USER MOD reduce.3.24.130724 H: found=0, std=0, add=1243, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1241 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 83 LYS NZ :NH3+ -156:sc= 0.113 (180deg=-0.297) USER MOD Set 1.2: A 85 SER OG : rot -11:sc= 0.619 USER MOD Set 2.1: A 17 THR OG1 : rot -89:sc= 0.00884 USER MOD Set 2.2: A 136 THR OG1 : rot 180:sc= -0.0279 USER MOD Set 3.1: A 2 SER OG : rot 180:sc= -0.124 USER MOD Set 3.2: A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 142:sc= 0.546 (180deg=0.0805) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -160:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 136:sc= 1.23 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl -177:sc= 0 (180deg=-0.00496) USER MOD Single : A 19 ASN : amide:sc=-0.00757 K(o=-0.0076,f=-3.6!) USER MOD Single : A 20 ASN : amide:sc= -2.57! C(o=-2.6!,f=-11!) USER MOD Single : A 22 SER OG : rot 75:sc= 0.051 USER MOD Single : A 24 CYS SG : rot 120:sc= -2.98! USER MOD Single : A 28 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0.164 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 35:sc= 0.235 USER MOD Single : A 38 SER OG : rot 176:sc= 1.23 USER MOD Single : A 39 SER OG : rot 180:sc= -0.0639 USER MOD Single : A 42 ASN : amide:sc= -1.7 K(o=-1.7,f=-4.3!) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 CYS SG : rot 180:sc= -1.84 USER MOD Single : A 52 ASN :FLIP amide:sc= -4.32! C(o=-5.6!,f=-4.3!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 68:sc= 1.08 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot -15:sc= -0.0853 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 CYS SG : rot 114:sc= 0.859 USER MOD Single : A 75 LYS NZ :NH3+ -154:sc= -0.187 (180deg=-0.669) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= -7.6! C(o=-7.6!,f=-11!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl -161:sc= -2.82 (180deg=-3.79) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 GLN : amide:sc= -0.226 X(o=-0.23,f=-0.55) USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 176:sc= 0.101 (180deg=0.0968) USER MOD Single : A 127 ASN : amide:sc= -7.5! C(o=-7.5!,f=-8.4!) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 CYS SG : rot 99:sc= -3.79! USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 145 GLN : amide:sc= -1.01 K(o=-1,f=-4.9!) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 149 ASN : amide:sc= -0.0827 X(o=-0.083,f=0) USER MOD Single : A 151 SER OG : rot 31:sc= 0.827 USER MOD Single : A 153 GLN : amide:sc= -0.135 K(o=-0.14,f=-1.9!) USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD Single : A 157 SER OG : rot 180:sc= 0 USER MOD Single : A 158 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 13.771 16.874 2.982 1.00 0.00 N ATOM 2 CA GLY A 1 14.718 17.053 4.066 1.00 0.00 C ATOM 3 C GLY A 1 14.753 15.866 5.008 1.00 0.00 C ATOM 4 O GLY A 1 13.715 15.424 5.500 1.00 0.00 O ATOM 0 H1 GLY A 1 13.302 17.779 2.778 1.00 0.00 H new ATOM 0 H2 GLY A 1 14.273 16.545 2.133 1.00 0.00 H new ATOM 0 H3 GLY A 1 13.058 16.169 3.257 1.00 0.00 H new ATOM 0 HA2 GLY A 1 15.713 17.213 3.652 1.00 0.00 H new ATOM 0 HA3 GLY A 1 14.458 17.951 4.627 1.00 0.00 H new ATOM 8 N SER A 2 15.951 15.347 5.259 1.00 0.00 N ATOM 9 CA SER A 2 16.116 14.200 6.144 1.00 0.00 C ATOM 10 C SER A 2 16.285 14.651 7.592 1.00 0.00 C ATOM 11 O SER A 2 15.682 14.085 8.504 1.00 0.00 O ATOM 12 CB SER A 2 17.325 13.367 5.713 1.00 0.00 C ATOM 13 OG SER A 2 18.539 14.024 6.036 1.00 0.00 O ATOM 0 H SER A 2 16.821 15.702 4.862 1.00 0.00 H new ATOM 0 HA SER A 2 15.218 13.587 6.075 1.00 0.00 H new ATOM 0 HB2 SER A 2 17.293 12.394 6.203 1.00 0.00 H new ATOM 0 HB3 SER A 2 17.281 13.185 4.639 1.00 0.00 H new ATOM 0 HG SER A 2 19.296 13.470 5.752 1.00 0.00 H new ATOM 19 N SER A 3 17.109 15.674 7.794 1.00 0.00 N ATOM 20 CA SER A 3 17.361 16.199 9.131 1.00 0.00 C ATOM 21 C SER A 3 16.303 17.227 9.519 1.00 0.00 C ATOM 22 O SER A 3 16.461 18.421 9.272 1.00 0.00 O ATOM 23 CB SER A 3 18.752 16.833 9.199 1.00 0.00 C ATOM 24 OG SER A 3 19.766 15.846 9.116 1.00 0.00 O ATOM 0 H SER A 3 17.613 16.156 7.050 1.00 0.00 H new ATOM 0 HA SER A 3 17.312 15.369 9.836 1.00 0.00 H new ATOM 0 HB2 SER A 3 18.869 17.549 8.385 1.00 0.00 H new ATOM 0 HB3 SER A 3 18.857 17.389 10.131 1.00 0.00 H new ATOM 0 HG SER A 3 20.645 16.276 9.160 1.00 0.00 H new ATOM 30 N GLY A 4 15.221 16.751 10.130 1.00 0.00 N ATOM 31 CA GLY A 4 14.151 17.641 10.543 1.00 0.00 C ATOM 32 C GLY A 4 13.149 16.958 11.452 1.00 0.00 C ATOM 33 O GLY A 4 12.313 16.180 10.993 1.00 0.00 O ATOM 0 H GLY A 4 15.067 15.766 10.346 1.00 0.00 H new ATOM 0 HA2 GLY A 4 14.577 18.502 11.058 1.00 0.00 H new ATOM 0 HA3 GLY A 4 13.637 18.020 9.660 1.00 0.00 H new ATOM 37 N SER A 5 13.232 17.249 12.746 1.00 0.00 N ATOM 38 CA SER A 5 12.328 16.654 13.724 1.00 0.00 C ATOM 39 C SER A 5 10.897 17.133 13.502 1.00 0.00 C ATOM 40 O SER A 5 10.491 18.172 14.022 1.00 0.00 O ATOM 41 CB SER A 5 12.780 16.999 15.144 1.00 0.00 C ATOM 42 OG SER A 5 11.789 16.648 16.094 1.00 0.00 O ATOM 0 H SER A 5 13.916 17.893 13.142 1.00 0.00 H new ATOM 0 HA SER A 5 12.354 15.572 13.596 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.708 16.474 15.371 1.00 0.00 H new ATOM 0 HB3 SER A 5 12.992 18.066 15.212 1.00 0.00 H new ATOM 0 HG SER A 5 12.103 16.877 16.994 1.00 0.00 H new ATOM 48 N SER A 6 10.137 16.367 12.726 1.00 0.00 N ATOM 49 CA SER A 6 8.751 16.713 12.432 1.00 0.00 C ATOM 50 C SER A 6 7.871 16.527 13.664 1.00 0.00 C ATOM 51 O SER A 6 7.741 15.421 14.187 1.00 0.00 O ATOM 52 CB SER A 6 8.223 15.857 11.279 1.00 0.00 C ATOM 53 OG SER A 6 8.548 16.432 10.026 1.00 0.00 O ATOM 0 H SER A 6 10.458 15.503 12.289 1.00 0.00 H new ATOM 0 HA SER A 6 8.719 17.763 12.140 1.00 0.00 H new ATOM 0 HB2 SER A 6 8.646 14.854 11.343 1.00 0.00 H new ATOM 0 HB3 SER A 6 7.141 15.753 11.365 1.00 0.00 H new ATOM 0 HG SER A 6 7.955 16.069 9.336 1.00 0.00 H new ATOM 59 N GLY A 7 7.268 17.620 14.123 1.00 0.00 N ATOM 60 CA GLY A 7 6.407 17.557 15.290 1.00 0.00 C ATOM 61 C GLY A 7 5.085 16.876 14.999 1.00 0.00 C ATOM 62 O GLY A 7 4.963 15.658 15.131 1.00 0.00 O ATOM 0 H GLY A 7 7.360 18.547 13.708 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.921 17.021 16.088 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.219 18.567 15.654 1.00 0.00 H new ATOM 66 N LYS A 8 4.090 17.663 14.604 1.00 0.00 N ATOM 67 CA LYS A 8 2.769 17.130 14.294 1.00 0.00 C ATOM 68 C LYS A 8 2.826 16.204 13.083 1.00 0.00 C ATOM 69 O LYS A 8 3.638 16.398 12.179 1.00 0.00 O ATOM 70 CB LYS A 8 1.784 18.272 14.031 1.00 0.00 C ATOM 71 CG LYS A 8 0.413 17.801 13.579 1.00 0.00 C ATOM 72 CD LYS A 8 -0.628 18.899 13.719 1.00 0.00 C ATOM 73 CE LYS A 8 -2.039 18.351 13.570 1.00 0.00 C ATOM 74 NZ LYS A 8 -3.054 19.440 13.517 1.00 0.00 N ATOM 0 H LYS A 8 4.174 18.673 14.491 1.00 0.00 H new ATOM 0 HA LYS A 8 2.426 16.554 15.154 1.00 0.00 H new ATOM 0 HB2 LYS A 8 1.674 18.863 14.941 1.00 0.00 H new ATOM 0 HB3 LYS A 8 2.201 18.932 13.271 1.00 0.00 H new ATOM 0 HG2 LYS A 8 0.463 17.476 12.540 1.00 0.00 H new ATOM 0 HG3 LYS A 8 0.112 16.935 14.169 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -0.524 19.379 14.692 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -0.453 19.666 12.965 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -2.102 17.751 12.662 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -2.261 17.688 14.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -4.003 19.026 13.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -3.012 19.997 14.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -2.857 20.059 12.704 1.00 0.00 H new ATOM 88 N VAL A 9 1.957 15.198 13.071 1.00 0.00 N ATOM 89 CA VAL A 9 1.907 14.244 11.970 1.00 0.00 C ATOM 90 C VAL A 9 0.468 13.877 11.626 1.00 0.00 C ATOM 91 O VAL A 9 -0.308 13.481 12.495 1.00 0.00 O ATOM 92 CB VAL A 9 2.687 12.959 12.305 1.00 0.00 C ATOM 93 CG1 VAL A 9 2.298 12.442 13.681 1.00 0.00 C ATOM 94 CG2 VAL A 9 2.448 11.899 11.241 1.00 0.00 C ATOM 0 H VAL A 9 1.278 15.023 13.812 1.00 0.00 H new ATOM 0 HA VAL A 9 2.371 14.728 11.110 1.00 0.00 H new ATOM 0 HB VAL A 9 3.751 13.194 12.319 1.00 0.00 H new ATOM 0 HG11 VAL A 9 2.859 11.534 13.900 1.00 0.00 H new ATOM 0 HG12 VAL A 9 2.525 13.199 14.432 1.00 0.00 H new ATOM 0 HG13 VAL A 9 1.231 12.222 13.699 1.00 0.00 H new ATOM 0 HG21 VAL A 9 3.007 10.998 11.493 1.00 0.00 H new ATOM 0 HG22 VAL A 9 1.384 11.665 11.193 1.00 0.00 H new ATOM 0 HG23 VAL A 9 2.781 12.273 10.273 1.00 0.00 H new ATOM 104 N VAL A 10 0.118 14.012 10.350 1.00 0.00 N ATOM 105 CA VAL A 10 -1.228 13.693 9.890 1.00 0.00 C ATOM 106 C VAL A 10 -1.325 12.239 9.439 1.00 0.00 C ATOM 107 O VAL A 10 -0.976 11.904 8.307 1.00 0.00 O ATOM 108 CB VAL A 10 -1.655 14.608 8.727 1.00 0.00 C ATOM 109 CG1 VAL A 10 -3.018 14.193 8.193 1.00 0.00 C ATOM 110 CG2 VAL A 10 -1.669 16.063 9.172 1.00 0.00 C ATOM 0 H VAL A 10 0.748 14.340 9.618 1.00 0.00 H new ATOM 0 HA VAL A 10 -1.897 13.854 10.735 1.00 0.00 H new ATOM 0 HB VAL A 10 -0.929 14.505 7.921 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -3.303 14.851 7.372 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -2.971 13.165 7.834 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.758 14.266 8.990 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -1.973 16.696 8.338 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -2.373 16.185 9.995 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -0.671 16.352 9.502 1.00 0.00 H new ATOM 120 N LYS A 11 -1.802 11.379 10.333 1.00 0.00 N ATOM 121 CA LYS A 11 -1.947 9.961 10.028 1.00 0.00 C ATOM 122 C LYS A 11 -3.328 9.667 9.451 1.00 0.00 C ATOM 123 O LYS A 11 -4.270 10.435 9.647 1.00 0.00 O ATOM 124 CB LYS A 11 -1.721 9.122 11.288 1.00 0.00 C ATOM 125 CG LYS A 11 -0.289 9.161 11.795 1.00 0.00 C ATOM 126 CD LYS A 11 -0.055 10.348 12.713 1.00 0.00 C ATOM 127 CE LYS A 11 -0.411 10.017 14.154 1.00 0.00 C ATOM 128 NZ LYS A 11 0.672 9.252 14.832 1.00 0.00 N ATOM 0 H LYS A 11 -2.095 11.640 11.275 1.00 0.00 H new ATOM 0 HA LYS A 11 -1.197 9.697 9.283 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -2.386 9.477 12.075 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -1.996 8.088 11.080 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -0.066 8.237 12.329 1.00 0.00 H new ATOM 0 HG3 LYS A 11 0.396 9.214 10.949 1.00 0.00 H new ATOM 0 HD2 LYS A 11 0.990 10.653 12.656 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -0.653 11.194 12.375 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.601 10.940 14.702 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -1.334 9.437 14.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 0.391 9.046 15.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 0.837 8.359 14.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 1.546 9.815 14.834 1.00 0.00 H new ATOM 142 N PHE A 12 -3.442 8.550 8.739 1.00 0.00 N ATOM 143 CA PHE A 12 -4.708 8.155 8.134 1.00 0.00 C ATOM 144 C PHE A 12 -4.646 6.714 7.634 1.00 0.00 C ATOM 145 O PHE A 12 -3.651 6.293 7.044 1.00 0.00 O ATOM 146 CB PHE A 12 -5.060 9.093 6.978 1.00 0.00 C ATOM 147 CG PHE A 12 -3.874 9.490 6.146 1.00 0.00 C ATOM 148 CD1 PHE A 12 -3.107 10.592 6.491 1.00 0.00 C ATOM 149 CD2 PHE A 12 -3.527 8.763 5.019 1.00 0.00 C ATOM 150 CE1 PHE A 12 -2.015 10.960 5.728 1.00 0.00 C ATOM 151 CE2 PHE A 12 -2.435 9.126 4.253 1.00 0.00 C ATOM 152 CZ PHE A 12 -1.679 10.227 4.607 1.00 0.00 C ATOM 0 H PHE A 12 -2.673 7.903 8.567 1.00 0.00 H new ATOM 0 HA PHE A 12 -5.483 8.223 8.897 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -5.797 8.607 6.338 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.529 9.991 7.379 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -3.366 11.170 7.366 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -4.116 7.903 4.736 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -1.425 11.820 6.008 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -2.173 8.549 3.378 1.00 0.00 H new ATOM 0 HZ PHE A 12 -0.827 10.514 4.008 1.00 0.00 H new ATOM 162 N SER A 13 -5.716 5.964 7.875 1.00 0.00 N ATOM 163 CA SER A 13 -5.782 4.569 7.454 1.00 0.00 C ATOM 164 C SER A 13 -6.812 4.385 6.344 1.00 0.00 C ATOM 165 O SER A 13 -7.772 5.149 6.240 1.00 0.00 O ATOM 166 CB SER A 13 -6.131 3.671 8.642 1.00 0.00 C ATOM 167 OG SER A 13 -7.484 3.837 9.027 1.00 0.00 O ATOM 0 H SER A 13 -6.549 6.298 8.359 1.00 0.00 H new ATOM 0 HA SER A 13 -4.803 4.285 7.069 1.00 0.00 H new ATOM 0 HB2 SER A 13 -5.950 2.629 8.379 1.00 0.00 H new ATOM 0 HB3 SER A 13 -5.479 3.906 9.483 1.00 0.00 H new ATOM 0 HG SER A 13 -7.887 2.959 9.193 1.00 0.00 H new ATOM 173 N TYR A 14 -6.606 3.367 5.516 1.00 0.00 N ATOM 174 CA TYR A 14 -7.514 3.083 4.412 1.00 0.00 C ATOM 175 C TYR A 14 -7.748 1.582 4.271 1.00 0.00 C ATOM 176 O TYR A 14 -6.818 0.820 4.007 1.00 0.00 O ATOM 177 CB TYR A 14 -6.955 3.649 3.105 1.00 0.00 C ATOM 178 CG TYR A 14 -7.637 3.106 1.870 1.00 0.00 C ATOM 179 CD1 TYR A 14 -9.009 3.239 1.695 1.00 0.00 C ATOM 180 CD2 TYR A 14 -6.910 2.460 0.878 1.00 0.00 C ATOM 181 CE1 TYR A 14 -9.636 2.744 0.568 1.00 0.00 C ATOM 182 CE2 TYR A 14 -7.528 1.964 -0.253 1.00 0.00 C ATOM 183 CZ TYR A 14 -8.892 2.108 -0.403 1.00 0.00 C ATOM 184 OH TYR A 14 -9.512 1.613 -1.528 1.00 0.00 O ATOM 0 H TYR A 14 -5.817 2.724 5.589 1.00 0.00 H new ATOM 0 HA TYR A 14 -8.469 3.562 4.628 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -7.054 4.734 3.117 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -5.889 3.427 3.049 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -9.595 3.738 2.453 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -5.843 2.344 0.993 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -10.704 2.855 0.448 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -6.947 1.466 -1.015 1.00 0.00 H new ATOM 0 HH TYR A 14 -8.845 1.196 -2.112 1.00 0.00 H new ATOM 194 N MET A 15 -8.997 1.165 4.447 1.00 0.00 N ATOM 195 CA MET A 15 -9.355 -0.245 4.338 1.00 0.00 C ATOM 196 C MET A 