM 0 H SER A 108 26.778 -10.676 -24.653 1.00 0.00 H new ATOM 0 HA SER A 108 28.510 -9.271 -26.419 1.00 0.00 H new ATOM 0 HB2 SER A 108 27.952 -11.045 -28.010 1.00 0.00 H new ATOM 0 HB3 SER A 108 26.246 -10.910 -27.635 1.00 0.00 H new ATOM 0 HG SER A 108 26.817 -9.738 -29.560 1.00 0.00 H new ATOM 1605 N LEU A 109 26.677 -7.431 -26.464 1.00 0.00 N ATOM 1606 CA LEU A 109 25.701 -6.343 -26.334 1.00 0.00 C ATOM 1607 C LEU A 109 24.345 -6.746 -26.931 1.00 0.00 C ATOM 1608 O LEU A 109 23.307 -6.387 -26.390 1.00 0.00 O ATOM 1609 CB LEU A 109 26.251 -5.079 -27.029 1.00 0.00 C ATOM 1610 CG LEU A 109 27.264 -4.278 -26.187 1.00 0.00 C ATOM 1611 CD1 LEU A 109 28.595 -4.994 -25.945 1.00 0.00 C ATOM 1612 CD2 LEU A 109 27.580 -2.950 -26.877 1.00 0.00 C ATOM 0 H LEU A 109 27.522 -7.157 -26.966 1.00 0.00 H new ATOM 0 HA LEU A 109 25.543 -6.132 -25.276 1.00 0.00 H new ATOM 0 HB2 LEU A 109 26.726 -5.372 -27.965 1.00 0.00 H new ATOM 0 HB3 LEU A 109 25.415 -4.428 -27.286 1.00 0.00 H new ATOM 0 HG LEU A 109 26.781 -4.141 -25.220 1.00 0.00 H new ATOM 0 HD11 LEU A 109 29.246 -4.358 -25.345 1.00 0.00 H new ATOM 0 HD12 LEU A 109 28.414 -5.930 -25.416 1.00 0.00 H new ATOM 0 HD13 LEU A 109 29.074 -5.204 -26.901 1.00 0.00 H new ATOM 0 HD21 LEU A 109 28.296 -2.389 -26.276 1.00 0.00 H new ATOM 0 HD22 LEU A 109 28.005 -3.144 -27.862 1.00 0.00 H new ATOM 0 HD23 LEU A 109 26.664 -2.369 -26.985 1.00 0.00 H new ATOM 1624 N GLU A 110 24.343 -7.581 -27.970 1.00 0.00 N ATOM 1625 CA GLU A 110 23.142 -8.175 -28.570 1.00 0.00 C ATOM 1626 C GLU A 110 22.300 -8.957 -27.552 1.00 0.00 C ATOM 1627 O GLU A 110 21.075 -8.851 -27.549 1.00 0.00 O ATOM 1628 CB GLU A 110 23.612 -9.125 -29.676 1.00 0.00 C ATOM 1629 CG GLU A 110 22.464 -9.666 -30.535 1.00 0.00 C ATOM 1630 CD GLU A 110 23.006 -10.527 -31.691 1.00 0.00 C ATOM 1631 OE1 GLU A 110 23.212 -11.752 -31.500 1.00 0.00 O ATOM 1632 OE2 GLU A 110 23.226 -9.988 -32.803 1.00 0.00 O ATOM 0 H GLU A 110 25.203 -7.874 -28.434 1.00 0.00 H new ATOM 0 HA GLU A 110 22.507 -7.377 -28.955 1.00 0.00 H new ATOM 0 HB2 GLU A 110 24.322 -8.603 -30.317 1.00 0.00 H new ATOM 0 HB3 GLU A 110 24.145 -9.962 -29.225 1.00 0.00 H new ATOM 0 HG2 GLU A 110 21.790 -10.260 -29.918 1.00 0.00 H new ATOM 0 HG3 GLU A 110 21.881 -8.837 -30.935 1.00 0.00 H new ATOM 1639 N VAL A 111 22.939 -9.700 -26.643 1.00 0.00 N ATOM 1640 CA VAL A 111 22.226 -10.479 -25.615 1.00 0.00 C ATOM 1641 C VAL A 111 21.660 -9.537 -24.558 1.00 0.00 C ATOM 1642 O VAL A 111 20.518 -9.709 -24.144 1.00 0.00 O ATOM 1643 CB VAL A 111 23.113 -11.570 -24.976 1.00 0.00 C ATOM 1644 CG1 VAL A 111 22.271 -12.500 -24.093 1.00 0.00 C ATOM 1645 CG2 VAL A 111 23.796 -12.453 -26.028 1.00 0.00 C ATOM 0 H VAL A 111 23.955 -9.781 -26.595 1.00 0.00 H new ATOM 0 HA VAL A 111 21.406 -11.004 -26.104 1.00 0.00 H new ATOM 0 HB VAL A 111 23.867 -11.041 -24.393 1.00 0.00 H new ATOM 0 HG11 VAL A 111 22.913 -13.262 -23.651 1.00 0.00 H new ATOM 0 HG12 VAL A 111 