15 -9.669 -0.615 2.892 1.00 0.00 C ATOM 197 O MET A 15 -10.526 -0.001 2.257 1.00 0.00 O ATOM 198 CB MET A 15 -10.557 -0.559 5.230 1.00 0.00 C ATOM 199 CG MET A 15 -10.734 -2.042 5.511 1.00 0.00 C ATOM 200 SD MET A 15 -12.405 -2.452 6.050 1.00 0.00 S ATOM 201 CE MET A 15 -12.383 -1.823 7.727 1.00 0.00 C ATOM 0 H MET A 15 -9.779 1.783 4.666 1.00 0.00 H new ATOM 0 HA MET A 15 -8.502 -0.838 4.669 1.00 0.00 H new ATOM 0 HB2 MET A 15 -10.445 -0.029 6.176 1.00 0.00 H new ATOM 0 HB3 MET A 15 -11.461 -0.177 4.755 1.00 0.00 H new ATOM 0 HG2 MET A 15 -10.497 -2.609 4.611 1.00 0.00 H new ATOM 0 HG3 MET A 15 -10.023 -2.350 6.278 1.00 0.00 H new ATOM 0 HE1 MET A 15 -13.332 -2.050 8.213 1.00 0.00 H new ATOM 0 HE2 MET A 15 -11.570 -2.292 8.281 1.00 0.00 H new ATOM 0 HE3 MET A 15 -12.234 -0.743 7.709 1.00 0.00 H new ATOM 211 N TRP A 16 -8.971 -1.622 2.379 1.00 0.00 N ATOM 212 CA TRP A 16 -9.177 -2.073 1.007 1.00 0.00 C ATOM 213 C TRP A 16 -9.529 -3.556 0.969 1.00 0.00 C ATOM 214 O TRP A 16 -8.660 -4.416 1.121 1.00 0.00 O ATOM 215 CB TRP A 16 -7.924 -1.813 0.170 1.00 0.00 C ATOM 216 CG TRP A 16 -7.967 -2.460 -1.181 1.00 0.00 C ATOM 217 CD1 TRP A 16 -9.082 -2.791 -1.896 1.00 0.00 C ATOM 218 CD2 TRP A 16 -6.845 -2.857 -1.977 1.00 0.00 C ATOM 219 NE1 TRP A 16 -8.721 -3.370 -3.089 1.00 0.00 N ATOM 220 CE2 TRP A 16 -7.354 -3.421 -3.163 1.00 0.00 C ATOM 221 CE3 TRP A 16 -5.460 -2.789 -1.805 1.00 0.00 C ATOM 222 CZ2 TRP A 16 -6.526 -3.914 -4.168 1.00 0.00 C ATOM 223 CZ3 TRP A 16 -4.639 -3.279 -2.803 1.00 0.00 C ATOM 224 CH2 TRP A 16 -5.174 -3.835 -3.973 1.00 0.00 C ATOM 0 H TRP A 16 -8.258 -2.141 2.892 1.00 0.00 H new ATOM 0 HA TRP A 16 -10.010 -1.510 0.587 1.00 0.00 H new ATOM 0 HB2 TRP A 16 -7.795 -0.738 0.046 1.00 0.00 H new ATOM 0 HB3 TRP A 16 -7.052 -2.178 0.712 1.00 0.00 H new ATOM 0 HD1 TRP A 16 -10.098 -2.623 -1.572 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -9.366 -3.707 -3.803 1.00 0.00 H new ATOM 0 HE3 TRP A 16 -5.038 -2.361 -0.908 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -6.937 -4.344 -5.070 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 -3.567 -3.233 -2.679 1.00 0.00 H new ATOM 0 HH2 TRP A 16 -4.506 -4.208 -4.735 1.00 0.00 H new ATOM 235 N THR A 17 -10.809 -3.851 0.766 1.00 0.00 N ATOM 236 CA THR A 17 -11.276 -5.230 0.709 1.00 0.00 C ATOM 237 C THR A 17 -11.320 -5.737 -0.728 1.00 0.00 C ATOM 238 O THR A 17 -12.057 -5.208 -1.561 1.00 0.00 O ATOM 239 CB THR A 17 -12.676 -5.376 1.335 1.00 0.00 C ATOM 240 OG1 THR A 17 -12.733 -4.668 2.579 1.00 0.00 O ATOM 241 CG2 THR A 17 -13.017 -6.841 1.564 1.00 0.00 C ATOM 0 H THR A 17 -11.541 -3.152 0.638 1.00 0.00 H new ATOM 0 HA THR A 17 -10.566 -5.827 1.281 1.00 0.00 H new ATOM 0 HB THR A 17 -13.405 -4.954 0.643 1.00 0.00 H new ATOM 0 HG1 THR A 17 -12.455 -5.263 3.307 1.00 0.00 H new ATOM 0 HG21 THR A 17 -14.010 -6.919 2.007 1.00 0.00 H new ATOM 0 HG22 THR A 17 -13.002 -7.371 0.612 1.00 0.00 H new ATOM 0 HG23 THR A 17 -12.284 -7.284 2.238 1.00 0.00 H new ATOM 249 N ILE A 18 -10.527 -6.765 -1.012 1.00 0.00 N ATOM 250 CA ILE A 18 -10.477 -7.344 -2.349 1.00 0.00 C ATOM 251 C ILE A 18 -11.368 -8.578 -2.447 1.00 0.00 C ATOM 252 O ILE A 18 -11.004 -9.657 -1.984 1.00 0.00 O ATOM 253 CB ILE A 18 -9.039 -7.731 -2.741 1.00 0.00 C ATOM 254 CG1 ILE A 18 -8.158 -6.483 -2.829 1.00 0.00 C ATOM 255 CG2 ILE A 18 -9.035 -8.483 -4.064 1.00 0.00 C ATOM 256 CD1 ILE A 18 -6.676 -6.787 -2.821 1.00 0.00 C ATOM 0 H ILE A 18 -9.911 -7.214 -0.334 1.00 0.00 H new ATOM 0 HA ILE A 18 -10.840 -6.581 -3.037 1.00 0.00 H new ATOM 0 HB ILE A 18 -8.632 -8.387 -1.971 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -8.404 -5.938 -3.741 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -8.390 -5.825 -1.992 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -8.012 -8.750 -4.328 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -9.633 -9.389 -3.969 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -9.457 -7.849 -4.844 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -6.113 -5.856 -2.886 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -6.416 -7.305 -1.898 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -6.430 -7.420 -3.674 1.00 0.00 H new ATOM 268 N ASN A 19 -12.538 -8.409 -3.056 1.00 0.00 N ATOM 269 CA ASN A 19 -13.481 -9.509 -3.217 1.00 0.00 C ATOM 270 C ASN A 19 -12.925 -10.569 -4.163 1.00 0.00 C ATOM 271 O ASN A 19 -12.403 -10.249 -5.231 1.00 0.00 O ATOM 272 CB ASN A 19 -14.819 -8.988 -3.746 1.00 0.00 C ATOM 273 CG ASN A 19 -15.239 -7.693 -3.079 1.00 0.00 C ATOM 274 OD1 ASN A 19 -14.589 -6.659 -3.241 1.00 0.00 O ATOM 275 ND2 ASN A 19 -16.331 -7.742 -2.325 1.00 0.00 N ATOM 0 H ASN A 19 -12.855 -7.521 -3.446 1.00 0.00 H new ATOM 0 HA ASN A 19 -13.637 -9.966 -2.240 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -14.745 -8.832 -4.822 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -15.589 -9.743 -3.585 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -16.662 -6.901 -1.852 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -16.838 -8.620 -2.219 1.00 0.00 H new ATOM 282 N ASN A 20 -13.042 -11.831 -3.764 1.00 0.00 N ATOM 283 CA ASN A 20 -12.551 -12.938 -4.577 1.00 0.00 C ATOM 284 C ASN A 20 -11.033 -12.879 -4.717 1.00 0.00 C ATOM 285 O ASN A 20 -10.492 -13.054 -5.809 1.00 0.00 O ATOM 286 CB ASN A 20 -13.204 -12.911 -5.961 1.00 0.00 C ATOM 287 CG ASN A 20 -14.693 -12.633 -5.892 1.00 0.00 C ATOM 288 OD1 ASN A 20 -15.137 -11.745 -5.164 1.00 0.00 O ATOM 289 ND2 ASN A 20 -15.472 -13.394 -6.652 1.00 0.00 N ATOM 0 H ASN A 20 -13.472 -12.113 -2.883 1.00 0.00 H new ATOM 0 HA ASN A 20 -12.816 -13.869 -4.076 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -12.723 -12.148 -6.572 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -13.038 -13.867 -6.457 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -16.482 -13.254 -6.648 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -15.060 -14.118 -7.240 1.00 0.00 H new ATOM 296 N PHE A 21 -10.351 -12.631 -3.604 1.00 0.00 N ATOM 297 CA PHE A 21 -8.895 -12.548 -3.602 1.00 0.00 C ATOM 298 C PHE A 21 -8.277 -13.818 -4.179 1.00 0.00 C ATOM 299 O PHE A 21 -7.210 -13.779 -4.792 1.00 0.00 O ATOM 300 CB PHE A 21 -8.378 -12.317 -2.180 1.00 0.00 C ATOM 301 CG PHE A 21 -6.879 -12.325 -2.079 1.00 0.00 C ATOM 302 CD1 PHE A 21 -6.134 -11.252 -2.540 1.00 0.00 C ATOM 303 CD2 PHE A 21 -6.216 -13.406 -1.522 1.00 0.00 C ATOM 304 CE1 PHE A 21 -4.755 -11.258 -2.448 1.00 0.00 C ATOM 305 CE2 PHE A 21 -4.837 -13.418 -1.427 1.00 0.00 C ATOM 306 CZ PHE A 21 -4.106 -12.341 -1.890 1.00 0.00 C ATOM 0 H PHE A 21 -10.783 -12.484 -2.692 1.00 0.00 H new ATOM 0 HA PHE A 21 -8.603 -11.705 -4.229 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -8.754 -11.361 -1.816 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -8.783 -13.089 -1.525 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -6.636 -10.401 -2.976 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -6.783 -14.250 -1.158 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -4.186 -10.416 -2.812 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -4.332 -14.268 -0.992 1.00 0.00 H new ATOM 0 HZ PHE A 21 -3.029 -12.346 -1.815 1.00 0.00 H new ATOM 316 N SER A 22 -8.956 -14.943 -3.979 1.00 0.00 N ATOM 317 CA SER A 22 -8.472 -16.227 -4.475 1.00 0.00 C ATOM 318 C SER A 22 -8.548 -16.283 -5.998 1.00 0.00 C ATOM 319 O SER A 22 -7.917 -17.130 -6.631 1.00 0.00 O ATOM 320 CB SER A 22 -9.287 -17.371 -3.870 1.00 0.00 C ATOM 321 OG SER A 22 -10.661 -17.246 -4.194 1.00 0.00 O ATOM 0 H SER A 22 -9.843 -14.992 -3.477 1.00 0.00 H new ATOM 0 HA SER A 22 -7.430 -16.336 -4.176 1.00 0.00 H new ATOM 0 HB2 SER A 22 -8.909 -18.325 -4.238 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.165 -17.376 -2.787 1.00 0.00 H new ATOM 0 HG SER A 22 -10.801 -17.502 -5.129 1.00 0.00 H new ATOM 327 N PHE A 23 -9.324 -15.375 -6.580 1.00 0.00 N ATOM 328 CA PHE A 23 -9.484 -15.321 -8.028 1.00 0.00 C ATOM 329 C PHE A 23 -8.474 -14.362 -8.652 1.00 0.00 C ATOM 330 O PHE A 23 -8.629 -13.939 -9.798 1.00 0.00 O ATOM 331 CB PHE A 23 -10.906 -14.888 -8.390 1.00 0.00 C ATOM 332 CG PHE A 23 -11.939 -15.948 -8.133 1.00 0.00 C ATOM 333 CD1 PHE A 23 -12.025 -16.564 -6.895 1.00 0.00 C ATOM 334 CD2 PHE A 23 -12.824 -16.328 -9.129 1.00 0.00 C ATOM 335 CE1 PHE A 23 -12.975 -17.539 -6.654 1.00 0.00 C ATOM 336 CE2 PHE A 23 -13.776 -17.302 -8.894 1.00 0.00 C ATOM 337 CZ PHE A 23 -13.851 -17.909 -7.656 1.00 0.00 C ATOM 0 H PHE A 23 -9.852 -14.666 -6.071 1.00 0.00 H new ATOM 0 HA PHE A 23 -9.304 -16.320 -8.425 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -11.162 -13.996 -7.818 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -10.936 -14.611 -9.444 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -11.342 -16.279 -6.109 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -12.769 -15.858 -10.100 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -13.032 -18.011 -5.684 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -14.461 -17.588 -9.678 1.00 0.00 H new ATOM 0 HZ PHE A 23 -14.593 -18.672 -7.471 1.00 0.00 H new ATOM 347 N CYS A 24 -7.442 -14.022 -7.888 1.00 0.00 N ATOM 348 CA CYS A 24 -6.406 -13.111 -8.364 1.00 0.00 C ATOM 349 C CYS A 24 -6.153 -13.307 -9.855 1.00 0.00 C ATOM 350 O CYS A 24 -5.513 -14.277 -10.263 1.00 0.00 O ATOM 351 CB CYS A 24 -5.110 -13.325 -7.581 1.00 0.00 C ATOM 352 SG CYS A 24 -4.683 -15.063 -7.322 1.00 0.00 S ATOM 0 H CYS A 24 -7.300 -14.363 -6.937 1.00 0.00 H new ATOM 0 HA CYS A 24 -6.753 -12.090 -8.204 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -4.293 -12.836 -8.111 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -5.199 -12.835 -6.611 1.00 0.00 H new ATOM 0 HG CYS A 24 -3.529 -15.312 -7.866 1.00 0.00 H new ATOM 358 N ARG A 25 -6.660 -12.382 -10.663 1.00 0.00 N ATOM 359 CA ARG A 25 -6.490 -12.455 -12.109 1.00 0.00 C ATOM 360 C ARG A 25 -5.232 -11.712 -12.548 1.00 0.00 C ATOM 361 O ARG A 25 -4.650 -12.017 -13.588 1.00 0.00 O ATOM 362 CB ARG A 25 -7.714 -11.871 -12.818 1.00 0.00 C ATOM 363 CG ARG A 25 -7.771 -12.196 -14.301 1.00 0.00 C ATOM 364 CD ARG A 25 -8.345 -13.583 -14.546 1.00 0.00 C ATOM 365 NE ARG A 25 -8.531 -13.855 -15.969 1.00 0.00 N ATOM 366 CZ ARG A 25 -9.209 -14.898 -16.435 1.00 0.00 C ATOM 367 NH1 ARG A 25 -9.764 -15.761 -15.595 1.00 0.00 N ATOM 368 NH2 ARG A 25 -9.335 -15.078 -17.743 1.00 0.00 N ATOM 0 H ARG A 25 -7.192 -11.573 -10.341 1.00 0.00 H new ATOM 0 HA ARG A 25 -6.385 -13.504 -12.384 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -8.616 -12.248 -12.337 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -7.714 -10.788 -12.692 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -8.381 -11.453 -14.814 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -6.769 -12.135 -14.727 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -7.679 -14.332 -14.118 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -9.301 -13.676 -14.031 1.00 0.00 H new ATOM 0 HE ARG A 25 -8.118 -13.209 -16.642 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -9.671 -15.625 -14.588 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -10.284 -16.561 -15.955 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -8.911 -14.415 -18.392 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -9.856 -15.879 -18.100 1.00 0.00 H new ATOM 382 N GLU A 26 -4.818 -10.735 -11.746 1.00 0.00 N ATOM 383 CA GLU A 26 -3.630 -9.948 -12.053 1.00 0.00 C ATOM 384 C GLU A 26 -2.461 -10.852 -12.432 1.00 0.00 C ATOM 385 O GLU A 26 -2.092 -11.753 -11.679 1.00 0.00 O ATOM 386 CB GLU A 26 -3.247 -9.074 -10.857 1.00 0.00 C ATOM 387 CG GLU A 26 -2.455 -7.834 -11.237 1.00 0.00 C ATOM 388 CD GLU A 26 -3.328 -6.742 -11.824 1.00 0.00 C ATOM 389 OE1 GLU A 26 -4.494 -6.619 -11.394 1.00 0.00 O ATOM 390 OE2 GLU A 26 -2.845 -6.010 -12.713 1.00 0.00 O ATOM 0 H GLU A 26 -5.288 -10.470 -10.880 1.00 0.00 H new ATOM 0 HA GLU A 26 -3.861 -9.306 -12.903 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -4.154 -8.769 -10.335 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -2.661 -9.669 -10.156 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -1.943 -7.450 -10.355 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -1.685 -8.106 -11.959 1.00 0.00 H new ATOM 397 N GLU A 27 -1.883 -10.605 -13.603 1.00 0.00 N ATOM 398 CA GLU A 27 -0.757 -11.398 -14.082 1.00 0.00 C ATOM 399 C GLU A 27 0.361 -11.436 -13.045 1.00 0.00 C ATOM 400 O GLU A 27 0.301 -10.748 -12.026 1.00 0.00 O ATOM 401 CB GLU A 27 -0.227 -10.827 -15.399 1.00 0.00 C ATOM 402 CG GLU A 27 -0.919 -11.391 -16.629 1.00 0.00 C ATOM 403 CD GLU A 27 -0.510 -12.821 -16.924 1.00 0.00 C ATOM 404 OE1 GLU A 27 0.668 -13.162 -16.692 1.00 0.00 O ATOM 405 OE2 GLU A 27 -1.370 -13.599 -17.388 1.00 0.00 O ATOM 0 H GLU A 27 -2.176 -9.862 -14.238 1.00 0.00 H new ATOM 0 HA GLU A 27 -1.108 -12.416 -14.251 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -0.347 -9.744 -15.390 1.00 0.00 H new ATOM 0 HB3 GLU A 27 0.842 -11.029 -15.469 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -1.999 -11.348 -16.486 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -0.687 -10.765 -17.491 1.00 0.00 H new ATOM 412 N MET A 28 1.380 -12.247 -13.311 1.00 0.00 N ATOM 413 CA MET A 28 2.512 -12.375 -12.402 1.00 0.00 C ATOM 414 C MET A 28 3.110 -11.009 -12.082 1.00 0.00 C ATOM 415 O MET A 28 2.924 -10.480 -10.987 1.00 0.00 O ATOM 416 CB MET A 28 3.583 -13.283 -13.010 1.00 0.00 C ATOM 417 CG MET A 28 4.994 -12.945 -12.559 1.00 0.00 C ATOM 418 SD MET A 28 6.072 -14.390 -12.508 1.00 0.00 S ATOM 419 CE MET A 28 5.629 -15.086 -10.917 1.00 0.00 C ATOM 0 H MET A 28 1.444 -12.825 -14.149 1.00 0.00 H new ATOM 0 HA MET A 28 2.152 -12.821 -11.475 1.00 0.00 H new ATOM 0 HB2 MET A 28 3.364 -14.317 -12.745 1.00 0.00 H new ATOM 0 HB3 MET A 28 3.532 -13.214 -14.097 1.00 0.00 H new ATOM 0 HG2 MET A 28 5.419 -12.203 -13.235 1.00 0.00 H new ATOM 0 HG3 MET A 28 4.956 -12.490 -11.569 1.00 0.00 H new ATOM 0 HE1 