21.798 -11.920 -23.300 1.00 0.00 H new ATOM 0 HG13 VAL A 111 21.502 -12.980 -24.699 1.00 0.00 H new ATOM 0 HG21 VAL A 111 24.408 -13.205 -25.530 1.00 0.00 H new ATOM 0 HG22 VAL A 111 23.038 -12.947 -26.636 1.00 0.00 H new ATOM 0 HG23 VAL A 111 24.428 -11.836 -26.667 1.00 0.00 H new ATOM 1655 N PHE A 112 22.395 -8.478 -24.193 1.00 0.00 N ATOM 1656 CA PHE A 112 21.881 -7.461 -23.255 1.00 0.00 C ATOM 1657 C PHE A 112 20.670 -6.722 -23.837 1.00 0.00 C ATOM 1658 O PHE A 112 19.650 -6.573 -23.167 1.00 0.00 O ATOM 1659 CB PHE A 112 22.990 -6.471 -22.872 1.00 0.00 C ATOM 1660 CG PHE A 112 23.894 -6.947 -21.776 1.00 0.00 C ATOM 1661 CD1 PHE A 112 23.522 -6.796 -20.427 1.00 0.00 C ATOM 1662 CD2 PHE A 112 25.113 -7.549 -22.112 1.00 0.00 C ATOM 1663 CE1 PHE A 112 24.368 -7.280 -19.416 1.00 0.00 C ATOM 1664 CE2 PHE A 112 25.965 -8.008 -21.102 1.00 0.00 C ATOM 1665 CZ PHE A 112 25.586 -7.891 -19.751 1.00 0.00 C ATOM 0 H PHE A 112 23.342 -8.300 -24.528 1.00 0.00 H new ATOM 0 HA PHE A 112 21.550 -7.977 -22.353 1.00 0.00 H new ATOM 0 HB2 PHE A 112 23.592 -6.259 -23.756 1.00 0.00 H new ATOM 0 HB3 PHE A 112 22.531 -5.531 -22.565 1.00 0.00 H new ATOM 0 HD1 PHE A 112 22.592 -6.311 -20.171 1.00 0.00 H new ATOM 0 HD2 PHE A 112 25.395 -7.659 -23.149 1.00 0.00 H new ATOM 0 HE1 PHE A 112 24.081 -7.182 -18.380 1.00 0.00 H new ATOM 0 HE2 PHE A 112 26.915 -8.453 -21.359 1.00 0.00 H new ATOM 0 HZ PHE A 112 26.232 -8.271 -18.973 1.00 0.00 H new ATOM 1675 N ARG A 113 20.745 -6.323 -25.111 1.00 0.00 N ATOM 1676 CA ARG A 113 19.647 -5.666 -25.848 1.00 0.00 C ATOM 1677 C ARG A 113 18.437 -6.597 -26.015 1.00 0.00 C ATOM 1678 O ARG A 113 17.305 -6.170 -25.804 1.00 0.00 O ATOM 1679 CB ARG A 113 20.175 -5.142 -27.199 1.00 0.00 C ATOM 1680 CG ARG A 113 21.175 -3.985 -27.007 1.00 0.00 C ATOM 1681 CD ARG A 113 21.786 -3.565 -28.347 1.00 0.00 C ATOM 1682 NE ARG A 113 22.700 -2.411 -28.204 1.00 0.00 N ATOM 1683 CZ ARG A 113 23.610 -2.027 -29.081 1.00 0.00 C ATOM 1684 NH1 ARG A 113 23.863 -2.691 -30.174 1.00 0.00 N ATOM 1685 NH2 ARG A 113 24.290 -0.945 -28.868 1.00 0.00 N ATOM 0 H ARG A 113 21.586 -6.448 -25.675 1.00 0.00 H new ATOM 0 HA ARG A 113 19.291 -4.815 -25.267 1.00 0.00 H new ATOM 0 HB2 ARG A 113 20.658 -5.955 -27.742 1.00 0.00 H new ATOM 0 HB3 ARG A 113 19.339 -4.803 -27.810 1.00 0.00 H new ATOM 0 HG2 ARG A 113 20.670 -3.134 -26.550 1.00 0.00 H new ATOM 0 HG3 ARG A 113 21.966 -4.292 -26.322 1.00 0.00 H new ATOM 0 HD2 ARG A 113 22.330 -4.406 -28.777 1.00 0.00 H new ATOM 0 HD3 ARG A 113 20.988 -3.311 -29.045 1.00 0.00 H new ATOM 0 HE ARG A 113 22.620 -1.861 -27.349 1.00 0.00 H new ATOM 0 HH11 ARG A 113 23.348 -3.547 -30.382 1.00 0.00 H new ATOM 0 HH12 ARG A 113 24.576 -2.355 -30.822 1.00 0.00 H new ATOM 0 HH21 ARG A 113 24.121 -0.394 -28.026 1.00 0.00 H new ATOM 0 HH22 ARG A 113 24.994 -0.644 -29.542 1.00 0.00 H new ATOM 1699 N THR A 114 18.680 -7.885 -26.273 1.00 0.00 N ATOM 1700 CA THR A 114 17.635 -8.927 -26.333 1.00 0.00 C ATOM 1701 C THR A 114 16.929 -9.090 -24.986 1.00 0.00 C ATOM 1702 O THR A 114 15.705 -8.969 -24.923 1.00 0.00 O ATOM 1703 CB THR A 114 18.202 -10.280 -26.814 1.00 0.00 C ATOM 1704 OG1 THR A 114 18.728 -10.145 -28.116 1.00 0.00 O ATOM 1705 CG2 THR A 114 17.137 -11.379 -26.889 1.00 0.00 C ATOM 0 H THR A 114 19.618 -8.244 -26.449 1.00 0.00 H new ATOM 0 HA THR A 114 16.899 -8.594 -27.065 1.00 0.00 H new ATOM 0 HB THR A 114 18.963 -10.561 -26.086 1.00 0.00 H new ATOM 0 HG1 THR A 114 19.525 -9.576 -28.089 1.00 0.00 H new ATOM 0 HG21 THR A 114 17.595 -12.306 -27.233 1.00 0.00 H new ATOM 0 HG22 THR A 114 16.703 -11.533 -25.901 1.00 0.00 H new ATOM 0 HG23 THR A 114 16.354 -11.080 -27.586 1.00 0.00 H new ATOM 1713 N VAL A 115 17.660 -9.297 -23.880 1.00 0.00 N ATOM 1714 CA VAL A 115 17.014 -9.510 -22.580 1.00 0.00 C ATOM 1715 C VAL A 115 16.404 -8.232 -22.006 1.00 0.00 C ATOM 1716 O VAL A 115 15.350 -8.344 -21.397 1.00 0.00 O ATOM 1717 CB VAL A 115 17.892 -10.285 -21.576 1.00 0.00 C ATOM 1718 CG1 VAL A 115 18.388 -11.612 -22.164 1.00 0.00 C ATOM 1719 CG2 VAL A 115 19.069 -9.488 -21.015 1.00 0.00 C ATOM 0 H VAL A 115 18.680 -9.321 -23.860 1.00 0.00 H new ATOM 0 HA VAL A 115 16.170 -10.172 -22.774 1.00 0.00 H new ATOM 0 HB VAL A 115 17.230 -10.486 -20.734 1.00 0.00 H new ATOM 0 HG11 VAL A 115 19.003 -12.129 -21.427 1.00 0.00 H new ATOM 0 HG12 VAL A 115 17.533 -12.236 -22.426 1.00 0.00 H new ATOM 0 HG13 VAL A 115 18.981 -11.415 -23.057 1.00 0.00 H new ATOM 0 HG21 VAL A 115 19.631 -10.110 -20.318 1.00 0.00 H new ATOM 0 HG22 VAL A 115 19.721 -9.178 -21.832 1.00 0.00 H new ATOM 0 HG23 VAL A 115 18.696 -8.606 -20.494 1.00 0.00 H new ATOM 1729 N ARG A 116 16.919 -7.015 -22.276 1.00 0.00 N ATOM 1730 CA ARG A 116 16.199 -5.777 -21.870 1.00 0.00 C ATOM 1731 C ARG A 116 14.850 -5.628 -22.590 1.00 0.00 C ATOM 1732 O ARG A 116 13.874 -5.245 -21.961 1.00 0.00 O ATOM 1733 CB ARG A 116 17.097 -4.512 -21.918 1.00 0.00 C ATOM 1734 CG ARG A 116 17.145 -3.747 -23.251 1.00 0.00 C ATOM 1735 CD ARG A 116 17.913 -2.421 -23.109 1.00 0.00 C ATOM 1736 NE ARG A 116 18.492 -1.875 -24.367 1.00 0.00 N ATOM 1737 CZ ARG A 116 17.984 -1.691 -25.575 1.00 0.00 C ATOM 1738 NH1 ARG A 116 16.772 -2.028 -25.907 1.00 0.00 N ATOM 1739 NH2 ARG A 116 18.710 -1.130 -26.493 1.00 0.00 N ATOM 0 H ARG A 116 17.804 -6.857 -22.759 1.00 0.00 H new ATOM 0 HA ARG A 116 15.947 -5.887 -20.815 1.00 0.00 H new ATOM 0 HB2 ARG A 116 16.757 -3.824 -21.144 1.00 0.00 H new ATOM 0 HB3 ARG A 116 18.114 -4.807 -21.659 1.00 0.00 H new ATOM 0 HG2 ARG A 116 17.622 -4.366 -24.011 1.00 0.00 H new ATOM 0 HG3 ARG A 116 16.130 -3.547 -23.594 1.00 0.00 H new ATOM 0 HD2 ARG A 116 17.240 -1.675 -22.687 1.00 0.00 H new ATOM 0 HD3 ARG A 116 18.720 -2.565 -22.391 1.00 0.00 H new ATOM 0 HE ARG A 116 19.467 -1.588 -24.282 1.00 0.00 H new ATOM 0 HH11 ARG A 116 16.156 -2.460 -25.218 1.00 0.00 H new ATOM 0 HH12 ARG A 116 16.438 -1.860 -26.856 