MET A 28 6.213 -15.989 -10.739 1.00 0.00 H new ATOM 0 HE2 MET A 28 5.836 -14.359 -10.131 1.00 0.00 H new ATOM 0 HE3 MET A 28 4.568 -15.334 -10.911 1.00 0.00 H new ATOM 429 N GLY A 29 3.830 -10.442 -13.045 1.00 0.00 N ATOM 430 CA GLY A 29 4.445 -9.143 -12.846 1.00 0.00 C ATOM 431 C GLY A 29 3.429 -8.064 -12.528 1.00 0.00 C ATOM 432 O GLY A 29 3.644 -7.245 -11.635 1.00 0.00 O ATOM 0 H GLY A 29 3.998 -10.860 -13.960 1.00 0.00 H new ATOM 0 HA2 GLY A 29 5.169 -9.208 -12.033 1.00 0.00 H new ATOM 0 HA3 GLY A 29 4.998 -8.865 -13.743 1.00 0.00 H new ATOM 436 N GLU A 30 2.320 -8.063 -13.261 1.00 0.00 N ATOM 437 CA GLU A 30 1.268 -7.074 -13.052 1.00 0.00 C ATOM 438 C GLU A 30 1.012 -6.858 -11.564 1.00 0.00 C ATOM 439 O GLU A 30 1.439 -7.653 -10.727 1.00 0.00 O ATOM 440 CB GLU A 30 -0.023 -7.516 -13.745 1.00 0.00 C ATOM 441 CG GLU A 30 0.003 -7.336 -15.253 1.00 0.00 C ATOM 442 CD GLU A 30 0.226 -5.894 -15.665 1.00 0.00 C ATOM 443 OE1 GLU A 30 1.388 -5.438 -15.626 1.00 0.00 O ATOM 444 OE2 GLU A 30 -0.762 -5.221 -16.026 1.00 0.00 O ATOM 0 H GLU A 30 2.127 -8.735 -14.004 1.00 0.00 H new ATOM 0 HA GLU A 30 1.600 -6.131 -13.486 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -0.207 -8.566 -13.516 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -0.858 -6.949 -13.334 1.00 0.00 H new ATOM 0 HG2 GLU A 30 0.793 -7.957 -15.676 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -0.939 -7.688 -15.673 1.00 0.00 H new ATOM 451 N VAL A 31 0.312 -5.774 -11.241 1.00 0.00 N ATOM 452 CA VAL A 31 -0.002 -5.452 -9.854 1.00 0.00 C ATOM 453 C VAL A 31 -1.358 -4.764 -9.744 1.00 0.00 C ATOM 454 O VAL A 31 -1.739 -3.978 -10.612 1.00 0.00 O ATOM 455 CB VAL A 31 1.074 -4.545 -9.231 1.00 0.00 C ATOM 456 CG1 VAL A 31 1.198 -3.247 -10.015 1.00 0.00 C ATOM 457 CG2 VAL A 31 0.755 -4.266 -7.770 1.00 0.00 C ATOM 0 H VAL A 31 -0.048 -5.105 -11.921 1.00 0.00 H new ATOM 0 HA VAL A 31 -0.031 -6.395 -9.308 1.00 0.00 H new ATOM 0 HB VAL A 31 2.032 -5.063 -9.278 1.00 0.00 H new ATOM 0 HG11 VAL A 31 1.963 -2.619 -9.560 1.00 0.00 H new ATOM 0 HG12 VAL A 31 1.477 -3.469 -11.045 1.00 0.00 H new ATOM 0 HG13 VAL A 31 0.243 -2.722 -10.003 1.00 0.00 H new ATOM 0 HG21 VAL A 31 1.526 -3.623 -7.346 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -0.212 -3.769 -7.697 1.00 0.00 H new ATOM 0 HG23 VAL A 31 0.722 -5.206 -7.219 1.00 0.00 H new ATOM 467 N ILE A 32 -2.082 -5.065 -8.671 1.00 0.00 N ATOM 468 CA ILE A 32 -3.395 -4.473 -8.446 1.00 0.00 C ATOM 469 C ILE A 32 -3.285 -3.171 -7.660 1.00 0.00 C ATOM 470 O ILE A 32 -3.134 -3.182 -6.438 1.00 0.00 O ATOM 471 CB ILE A 32 -4.326 -5.439 -7.689 1.00 0.00 C ATOM 472 CG1 ILE A 32 -4.492 -6.742 -8.475 1.00 0.00 C ATOM 473 CG2 ILE A 32 -5.678 -4.787 -7.441 1.00 0.00 C ATOM 474 CD1 ILE A 32 -4.816 -7.935 -7.603 1.00 0.00 C ATOM 0 H ILE A 32 -1.782 -5.715 -7.944 1.00 0.00 H new ATOM 0 HA ILE A 32 -3.820 -4.266 -9.428 1.00 0.00 H new ATOM 0 HB ILE A 32 -3.876 -5.673 -6.724 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -5.285 -6.614 -9.212 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -3.574 -6.944 -9.027 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -6.324 -5.482 -6.905 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -5.543 -3.884 -6.845 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -6.137 -4.527 -8.395 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -4.920 -8.823 -8.226 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -4.012 -8.088 -6.883 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -5.750 -7.754 -7.071 1.00 0.00 H new ATOM 486 N LYS A 33 -3.362 -2.050 -8.369 1.00 0.00 N ATOM 487 CA LYS A 33 -3.274 -0.738 -7.738 1.00 0.00 C ATOM 488 C LYS A 33 -4.636 -0.295 -7.212 1.00 0.00 C ATOM 489 O LYS A 33 -5.598 -0.180 -7.972 1.00 0.00 O ATOM 490 CB LYS A 33 -2.740 0.294 -8.734 1.00 0.00 C ATOM 491 CG LYS A 33 -1.228 0.271 -8.881 1.00 0.00 C ATOM 492 CD LYS A 33 -0.784 0.922 -10.180 1.00 0.00 C ATOM 493 CE LYS A 33 0.575 0.405 -10.627 1.00 0.00 C ATOM 494 NZ LYS A 33 1.329 1.426 -11.405 1.00 0.00 N ATOM 0 H LYS A 33 -3.485 -2.024 -9.381 1.00 0.00 H new ATOM 0 HA LYS A 33 -2.586 -0.812 -6.896 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.194 0.115 -9.709 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -3.051 1.289 -8.415 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -0.772 0.790 -8.038 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -0.874 -0.760 -8.850 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -1.523 0.726 -10.957 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -0.738 2.003 -10.049 1.00 0.00 H new ATOM 0 HE2 LYS A 33 1.157 0.112 -9.753 1.00 0.00 H new ATOM 0 HE3 LYS A 33 0.441 -0.489 -11.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 2.249 1.035 -11.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 0.786 1.688 -12.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 1.480 2.270 -10.816 1.00 0.00 H new ATOM 508 N SER A 34 -4.709 -0.046 -5.909 1.00 0.00 N ATOM 509 CA SER A 34 -5.953 0.383 -5.281 1.00 0.00 C ATOM 510 C SER A 34 -6.227 1.856 -5.567 1.00 0.00 C ATOM 511 O SER A 34 -5.369 2.568 -6.090 1.00 0.00 O ATOM 512 CB SER A 34 -5.895 0.147 -3.771 1.00 0.00 C ATOM 513 OG SER A 34 -4.991 1.044 -3.149 1.00 0.00 O ATOM 0 H SER A 34 -3.921 -0.134 -5.267 1.00 0.00 H new ATOM 0 HA SER A 34 -6.766 -0.208 -5.703 1.00 0.00 H new ATOM 0 HB2 SER A 34 -6.889 0.272 -3.342 1.00 0.00 H new ATOM 0 HB3 SER A 34 -5.588 -0.880 -3.572 1.00 0.00 H new ATOM 0 HG SER A 34 -4.973 0.874 -2.184 1.00 0.00 H new ATOM 519 N SER A 35 -7.428 2.307 -5.220 1.00 0.00 N ATOM 520 CA SER A 35 -7.817 3.695 -5.443 1.00 0.00 C ATOM 521 C SER A 35 -6.984 4.638 -4.579 1.00 0.00 C ATOM 522 O SER A 35 -6.199 4.199 -3.738 1.00 0.00 O ATOM 523 CB SER A 35 -9.304 3.885 -5.137 1.00 0.00 C ATOM 524 OG SER A 35 -10.107 3.455 -6.223 1.00 0.00 O ATOM 0 H SER A 35 -8.148 1.732 -4.783 1.00 0.00 H new ATOM 0 HA SER A 35 -7.635 3.934 -6.491 1.00 0.00 H new ATOM 0 HB2 SER A 35 -9.569 3.324 -4.241 1.00 0.00 H new ATOM 0 HB3 SER A 35 -9.504 4.936 -4.926 1.00 0.00 H new ATOM 0 HG SER A 35 -11.053 3.585 -6.002 1.00 0.00 H new ATOM 530 N THR A 36 -7.161 5.938 -4.793 1.00 0.00 N ATOM 531 CA THR A 36 -6.427 6.944 -4.037 1.00 0.00 C ATOM 532 C THR A 36 -7.158 7.307 -2.750 1.00 0.00 C ATOM 533 O THR A 36 -8.330 7.683 -2.775 1.00 0.00 O ATOM 534 CB THR A 36 -6.208 8.223 -4.868 1.00 0.00 C ATOM 535 OG1 THR A 36 -7.464 8.713 -5.352 1.00 0.00 O ATOM 536 CG2 THR A 36 -5.277 7.954 -6.040 1.00 0.00 C ATOM 0 H THR A 36 -7.807 6.319 -5.484 1.00 0.00 H new ATOM 0 HA THR A 36 -5.458 6.509 -3.791 1.00 0.00 H new ATOM 0 HB THR A 36 -5.749 8.974 -4.225 1.00 0.00 H new ATOM 0 HG1 THR A 36 -8.161 8.543 -4.684 1.00 0.00 H new ATOM 0 HG21 THR A 36 -5.138 8.871 -6.612 1.00 0.00 H new ATOM 0 HG22 THR A 36 -4.313 7.609 -5.667 1.00 0.00 H new ATOM 0 HG23 THR A 36 -5.713 7.189 -6.682 1.00 0.00 H new ATOM 544 N PHE A 37 -6.460 7.192 -1.625 1.00 0.00 N ATOM 545 CA PHE A 37 -7.044 7.507 -0.327 1.00 0.00 C ATOM 546 C PHE A 37 -6.232 8.584 0.387 1.00 0.00 C ATOM 547 O PHE A 37 -5.004 8.603 0.312 1.00 0.00 O ATOM 548 CB PHE A 37 -7.119 6.250 0.542 1.00 0.00 C ATOM 549 CG PHE A 37 -5.795 5.563 0.718 1.00 0.00 C ATOM 550 CD1 PHE A 37 -4.937 5.936 1.740 1.00 0.00 C ATOM 551 CD2 PHE A 37 -5.409 4.544 -0.138 1.00 0.00 C ATOM 552 CE1 PHE A 37 -3.718 5.306 1.903 1.00 0.00 C ATOM 553 CE2 PHE A 37 -4.191 3.910 0.021 1.00 0.00 C ATOM 554 CZ PHE A 37 -3.345 4.291 1.044 1.00 0.00 C ATOM 0 H PHE A 37 -5.489 6.883 -1.586 1.00 0.00 H new ATOM 0 HA PHE A 37 -8.052 7.886 -0.493 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -7.513 6.519 1.522 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -7.826 5.551 0.095 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -5.224 6.728 2.416 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -6.068 4.242 -0.939 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -3.057 5.607 2.702 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -3.901 3.118 -0.654 1.00 0.00 H new ATOM 0 HZ PHE A 37 -2.394 3.796 1.172 1.00 0.00 H new ATOM 564 N SER A 38 -6.929 9.481 1.079 1.00 0.00 N ATOM 565 CA SER A 38 -6.274 10.564 1.803 1.00 0.00 C ATOM 566 C SER A 38 -6.854 10.707 3.207 1.00 0.00 C ATOM 567 O SER A 38 -7.737 9.948 3.606 1.00 0.00 O ATOM 568 CB SER A 38 -6.426 11.881 1.039 1.00 0.00 C ATOM 569 OG SER A 38 -7.663 12.505 1.339 1.00 0.00 O ATOM 0 H SER A 38 -7.946 9.479 1.153 1.00 0.00 H new ATOM 0 HA SER A 38 -5.215 10.323 1.889 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.605 12.551 1.296 1.00 0.00 H new ATOM 0 HB3 SER A 38 -6.360 11.693 -0.033 1.00 0.00 H new ATOM 0 HG SER A 38 -7.705 13.378 0.896 1.00 0.00 H new ATOM 575 N SER A 39 -6.350 11.687 3.951 1.00 0.00 N ATOM 576 CA SER A 39 -6.814 11.928 5.312 1.00 0.00 C ATOM 577 C SER A 39 -8.338 11.997 5.362 1.00 0.00 C ATOM 578 O SER A 39 -8.970 11.384 6.222 1.00 0.00 O ATOM 579 CB SER A 39 -6.216 13.227 5.855 1.00 0.00 C ATOM 580 OG SER A 39 -6.635 14.342 5.086 1.00 0.00 O ATOM 0 H SER A 39 -5.621 12.326 3.634 1.00 0.00 H new ATOM 0 HA SER A 39 -6.484 11.096 5.935 1.00 0.00 H new ATOM 0 HB2 SER A 39 -6.517 13.364 6.894 1.00 0.00 H new ATOM 0 HB3 SER A 39 -5.128 13.162 5.845 1.00 0.00 H new ATOM 0 HG SER A 39 -6.241 15.160 5.454 1.00 0.00 H new ATOM 586 N GLY A 40 -8.921 12.748 4.433 1.00 0.00 N ATOM 587 CA GLY A 40 -10.365 12.885 4.389 1.00 0.00 C ATOM 588 C GLY A 40 -10.808 14.330 4.286 1.00 0.00 C ATOM 589 O GLY A 40 -11.694 14.769 5.018 1.00 0.00 O ATOM 0 H GLY A 40 -8.419 13.264 3.710 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -10.754 12.328 3.537 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -10.796 12.439 5.285 1.00 0.00 H new ATOM 593 N ALA A 41 -10.189 15.074 3.375 1.00 0.00 N ATOM 594 CA ALA A 41 -10.525 16.479 3.178 1.00 0.00 C ATOM 595 C ALA A 41 -9.779 17.060 1.982 1.00 0.00 C ATOM 596 O ALA A 41 -8.896 16.416 1.418 1.00 0.00 O ATOM 597 CB ALA A 41 -10.213 17.277 4.436 1.00 0.00 C ATOM 0 H ALA A 41 -9.452 14.727 2.761 1.00 0.00 H new ATOM 0 HA ALA A 41 -11.593 16.546 2.973 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -10.469 18.324 4.275 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -10.796 16.885 5.269 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -9.151 17.194 4.665 1.00 0.00 H new ATOM 603 N ASN A 42 -10.143 18.280 1.599 1.00 0.00 N ATOM 604 CA ASN A 42 -9.508 18.947 0.468 1.00 0.00 C ATOM 605 C ASN A 42 -7.988 18.874 0.577 1.00 0.00 C ATOM 606 O ASN A 42 -7.374 19.614 1.345 1.00 0.00 O ATOM 607 CB ASN A 42 -9.956 20.408 0.394 1.00 0.00 C ATOM 608 CG ASN A 42 -9.729 21.149 1.698 1.00 0.00 C ATOM 609 OD1 ASN A 42 -9.162 20.603 2.644 1.00 0.00 O ATOM 610 ND2 ASN A 42 -10.171 22.400 1.752 1.00 0.00 N ATOM 0 H ASN A 42 -10.874 18.826 2.055 1.00 0.00 H new ATOM 0 HA ASN A 42 -9.814 18.434 -0.444 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -9.413 20.912 -0.406 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -11.014 20.448 0.136 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -10.046 22.949 2.603 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -10.636 22.812 0.943 1.00 0.00 H new ATOM 617 N ASP A 43 -7.388 17.978 -0.198 1.00 0.00 N ATOM 618 CA ASP A 43 -5.939 17.809 -0.191 1.00 0.00 C ATOM 619 C ASP A 43 -5.431 17.419 -1.576 1.00 0.00 C ATOM 620 O ASP A 43 -6.216 17.129 -2.479 1.00 0.00 O ATOM 621 CB ASP A 43 -5.533 16.747 0.832 1.00 0.00 C ATOM 622 CG ASP A 43 -5.676 15.338 0.293 1.00 0.00 C ATOM 623 OD1 ASP A 43 -6.797 14.791 0.355 1.00 0.00 O ATOM 624 OD2 ASP A 43 -4.668 14.782 -0.191 1.00 0.00 O ATOM 0 H ASP A 43 -7.882 17.357 -0.839 1.00 0.00 H new ATOM 0 HA ASP A 43 -5.488 18.762 0.087 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -4.499 16.914 1.134 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -6.147 16.855 1.726 1.00 0.00 H new ATOM 629 N LYS A 44 -4.112 17.415 -1.737 1.00 0.00 N ATOM 630 CA LYS A 44 -3.497 17.061 -3.010 1.00 0.00 C ATOM 631 C LYS A 44 -2.633 15.812 -2.869 1.00 0.00 C ATOM 632 O LYS A 44 -2.544 14.999 -3.791 1.00 0.00 O ATOM 633 CB LYS A 44 -2.649 18.224 -3.532 1.00 0.00 C ATOM 634 CG LYS A 44 -3.437 19.506 -3.740 1.00 0.00 C ATOM 635 CD LYS A 44 -4.314 19.426 -4.978 1.00 0.00 C ATOM 636 CE LYS A 44 -4.623 20.808 -5.533 1.00 0.00 C ATOM 637 NZ LYS A 44 -4.818 20.783 -7.009 1.00 0.00 N ATOM 0 H LYS A 44 -3.448 17.653 -1.000 1.00 0.00 H new ATOM 0 HA LYS A 44 -4.294 16.851 -3.723 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -1.838 18.416 -2.829 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -2.190 17.932 -4.477 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -4.058 19.699 -2.865 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -2.749 20.346 -3.834 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.814 18.830 -5.741 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -5.245 18.915 -4.733 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -5.521 21.199 -5.055 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -3.808 21.489 -5.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -5.027 21.744 -7.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -3.952 20.434 -7.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -5.612 20.153 -7.244 1.00 0.00 H new ATOM 651 N LEU A 45 -2.001 15.664 -1.711 1.00 0.00 N ATOM 652 CA LEU A 45 -1.145 14.512 -1.448 1.00 0.00 C ATOM 653 C LEU A 45 -1.975 13.242 -1.291 1.00 0.00 C ATOM 654 O LEU A 45 -2.616 13.029 -0.262 1.00 0.00 O ATOM 655 CB LEU A 45 -0.310 14.748 -0.188 1.00 0.00 C ATOM 656 CG LEU A 45 0.525 13.562 0.295 1.00 0.00 C ATOM 657 CD1 LEU A 45 0.939 12.687 -0.877 1.00 0.00 C ATOM 658 CD2 LEU A 45 1.750 14.049 1.058 1.00 0.00 C ATOM 0 H LEU A 45 -2.065 16.327 -0.938 1.00 0.00 H new ATOM 0 HA LEU A 45 -0.477 14.385 -2.300 1.00 0.00 H new ATOM 0 HB2 LEU A 45 0.360 15.588 -0.372 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -0.981 15.047 0.618 1.00 0.00 H new ATOM 0 HG LEU A 45 -0.086 12.963 0.970 1.00 0.00 H new ATOM 0 HD11 LEU A 45 1.532 11.848 -0.513 1.00 0.00 H new ATOM 0 HD12 LEU A 45 0.049 12.310 -1.382 1.00 0.00 H new ATOM 0 HD13 LEU A 45 1.532 13.274 -1.578 1.00 0.00 H new ATOM 0 HD21 LEU A 45 2.333 13.192 1.395 1.00 0.00 H new ATOM 0 HD22 LEU A 45 2.362 14.671 0.405 1.00 0.00 H new ATOM 0 HD23 LEU A 45 1.432 14.633 1.921 1.00 0.00 H new ATOM 670 N LYS A 46 -1.957 12.399 -2.318 1.00 0.00 N ATOM 671 CA LYS A 46 -2.705 11.147 -2.295 1.00 0.00 C ATOM 672 C LYS A 46 -1.769 9.958 -2.102 1.00 0.00 C ATOM 673 O LYS A 46 -0.548 10.101 -2.167 1.00 0.00 O ATOM 674 CB LYS A 46 -3.499 10.979 -3.592 1.00 0.00 C ATOM 675 CG LYS A 46 -4.560 12.047 -3.798 1.00 0.00 C ATOM 676 CD LYS A 46 -5.754 11.831 -2.883 1.00 0.00 C ATOM 677 CE LYS A 46 -6.899 12.769 -3.230 1.00 0.00 C ATOM 678 NZ LYS A 46 -8.215 12.221 -2.797 1.00 0.00 N ATOM 0 H LYS A 46 -1.432 12.560 -3.178 1.00 0.00 H new ATOM 0 HA LYS A 46 -3.398 11.182 -1.454 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -2.809 10.997 -4.436 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -3.977 9.999 -3.591 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -4.129 13.030 -3.609 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -4.890 12.038 -4.837 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -6.092 10.798 -2.962 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -5.453 11.990 -1.847 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -6.734 13.736 -2.754 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -6.914 12.942 -4.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -8.970 12.889 -3.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -8.385 11.311 -3.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -8.210 12.080 -1.767 1.00 0.00 H new ATOM 692 N TRP A 47 -2.349 8.787 -1.866 1.00 0.00 N ATOM 693 CA TRP A 47 -1.566 7.573 -1.666 1.00 0.00 C ATOM 694 C TRP A 47 -2.280 6.361 -2.255 1.00 0.00 C ATOM 695 O TRP A 47 -3.507 6.341 -2.355 1.00 0.00 O ATOM 696 CB TRP A 47 -1.303 7.351 -0.175 1.00 0.00 C ATOM 697 CG TRP A 47 -0.636 8.517 0.490 1.00 0.00 C ATOM 698 CD1 TRP A 47 -1.236 9.656 0.944 1.00 0.00 C ATOM 699 CD2 TRP A 47 0.761 8.656 0.774 1.00 0.00 C ATOM 700 NE1 TRP A 47 -0.298 10.496 1.493 1.00 0.00 N ATOM 701 CE2 TRP A 47 0.935 9.905 1.402 1.00 0.00 C ATOM 702 CE3 TRP A 47 1.880 7.848 0.561 1.00 0.00 C ATOM 703 CZ2 TRP A 47 2.183 10.362 1.816 1.00 0.00 C ATOM 704 CZ3 TRP A 47 3.118 8.303 0.973 1.00 0.00 C ATOM 705 CH2 TRP A 47 3.262 9.550 1.595 1.00 0.00 C ATOM 0 H TRP A 47 -3.358 8.652 -1.808 1.00 0.00 H new ATOM 0 HA TRP A 47 -0.614 7.696 -2.182 1.00 0.00 H new ATOM 0 HB2 TRP A 47 -2.249 7.148 0.327 1.00 0.00 H new ATOM 0 HB3 TRP A 47 -0.679 6.466 -0.051 1.00 0.00 H new ATOM 0 HD1 TRP A 47 -2.294 9.866 0.881 1.00 0.00 H new ATOM 0 HE1 TRP A 47 -0.488 11.411 1.902 1.00 0.00 H new ATOM 0 HE3 TRP A 47 1.780 6.885 0.083 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 2.296 11.324 2.295 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 3.990 7.686 0.813 1.00 0.00 H new ATOM 0 HH2 TRP A 47 4.243 9.877 1.906 1.00 0.00 H new ATOM 716 N CYS A 48 -1.505 5.355 -2.643 1.00 0.00 N ATOM 717 CA CYS A 48 -2.064 4.139 -3.223 1.00 0.00 C ATOM 718 C CYS A 48 -1.265 2.913 -2.791 1.00 0.00 C ATOM 719 O CYS A 48 -0.077 3.011 -2.480 1.00 0.00 O ATOM 720 CB CYS A 48 -2.083 4.239 -4.749 1.00 0.00 C ATOM 721 SG CYS A 48 -0.545 3.718 -5.542 1.00 0.00 S ATOM 0 H CYS A 48 -0.488 5.357 -2.567 1.00 0.00 H new ATOM 0 HA CYS A 48 -3.086 4.030 -2.861 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -2.901 3.629 -5.132 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -2.294 5.270 -5.032 1.00 0.00 H new ATOM 0 HG CYS A 48 -0.660 3.837 -6.831 1.00 0.00 H new ATOM 727 N LEU A 49 -1.925 1.760 -2.774 1.00 0.00 N ATOM 728 CA LEU A 49 -1.276 0.514 -2.379 1.00 0.00 C ATOM 729 C LEU A 49 -1.105 -0.414 -3.577 1.00 0.00 C ATOM 730 O LEU A 49 -2.013 -0.562 -4.395 1.00 0.00 O ATOM 731 CB LEU A 49 -2.092 -0.185 -1.290 1.00 0.00 C ATOM 732 CG LEU A 49 -2.195 0.549 0.048 1.00 0.00 C ATOM 733 CD1 LEU A 49 -3.204 -0.135 0.956 1.00 0.00 C ATOM 734 CD2 LEU A 49 -0.832 0.623 0.722 1.00 0.00 C ATOM 0 H LEU A 49 -2.908 1.662 -3.029 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.288 0.755 -1.986 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -3.100 -0.350 -1.669 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.654 -1.167 -1.110 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.540 1.565 -0.143 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -3.263 0.401 1.903 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -4.183 -0.135 0.477 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.890 -1.162 1.140 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -0.924 1.148 1.673 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.459 -0.386 0.900 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.136 1.159 0.077 1.00 0.00 H new ATOM 746 N ARG A 50 0.064 -1.038 -3.672 1.00 0.00 N ATOM 747 CA ARG A 50 0.354 -1.953 -4.770 1.00 0.00 C ATOM 748 C ARG A 50 0.472 -3.388 -4.264 1.00 0.00 C ATOM 749 O ARG A 50 1.482 -3.768 -3.672 1.00 0.00 O ATOM 750 CB ARG A 50 1.647 -1.543 -5.476 1.00 0.00 C ATOM 751 CG ARG A 50 1.431 -0.575 -6.628 1.00 0.00 C ATOM 752 CD ARG A 50 2.751 -0.131 -7.238 1.00 0.00 C ATOM 753 NE ARG A 50 3.466 -1.241 -7.864 1.00 0.00 N ATOM 754 CZ ARG A 50 4.655 -1.116 -8.441 1.00 0.00 C ATOM 755 NH1 ARG A 50 5.261 0.063 -8.472 1.00 0.00 N ATOM 756 NH2 ARG A 50 5.242 -2.173 -8.989 1.00 0.00 N ATOM 0 H ARG A 50 0.826 -0.927 -3.003 1.00 0.00 H new ATOM 0 HA ARG A 50 -0.471 -1.902 -5.480 1.00 0.00 H new ATOM 0 HB2 ARG A 50 2.319 -1.086 -4.749 1.00 0.00 H new ATOM 0 HB3 ARG A 50 2.145 -2.437 -5.852 1.00 0.00 H new ATOM 0 HG2 ARG A 50 0.817 -1.050 -7.393 1.00 0.00 H new ATOM 0 HG3 ARG A 50 0.881 0.297 -6.274 1.00 0.00 H new ATOM 0 HD2 ARG A 50 2.564 0.645 -7.981 1.00 0.00 H new ATOM 0 HD3 ARG A 50 3.377 0.313 -6.464 1.00 0.00 H new ATOM 0 HE ARG A 50 3.028 -2.162 -7.857 1.00 0.00 H new ATOM 0 HH11 ARG A 50 4.814 0.878 -8.052 1.00 0.00 H new ATOM 0 HH12 ARG A 50 6.175 0.155 -8.916 1.00 0.00 H new ATOM 0 HH21 ARG A 50 4.779 -3.082 -8.967 1.00 0.00 H new ATOM 0 HH22 ARG A 50 6.156 -2.076 -9.432 1.00 0.00 H new ATOM 770 N VAL A 51 -0.568 -4.181 -4.503 1.00 0.00 N ATOM 771 CA VAL A 51 -0.582 -5.574 -4.073 1.00 0.00 C ATOM 772 C VAL A 51 -0.401 -6.517 -5.257 1.00 0.00 C ATOM 773 O VAL A 51 -0.891 -6.252 -6.354 1.00 0.00 O ATOM 774 CB VAL A 51 -1.894 -5.925 -3.347 1.00 0.00 C ATOM 775 CG1 VAL A 51 -1.966 -7.418 -3.064 1.00 0.00 C ATOM 776 CG2 VAL A 51 -2.022 -5.124 -2.060 1.00 0.00 C ATOM 0 H VAL A 51 -1.412 -3.882 -4.992 1.00 0.00 H new ATOM 0 HA VAL A 51 0.251 -5.699 -3.382 1.00 0.00 H new ATOM 0 HB VAL A 51 -2.729 -5.662 -3.997 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -2.900 -7.646 -2.551 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -1.924 -7.969 -4.004 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -1.125 -7.710 -2.435 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -2.955 -5.385 -1.560 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -1.182 -5.353 -1.404 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -2.021 -4.059 -2.293 1.00 0.00 H new ATOM 786 N ASN A 52 0.305 -7.619 -5.027 1.00 0.00 N ATOM 787 CA ASN A 52 0.551 -8.602 -6.076 1.00 0.00 C ATOM 788 C ASN A 52 0.310 -10.018 -5.561 1.00 0.00 C ATOM 789 O ASN A 52 1.135 -10.598 -4.854 1.00 0.00 O ATOM 790 CB ASN A 52 1.983 -8.475 -6.598 1.00 0.00 C ATOM 791 CG ASN A 52 2.476 -7.041 -6.590 1.00 0.00 C ATOM 792 OD1 ASN A 52 2.878 -6.547 -7.755 1.00 0.00 O flip ATOM 793 ND2 ASN A 52 2.495 -6.385 -5.548 1.00 0.00 N flip ATOM 0 H ASN A 52 0.717 -7.854 -4.124 1.00 0.00 H new ATOM 0 HA ASN A 52 -0.145 -8.407 -6.892 1.00 0.00 H new ATOM 0 HB2 ASN A 52 2.645 -9.088 -5.986 1.00 0.00 H new ATOM 0 HB3 ASN A 52 2.033 -8.868 -7.614 1.00 0.00 H new ATOM 0 HD21 ASN A 52 2.176 -6.805 -4.675 1.00 0.00 H new ATOM 0 HD22 ASN A 52 2.829 -5.421 -5.558 1.00 0.00 H new ATOM 800 N PRO A 53 -0.848 -10.590 -5.924 1.00 0.00 N ATOM 801 CA PRO A 53 -1.225 -11.946 -5.511 1.00 0.00 C ATOM 802 C PRO A 53 -0.372 -13.015 -6.186 1.00 0.00 C ATOM 803 O PRO A 53 0.077 -13.963 -5.542 1.00 0.00 O ATOM 804 CB PRO A 53 -2.683 -12.061 -5.963 1.00 0.00 C ATOM 805 CG PRO A 53 -2.809 -11.094 -7.089 1.00 0.00 C ATOM 806 CD PRO A 53 -1.878 -9.958 -6.765 1.00 0.00 C ATOM 0 HA PRO A 53 -1.082 -12.102 -4.442 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -2.919 -13.075 -6.284 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -3.369 -11.816 -5.152 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -2.540 -11.561 -8.036 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -3.836 -10.741 -7.188 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -1.448 -9.521 -7.666 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -2.392 -9.156 -6.236 1.00 0.00 H new ATOM 814 N LYS A 54 -0.152 -12.856 -7.486 1.00 0.00 N ATOM 815 CA LYS A 54 0.649 -13.807 -8.249 1.00 0.00 C ATOM 816 C LYS A 54 2.139 -13.550 -8.045 1.00 0.00 C ATOM 817 O LYS A 54 2.981 -14.287 -8.555 1.00 0.00 O ATOM 818 CB LYS A 54 0.304 -13.717 -9.737 1.00 0.00 C ATOM 819 CG LYS A 54 0.879 -14.853 -10.564 1.00 0.00 C ATOM 820 CD LYS A 54 0.176 -14.979 -11.905 1.00 0.00 C ATOM 821 CE LYS A 54 0.510 -16.296 -12.589 1.00 0.00 C ATOM 822 NZ LYS A 54 -0.304 -17.422 -12.054 1.00 0.00 N ATOM 0 H LYS A 54 -0.517 -12.077 -8.034 1.00 0.00 H new ATOM 0 HA LYS A 54 0.419 -14.810 -7.889 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -0.780 -13.709 -9.850 1.00 0.00 H new ATOM 0 HB3 LYS A 54 0.673 -12.770 -10.130 1.00 0.00 H new ATOM 0 HG2 LYS A 54 1.944 -14.684 -10.725 1.00 0.00 H new ATOM 0 HG3 LYS A 54 0.784 -15.789 -10.013 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -0.902 -14.906 -11.760 1.00 0.00 H new ATOM 0 HD3 LYS A 54 0.468 -14.149 -12.549 1.00 0.00 H new ATOM 0 HE2 LYS A 54 0.339 -16.202 -13.661 1.00 0.00 H new ATOM 0 HE3 LYS A 54 1.569 -16.517 -12.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -0.046 -18.301 -12.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -0.122 -17.529 -11.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -1.313 -17.223 -12.206 1.00 0.00 H new ATOM 836 N GLY A 55 2.457 -12.500 -7.293 1.00 0.00 N ATOM 837 CA GLY A 55 3.845 -12.166 -7.034 1.00 0.00 C ATOM 838 C GLY A 55 4.566 -11.680 -8.276 1.00 0.00 C ATOM 839 O GLY A 55 4.226 -12.070 -9.394 1.00 0.00 O ATOM 0 H GLY A 55 1.778 -11.875 -6.859 1.00 0.00 H new ATOM 0 HA2 GLY A 55 3.893 -11.395 -6.265 1.00 0.00 H new ATOM 0 HA3 GLY A 55 4.359 -13.042 -6.639 1.00 0.00 H new ATOM 843 N LEU A 56 5.563 -10.824 -8.082 1.00 0.00 N ATOM 844 CA LEU A 56 6.333 -10.281 -9.195 1.00 0.00 C ATOM 845 C LEU A 56 7.050 -11.393 -9.955 1.00 0.00 C ATOM 846 O LEU A 56 6.879 -11.542 -11.165 1.00 0.00 O ATOM 847 CB LEU A 56 7.350 -9.258 -8.687 1.00 0.00 C ATOM 848 CG LEU A 56 6.778 -7.922 -8.211 1.00 0.00 C ATOM 849 CD1 LEU A 56 5.880 -7.315 -9.278 1.00 0.00 C ATOM 850 CD2 LEU A 56 6.012 -8.104 -6.908 1.00 0.00 C ATOM 0 H LEU A 56 5.857 -10.491 -7.164 1.00 0.00 H new ATOM 0 HA LEU A 56 5.640 -9.788 -9.877 1.00 0.00 H new ATOM 0 HB2 LEU A 56 7.906 -9.706 -7.864 1.00 0.00 H new ATOM 0 HB3 LEU A 56 8.066 -9.060 -9.485 1.00 0.00 H new ATOM 0 HG LEU A 56 7.607 -7.238 -8.030 1.00 0.00 H new ATOM 0 HD11 LEU A 56 5.482 -6.365 -8.921 1.00 0.00 H new ATOM 0 HD12 LEU A 56 6.457 -7.148 -10.188 1.00 0.00 H new ATOM 0 HD13 LEU A 56 5.056 -7.996 -9.491 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.612 -7.143 -6.584 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.192 -8.805 -7.063 1.00 0.00 H new ATOM 0 HD23 LEU A 56 6.683 -8.494 -6.143 1.00 0.00 H new ATOM 862 N ASP A 57 7.851 -12.172 -9.236 1.00 0.00 N ATOM 863 CA ASP A 57 8.592 -13.273 -9.841 1.00 0.00 C ATOM 864 C ASP A 57 8.517 -14.522 -8.969 1.00 0.00 C ATOM 865 O ASP A 57 8.024 -14.475 -7.843 1.00 0.00 O ATOM 866 CB ASP A 57 10.053 -12.874 -10.058 1.00 0.00 C ATOM 867 CG ASP A 57 10.925 -14.056 -10.436 1.00 0.00 C ATOM 868 OD1 ASP A 57 10.777 -14.564 -11.567 1.00 0.00 O ATOM 869 OD2 ASP A 57 11.754 -14.472 -9.600 1.00 0.00 O ATOM 0 H ASP A 57 8.004 -12.061 -8.234 1.00 0.00 H new ATOM 0 HA ASP A 57 8.138 -13.498 -10.806 1.00 0.00 H new ATOM 0 HB2 ASP A 57 10.108 -12.120 -10.843 1.00 0.00 H new ATOM 0 HB3 ASP A 57 10.441 -12.416 -9.148 1.00 0.00 H new ATOM 874 N GLU A 58 9.007 -15.638 -9.500 1.00 0.00 N ATOM 875 CA GLU A 58 8.993 -16.900 -8.770 1.00 0.00 C ATOM 876 C GLU A 58 9.622 -16.738 -7.390 1.00 0.00 C ATOM 877 O GLU A 58 9.395 -17.550 -6.493 1.00 0.00 O ATOM 878 CB GLU A 58 9.738 -17.980 -9.559 1.00 0.00 C ATOM 879 CG GLU A 58 9.036 -18.389 -10.843 1.00 0.00 C ATOM 880 CD GLU A 58 9.336 -17.452 -11.996 1.00 0.00 C ATOM 881 OE1 GLU A 58 10.520 -17.098 -12.179 1.00 0.00 O ATOM 882 OE2 GLU A 58 8.389 -17.072 -12.715 1.00 0.00 O ATOM 0 H GLU A 58 9.418 -15.694 -10.432 1.00 0.00 H new ATOM 0 HA GLU A 58 7.954 -17.205 -8.643 1.00 0.00 H new ATOM 0 HB2 GLU A 58 10.737 -17.617 -9.801 1.00 0.00 H new ATOM 0 HB3 GLU A 58 9.862 -18.859 -8.927 1.00 0.00 H new ATOM 0 HG2 GLU A 58 9.341 -19.400 -11.113 1.00 0.00 H new ATOM 0 HG3 GLU A 58 7.960 -18.415 -10.672 1.00 0.00 H new ATOM 889 N GLU A 59 10.415 -15.683 -7.228 1.00 0.00 N ATOM 890 CA GLU A 59 11.078 -15.415 -5.957 1.00 0.00 C ATOM 891 C GLU A 59 10.059 -15.271 -4.831 1.00 0.00 C ATOM 892 O GLU A 59 10.225 -15.841 -3.752 1.00 0.00 O ATOM 893 CB GLU A 59 11.926 -14.145 -6.057 1.00 0.00 C ATOM 894 CG GLU A 59 12.610 -13.766 -4.755 1.00 0.00 C ATOM 895 CD GLU A 59 13.972 -14.414 -4.600 1.00 0.00 C ATOM 896 OE1 GLU A 59 14.578 -14.773 -5.632 1.00 0.00 O ATOM 897 OE2 GLU A 59 14.432 -14.562 -3.449 1.00 0.00 O ATOM 0 H GLU A 59 10.614 -15.001 -7.960 1.00 0.00 H new ATOM 0 HA GLU A 59 11.727 -16.261 -5.730 1.00 0.00 H new ATOM 0 HB2 GLU A 59 12.683 -14.284 -6.828 1.00 0.00 H new ATOM 0 HB3 GLU A 59 11.292 -13.319 -6.378 1.00 0.00 H new ATOM 0 HG2 GLU A 59 12.720 -12.683 -4.709 1.00 0.00 H new ATOM 0 HG3 GLU A 59 11.976 -14.058 -3.918 1.00 0.00 H new ATOM 904 N SER A 60 9.004 -14.505 -5.089 1.00 0.00 N ATOM 905 CA SER A 60 7.959 -14.282 -4.097 1.00 0.00 C ATOM 906 C SER A 60 6.593 -14.675 -4.649 1.00 0.00 C ATOM 907 O SER A 60 5.634 -13.906 -4.574 1.00 0.00 O ATOM 908 CB SER A 60 7.944 -12.814 -3.663 1.00 0.00 C ATOM 909 OG SER A 60 7.256 -12.011 -4.606 1.00 0.00 O ATOM 0 H SER A 60 8.850 -14.028 -5.977 1.00 0.00 H new ATOM 0 HA SER A 60 8.175 -14.908 -3.231 1.00 0.00 H new ATOM 0 HB2 SER A 60 7.466 -12.725 -2.687 1.00 0.00 H new ATOM 0 HB3 SER A 60 8.967 -12.454 -3.551 1.00 0.00 H new ATOM 0 HG SER A 60 6.302 -12.236 -4.593 1.00 0.00 H new ATOM 915 N LYS A 61 6.510 -15.880 -5.203 1.00 0.00 N ATOM 916 CA LYS A 61 5.262 -16.379 -5.767 1.00 0.00 C ATOM 917 C LYS A 61 4.391 -17.012 -4.686 1.00 0.00 C ATOM 918 O LYS A 61 3.163 -16.994 -4.776 1.00 0.00 O ATOM 919 CB LYS A 61 5.549 -17.402 -6.868 1.00 0.00 C ATOM 920 CG LYS A 61 6.035 -18.742 -6.343 1.00 0.00 C ATOM 921 CD LYS A 61 6.430 -19.675 -7.475 1.00 0.00 C ATOM 922 CE LYS A 61 5.208 -20.233 -8.189 1.00 0.00 C ATOM 923 NZ LYS A 61 4.606 -21.376 -7.448 1.00 0.00 N ATOM 0 H LYS A 61 7.293 -16.529 -5.273 1.00 0.00 H new ATOM 0 HA LYS A 61 4.723 -15.534 -6.195 1.00 0.00 H new ATOM 0 HB2 LYS A 61 4.642 -17.558 -7.453 1.00 0.00 H new ATOM 0 HB3 LYS A 61 6.299 -16.993 -7.545 1.00 0.00 H new ATOM 0 HG2 LYS A 61 6.889 -18.587 -5.683 1.00 0.00 H new ATOM 0 HG3 LYS A 61 5.250 -19.206 -5.745 1.00 0.00 H new ATOM 0 HD2 LYS A 61 7.056 -19.139 -8.188 1.00 0.00 H new ATOM 0 HD3 LYS A 61 7.028 -20.496 -7.080 1.00 0.00 H new ATOM 0 HE2 LYS A 61 4.465 -19.445 -8.306 1.00 0.00 H new ATOM 0 HE3 LYS A 61 5.489 -20.558 -9.