1.00 0.00 H new ATOM 0 HH21 ARG A 116 19.663 -0.835 -26.280 1.00 0.00 H new ATOM 0 HH22 ARG A 116 18.328 -0.984 -27.427 1.00 0.00 H new ATOM 1753 N GLY A 117 14.774 -6.016 -23.865 1.00 0.00 N ATOM 1754 CA GLY A 117 13.522 -6.054 -24.638 1.00 0.00 C ATOM 1755 C GLY A 117 12.505 -7.037 -24.050 1.00 0.00 C ATOM 1756 O GLY A 117 11.376 -6.651 -23.760 1.00 0.00 O ATOM 0 H GLY A 117 15.588 -6.317 -24.400 1.00 0.00 H new ATOM 0 HA2 GLY A 117 13.085 -5.056 -24.666 1.00 0.00 H new ATOM 0 HA3 GLY A 117 13.742 -6.335 -25.668 1.00 0.00 H new ATOM 1760 N GLN A 118 12.933 -8.272 -23.759 1.00 0.00 N ATOM 1761 CA GLN A 118 12.093 -9.265 -23.064 1.00 0.00 C ATOM 1762 C GLN A 118 11.648 -8.786 -21.678 1.00 0.00 C ATOM 1763 O GLN A 118 10.475 -8.900 -21.321 1.00 0.00 O ATOM 1764 CB GLN A 118 12.859 -10.584 -22.894 1.00 0.00 C ATOM 1765 CG GLN A 118 12.991 -11.349 -24.222 1.00 0.00 C ATOM 1766 CD GLN A 118 13.593 -12.731 -24.004 1.00 0.00 C ATOM 1767 OE1 GLN A 118 14.619 -13.096 -24.560 1.00 0.00 O ATOM 1768 NE2 GLN A 118 12.978 -13.541 -23.165 1.00 0.00 N ATOM 0 H GLN A 118 13.865 -8.613 -23.995 1.00 0.00 H new ATOM 0 HA GLN A 118 11.207 -9.409 -23.683 1.00 0.00 H new ATOM 0 HB2 GLN A 118 13.852 -10.378 -22.494 1.00 0.00 H new ATOM 0 HB3 GLN A 118 12.345 -11.210 -22.164 1.00 0.00 H new ATOM 0 HG2 GLN A 118 12.010 -11.446 -24.688 1.00 0.00 H new ATOM 0 HG3 GLN A 118 13.617 -10.782 -24.911 1.00 0.00 H new ATOM 0 HE21 GLN A 118 12.122 -13.239 -22.700 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.358 -14.469 -22.981 1.00 0.00 H new ATOM 1777 N VAL A 119 12.591 -8.232 -20.910 1.00 0.00 N ATOM 1778 CA VAL A 119 12.327 -7.703 -19.568 1.00 0.00 C ATOM 1779 C VAL A 119 11.264 -6.610 -19.633 1.00 0.00 C ATOM 1780 O VAL A 119 10.322 -6.685 -18.862 1.00 0.00 O ATOM 1781 CB VAL A 119 13.620 -7.172 -18.903 1.00 0.00 C ATOM 1782 CG1 VAL A 119 13.390 -6.228 -17.723 1.00 0.00 C ATOM 1783 CG2 VAL A 119 14.470 -8.316 -18.354 1.00 0.00 C ATOM 0 H VAL A 119 13.563 -8.137 -21.203 1.00 0.00 H new ATOM 0 HA VAL A 119 11.954 -8.520 -18.950 1.00 0.00 H new ATOM 0 HB VAL A 119 14.113 -6.627 -19.708 1.00 0.00 H new ATOM 0 HG11 VAL A 119 14.351 -5.907 -17.321 1.00 0.00 H new ATOM 0 HG12 VAL A 119 12.828 -5.357 -18.058 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.827 -6.746 -16.947 1.00 0.00 H new ATOM 0 HG21 VAL A 119 15.371 -7.911 -17.893 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.898 -8.869 -17.609 1.00 0.00 H new ATOM 0 HG23 VAL A 119 14.748 -8.986 -19.168 1.00 0.00 H new ATOM 1793 N LYS A 120 11.351 -5.643 -20.558 1.00 0.00 N ATOM 1794 CA LYS A 120 10.359 -4.557 -20.695 1.00 0.00 C ATOM 1795 C LYS A 120 8.931 -5.099 -20.795 1.00 0.00 C ATOM 1796 O LYS A 120 8.085 -4.721 -19.994 1.00 0.00 O ATOM 1797 CB LYS A 120 10.699 -3.676 -21.902 1.00 0.00 C ATOM 1798 CG LYS A 120 9.760 -2.455 -21.940 1.00 0.00 C ATOM 1799 CD LYS A 120 9.954 -1.604 -23.200 1.00 0.00 C ATOM 1800 CE LYS A 120 9.456 -2.312 -24.472 1.00 0.00 C ATOM 1801 NZ LYS A 120 7.974 -2.375 -24.557 1.00 0.00 N ATOM 0 H LYS A 120 12.112 -5.588 -21.236 1.00 0.00 H new ATOM 0 HA LYS A 120 10.406 -3.947 -19.793 1.00 0.00 H new ATOM 0 HB2 LYS A 120 11.736 -3.346 -21.842 1.00 0.00 H new ATOM 0 HB3 LYS A 120 10.600 -4.251 -22.823 1.00 0.00 H new ATOM 0 HG2 LYS A 120 8.725 -2.795 -21.891 1.00 0.00 H new ATOM 0 HG3 LYS A 120 9.935 -1.838 -21.058 1.00 0.00 H new ATOM 0 HD2 LYS A 120 9.423 -0.660 -23.082 1.00 0.00 H new ATOM 0 HD3 LYS A 120 11.011 -1.363 -23.312 1.00 0.00 H new ATOM 0 HE2 LYS A 120 9.843 -1.790 -25.347 1.00 0.00 H new ATOM 0 HE3 LYS A 120 9.860 -3.324 -24.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 7.691 -3.253 -25.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 7.570 -2.358 -23.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 7.622 -1.558 -25.095 1.00 0.00 H new ATOM 1815 N GLU A 121 8.674 -6.018 -21.728 1.00 0.00 N ATOM 1816 CA GLU A 121 7.328 -6.582 -21.943 1.00 0.00 C ATOM 1817 C GLU A 121 6.779 -7.251 -20.674 1.00 0.00 C ATOM 1818 O GLU A 121 5.639 -7.015 -20.273 1.00 0.00 O ATOM 1819 CB GLU A 121 7.359 -7.625 -23.073 1.00 0.00 C ATOM 1820 CG GLU A 121 7.807 -7.080 -24.436 1.00 0.00 C ATOM 1821 CD GLU A 121 6.844 -6.026 -25.019 1.00 0.00 C ATOM 1822 OE1 GLU A 121 5.626 -6.304 -25.141 1.00 0.00 O ATOM 1823 OE2 GLU A 121 7.309 -4.915 -25.377 1.00 0.00 O ATOM 0 H GLU A 121 9.385 -6.394 -22.356 1.00 0.00 H new ATOM 0 HA GLU A 121 6.675 -5.752 -22.212 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.028 -8.435 -22.783 1.00 0.00 H new ATOM 0 HB3 GLU A 121 6.363 -8.056 -23.179 1.00 0.00 H new ATOM 0 HG2 GLU A 121 8.799 -6.639 -24.335 1.00 0.00 H new ATOM 0 HG3 GLU A 121 7.897 -7.908 -25.139 1.00 0.00 H new ATOM 1830 N ARG A 122 7.611 -8.057 -20.007 1.00 0.00 N ATOM 1831 CA ARG A 122 7.222 -8.797 -18.795 1.00 0.00 C ATOM 1832 C ARG A 122 7.131 -7.905 -17.550 1.00 0.00 C ATOM 1833 O ARG A 122 6.232 -8.077 -16.732 1.00 0.00 O ATOM 1834 CB ARG A 122 8.184 -9.980 -18.622 1.00 0.00 C ATOM 1835 CG ARG A 122 7.896 -11.066 -19.669 1.00 0.00 C ATOM 1836 CD ARG A 122 8.719 -12.327 -19.410 1.00 0.00 C ATOM 1837 NE ARG A 122 8.224 -13.443 -20.243 1.00 0.00 N ATOM 1838 CZ ARG A 122 7.407 -14.421 -19.889 1.00 0.00 C ATOM 1839 NH1 ARG A 122 6.862 -14.482 -18.706 1.00 0.00 N ATOM 1840 NH2 ARG A 122 7.116 -15.366 -20.732 1.00 0.00 N ATOM 0 H ARG A 122 8.577 -8.217 -20.291 1.00 0.00 H new ATOM 0 HA ARG A 122 6.208 -9.179 -18.918 1.00 0.00 H new ATOM 0 HB2 ARG A 122 9.214 -9.636 -18.720 1.00 0.00 H new ATOM 0 HB3 ARG A 122 8.081 -10.396 -17.620 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.835 -11.314 -19.655 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.120 -10.682 -20.664 1.00 0.00 H new ATOM 0 HD2 ARG A 122 9.769 -12.136 -19.632 1.00 0.00 H new ATOM 0 HD3 ARG A 122 8.660 -12.597 -18.356 1.00 0.00 H new ATOM 0 HE ARG A 122 8.552 -13.461 -21.208 1.00 0.00 H new ATOM 0 HH11 