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 3.776 -21.728 -7.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 5.307 -22.139 -7.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 4.314 -21.061 -6.501 1.00 0.00 H new ATOM 937 N ASP A 62 5.033 -17.567 -3.665 1.00 0.00 N ATOM 938 CA ASP A 62 4.317 -18.202 -2.565 1.00 0.00 C ATOM 939 C ASP A 62 3.527 -17.172 -1.763 1.00 0.00 C ATOM 940 O ASP A 62 2.312 -17.290 -1.609 1.00 0.00 O ATOM 941 CB ASP A 62 5.295 -18.939 -1.649 1.00 0.00 C ATOM 942 CG ASP A 62 5.763 -20.254 -2.240 1.00 0.00 C ATOM 943 OD1 ASP A 62 6.616 -20.225 -3.152 1.00 0.00 O ATOM 944 OD2 ASP A 62 5.277 -21.313 -1.790 1.00 0.00 O ATOM 0 H ASP A 62 6.049 -17.590 -3.576 1.00 0.00 H new ATOM 0 HA ASP A 62 3.616 -18.921 -2.988 1.00 0.00 H new ATOM 0 HB2 ASP A 62 6.159 -18.302 -1.457 1.00 0.00 H new ATOM 0 HB3 ASP A 62 4.817 -19.126 -0.687 1.00 0.00 H new ATOM 949 N TYR A 63 4.227 -16.163 -1.255 1.00 0.00 N ATOM 950 CA TYR A 63 3.592 -15.114 -0.467 1.00 0.00 C ATOM 951 C TYR A 63 3.108 -13.977 -1.361 1.00 0.00 C ATOM 952 O TYR A 63 3.316 -13.995 -2.575 1.00 0.00 O ATOM 953 CB TYR A 63 4.567 -14.574 0.581 1.00 0.00 C ATOM 954 CG TYR A 63 5.531 -15.615 1.104 1.00 0.00 C ATOM 955 CD1 TYR A 63 6.641 -15.998 0.361 1.00 0.00 C ATOM 956 CD2 TYR A 63 5.331 -16.216 2.341 1.00 0.00 C ATOM 957 CE1 TYR A 63 7.524 -16.949 0.835 1.00 0.00 C ATOM 958 CE2 TYR A 63 6.210 -17.166 2.824 1.00 0.00 C ATOM 959 CZ TYR A 63 7.304 -17.530 2.067 1.00 0.00 C ATOM 960 OH TYR A 63 8.181 -18.478 2.543 1.00 0.00 O ATOM 0 H TYR A 63 5.234 -16.050 -1.375 1.00 0.00 H new ATOM 0 HA TYR A 63 2.728 -15.547 0.038 1.00 0.00 H new ATOM 0 HB2 TYR A 63 5.135 -13.751 0.147 1.00 0.00 H new ATOM 0 HB3 TYR A 63 3.999 -14.164 1.416 1.00 0.00 H new ATOM 0 HD1 TYR A 63 6.816 -15.545 -0.603 1.00 0.00 H new ATOM 0 HD2 TYR A 63 4.474 -15.936 2.935 1.00 0.00 H new ATOM 0 HE1 TYR A 63 8.382 -17.236 0.245 1.00 0.00 H new ATOM 0 HE2 TYR A 63 6.042 -17.621 3.789 1.00 0.00 H new ATOM 0 HH TYR A 63 7.883 -18.786 3.424 1.00 0.00 H new ATOM 970 N LEU A 64 2.462 -12.989 -0.753 1.00 0.00 N ATOM 971 CA LEU A 64 1.948 -11.841 -1.493 1.00 0.00 C ATOM 972 C LEU A 64 2.925 -10.672 -1.431 1.00 0.00 C ATOM 973 O LEU A 64 3.738 -10.576 -0.511 1.00 0.00 O ATOM 974 CB LEU A 64 0.589 -11.416 -0.933 1.00 0.00 C ATOM 975 CG LEU A 64 -0.061 -10.203 -1.601 1.00 0.00 C ATOM 976 CD1 LEU A 64 -1.577 -10.313 -1.544 1.00 0.00 C ATOM 977 CD2 LEU A 64 0.407 -8.915 -0.940 1.00 0.00 C ATOM 0 H LEU A 64 2.281 -12.959 0.250 1.00 0.00 H new ATOM 0 HA LEU A 64 1.828 -12.135 -2.536 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.095 -12.261 -1.014 1.00 0.00 H new ATOM 0 HB3 LEU A 64 0.707 -11.201 0.129 1.00 0.00 H new ATOM 0 HG LEU A 64 0.243 -10.181 -2.647 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -2.023 -9.442 -2.024 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.896 -11.217 -2.064 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.900 -10.360 -0.504 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -0.066 -8.063 -1.428 1.00 0.00 H new ATOM 0 HD22 LEU A 64 0.133 -8.927 0.115 1.00 0.00 H new ATOM 0 HD23 LEU A 64 1.490 -8.831 -1.032 1.00 0.00 H new ATOM 989 N SER A 65 2.839 -9.782 -2.415 1.00 0.00 N ATOM 990 CA SER A 65 3.717 -8.619 -2.474 1.00 0.00 C ATOM 991 C SER A 65 2.913 -7.327 -2.373 1.00 0.00 C ATOM 992 O SER A 65 2.120 -7.004 -3.259 1.00 0.00 O ATOM 993 CB SER A 65 4.526 -8.630 -3.772 1.00 0.00 C ATOM 994 OG SER A 65 5.631 -7.746 -3.691 1.00 0.00 O ATOM 0 H SER A 65 2.170 -9.844 -3.182 1.00 0.00 H new ATOM 0 HA SER A 65 4.402 -8.668 -1.627 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.879 -9.641 -3.976 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.886 -8.342 -4.606 1.00 0.00 H new ATOM 0 HG SER A 65 5.509 -7.138 -2.932 1.00 0.00 H new ATOM 1000 N LEU A 66 3.123 -6.590 -1.288 1.00 0.00 N ATOM 1001 CA LEU A 66 2.419 -5.331 -1.069 1.00 0.00 C ATOM 1002 C LEU A 66 3.401 -4.200 -0.782 1.00 0.00 C ATOM 1003 O LEU A 66 4.085 -4.203 0.242 1.00 0.00 O ATOM 1004 CB LEU A 66 1.432 -5.471 0.091 1.00 0.00 C ATOM 1005 CG LEU A 66 0.338 -4.406 0.175 1.00 0.00 C ATOM 1006 CD1 LEU A 66 -0.792 -4.870 1.080 1.00 0.00 C ATOM 1007 CD2 LEU A 66 0.915 -3.088 0.672 1.00 0.00 C ATOM 0 H LEU A 66 3.775 -6.843 -0.546 1.00 0.00 H new ATOM 0 HA LEU A 66 1.870 -5.088 -1.979 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.955 -6.448 0.019 1.00 0.00 H new ATOM 0 HB3 LEU A 66 1.995 -5.459 1.024 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.067 -4.249 -0.825 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.561 -4.099 1.127 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -1.223 -5.788 0.682 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -0.403 -5.056 2.081 1.00 0.00 H new ATOM 0 HD21 LEU A 66 0.123 -2.341 0.726 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.347 -3.230 1.662 1.00 0.00 H new ATOM 0 HD23 LEU A 66 1.689 -2.747 -0.016 1.00 0.00 H new ATOM 1019 N TYR A 67 3.465 -3.235 -1.692 1.00 0.00 N ATOM 1020 CA TYR A 67 4.364 -2.097 -1.537 1.00 0.00 C ATOM 1021 C TYR A 67 3.582 -0.788 -1.491 1.00 0.00 C ATOM 1022 O TYR A 67 2.525 -0.659 -2.111 1.00 0.00 O ATOM 1023 CB TYR A 67 5.375 -2.060 -2.684 1.00 0.00 C ATOM 1024 CG TYR A 67 6.515 -3.039 -2.519 1.00 0.00 C ATOM 1025 CD1 TYR A 67 6.374 -4.369 -2.893 1.00 0.00 C ATOM 1026 CD2 TYR A 67 7.733 -2.634 -1.987 1.00 0.00 C ATOM 1027 CE1 TYR A 67 7.413 -5.268 -2.743 1.00 0.00 C ATOM 1028 CE2 TYR A 67 8.778 -3.525 -1.834 1.00 0.00 C ATOM 1029 CZ TYR A 67 8.612 -4.841 -2.213 1.00 0.00 C ATOM 1030 OH TYR A 67 9.650 -5.732 -2.062 1.00 0.00 O ATOM 0 H TYR A 67 2.905 -3.218 -2.545 1.00 0.00 H new ATOM 0 HA TYR A 67 4.898 -2.213 -0.594 1.00 0.00 H new ATOM 0 HB2 TYR A 67 4.858 -2.272 -3.620 1.00 0.00 H new ATOM 0 HB3 TYR A 67 5.782 -1.052 -2.766 1.00 0.00 H new ATOM 0 HD1 TYR A 67 5.436 -4.707 -3.308 1.00 0.00 H new ATOM 0 HD2 TYR A 67 7.865 -1.605 -1.688 1.00 0.00 H new ATOM 0 HE1 TYR A 67 7.286 -6.299 -3.039 1.00 0.00 H new ATOM 0 HE2 TYR A 67 9.719 -3.193 -1.420 1.00 0.00 H new ATOM 0 HH TYR A 67 10.424 -5.271 -1.676 1.00 0.00 H new ATOM 1040 N LEU A 68 4.110 0.182 -0.752 1.00 0.00 N ATOM 1041 CA LEU A 68 3.463 1.484 -0.624 1.00 0.00 C ATOM 1042 C LEU A 68 3.987 2.458 -1.674 1.00 0.00 C ATOM 1043 O LEU A 68 5.117 2.938 -1.583 1.00 0.00 O ATOM 1044 CB LEU A 68 3.694 2.054 0.777 1.00 0.00 C ATOM 1045 CG LEU A 68 2.866 3.285 1.146 1.00 0.00 C ATOM 1046 CD1 LEU A 68 3.211 4.453 0.236 1.00 0.00 C ATOM 1047 CD2 LEU A 68 1.379 2.969 1.070 1.00 0.00 C ATOM 0 H LEU A 68 4.983 0.092 -0.233 1.00 0.00 H new ATOM 0 HA LEU A 68 2.393 1.348 -0.783 1.00 0.00 H new ATOM 0 HB2 LEU A 68 3.487 1.270 1.505 1.00 0.00 H new ATOM 0 HB3 LEU A 68 4.749 2.308 0.874 1.00 0.00 H new ATOM 0 HG LEU A 68 3.106 3.567 2.171 1.00 0.00 H new ATOM 0 HD11 LEU A 68 2.612 5.320 0.514 1.00 0.00 H new ATOM 0 HD12 LEU A 68 4.269 4.695 0.340 1.00 0.00 H new ATOM 0 HD13 LEU A 68 3.000 4.183 -0.799 1.00 0.00 H new ATOM 0 HD21 LEU A 68 0.804 3.856 1.336 1.00 0.00 H new ATOM 0 HD22 LEU A 68 1.124 2.662 0.056 1.00 0.00 H new ATOM 0 HD23 LEU A 68 1.143 2.162 1.764 1.00 0.00 H new ATOM 1059 N LEU A 69 3.157 2.747 -2.671 1.00 0.00 N ATOM 1060 CA LEU A 69 3.535 3.666 -3.738 1.00 0.00 C ATOM 1061 C LEU A 69 2.892 5.034 -3.532 1.00 0.00 C ATOM 1062 O LEU A 69 1.828 5.147 -2.922 1.00 0.00 O ATOM 1063 CB LEU A 69 3.124 3.097 -5.097 1.00 0.00 C ATOM 1064 CG LEU A 69 3.526 3.922 -6.320 1.00 0.00 C ATOM 1065 CD1 LEU A 69 4.911 3.520 -6.804 1.00 0.00 C ATOM 1066 CD2 LEU A 69 2.502 3.759 -7.434 1.00 0.00 C ATOM 0 H LEU A 69 2.218 2.358 -2.762 1.00 0.00 H new ATOM 0 HA LEU A 69 4.618 3.786 -3.713 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.556 2.101 -5.197 1.00 0.00 H new ATOM 0 HB3 LEU A 69 2.041 2.976 -5.105 1.00 0.00 H new ATOM 0 HG LEU A 69 3.555 4.973 -6.031 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.180 4.118 -7.675 1.00 0.00 H new ATOM 0 HD12 LEU A 69 5.638 3.689 -6.009 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.909 2.464 -7.075 1.00 0.00 H new ATOM 0 HD21 LEU A 69 2.805 4.353 -8.296 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.440 2.709 -7.721 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.527 4.098 -7.084 1.00 0.00 H new ATOM 1078 N LEU A 70 3.544 6.072 -4.046 1.00 0.00 N ATOM 1079 CA LEU A 70 3.035 7.433 -3.920 1.00 0.00 C ATOM 1080 C LEU A 70 2.384 7.893 -5.221 1.00 0.00 C ATOM 1081 O LEU A 70 3.059 8.391 -6.122 1.00 0.00 O ATOM 1082 CB LEU A 70 4.167 8.388 -3.537 1.00 0.00 C ATOM 1083 CG LEU A 70 3.861 9.880 -3.674 1.00 0.00 C ATOM 1084 CD1 LEU A 70 2.594 10.238 -2.913 1.00 0.00 C ATOM 1085 CD2 LEU A 70 5.036 10.713 -3.180 1.00 0.00 C ATOM 0 H LEU A 70 4.426 5.997 -4.554 1.00 0.00 H new ATOM 0 HA LEU A 70 2.279 7.441 -3.134 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.449 8.189 -2.503 1.00 0.00 H new ATOM 0 HB3 LEU A 70 5.035 8.157 -4.155 1.00 0.00 H new ATOM 0 HG LEU A 70 3.701 10.103 -4.729 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.393 11.304 -3.022 1.00 0.00 H new ATOM 0 HD12 LEU A 70 1.756 9.667 -3.313 1.00 0.00 H new ATOM 0 HD13 LEU A 70 2.724 10.000 -1.857 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.801 11.772 -3.285 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.228 10.486 -2.131 1.00 0.00 H new ATOM 0 HD23 LEU A 70 5.922 10.478 -3.770 1.00 0.00 H new ATOM 1097 N VAL A 71 1.069 7.726 -5.310 1.00 0.00 N ATOM 1098 CA VAL A 71 0.326 8.127 -6.499 1.00 0.00 C ATOM 1099 C VAL A 71 0.712 9.535 -6.939 1.00 0.00 C ATOM 1100 O VAL A 71 1.305 9.723 -8.001 1.00 0.00 O ATOM 1101 CB VAL A 71 -1.194 8.075 -6.255 1.00 0.00 C ATOM 1102 CG1 VAL A 71 -1.512 8.383 -4.799 1.00 0.00 C ATOM 1103 CG2 VAL A 71 -1.915 9.042 -7.182 1.00 0.00 C ATOM 0 H VAL A 71 0.496 7.316 -4.573 1.00 0.00 H new ATOM 0 HA VAL A 71 0.584 7.420 -7.287 1.00 0.00 H new ATOM 0 HB VAL A 71 -1.545 7.067 -6.474 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -2.590 8.342 -4.645 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -1.026 7.648 -4.157 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -1.148 9.380 -4.550 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -2.988 8.992 -6.996 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -1.561 10.056 -6.996 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -1.713 8.771 -8.218 1.00 0.00 H new ATOM 1113 N SER A 72 0.371 10.520 -6.115 1.00 0.00 N ATOM 1114 CA SER A 72 0.679 11.912 -6.420 1.00 0.00 C ATOM 1115 C SER A 72 1.047 12.678 -5.153 1.00 0.00 C ATOM 1116 O SER A 72 0.482 12.440 -4.084 1.00 0.00 O ATOM 1117 CB SER A 72 -0.513 12.582 -7.106 1.00 0.00 C ATOM 1118 OG SER A 72 -0.180 13.885 -7.551 1.00 0.00 O ATOM 0 H SER A 72 -0.119 10.380 -5.231 1.00 0.00 H new ATOM 0 HA SER A 72 1.535 11.929 -7.095 1.00 0.00 H new ATOM 0 HB2 SER A 72 -0.836 11.977 -7.953 1.00 0.00 H new ATOM 0 HB3 SER A 72 -1.353 12.635 -6.413 1.00 0.00 H new ATOM 0 HG SER A 72 -0.958 14.291 -7.987 1.00 0.00 H new ATOM 1124 N CYS A 73 1.996 13.598 -5.279 1.00 0.00 N ATOM 1125 CA CYS A 73 2.441 14.400 -4.145 1.00 0.00 C ATOM 1126 C CYS A 73 2.590 15.865 -4.539 1.00 0.00 C ATOM 1127 O CYS A 73 3.017 16.195 -5.646 1.00 0.00 O ATOM 1128 CB CYS A 73 3.769 13.866 -3.606 1.00 0.00 C ATOM 1129 SG CYS A 73 5.143 13.990 -4.775 1.00 0.00 S ATOM 0 H CYS A 73 2.473 13.808 -6.156 1.00 0.00 H new ATOM 0 HA CYS A 73 1.685 14.329 -3.363 1.00 0.00 H new ATOM 0 HB2 CYS A 73 4.027 14.413 -2.699 1.00 0.00 H new ATOM 0 HB3 CYS A 73 3.640 12.821 -3.323 1.00 0.00 H new ATOM 0 HG CYS A 73 6.020 14.838 -4.326 1.00 0.00 H new ATOM 1135 N PRO A 74 2.230 16.767 -3.614 1.00 0.00 N ATOM 1136 CA PRO A 74 2.314 18.213 -3.843 1.00 0.00 C ATOM 1137 C PRO A 74 3.755 18.707 -3.905 1.00 0.00 C ATOM 1138 O PRO A 74 4.112 19.506 -4.772 1.00 0.00 O ATOM 1139 CB PRO A 74 1.596 18.807 -2.628 1.00 0.00 C ATOM 1140 CG PRO A 74 1.732 17.772 -1.565 1.00 0.00 C ATOM 1141 CD PRO A 74 1.713 16.445 -2.274 1.00 0.00 C ATOM 0 HA PRO A 74 1.874 18.501 -4.798 1.00 0.00 H new ATOM 0 HB2 PRO A 74 2.049 19.750 -2.323 1.00 0.00 H new ATOM 0 HB3 PRO A 74 0.549 19.013 -2.849 1.00 0.00 H new ATOM 0 HG2 PRO A 74 2.660 17.904 -1.008 1.00 0.00 H new ATOM 0 HG3 PRO A 74 0.916 17.842 -0.846 1.00 0.00 H new ATOM 0 HD2 PRO A 74 2.339 15.710 -1.768 1.00 0.00 H new ATOM 0 HD3 PRO A 74 0.707 16.029 -2.321 1.00 0.00 H new ATOM 1149 N LYS A 75 4.580 18.227 -2.981 1.00 0.00 N ATOM 1150 CA LYS A 75 5.984 18.619 -2.930 1.00 0.00 C ATOM 1151 C LYS A 75 6.864 17.576 -3.611 1.00 0.00 C ATOM 1152 O LYS A 75 6.467 16.421 -3.767 1.00 0.00 O ATOM 1153 CB LYS A 75 6.430 18.809 -1.479 1.00 0.00 C ATOM 1154 CG LYS A 75 5.783 17.833 -0.511 1.00 0.00 C ATOM 1155 CD LYS A 75 6.340 17.990 0.894 1.00 0.00 C ATOM 1156 CE LYS A 75 5.402 17.396 1.934 1.00 0.00 C ATOM 1157 NZ LYS A 75 4.083 18.085 1.950 1.00 0.00 N ATOM 0 H LYS A 75 4.301 17.565 -2.257 1.00 0.00 H new ATOM 0 HA LYS A 75 6.091 19.564 -3.463 1.00 0.00 H new ATOM 0 HB2 LYS A 75 7.513 18.699 -1.423 1.00 0.00 H new ATOM 0 HB3 LYS A 75 6.196 19.827 -1.166 1.00 0.00 H new ATOM 0 HG2 LYS A 75 4.705 17.994 -0.496 1.00 0.00 H new ATOM 0 HG3 LYS A 75 5.948 16.813 -0.857 1.00 0.00 H new ATOM 0 HD2 LYS A 75 7.312 17.502 0.958 1.00 0.00 H new ATOM 0 HD3 LYS A 75 6.500 19.047 1.108 1.00 0.00 H new ATOM 0 HE2 LYS A 75 5.255 16.336 1.727 1.00 0.00 H new ATOM 0 HE3 LYS A 75 5.861 17.468 2.