ARG A 122 7.061 -13.759 -18.015 1.00 0.00 H new ATOM 0 HH12 ARG A 122 6.237 -15.253 -18.472 1.00 0.00 H new ATOM 0 HH21 ARG A 122 7.518 -15.355 -21.669 1.00 0.00 H new ATOM 0 HH22 ARG A 122 6.486 -16.119 -20.456 1.00 0.00 H new ATOM 1854 N VAL A 123 7.977 -6.883 -17.457 1.00 0.00 N ATOM 1855 CA VAL A 123 7.896 -5.811 -16.455 1.00 0.00 C ATOM 1856 C VAL A 123 6.606 -5.007 -16.615 1.00 0.00 C ATOM 1857 O VAL A 123 5.930 -4.798 -15.612 1.00 0.00 O ATOM 1858 CB VAL A 123 9.111 -4.878 -16.551 1.00 0.00 C ATOM 1859 CG1 VAL A 123 8.878 -3.585 -15.785 1.00 0.00 C ATOM 1860 CG2 VAL A 123 10.350 -5.522 -15.924 1.00 0.00 C ATOM 0 H VAL A 123 8.765 -6.769 -18.095 1.00 0.00 H new ATOM 0 HA VAL A 123 7.893 -6.280 -15.471 1.00 0.00 H new ATOM 0 HB VAL A 123 9.258 -4.684 -17.613 1.00 0.00 H new ATOM 0 HG11 VAL A 123 9.757 -2.947 -15.873 1.00 0.00 H new ATOM 0 HG12 VAL A 123 8.012 -3.069 -16.198 1.00 0.00 H new ATOM 0 HG13 VAL A 123 8.698 -3.812 -14.734 1.00 0.00 H new ATOM 0 HG21 VAL A 123 11.196 -4.839 -16.006 1.00 0.00 H new ATOM 0 HG22 VAL A 123 10.157 -5.736 -14.873 1.00 0.00 H new ATOM 0 HG23 VAL A 123 10.581 -6.450 -16.446 1.00 0.00 H new ATOM 1870 N GLU A 124 6.244 -4.573 -17.832 1.00 0.00 N ATOM 1871 CA GLU A 124 4.967 -3.889 -18.092 1.00 0.00 C ATOM 1872 C GLU A 124 3.814 -4.748 -17.574 1.00 0.00 C ATOM 1873 O GLU A 124 3.069 -4.326 -16.695 1.00 0.00 O ATOM 1874 CB GLU A 124 4.745 -3.619 -19.595 1.00 0.00 C ATOM 1875 CG GLU A 124 5.558 -2.450 -20.151 1.00 0.00 C ATOM 1876 CD GLU A 124 5.281 -2.239 -21.651 1.00 0.00 C ATOM 1877 OE1 GLU A 124 4.174 -1.766 -22.008 1.00 0.00 O ATOM 1878 OE2 GLU A 124 6.180 -2.523 -22.481 1.00 0.00 O ATOM 0 H GLU A 124 6.826 -4.686 -18.662 1.00 0.00 H new ATOM 0 HA GLU A 124 5.002 -2.930 -17.576 1.00 0.00 H new ATOM 0 HB2 GLU A 124 4.996 -4.520 -20.155 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.686 -3.423 -19.764 1.00 0.00 H new ATOM 0 HG2 GLU A 124 5.313 -1.541 -19.602 1.00 0.00 H new ATOM 0 HG3 GLU A 124 6.621 -2.638 -19.998 1.00 0.00 H new ATOM 1885 N ASN A 125 3.745 -5.993 -18.043 1.00 0.00 N ATOM 1886 CA ASN A 125 2.752 -6.990 -17.639 1.00 0.00 C ATOM 1887 C ASN A 125 2.675 -7.200 -16.111 1.00 0.00 C ATOM 1888 O ASN A 125 1.615 -7.587 -15.630 1.00 0.00 O ATOM 1889 CB ASN A 125 3.050 -8.331 -18.347 1.00 0.00 C ATOM 1890 CG ASN A 125 2.833 -8.331 -19.856 1.00 0.00 C ATOM 1891 OD1 ASN A 125 2.242 -7.436 -20.446 1.00 0.00 O ATOM 1892 ND2 ASN A 125 3.273 -9.373 -20.533 1.00 0.00 N ATOM 0 H ASN A 125 4.401 -6.348 -18.739 1.00 0.00 H new ATOM 0 HA ASN A 125 1.777 -6.607 -17.942 1.00 0.00 H new ATOM 0 HB2 ASN A 125 4.085 -8.608 -18.145 1.00 0.00 H new ATOM 0 HB3 ASN A 125 2.421 -9.104 -17.906 1.00 0.00 H new ATOM 0 HD21 ASN A 125 3.120 -9.429 -21.540 1.00 0.00 H new ATOM 0 HD22 ASN A 125 3.767 -10.124 -20.050 1.00 0.00 H new ATOM 1899 N LEU A 126 3.749 -6.945 -15.348 1.00 0.00 N ATOM 1900 CA LEU A 126 3.801 -7.075 -13.888 1.00 0.00 C ATOM 