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 3.652 17.989 2.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 4.215 19.093 1.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 3.458 17.655 1.238 1.00 0.00 H new ATOM 1171 N SER A 76 8.061 17.990 -4.014 1.00 0.00 N ATOM 1172 CA SER A 76 8.997 17.092 -4.681 1.00 0.00 C ATOM 1173 C SER A 76 9.082 15.756 -3.949 1.00 0.00 C ATOM 1174 O SER A 76 8.767 14.708 -4.510 1.00 0.00 O ATOM 1175 CB SER A 76 10.384 17.733 -4.760 1.00 0.00 C ATOM 1176 OG SER A 76 11.105 17.252 -5.881 1.00 0.00 O ATOM 0 H SER A 76 8.406 18.942 -3.890 1.00 0.00 H new ATOM 0 HA SER A 76 8.631 16.911 -5.692 1.00 0.00 H new ATOM 0 HB2 SER A 76 10.284 18.816 -4.826 1.00 0.00 H new ATOM 0 HB3 SER A 76 10.940 17.519 -3.847 1.00 0.00 H new ATOM 0 HG SER A 76 11.987 17.678 -5.910 1.00 0.00 H new ATOM 1182 N GLU A 77 9.512 15.804 -2.691 1.00 0.00 N ATOM 1183 CA GLU A 77 9.640 14.597 -1.882 1.00 0.00 C ATOM 1184 C GLU A 77 8.820 14.712 -0.601 1.00 0.00 C ATOM 1185 O GLU A 77 8.477 15.812 -0.166 1.00 0.00 O ATOM 1186 CB GLU A 77 11.109 14.340 -1.539 1.00 0.00 C ATOM 1187 CG GLU A 77 11.635 15.219 -0.417 1.00 0.00 C ATOM 1188 CD GLU A 77 13.127 15.060 -0.202 1.00 0.00 C ATOM 1189 OE1 GLU A 77 13.660 13.975 -0.516 1.00 0.00 O ATOM 1190 OE2 GLU A 77 13.762 16.021 0.281 1.00 0.00 O ATOM 0 H GLU A 77 9.777 16.664 -2.211 1.00 0.00 H new ATOM 0 HA GLU A 77 9.258 13.758 -2.464 1.00 0.00 H new ATOM 0 HB2 GLU A 77 11.230 13.294 -1.257 1.00 0.00 H new ATOM 0 HB3 GLU A 77 11.715 14.502 -2.430 1.00 0.00 H new ATOM 0 HG2 GLU A 77 11.413 16.262 -0.643 1.00 0.00 H new ATOM 0 HG3 GLU A 77 11.111 14.975 0.507 1.00 0.00 H new ATOM 1197 N VAL A 78 8.507 13.568 -0.001 1.00 0.00 N ATOM 1198 CA VAL A 78 7.728 13.539 1.231 1.00 0.00 C ATOM 1199 C VAL A 78 8.105 12.338 2.092 1.00 0.00 C ATOM 1200 O VAL A 78 8.334 11.242 1.580 1.00 0.00 O ATOM 1201 CB VAL A 78 6.216 13.492 0.938 1.00 0.00 C ATOM 1202 CG1 VAL A 78 5.919 12.503 -0.179 1.00 0.00 C ATOM 1203 CG2 VAL A 78 5.441 13.134 2.197 1.00 0.00 C ATOM 0 H VAL A 78 8.781 12.649 -0.348 1.00 0.00 H new ATOM 0 HA VAL A 78 7.958 14.457 1.772 1.00 0.00 H new ATOM 0 HB VAL A 78 5.896 14.481 0.610 1.00 0.00 H new ATOM 0 HG11 VAL A 78 4.846 12.483 -0.372 1.00 0.00 H new ATOM 0 HG12 VAL A 78 6.445 12.807 -1.084 1.00 0.00 H new ATOM 0 HG13 VAL A 78 6.253 11.509 0.117 1.00 0.00 H new ATOM 0 HG21 VAL A 78 4.375 13.105 1.972 1.00 0.00 H new ATOM 0 HG22 VAL A 78 5.763 12.157 2.557 1.00 0.00 H new ATOM 0 HG23 VAL A 78 5.630 13.883 2.966 1.00 0.00 H new ATOM 1213 N ARG A 79 8.168 12.553 3.402 1.00 0.00 N ATOM 1214 CA ARG A 79 8.518 11.488 4.335 1.00 0.00 C ATOM 1215 C ARG A 79 7.296 11.039 5.130 1.00 0.00 C ATOM 1216 O ARG A 79 6.664 11.838 5.820 1.00 0.00 O ATOM 1217 CB ARG A 79 9.617 11.959 5.290 1.00 0.00 C ATOM 1218 CG ARG A 79 11.023 11.686 4.782 1.00 0.00 C ATOM 1219 CD ARG A 79 12.019 12.696 5.330 1.00 0.00 C ATOM 1220 NE ARG A 79 13.357 12.127 5.466 1.00 0.00 N ATOM 1221 CZ ARG A 79 13.727 11.355 6.482 1.00 0.00 C ATOM 1222 NH1 ARG A 79 12.864 11.062 7.446 1.00 0.00 N ATOM 1223 NH2 ARG A 79 14.963 10.874 6.536 1.00 0.00 N ATOM 0 H ARG A 79 7.981 13.454 3.841 1.00 0.00 H new ATOM 0 HA ARG A 79 8.886 10.640 3.758 1.00 0.00 H new ATOM 0 HB2 ARG A 79 9.503 13.029 5.462 1.00 0.00 H new ATOM 0 HB3 ARG A 79 9.486 11.466 6.253 1.00 0.00 H new ATOM 0 HG2 ARG A 79 11.327 10.680 5.071 1.00 0.00 H new ATOM 0 HG3 ARG A 79 11.031 11.720 3.693 1.00 0.00 H new ATOM 0 HD2 ARG A 79 12.059 13.561 4.669 1.00 0.00 H new ATOM 0 HD3 ARG A 79 11.676 13.053 6.301 1.00 0.00 H new ATOM 0 HE ARG A 79 14.045 12.333 4.742 1.00 0.00 H new ATOM 0 HH11 ARG A 79 11.913 11.430 7.408 1.00 0.00 H new ATOM 0 HH12 ARG A 79 13.151 10.469 8.225 1.00 0.00 H new ATOM 0 HH21 ARG A 79 15.630 11.097 5.797 1.00 0.00 H new ATOM 0 HH22 ARG A 79 15.246 10.281 7.316 1.00 0.00 H new ATOM 1237 N ALA A 80 6.970 9.754 5.029 1.00 0.00 N ATOM 1238 CA ALA A 80 5.825 9.198 5.739 1.00 0.00 C ATOM 1239 C ALA A 80 6.041 7.722 6.057 1.00 0.00 C ATOM 1240 O ALA A 80 6.820 7.040 5.391 1.00 0.00 O ATOM 1241 CB ALA A 80 4.555 9.385 4.923 1.00 0.00 C ATOM 0 H ALA A 80 7.483 9.079 4.462 1.00 0.00 H new ATOM 0 HA ALA A 80 5.718 9.734 6.682 1.00 0.00 H new ATOM 0 HB1 ALA A 80 3.708 8.965 5.466 1.00 0.00 H new ATOM 0 HB2 ALA A 80 4.385 10.448 4.753 1.00 0.00 H new ATOM 0 HB3 ALA A 80 4.660 8.876 3.965 1.00 0.00 H new ATOM 1247 N LYS A 81 5.345 7.234 7.079 1.00 0.00 N ATOM 1248 CA LYS A 81 5.459 5.839 7.485 1.00 0.00 C ATOM 1249 C LYS A 81 4.248 5.036 7.022 1.00 0.00 C ATOM 1250 O LYS A 81 3.124 5.540 7.011 1.00 0.00 O ATOM 1251 CB LYS A 81 5.599 5.739 9.006 1.00 0.00 C ATOM 1252 CG LYS A 81 6.945 6.212 9.525 1.00 0.00 C ATOM 1253 CD LYS A 81 6.850 6.698 10.962 1.00 0.00 C ATOM 1254 CE LYS A 81 7.907 7.747 11.267 1.00 0.00 C ATOM 1255 NZ LYS A 81 7.813 8.238 12.670 1.00 0.00 N ATOM 0 H LYS A 81 4.696 7.785 7.641 1.00 0.00 H new ATOM 0 HA LYS A 81 6.350 5.422 7.015 1.00 0.00 H new ATOM 0 HB2 LYS A 81 4.811 6.328 9.475 1.00 0.00 H new ATOM 0 HB3 LYS A 81 5.446 4.703 9.309 1.00 0.00 H new ATOM 0 HG2 LYS A 81 7.667 5.397 9.463 1.00 0.00 H new ATOM 0 HG3 LYS A 81 7.318 7.017 8.892 1.00 0.00 H new ATOM 0 HD2 LYS A 81 5.859 7.116 11.141 1.00 0.00 H new ATOM 0 HD3 LYS A 81 6.967 5.854 11.641 1.00 0.00 H new ATOM 0 HE2 LYS A 81 8.897 7.325 11.096 1.00 0.00 H new ATOM 0 HE3 LYS A 81 7.795 8.586 10.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 8.551 8.952 12.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 6.877 8.664 12.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 7.946 7.442 13.326 1.00 0.00 H new ATOM 1269 N PHE A 82 4.483 3.785 6.641 1.00 0.00 N ATOM 1270 CA PHE A 82 3.410 2.913 6.177 1.00 0.00 C ATOM 1271 C PHE A 82 3.363 1.626 6.995 1.00 0.00 C ATOM 1272 O PHE A 82 4.374 1.188 7.544 1.00 0.00 O ATOM 1273 CB PHE A 82 3.598 2.581 4.695 1.00 0.00 C ATOM 1274 CG PHE A 82 4.839 1.785 4.412 1.00 0.00 C ATOM 1275 CD1 PHE A 82 6.065 2.415 4.265 1.00 0.00 C ATOM 1276 CD2 PHE A 82 4.781 0.405 4.293 1.00 0.00 C ATOM 1277 CE1 PHE A 82 7.208 1.684 4.004 1.00 0.00 C ATOM 1278 CE2 PHE A 82 5.922 -0.331 4.032 1.00 0.00 C ATOM 1279 CZ PHE A 82 7.137 0.310 3.888 1.00 0.00 C ATOM 0 H PHE A 82 5.407 3.352 6.644 1.00 0.00 H new ATOM 0 HA PHE A 82 2.465 3.441 6.307 1.00 0.00 H new ATOM 0 HB2 PHE A 82 2.730 2.023 4.343 1.00 0.00 H new ATOM 0 HB3 PHE A 82 3.633 3.509 4.125 1.00 0.00 H new ATOM 0 HD1 PHE A 82 6.127 3.489 4.356 1.00 0.00 H new ATOM 0 HD2 PHE A 82 3.834 -0.101 4.405 1.00 0.00 H new ATOM 0 HE1 PHE A 82 8.157 2.187 3.891 1.00 0.00 H new ATOM 0 HE2 PHE A 82 5.863 -1.406 3.941 1.00 0.00 H new ATOM 0 HZ PHE A 82 8.030 -0.263 3.685 1.00 0.00 H new ATOM 1289 N LYS A 83 2.181 1.024 7.074 1.00 0.00 N ATOM 1290 CA LYS A 83 1.999 -0.213 7.824 1.00 0.00 C ATOM 1291 C LYS A 83 0.941 -1.096 7.170 1.00 0.00 C ATOM 1292 O LYS A 83 -0.180 -0.654 6.916 1.00 0.00 O ATOM 1293 CB LYS A 83 1.599 0.097 9.268 1.00 0.00 C ATOM 1294 CG LYS A 83 1.636 -1.116 10.183 1.00 0.00 C ATOM 1295 CD LYS A 83 0.322 -1.878 10.152 1.00 0.00 C ATOM 1296 CE LYS A 83 -0.777 -1.124 10.884 1.00 0.00 C ATOM 1297 NZ LYS A 83 -2.068 -1.867 10.865 1.00 0.00 N ATOM 0 H LYS A 83 1.333 1.374 6.627 1.00 0.00 H new ATOM 0 HA LYS A 83 2.946 -0.752 7.823 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.267 0.862 9.665 1.00 0.00 H new ATOM 0 HB3 LYS A 83 0.593 0.517 9.275 1.00 0.00 H new ATOM 0 HG2 LYS A 83 2.448 -1.777 9.880 1.00 0.00 H new ATOM 0 HG3 LYS A 83 1.849 -0.797 11.203 1.00 0.00 H new ATOM 0 HD2 LYS A 83 0.022 -2.046 9.118 1.00 0.00 H new ATOM 0 HD3 LYS A 83 0.458 -2.859 10.608 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -0.473 -0.951 11.916 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -0.914 -0.145 10.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -2.855 -1.199 10.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -2.172 -2.358 9.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -2.079 -2.563 11.637 1.00 0.00 H new ATOM 1311 N PHE A 84 1.304 -2.345 6.899 1.00 0.00 N ATOM 1312 CA PHE A 84 0.386 -3.290 6.275 1.00 0.00 C ATOM 1313 C PHE A 84 -0.147 -4.288 7.299 1.00 0.00 C ATOM 1314 O PHE A 84 0.604 -4.805 8.126 1.00 0.00 O ATOM 1315 CB PHE A 84 1.084 -4.035 5.135 1.00 0.00 C ATOM 1316 CG PHE A 84 1.749 -3.124 4.143 1.00 0.00 C ATOM 1317 CD1 PHE A 84 1.183 -1.903 3.816 1.00 0.00 C ATOM 1318 CD2 PHE A 84 2.940 -3.491 3.537 1.00 0.00 C ATOM 1319 CE1 PHE A 84 1.793 -1.062 2.904 1.00 0.00 C ATOM 1320 CE2 PHE A 84 3.554 -2.655 2.624 1.00 0.00 C ATOM 1321 CZ PHE A 84 2.980 -1.439 2.306 1.00 0.00 C ATOM 0 H PHE A 84 2.228 -2.726 7.102 1.00 0.00 H new ATOM 0 HA PHE A 84 -0.455 -2.727 5.870 1.00 0.00 H new ATOM 0 HB2 PHE A 84 1.831 -4.709 5.555 1.00 0.00 H new ATOM 0 HB3 PHE A 84 0.353 -4.654 4.615 1.00 0.00 H new ATOM 0 HD1 PHE A 84 0.254 -1.604 4.279 1.00 0.00 H new ATOM 0 HD2 PHE A 84 3.393 -4.441 3.781 1.00 0.00 H new ATOM 0 HE1 PHE A 84 1.342 -0.112 2.659 1.00 0.00 H new ATOM 0 HE2 PHE A 84 4.482 -2.952 2.159 1.00 0.00 H new ATOM 0 HZ PHE A 84 3.458 -0.785 1.592 1.00 0.00 H new ATOM 1331 N SER A 85 -1.447 -4.553 7.237 1.00 0.00 N ATOM 1332 CA SER A 85 -2.083 -5.486 8.161 1.00 0.00 C ATOM 1333 C SER A 85 -3.268 -6.183 7.500 1.00 0.00 C ATOM 1334 O SER A 85 -3.777 -5.728 6.475 1.00 0.00 O ATOM 1335 CB SER A 85 -2.545 -4.752 9.421 1.00 0.00 C ATOM 1336 OG SER A 85 -3.344 -3.629 9.093 1.00 0.00 O ATOM 0 H SER A 85 -2.082 -4.135 6.557 1.00 0.00 H new ATOM 0 HA SER A 85 -1.349 -6.242 8.438 1.00 0.00 H new ATOM 0 HB2 SER A 85 -3.112 -5.433 10.055 1.00 0.00 H new ATOM 0 HB3 SER A 85 -1.677 -4.429 9.996 1.00 0.00 H new ATOM 0 HG SER A 85 -3.293 -3.462 8.129 1.00 0.00 H new ATOM 1342 N ILE A 86 -3.703 -7.289 8.095 1.00 0.00 N ATOM 1343 CA ILE A 86 -4.828 -8.048 7.566 1.00 0.00 C ATOM 1344 C ILE A 86 -5.946 -8.165 8.597 1.00 0.00 C ATOM 1345 O ILE A 86 -5.704 -8.502 9.756 1.00 0.00 O ATOM 1346 CB ILE A 86 -4.399 -9.461 7.129 1.00 0.00 C ATOM 1347 CG1 ILE A 86 -3.350 -9.378 6.018 1.00 0.00 C ATOM 1348 CG2 ILE A 86 -5.606 -10.262 6.666 1.00 0.00 C ATOM 1349 CD1 ILE A 86 -2.422 -10.572 5.973 1.00 0.00 C ATOM 0 H ILE A 86 -3.293 -7.679 8.944 1.00 0.00 H new ATOM 0 HA ILE A 86 -5.194 -7.503 6.696 1.00 0.00 H new ATOM 0 HB ILE A 86 -3.956 -9.971 7.984 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -3.857 -9.285 5.057 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -2.758 -8.473 6.155 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -5.286 -11.258 6.360 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -6.322 -10.346 7.483 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -6.076 -9.757 5.822 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.705 -10.445 5.162 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -1.888 -10.654 6.920 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -3.003 -11.479 5.805 1.00 0.00 H new ATOM 1361 N LEU A 87 -7.172 -7.886 8.166 1.00 0.00 N ATOM 1362 CA LEU A 87 -8.329 -7.961 9.051 1.00 0.00 C ATOM 1363 C LEU A 87 -9.070 -9.282 8.868 1.00 0.00 C ATOM 1364 O LEU A 87 -9.763 -9.482 7.872 1.00 0.00 O ATOM 1365 CB LEU A 87 -9.276 -6.790 8.785 1.00 0.00 C ATOM 1366 CG LEU A 87 -8.789 -5.415 9.241 1.00 0.00 C ATOM 1367 CD1 LEU A 87 -9.966 -4.479 9.469 1.00 0.00 C ATOM 1368 CD2 LEU A 87 -7.950 -5.538 10.505 1.00 0.00 C ATOM 0 H LEU A 87 -7.390 -7.606 7.210 1.00 0.00 H new ATOM 0 HA LEU A 87 -7.973 -7.905 10.080 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.475 -6.746 7.714 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -10.226 -6.998 9.277 1.00 0.00 H new ATOM 0 HG LEU A 87 -8.164 -4.993 8.454 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -9.599 -3.505 9.793 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -10.526 -4.365 8.541 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -10.618 -4.895 10.237 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -7.612 -4.549 10.815 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -8.551 -5.981 11.299 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -7.085 -6.172 10.308 1.00 0.00 H new ATOM 1380 N ASN A 88 -8.919 -10.178 9.837 1.00 0.00 N ATOM 1381 CA ASN A 88 -9.575 -11.480 9.783 1.00 0.00 C ATOM 1382 C ASN A 88 -11.092 -11.322 9.721 1.00 0.00 C ATOM 1383 O ASN A 88 -11.608 -10.207 9.654 1.00 0.00 O ATOM 1384 CB ASN A 88 -9.188 -12.320 11.002 1.00 0.00 C ATOM 1385 CG ASN A 88 -10.008 -11.971 12.229 1.00 0.00 C ATOM 1386 OD1 ASN A 88 -10.767 -12.797 12.737 1.00 0.00 O ATOM 1387 ND2 ASN A 88 -9.859 -10.743 12.710 1.00 0.00 N ATOM 0 H ASN A 88 -8.349 -10.027 10.669 1.00 0.00 H new ATOM 0 HA ASN A 88 -9.243 -11.990 8.879 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -9.320 -13.376 10.769 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -8.131 -12.172 11.221 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -10.385 -10.451 13.533 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -9.218 -10.092 12.256 1.00 0.00 H new ATOM 1394 N ALA A 89 -11.799 -12.447 9.744 1.00 0.00 N ATOM 1395 CA ALA A 89 -13.256 -12.434 9.693 1.00 0.00 C ATOM 1396 C ALA A 89 -13.836 -11.556 10.796 1.00 0.00 C ATOM 1397 O ALA A 89 -14.921 -10.991 10.650 1.00 0.00 O ATOM 1398 CB ALA A 89 -13.801 -13.850 9.802 1.00 0.00 C ATOM 0 H ALA A 89 -11.387 -13.378 9.798 1.00 0.00 H new ATOM 0 HA ALA A 89 -13.557 -12.014 8.734 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -14.890 -13.825 9.763 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -13.422 -14.450 8.975 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -13.482 -14.291 10.747 1.00 0.00 H new ATOM 1404 N LYS A 90 -13.108 -11.444 11.902 1.00 0.00 N ATOM 1405 CA LYS A 90 -13.549 -10.634 13.031 1.00 0.00 C ATOM 1406 C LYS A 90 -13.111 -9.183 12.864 1.00 0.00 C ATOM 1407 O LYS A 90 -13.159 -8.397 13.809 1.00 0.00 O ATOM 1408 CB LYS A 90 -12.990 -11.199 14.339 1.00 0.00 C ATOM 1409 CG LYS A 90 -13.760 -12.399 14.861 1.00 0.00 C ATOM 1410 CD LYS A 90 -13.189 -13.703 14.329 1.00 0.00 C ATOM 1411 CE LYS A 90 -12.124 -14.266 15.258 1.00 0.00 C ATOM 1412 NZ LYS A 90 -12.721 -15.063 16.366 1.00 0.00 N ATOM 0 H LYS A 90 -12.209 -11.905 12.040 1.00 0.00 H new ATOM 0 HA LYS A 90 -14.638 -10.665 13.064 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -11.949 -11.484 14.186 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -12.998 -10.415 15.096 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -13.730 -12.406 15.951 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -14.807 -12.314 14.571 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -13.991 -14.431 14.210 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -12.760 -13.537 13.341 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -11.439 -14.893 14.688 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -11.536 -13.448 15.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -11.964 -15.430 16.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -13.355 -14.458 16.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -13.261 -15.858 15.970 1.00 0.00 H new ATOM 1426 N GLY A 91 -12.686 -8.833 11.653 1.00 0.00 N ATOM 1427 CA GLY A 91 -12.247 -7.476 11.384 1.00 0.00 C ATOM 1428 C GLY A 91 -11.125 -7.037 12.303 1.00 0.00 C ATOM 1429 O GLY A 91 -10.948 -5.844 12.551 1.00 0.00 O ATOM 0 H GLY A 91 -12.638 -9.465 10.854 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -11.914 -7.404 10.349 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -13.091 -6.795 11.495 1.00 0.00 H new ATOM 1433 N GLU A 92 -10.366 -8.002 12.812 1.00 0.00 N ATOM 1434 CA GLU A 92 -9.256 -7.707 13.711 1.00 0.00 C ATOM 1435 C GLU A 92 -7.921 -7.803 12.978 1.00 0.00 C ATOM 1436 O GLU A 92 -7.733 -8.666 12.122 1.00 0.00 O ATOM 1437 CB GLU A 92 -9.267 -8.668 14.902 1.00 0.00 C ATOM 1438 CG GLU A 92 -10.603 -8.730 15.622 1.00 0.00 C ATOM 1439 CD GLU A 92 -10.496 -9.362 16.997 1.00 0.00 C ATOM 1440 OE1 GLU A 92 -9.962 -8.703 17.913 1.00 0.00 O ATOM 1441 OE2 GLU A 92 -10.948 -10.516 17.155 1.00 0.00 O ATOM 0 H GLU A 92 -10.499 -8.994 12.617 1.00 0.00 H new ATOM 0 HA GLU A 92 -9.378 -6.687 14.075 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -9.005 -9.667 14.554 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -8.496 -8.364 15.610 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -11.006 -7.722 15.720 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -11.311 -9.299 15.019 1.00 0.00 H new ATOM 1448 N GLU A 93 -6.999 -6.909 13.322 1.00 0.00 N ATOM 1449 CA GLU A 93 -5.683 -6.892 12.695 1.00 0.00 C ATOM 1450 C GLU A 93 -4.917 -8.175 13.003 1.00 0.00 C ATOM 1451 O GLU A 93 -4.879 -8.632 14.146 1.00 0.00 O ATOM 1452 CB GLU A 93 -4.881 -5.680 13.175 1.00 0.00 C ATOM 1453 CG GLU A 93 -5.118 -4.427 12.347 1.00 0.00 C ATOM 1454 CD GLU A 93 -4.830 -3.155 13.120 1.00 0.00 C ATOM 1455 OE1 GLU A 93 -5.563 -2.872 14.090 1.00 0.00 O ATOM 1456 OE2 GLU A 93 -3.872 -2.442 12.754 1.00 0.00 O ATOM 0 H GLU A 93 -7.139 -6.188 14.030 1.00 0.00 H new ATOM 0 HA GLU A 93 -5.824 -6.823 11.616 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -5.138 -5.473 14.214 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -3.819 -5.925 13.152 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -4.488 -4.458 11.458 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -6.152 -4.413 12.004 1.00 0.00 H new ATOM 1463 N THR A 94 -4.308 -8.755 11.973 1.00 0.00 N ATOM 1464 CA THR A 94 -3.544 -9.987 12.131 1.00 0.00 C ATOM 1465 C THR A 94 -2.506 -10.136 11.025 1.00 0.00 C ATOM 1466 O THR A 94 -2.727 -9.713 9.890 1.00 0.00 O ATOM 1467 CB THR A 94 -4.464 -11.222 12.126 1.00 0.00 C ATOM 1468 OG1 THR A 94 -3.780 -12.345 12.693 1.00 0.00 O ATOM 1469 CG2 THR A 94 -4.913 -11.557 10.711 1.00 0.00 C ATOM 0 H THR A 94 -4.329 -8.391 11.020 1.00 0.00 H new ATOM 0 HA THR A 94 -3.038 -9.924 13.094 1.00 0.00 H new ATOM 0 HB THR A 94 -5.345 -10.993 12.725 1.00 0.00 H new ATOM 0 HG1 THR A 94 -4.372 -13.126 12.688 1.00 0.00 H new ATOM 0 HG21 THR A 94 -5.562 -12.433 10.733 1.00 0.00 H new ATOM 0 HG22 THR A 94 -5.459 -10.711 10.293 1.00 0.00 H new ATOM 0 HG23 THR A 94 -4.040 -11.767 10.093 1.00 0.00 H new ATOM 1477 N LYS A 95 -1.371 -10.740 11.363 1.00 0.00 N ATOM 1478 CA LYS A 95 -0.298 -10.947 10.398 1.00 0.00 C ATOM 1479 C LYS A 95 0.107 -9.630 9.744 1.00 0.00 C ATOM 1480 O LYS A 95 0.263 -9.554 8.525 1.00 0.00 O ATOM 1481 CB LYS A 95 -0.734 -11.949 9.327 1.00 0.00 C ATOM 1482 CG LYS A 95 -1.115 -13.309 9.885 1.00 0.00 C ATOM 1483 CD LYS A 95 0.023 -13.925 10.681 1.00 0.00 C ATOM 1484 CE LYS A 95 -0.159 -15.426 10.843 1.00 0.00 C ATOM 1485 NZ LYS A 95 0.643 -15.962 11.978 1.00 0.00 N ATOM 0 H LYS A 95 -1.171 -11.095 12.298 1.00 0.00 H new ATOM 0 HA LYS A 95 0.564 -11.347 10.931 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -1.584 -11.538 8.782 1.00 0.00 H new ATOM 0 HB3 LYS A 95 0.075 -12.075 8.608 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -1.993 -13.208 10.523 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -1.390 -13.975 9.067 1.00 0.00 H new ATOM 0 HD2 LYS A 95 0.970 -13.724 10.179 1.00 0.00 H new ATOM 0 HD3 LYS A 95 0.077 -13.456 11.663 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -1.213 -15.649 11.006 1.00 0.00 H new ATOM 0 HE3 LYS A 95 0.134 -15.929 9.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 0.492 -16.988 12.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 1.652 -15.772 11.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 0.346 -15.501 12.861 1.00 0.00 H new ATOM 1499 N ALA A 96 0.277 -8.596 10.561 1.00 0.00 N ATOM 1500 CA ALA A 96 0.668 -7.284 10.061 1.00 0.00 C ATOM 1501 C ALA A 96 2.160 -7.041 10.263 1.00 0.00 C ATOM 1502 O ALA A 96 2.783 -7.643 11.137 1.00 0.00 O ATOM 1503 CB ALA A 96 -0.144 -6.195 10.747 1.00 0.00 C ATOM 0 H ALA A 96 0.150 -8.642 11.572 1.00 0.00 H new ATOM 0 HA ALA A 96 0.464 -7.255 8.991 1.00 0.00 H new ATOM 0 HB1 ALA A 96 0.158 -5.220 10.364 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -1.204 -6.351 10.547 1.00 0.00 H new ATOM 0 HB3 ALA A 96 0.032 -6.233 11.822 1.00 0.00 H new ATOM 1509 N MET A 97 2.726 -6.156 9.449 1.00 0.00 N ATOM 1510 CA MET A 97 4.146 -5.834 9.540 1.00 0.00 C ATOM 1511 C MET A 97 4.354 -4.328 9.664 1.00 0.00 C ATOM 1512 O MET A 97 3.924 -3.560 8.804 1.00 0.00 O ATOM 1513 CB MET A 97 4.890 -6.364 8.313 1.00 0.00 C ATOM 1514 CG MET A 97 4.713 -7.858 8.093 1.00 0.00 C ATOM 1515 SD MET A 97 5.955 -8.549 6.984 1.00 0.00 S ATOM 1516 CE MET A 97 6.017 -7.284 5.716 1.00 0.00 C ATOM 0 H MET A 97 2.224 -5.649 8.720 1.00 0.00 H new ATOM 0 HA MET A 97 4.546 -6.313 10.434 1.00 0.00 H new ATOM 0 HB2 MET A 97 4.541 -5.831 7.429 1.00 0.00 H new ATOM 0 HB3 MET A 97 5.952 -6.144 8.419 1.00 0.00 H new ATOM 0 HG2 MET A 97 4.763 -8.371 9.053 1.00 0.00 H new ATOM 0 HG3 MET A 97 3.721 -8.046 7.683 1.00 0.00 H new ATOM 0 HE1 MET A 97 6.464 -7.697 4.812 1.00 0.00 H new ATOM 0 HE2 MET A 97 5.007 -6.939 5.496 1.00 0.00 H new ATOM 0 HE3 MET A 97 6.618 -6.445 6.068 1.00 0.00 H new ATOM 1526 N GLU A 98 5.017 -3.914 10.740 1.00 0.00 N ATOM 1527 CA GLU A 98 5.281 -2.499 10.975 1.00 0.00 C ATOM 1528 C GLU A 98 6.661 -2.109 10.454 1.00 0.00 C ATOM 1529 O GLU A 98 7.532 -2.960 10.277 1.00 0.00 O ATOM 1530 CB GLU A 98 5.179 -2.180 12.469 1.00 0.00 C ATOM 1531 CG GLU A 98 3.777 -2.345 13.032 1.00 0.00 C ATOM 1532 CD GLU A 98 3.614 -1.692 14.391 1.00 0.00 C ATOM 1533 OE1 GLU A 98 4.491 -1.896 15.256 1.00 0.00 O ATOM 1534 OE2 GLU A 98 2.609 -0.977 14.588 1.00 0.00 O ATOM 0 H GLU A 98 5.380 -4.537 11.461 1.00 0.00 H new ATOM 0 HA GLU A 98 4.531 -1.921 10.435 1.00 0.00 H new ATOM 0 HB2 GLU A 98 5.861 -2.830 13.018 1.00 0.00 H new ATOM 0 HB3 GLU A 98 5.511 -1.155 12.637 1.00 0.00 H new ATOM 0 HG2 GLU A 98 3.057 -1.913 12.337 1.00 0.00 H new ATOM 0 HG3 GLU A 98 3.545 -3.407 13.113 1.00 0.00 H new ATOM 1541 N SER A 99 6.850 -0.816 10.209 1.00 0.00 N ATOM 1542 CA SER A 99 8.122 -0.313 9.704 1.00 0.00 C ATOM 1543 C SER A 99 8.918 0.366 10.815 1.00 0.00 C ATOM 1544 O SER A 99 8.359 0.768 11.835 1.00 0.00 O ATOM 1545 CB SER A 99 7.885 0.671 8.556 1.00 0.00 C ATOM 1546 OG SER A 99 7.402 1.912 9.040 1.00 0.00 O ATOM 0 H SER A 99 6.139 -0.099 10.352 1.00 0.00 H new ATOM 0 HA SER A 99 8.699 -1.161 9.334 1.00 0.00 H new ATOM 0 HB2 SER A 99 8.815 0.827 8.009 1.00 0.00 H new ATOM 0 HB3 SER A 99 7.168 0.248 7.852 1.00 0.00 H new ATOM 0 HG SER A 99 7.260 2.524 8.288 1.00 0.00 H new ATOM 1552 N GLN A 100 10.225 0.490 10.607 1.00 0.00 N ATOM 1553 CA GLN A 100 11.098 1.119 11.591 1.00 0.00 C ATOM 1554 C GLN A 100 10.972 2.638 11.537 1.00 0.00 C ATOM 1555 O GLN A 100 10.495 3.265 12.484 1.00 0.00 O ATOM 1556 CB GLN A 100 12.551 0.707 11.352 1.00 0.00 C ATOM 1557 CG GLN A 100 13.472 1.020 12.520 1.00 0.00 C ATOM 1558 CD GLN A 100 13.020 0.366 13.811 1.00 0.00 C ATOM 1559 OE1 GLN A 100 12.260 0.951 14.584 1.00 0.00 O ATOM 1560 NE2 GLN A 100 13.486 -0.854 14.052 1.00 0.00 N ATOM 0 H GLN A 100 10.702 0.164 9.767 1.00 0.00 H new ATOM 0 HA GLN A 100 10.791 0.782 12.581 1.00 0.00 H new ATOM 0 HB2 GLN A 100 12.588 -0.363 11.148 1.00 0.00 H new ATOM 0 HB3 GLN A 100 12.922 1.214 10.461 1.00 0.00 H new ATOM 0 HG2 GLN A 100 14.482 0.685 12.282 1.00 0.00 H new ATOM 0 HG3 GLN A 100 13.519 2.100 12.661 1.00 0.00 H new ATOM 0 HE21 GLN A 100 14.114 -1.301 13.384 1.00 0.00 H new ATOM 0 HE22 GLN A 100 13.216 -1.344 14.905 1.00 0.00 H new ATOM 1569 N ARG A 101 11.403 3.224 10.425 1.00 0.00 N ATOM 1570 CA ARG A 101 11.340 4.670 10.249 1.00 0.00 C ATOM 1571 C ARG A 101 10.778 5.026 8.876 1.00 0.00 C ATOM 1572 O ARG A 101 10.663 4.170 8.000 1.00 0.00 O ATOM 1573 CB ARG A 101 12.730 5.286 10.419 1.00 0.00 C ATOM 1574 CG ARG A 101 13.187 5.369 11.866 1.00 0.00 C ATOM 1575 CD ARG A 101 12.367 6.380 12.652 1.00 0.00 C ATOM 1576 NE ARG A 101 13.137 6.987 13.735 1.00 0.00 N ATOM 1577 CZ ARG A 101 12.714 8.026 14.445 1.00 0.00 C ATOM 1578 NH1 ARG A 101 11.533 8.572 14.188 1.00 0.00 N ATOM 1579 NH2 ARG A 101 13.472 8.522 15.414 1.00 0.00 N ATOM 0 H ARG A 101 11.800 2.720 9.632 1.00 0.00 H new ATOM 0 HA ARG A 101 10.675 5.076 11.011 1.00 0.00 H new ATOM 0 HB2 ARG A 101 13.451 4.697 9.852 1.00 0.00 H new ATOM 0 HB3 ARG A 101 12.729 6.288 9.989 1.00 0.00 H new ATOM 0 HG2 ARG A 101 13.101 4.388 12.333 1.00 0.00 H new ATOM 0 HG3 ARG A 101 14.240 5.647 11.901 1.00 0.00 H new ATOM 0 HD2 ARG A 101 12.011 7.160 11.979 1.00 0.00 H new ATOM 0 HD3 ARG A 101 11.486 5.889 13.065 1.00 0.00 H new ATOM 0 HE ARG A 101 14.050 6.591 13.958 1.00 0.00 H new ATOM 0 HH11 ARG A 101 10.947 8.194 13.443 1.00 0.00 H new ATOM 0 HH12 ARG A 101 11.210 9.370 14.735 1.00 0.00 H new ATOM 0 HH21 ARG A 101 14.381 8.105 15.614 1.00 0.00 H new ATOM 0 HH22 ARG A 101 13.146 9.320 15.959 1.00 0.00 H new ATOM 1593 N ALA A 102 10.430 6.296 8.697 1.00 0.00 N ATOM 1594 CA ALA A 102 9.881 6.766 7.431 1.00 0.00 C ATOM 1595 C ALA A 102 10.955 6.806 6.348 1.00 0.00 C ATOM 1596 O ALA A 102 12.150 6.799 6.645 1.00 0.00 O ATOM 1597 CB ALA A 102 9.254 8.142 7.605 1.00 0.00 C ATOM 0 H ALA A 102 10.518 7.018 9.412 1.00 0.00 H new ATOM 0 HA ALA A 102 9.109 6.064 7.116 1.00 0.00 H new ATOM 0 HB1 ALA A 102 8.848 8.480 6.652 1.00 0.00 H new ATOM 0 HB2 ALA A 102 8.452 8.086 8.341 1.00 0.00 H new ATOM 0 HB3 ALA A 102 10.012 8.847 7.947 1.00 0.00 H new ATOM 1603 N TYR A 103 10.521 6.847 5.093 1.00 0.00 N ATOM 1604 CA TYR A 103 11.446 6.884 3.966 1.00 0.00 C ATOM 1605 C TYR A 103 11.135 8.060 3.045 1.00 0.00 C ATOM 1606 O TYR A 103 10.097 8.708 3.177 1.00 0.00 O ATOM 1607 CB TYR A 103 11.378 5.574 3.180 1.00 0.00 C ATOM 1608 CG TYR A 103 12.065 4.417 3.870 1.00 0.00 C ATOM 1609 CD1 TYR A 103 11.674 4.008 5.139 1.00 0.00 C ATOM 1610 CD2 TYR A 103 13.107 3.735 3.254 1.00 0.00 C ATOM 1611 CE1 TYR A 103 12.300 2.952 5.774 1.00 0.00 C ATOM 1612 CE2 TYR A 103 13.737 2.677 3.880 1.00 0.00 C ATOM 1613 CZ TYR A 103 13.330 2.290 5.140 1.00 0.00 C ATOM 1614 OH TYR A 103 13.957 1.238 5.768 1.00 0.00 O ATOM 0 H TYR A 103 9.535 6.855 4.831 1.00 0.00 H new ATOM 0 HA TYR A 103 12.454 7.011 4.360 1.00 0.00 H new ATOM 0 HB2 TYR A 103 10.333 5.316 3.010 1.00 0.00 H new ATOM 0 HB3 TYR A 103 11.833 5.724 2.201 1.00 0.00 H new ATOM 0 HD1 TYR A 103 10.867 4.524 5.638 1.00 0.00 H new ATOM 0 HD2 TYR A 103 13.430 4.037 2.269 1.00 0.00 H new ATOM 0 HE1 TYR A 103 11.984 2.647 6.761 1.00 0.00 H new ATOM 0 HE2 TYR A 103 14.544 2.156 3.386 1.00 0.00 H new ATOM 0 HH TYR A 103 14.659 0.881 5.185 1.00 0.00 H new ATOM 1624 N ARG A 104 12.042 8.328 2.112 1.00 0.00 N ATOM 1625 CA ARG A 104 11.866 9.425 1.168 1.00 0.00 C ATOM 