1901 C LEU A 126 3.448 -5.775 -13.160 1.00 0.00 C ATOM 1902 O LEU A 126 2.466 -5.722 -12.426 1.00 0.00 O ATOM 1903 CB LEU A 126 5.202 -7.597 -13.517 1.00 0.00 C ATOM 1904 CG LEU A 126 5.447 -8.019 -12.061 1.00 0.00 C ATOM 1905 CD1 LEU A 126 5.728 -6.859 -11.102 1.00 0.00 C ATOM 1906 CD2 LEU A 126 4.294 -8.851 -11.505 1.00 0.00 C ATOM 0 H LEU A 126 4.634 -6.632 -15.747 1.00 0.00 H new ATOM 0 HA LEU A 126 3.040 -7.783 -13.558 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.420 -8.453 -14.155 1.00 0.00 H new ATOM 0 HB3 LEU A 126 5.925 -6.821 -13.767 1.00 0.00 H new ATOM 0 HG LEU A 126 6.353 -8.623 -12.113 1.00 0.00 H new ATOM 0 HD11 LEU A 126 5.889 -7.249 -10.097 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.619 -6.323 -11.430 1.00 0.00 H new ATOM 0 HD13 LEU A 126 4.877 -6.178 -11.095 1.00 0.00 H new ATOM 0 HD21 LEU A 126 4.510 -9.128 -10.473 1.00 0.00 H new ATOM 0 HD22 LEU A 126 3.374 -8.267 -11.540 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.174 -9.753 -12.105 1.00 0.00 H new ATOM 1918 N ILE A 127 4.236 -4.714 -13.357 1.00 0.00 N ATOM 1919 CA ILE A 127 4.097 -3.414 -12.695 1.00 0.00 C ATOM 1920 C ILE A 127 2.720 -2.786 -12.967 1.00 0.00 C ATOM 1921 O ILE A 127 2.132 -2.143 -12.101 1.00 0.00 O ATOM 1922 CB ILE A 127 5.302 -2.543 -13.150 1.00 0.00 C ATOM 1923 CG1 ILE A 127 5.933 -1.732 -12.003 1.00 0.00 C ATOM 1924 CG2 ILE A 127 5.038 -1.672 -14.390 1.00 0.00 C ATOM 1925 CD1 ILE A 127 4.976 -0.774 -11.298 1.00 0.00 C ATOM 0 H ILE A 127 5.020 -4.739 -14.009 1.00 0.00 H new ATOM 0 HA ILE A 127 4.127 -3.510 -11.610 1.00 0.00 H new ATOM 0 HB ILE A 127 6.042 -3.277 -13.469 1.00 0.00 H new ATOM 0 HG12 ILE A 127 6.339 -2.425 -11.267 1.00 0.00 H new ATOM 0 HG13 ILE A 127 6.772 -1.160 -12.399 1.00 0.00 H new ATOM 0 HG21 ILE A 127 5.935 -1.101 -14.631 1.00 0.00 H new ATOM 0 HG22 ILE A 127 4.776 -2.310 -15.234 1.00 0.00 H new ATOM 0 HG23 ILE A 127 4.216 -0.987 -14.185 1.00 0.00 H new ATOM 0 HD11 ILE A 127 5.507 -0.246 -10.506 1.00 0.00 H new ATOM 0 HD12 ILE A 127 4.588 -0.053 -12.017 1.00 0.00 H new ATOM 0 HD13 ILE A 127 4.149 -1.338 -10.867 1.00 0.00 H new ATOM 1937 N ALA A 128 2.142 -3.063 -14.132 1.00 0.00 N ATOM 1938 CA ALA A 128 0.838 -2.542 -14.535 1.00 0.00 C ATOM 1939 C ALA A 128 -0.360 -3.256 -13.854 1.00 0.00 C ATOM 1940 O ALA A 128 -1.489 -2.778 -13.962 1.00 0.00 O ATOM 1941 CB ALA A 128 0.784 -2.518 -16.067 1.00 0.00 C ATOM 0 H ALA A 128 2.572 -3.665 -14.834 1.00 0.00 H new ATOM 0 HA ALA A 128 0.729 -1.520 -14.172 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -0.182 -2.132 -16.391 1.00 0.00 H new ATOM 0 HB2 ALA A 128 1.578 -1.876 -16.449 1.00 0.00 H new ATOM 0 HB3 ALA A 128 0.918 -3.529 -16.452 1.00 0.00 H new ATOM 1947 N LYS A 129 -0.134 -4.348 -13.098 1.00 0.00 N ATOM 1948 CA LYS A 129 -1.145 -4.990 -12.221 1.00 0.00 C ATOM 1949 C LYS A 129 -1.420 -4.182 -10.943 1.00 0.00 C ATOM 1950 O LYS A 129 -2.509 -4.269 -10.375 1.00 0.00 O ATOM 1951 CB LYS A 129 -0.689 -6.408 -11.813 1.00 0.00 C ATOM 1952 CG LYS A 129 -0.528 -7.356 -13.003 1.00 0.00 C ATOM 1953 CD LYS A 129 -0.085 -8.760 -12.556 1.00 0.00 C ATOM 1954 CE LYS A 129 0.055 -9.646 -13.801 1.00 0.00 C ATOM 1955 NZ LYS A 129 0.362 -11.070 -13.475 1.00 0.00 N ATOM 0 H LYS A 129 0.770 -4.820 -13.076 1.00 0.00 H new ATOM 0 HA LYS A 129 -2.065 -5.036 -12.804 1.00 0.00 H new ATOM 0 HB2 LYS A 129 0.260 -6.338 -11.281 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.414 -6.829 -11.117 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -1.473 -7.427 -13.542 1.00 0.00 H new ATOM 0 HG3 LYS A 129 0.206 -6.947 -13.698 1.00 0.00 H new ATOM 0 HD2 LYS A 129 0.863 -8.706 -12.021 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -0.815 -9.186 -11.868 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -0.870 -9.602 -14.376 1.00 0.00 H new ATOM 0 HE3 LYS A 129 0.845 -9.247 -14.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 0.116 -11.673 -14.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 1.376 -11.168 -13.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -0.192 -11.363 -12.645 1.00 0.00 H new ATOM 1969 N ILE A 130 -0.418 -3.418 -10.494 1.00 0.00 N ATOM 1970 CA ILE A 130 -0.375 -2.685 -9.212 1.00 0.00 C ATOM 1971 C ILE A 130 -0.282 -1.153 -9.380 1.00 0.00 C ATOM 1972 O ILE A 130 -0.414 -0.422 -8.396 1.00 0.00 O ATOM 1973 CB ILE A 130 0.764 -3.240 -8.320 1.00 0.00 C ATOM 1974 CG1 ILE A 130 2.095 -3.353 -9.103 1.00 0.00 C ATOM 1975 CG2 ILE A 130 0.345 -4.587 -7.705 1.00 0.00 C ATOM 1976 CD1 ILE A 130 3.294 -3.823 -8.276 1.00 0.00 C ATOM 0 H ILE A 130 0.433 -3.284 -11.040 1.00 0.00 H new ATOM 0 HA ILE A 130 -1.329 -2.857 -8.713 1.00 0.00 H new ATOM 0 HB ILE A 130 0.940 -2.536 -7.507 1.00 0.00 H new ATOM 0 HG12 ILE A 130 1.953 -4.044 -9.934 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.329 -2.380 -9.534 1.00 0.00 H new ATOM 0 HG21 ILE A 130 1.152 -4.968 -7.080 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.549 -4.447 -7.097 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.134 -5.301 -8.501 1.00 0.00 H new ATOM 0 HD11 ILE A 130 4.178 -3.870 -8.912 1.00 0.00 H new ATOM 0 HD12 ILE A 130 3.471 -3.122 -7.460 1.00 0.00 H new ATOM 0 HD13 ILE A 130 3.088 -4.812 -7.866 1.00 0.00 H new ATOM 1988 N SER A 131 -0.088 -0.668 -10.614 1.00 0.00 N ATOM 1989 CA SER A 131 -0.132 0.760 -10.985 1.00 0.00 C ATOM 1990 C SER A 131 -1.567 1.302 -11.063 1.00 0.00 C ATOM 1991 O SER A 131 -2.419 0.676 -11.740 1.00 0.00 O ATOM 1992 CB SER A 131 0.586 0.994 -12.311 1.00 0.00 C ATOM 1993 OG SER A 131 1.947 0.649 -12.150 1.00 0.00 O ATOM 1994 OXT SER A 131 -1.835 2.367 -10.459 1.00 0.00 O ATOM 0 H SER A 131 0.110 -1.275 -11.409 1.00 0.00 H new ATOM 0 HA SER A 131 0.382 1.306 -10.194 1.00 0.00 H new ATOM 0 HB2 SER A 131 0.133 0.392 -13.099 1.00 0.00 H new ATOM 0 HB3 SER A 131 0.493 2.037 -12.614 1.00 0.00 H new ATOM 0 HG SER A 131 2.037 -0.327 -12.128 1.00 0.00 H new