1626 C ARG A 104 10.933 9.019 0.030 1.00 0.00 C ATOM 1627 O ARG A 104 11.348 8.352 -0.918 1.00 0.00 O ATOM 1628 CB ARG A 104 13.219 9.861 0.602 1.00 0.00 C ATOM 1629 CG ARG A 104 13.116 10.961 -0.442 1.00 0.00 C ATOM 1630 CD ARG A 104 14.334 10.979 -1.353 1.00 0.00 C ATOM 1631 NE ARG A 104 15.491 11.593 -0.707 1.00 0.00 N ATOM 1632 CZ ARG A 104 16.699 11.641 -1.257 1.00 0.00 C ATOM 1633 NH1 ARG A 104 16.907 11.116 -2.457 1.00 0.00 N ATOM 1634 NH2 ARG A 104 17.703 12.217 -0.607 1.00 0.00 N ATOM 0 H ARG A 104 12.906 7.801 1.989 1.00 0.00 H new ATOM 0 HA ARG A 104 11.416 10.262 1.702 1.00 0.00 H new ATOM 0 HB2 ARG A 104 13.851 10.206 1.420 1.00 0.00 H new ATOM 0 HB3 ARG A 104 13.714 8.997 0.159 1.00 0.00 H new ATOM 0 HG2 ARG A 104 12.216 10.815 -1.039 1.00 0.00 H new ATOM 0 HG3 ARG A 104 13.016 11.927 0.054 1.00 0.00 H new ATOM 0 HD2 ARG A 104 14.582 9.959 -1.647 1.00 0.00 H new ATOM 0 HD3 ARG A 104 14.096 11.525 -2.266 1.00 0.00 H new ATOM 0 HE ARG A 104 15.365 12.007 0.216 1.00 0.00 H new ATOM 0 HH11 ARG A 104 16.138 10.674 -2.960 1.00 0.00 H new ATOM 0 HH12 ARG A 104 17.836 11.155 -2.877 1.00 0.00 H new ATOM 0 HH21 ARG A 104 17.547 12.623 0.316 1.00 0.00 H new ATOM 0 HH22 ARG A 104 18.630 12.253 -1.030 1.00 0.00 H new ATOM 1648 N PHE A 105 9.673 9.426 0.132 1.00 0.00 N ATOM 1649 CA PHE A 105 8.681 9.104 -0.887 1.00 0.00 C ATOM 1650 C PHE A 105 8.633 10.187 -1.961 1.00 0.00 C ATOM 1651 O PHE A 105 8.757 11.376 -1.666 1.00 0.00 O ATOM 1652 CB PHE A 105 7.299 8.940 -0.251 1.00 0.00 C ATOM 1653 CG PHE A 105 7.083 7.591 0.373 1.00 0.00 C ATOM 1654 CD1 PHE A 105 6.790 6.489 -0.414 1.00 0.00 C ATOM 1655 CD2 PHE A 105 7.172 7.426 1.745 1.00 0.00 C ATOM 1656 CE1 PHE A 105 6.590 5.246 0.157 1.00 0.00 C ATOM 1657 CE2 PHE A 105 6.974 6.185 2.322 1.00 0.00 C ATOM 1658 CZ PHE A 105 6.681 5.094 1.527 1.00 0.00 C ATOM 0 H PHE A 105 9.314 9.980 0.910 1.00 0.00 H new ATOM 0 HA PHE A 105 8.971 8.164 -1.356 1.00 0.00 H new ATOM 0 HB2 PHE A 105 7.164 9.709 0.510 1.00 0.00 H new ATOM 0 HB3 PHE A 105 6.536 9.106 -1.011 1.00 0.00 H new ATOM 0 HD1 PHE A 105 6.717 6.602 -1.486 1.00 0.00 H new ATOM 0 HD2 PHE A 105 7.399 8.276 2.371 1.00 0.00 H new ATOM 0 HE1 PHE A 105 6.363 4.395 -0.467 1.00 0.00 H new ATOM 0 HE2 PHE A 105 7.048 6.069 3.393 1.00 0.00 H new ATOM 0 HZ PHE A 105 6.523 4.124 1.976 1.00 0.00 H new ATOM 1668 N VAL A 106 8.453 9.767 -3.210 1.00 0.00 N ATOM 1669 CA VAL A 106 8.389 10.700 -4.329 1.00 0.00 C ATOM 1670 C VAL A 106 7.493 10.164 -5.440 1.00 0.00 C ATOM 1671 O VAL A 106 7.421 8.956 -5.663 1.00 0.00 O ATOM 1672 CB VAL A 106 9.789 10.983 -4.904 1.00 0.00 C ATOM 1673 CG1 VAL A 106 10.727 11.471 -3.811 1.00 0.00 C ATOM 1674 CG2 VAL A 106 10.347 9.741 -5.583 1.00 0.00 C ATOM 0 H VAL A 106 8.349 8.787 -3.472 1.00 0.00 H new ATOM 0 HA VAL A 106 7.969 11.629 -3.944 1.00 0.00 H new ATOM 0 HB VAL A 106 9.703 11.770 -5.653 1.00 0.00 H new ATOM 0 HG11 VAL A 106 11.711 11.666 -4.237 1.00 0.00 H new ATOM 0 HG12 VAL A 106 10.332 12.389 -3.376 1.00 0.00 H new ATOM 0 HG13 VAL A 106 10.811 10.709 -3.036 1.00 0.00 H new ATOM 0 HG21 VAL A 106 11.337 9.959 -5.984 1.00 0.00 H new ATOM 0 HG22 VAL A 106 10.420 8.931 -4.857 1.00 0.00 H new ATOM 0 HG23 VAL A 106 9.685 9.442 -6.395 1.00 0.00 H new ATOM 1684 N GLN A 107 6.814 11.071 -6.134 1.00 0.00 N ATOM 1685 CA GLN A 107 5.922 10.688 -7.222 1.00 0.00 C ATOM 1686 C GLN A 107 6.530 9.564 -8.055 1.00 0.00 C ATOM 1687 O GLN A 107 7.386 9.802 -8.906 1.00 0.00 O ATOM 1688 CB GLN A 107 5.624 11.895 -8.114 1.00 0.00 C ATOM 1689 CG GLN A 107 4.267 11.829 -8.794 1.00 0.00 C ATOM 1690 CD GLN A 107 4.237 12.578 -10.112 1.00 0.00 C ATOM 1691 OE1 GLN A 107 4.912 13.595 -10.276 1.00 0.00 O ATOM 1692 NE2 GLN A 107 3.452 12.079 -11.060 1.00 0.00 N ATOM 0 H GLN A 107 6.864 12.075 -5.963 1.00 0.00 H new ATOM 0 HA GLN A 107 4.990 10.329 -6.785 1.00 0.00 H new ATOM 0 HB2 GLN A 107 5.676 12.802 -7.512 1.00 0.00 H new ATOM 0 HB3 GLN A 107 6.399 11.973 -8.876 1.00 0.00 H new ATOM 0 HG2 GLN A 107 4.002 10.786 -8.967 1.00 0.00 H new ATOM 0 HG3 GLN A 107 3.511 12.244 -8.128 1.00 0.00 H new ATOM 0 HE21 GLN A 107 2.910 11.234 -10.881 1.00 0.00 H new ATOM 0 HE22 GLN A 107 3.391 12.541 -11.967 1.00 0.00 H new ATOM 1701 N GLY A 108 6.082 8.338 -7.802 1.00 0.00 N ATOM 1702 CA GLY A 108 6.594 7.196 -8.536 1.00 0.00 C ATOM 1703 C GLY A 108 7.561 6.366 -7.716 1.00 0.00 C ATOM 1704 O GLY A 108 8.360 5.607 -8.264 1.00 0.00 O ATOM 0 H GLY A 108 5.374 8.116 -7.102 1.00 0.00 H new ATOM 0 HA2 GLY A 108 5.761 6.569 -8.854 1.00 0.00 H new ATOM 0 HA3 GLY A 108 7.094 7.544 -9.440 1.00 0.00 H new ATOM 1708 N LYS A 109 7.491 6.510 -6.397 1.00 0.00 N ATOM 1709 CA LYS A 109 8.368 5.768 -5.498 1.00 0.00 C ATOM 1710 C LYS A 109 7.624 4.605 -4.850 1.00 0.00 C ATOM 1711 O LYS A 109 6.431 4.703 -4.559 1.00 0.00 O ATOM 1712 CB LYS A 109 8.926 6.696 -4.416 1.00 0.00 C ATOM 1713 CG LYS A 109 10.220 6.197 -3.796 1.00 0.00 C ATOM 1714 CD LYS A 109 11.290 5.965 -4.849 1.00 0.00 C ATOM 1715 CE LYS A 109 12.687 6.087 -4.260 1.00 0.00 C ATOM 1716 NZ LYS A 109 13.728 6.204 -5.319 1.00 0.00 N ATOM 0 H LYS A 109 6.836 7.134 -5.926 1.00 0.00 H new ATOM 0 HA LYS A 109 9.194 5.366 -6.085 1.00 0.00 H new ATOM 0 HB2 LYS A 109 9.096 7.682 -4.847 1.00 0.00 H new ATOM 0 HB3 LYS A 109 8.179 6.816 -3.631 1.00 0.00 H new ATOM 0 HG2 LYS A 109 10.578 6.923 -3.066 1.00 0.00 H new ATOM 0 HG3 LYS A 109 10.032 5.269 -3.257 1.00 0.00 H new ATOM 0 HD2 LYS A 109 11.163 4.974 -5.286 1.00 0.00 H new ATOM 0 HD3 LYS A 109 11.170 6.687 -5.657 1.00 0.00 H new ATOM 0 HE2 LYS A 109 12.732 6.960 -3.609 1.00 0.00 H new ATOM 0 HE3 LYS A 109 12.897 5.216 -3.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 14.666 6.285 -4.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 13.703 5.359 -5.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 13.543 7.049 -5.896 1.00 0.00 H new ATOM 1730 N ASP A 110 8.335 3.506 -4.625 1.00 0.00 N ATOM 1731 CA ASP A 110 7.743 2.324 -4.009 1.00 0.00 C ATOM 1732 C ASP A 110 8.602 1.826 -2.852 1.00 0.00 C ATOM 1733 O ASP A 110 9.788 1.544 -3.023 1.00 0.00 O ATOM 1734 CB ASP A 110 7.570 1.214 -5.047 1.00 0.00 C ATOM 1735 CG ASP A 110 8.875 0.845 -5.724 1.00 0.00 C ATOM 1736 OD1 ASP A 110 9.669 0.098 -5.114 1.00 0.00 O ATOM 1737 OD2 ASP A 110 9.104 1.305 -6.862 1.00 0.00 O ATOM 0 H ASP A 110 9.323 3.409 -4.860 1.00 0.00 H new ATOM 0 HA ASP A 110 6.764 2.601 -3.618 1.00 0.00 H new ATOM 0 HB2 ASP A 110 7.153 0.331 -4.564 1.00 0.00 H new ATOM 0 HB3 ASP A 110 6.851 1.535 -5.801 1.00 0.00 H new ATOM 1742 N TRP A 111 7.997 1.721 -1.675 1.00 0.00 N ATOM 1743 CA TRP A 111 8.708 1.258 -0.488 1.00 0.00 C ATOM 1744 C TRP A 111 7.841 0.305 0.328 1.00 0.00 C ATOM 1745 O TRP A 111 6.804 0.697 0.861 1.00 0.00 O ATOM 1746 CB TRP A 111 9.132 2.448 0.374 1.00 0.00 C ATOM 1747 CG TRP A 111 10.306 3.195 -0.181 1.00 0.00 C ATOM 1748 CD1 TRP A 111 10.317 4.483 -0.636 1.00 0.00 C ATOM 1749 CD2 TRP A 111 11.640 2.699 -0.342 1.00 0.00 C ATOM 1750 NE1 TRP A 111 11.578 4.817 -1.070 1.00 0.00 N ATOM 1751 CE2 TRP A 111 12.407 3.740 -0.899 1.00 0.00 C ATOM 1752 CE3 TRP A 111 12.261 1.478 -0.067 1.00 0.00 C ATOM 1753 CZ2 TRP A 111 13.762 3.595 -1.187 1.00 0.00 C ATOM 1754 CZ3 TRP A 111 13.605 1.335 -0.353 1.00 0.00 C ATOM 1755 CH2 TRP A 111 14.344 2.388 -0.908 1.00 0.00 C ATOM 0 H TRP A 111 7.016 1.950 -1.516 1.00 0.00 H new ATOM 0 HA TRP A 111 9.598 0.720 -0.814 1.00 0.00 H new ATOM 0 HB2 TRP A 111 8.290 3.133 0.475 1.00 0.00 H new ATOM 0 HB3 TRP A 111 9.377 2.093 1.375 1.00 0.00 H new ATOM 0 HD1 TRP A 111 9.461 5.142 -0.652 1.00 0.00 H new ATOM 0 HE1 TRP A 111 11.852 5.720 -1.457 1.00 0.00 H new ATOM 0 HE3 TRP A 111 11.700 0.660 0.362 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 14.333 4.406 -1.615 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 14.095 0.395 -0.145 1.00 0.00 H new ATOM 0 HH2 TRP A 111 15.393 2.245 -1.120 1.00 0.00 H new ATOM 1766 N GLY A 112 8.274 -0.948 0.423 1.00 0.00 N ATOM 1767 CA GLY A 112 7.525 -1.937 1.177 1.00 0.00 C ATOM 1768 C GLY A 112 8.280 -3.242 1.331 1.00 0.00 C ATOM 1769 O GLY A 112 9.510 -3.266 1.281 1.00 0.00 O ATOM 0 H GLY A 112 9.130 -1.296 -0.009 1.00 0.00 H new ATOM 0 HA2 GLY A 112 7.292 -1.537 2.164 1.00 0.00 H new ATOM 0 HA3 GLY A 112 6.575 -2.127 0.678 1.00 0.00 H new ATOM 1773 N PHE A 113 7.542 -4.331 1.522 1.00 0.00 N ATOM 1774 CA PHE A 113 8.150 -5.646 1.687 1.00 0.00 C ATOM 1775 C PHE A 113 7.664 -6.609 0.608 1.00 0.00 C ATOM 1776 O PHE A 113 6.517 -6.539 0.166 1.00 0.00 O ATOM 1777 CB PHE A 113 7.827 -6.211 3.072 1.00 0.00 C ATOM 1778 CG PHE A 113 8.066 -5.234 4.188 1.00 0.00 C ATOM 1779 CD1 PHE A 113 7.066 -4.363 4.590 1.00 0.00 C ATOM 1780 CD2 PHE A 113 9.291 -5.187 4.835 1.00 0.00 C ATOM 1781 CE1 PHE A 113 7.285 -3.463 5.616 1.00 0.00 C ATOM 1782 CE2 PHE A 113 9.514 -4.289 5.861 1.00 0.00 C ATOM 1783 CZ PHE A 113 8.509 -3.427 6.253 1.00 0.00 C ATOM 0 H PHE A 113 6.523 -4.329 1.566 1.00 0.00 H new ATOM 0 HA PHE A 113 9.230 -5.534 1.590 1.00 0.00 H new ATOM 0 HB2 PHE A 113 6.784 -6.526 3.093 1.00 0.00 H new ATOM 0 HB3 PHE A 113 8.433 -7.101 3.243 1.00 0.00 H new ATOM 0 HD1 PHE A 113 6.106 -4.388 4.097 1.00 0.00 H new ATOM 0 HD2 PHE A 113 10.080 -5.860 4.534 1.00 0.00 H new ATOM 0 HE1 PHE A 113 6.498 -2.788 5.919 1.00 0.00 H new ATOM 0 HE2 PHE A 113 10.473 -4.261 6.356 1.00 0.00 H new ATOM 0 HZ PHE A 113 8.680 -2.726 7.056 1.00 0.00 H new ATOM 1793 N LYS A 114 8.546 -7.509 0.186 1.00 0.00 N ATOM 1794 CA LYS A 114 8.210 -8.488 -0.841 1.00 0.00 C ATOM 1795 C LYS A 114 7.333 -9.598 -0.269 1.00 0.00 C ATOM 1796 O LYS A 114 6.210 -9.814 -0.726 1.00 0.00 O ATOM 1797 CB LYS A 114 9.484 -9.088 -1.440 1.00 0.00 C ATOM 1798 CG LYS A 114 9.329 -9.526 -2.886 1.00 0.00 C ATOM 1799 CD LYS A 114 10.654 -9.485 -3.627 1.00 0.00 C ATOM 1800 CE LYS A 114 10.622 -10.351 -4.877 1.00 0.00 C ATOM 1801 NZ LYS A 114 11.810 -10.118 -5.744 1.00 0.00 N ATOM 0 H LYS A 114 9.500 -7.581 0.540 1.00 0.00 H new ATOM 0 HA LYS A 114 7.653 -7.977 -1.626 1.00 0.00 H new ATOM 0 HB2 LYS A 114 10.286 -8.353 -1.376 1.00 0.00 H new ATOM 0 HB3 LYS A 114 9.788 -9.946 -0.840 1.00 0.00 H new ATOM 0 HG2 LYS A 114 8.924 -10.537 -2.919 1.00 0.00 H new ATOM 0 HG3 LYS A 114 8.610 -8.878 -3.388 1.00 0.00 H new ATOM 0 HD2 LYS A 114 10.886 -8.456 -3.902 1.00 0.00 H new ATOM 0 HD3 LYS A 114 11.452 -9.826 -2.967 1.00 0.00 H new ATOM 0 HE2 LYS A 114 10.583 -11.402 -4.590 1.00 0.00 H new ATOM 0 HE3 LYS A 114 9.714 -10.140 -5.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 11.751 -10.727 -6.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 11.834 -9.121 -6.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 12.676 -10.343 -5.214 1.00 0.00 H new ATOM 1815 N LYS A 115 7.853 -10.298 0.733 1.00 0.00 N ATOM 1816 CA LYS A 115 7.117 -11.384 1.370 1.00 0.00 C ATOM 1817 C LYS A 115 6.261 -10.860 2.519 1.00 0.00 C ATOM 1818 O LYS A 115 6.727 -10.748 3.653 1.00 0.00 O ATOM 1819 CB LYS A 115 8.086 -12.450 1.887 1.00 0.00 C ATOM 1820 CG LYS A 115 8.470 -13.481 0.841 1.00 0.00 C ATOM 1821 CD LYS A 115 9.697 -13.049 0.056 1.00 0.00 C ATOM 1822 CE LYS A 115 9.938 -13.952 -1.145 1.00 0.00 C ATOM 1823 NZ LYS A 115 10.789 -15.123 -0.796 1.00 0.00 N ATOM 0 H LYS A 115 8.781 -10.133 1.122 1.00 0.00 H new ATOM 0 HA LYS A 115 6.459 -11.831 0.624 1.00 0.00 H new ATOM 0 HB2 LYS A 115 8.989 -11.961 2.252 1.00 0.00 H new ATOM 0 HB3 LYS A 115 7.633 -12.959 2.738 1.00 0.00 H new ATOM 0 HG2 LYS A 115 8.666 -14.437 1.326 1.00 0.00 H new ATOM 0 HG3 LYS A 115 7.635 -13.635 0.157 1.00 0.00 H new ATOM 0 HD2 LYS A 115 9.571 -12.020 -0.281 1.00 0.00 H new ATOM 0 HD3 LYS A 115 10.571 -13.067 0.707 1.00 0.00 H new ATOM 0 HE2 LYS A 115 8.982 -14.301 -1.535 1.00 0.00 H new ATOM 0 HE3 LYS A 115 10.416 -13.379 -1.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 10.874 -15.749 -1.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 11.734 -14.793 -0.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 10.354 -15.646 -0.009 1.00 0.00 H new ATOM 1837 N PHE A 116 5.006 -10.542 2.219 1.00 0.00 N ATOM 1838 CA PHE A 116 4.084 -10.031 3.227 1.00 0.00 C ATOM 1839 C PHE A 116 3.431 -11.175 3.996 1.00 0.00 C ATOM 1840 O PHE A 116 3.521 -11.243 5.223 1.00 0.00 O ATOM 1841 CB PHE A 116 3.009 -9.163 2.571 1.00 0.00 C ATOM 1842 CG PHE A 116 1.967 -8.669 3.535 1.00 0.00 C ATOM 1843 CD1 PHE A 116 2.337 -8.092 4.739 1.00 0.00 C ATOM 1844 CD2 PHE A 116 0.619 -8.782 3.236 1.00 0.00 C ATOM 1845 CE1 PHE A 116 1.381 -7.638 5.627 1.00 0.00 C ATOM 1846 CE2 PHE A 116 -0.342 -8.329 4.121 1.00 0.00 C ATOM 1847 CZ PHE A 116 0.040 -7.755 5.318 1.00 0.00 C ATOM 0 H PHE A 116 4.604 -10.629 1.286 1.00 0.00 H new ATOM 0 HA PHE A 116 4.653 -9.423 3.930 1.00 0.00 H new ATOM 0 HB2 PHE A 116 3.486 -8.307 2.093 1.00 0.00 H new ATOM 0 HB3 PHE A 116 2.521 -9.737 1.783 1.00 0.00 H new ATOM 0 HD1 PHE A 116 3.384 -7.996 4.986 1.00 0.00 H new ATOM 0 HD2 PHE A 116 0.315 -9.229 2.301 1.00 0.00 H new ATOM 0 HE1 PHE A 116 1.682 -7.191 6.563 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -1.390 -8.424 3.877 1.00 0.00 H new ATOM 0 HZ PHE A 116 -0.708 -7.399 6.011 1.00 0.00 H new ATOM 1857 N ILE A 117 2.774 -12.071 3.268 1.00 0.00 N ATOM 1858 CA ILE A 117 2.106 -13.212 3.881 1.00 0.00 C ATOM 1859 C ILE A 117 1.908 -14.340 2.874 1.00 0.00 C ATOM 1860 O ILE A 117 1.823 -14.102 1.669 1.00 0.00 O ATOM 1861 CB ILE A 117 0.738 -12.816 4.466 1.00 0.00 C ATOM 1862 CG1 ILE A 117 0.062 -14.030 5.107 1.00 0.00 C ATOM 1863 CG2 ILE A 117 -0.149 -12.220 3.383 1.00 0.00 C ATOM 1864 CD1 ILE A 117 0.808 -14.575 6.305 1.00 0.00 C ATOM 0 H ILE A 117 2.690 -12.029 2.252 1.00 0.00 H new ATOM 0 HA ILE A 117 2.751 -13.558 4.689 1.00 0.00 H new ATOM 0 HB ILE A 117 0.894 -12.061 5.237 1.00 0.00 H new ATOM 0 HG12 ILE A 117 -0.947 -13.754 5.412 1.00 0.00 H new ATOM 0 HG13 ILE A 117 -0.035 -14.818 4.360 1.00 0.00 H new ATOM 0 HG21 ILE A 117 -1.112 -11.945 3.812 1.00 0.00 H new ATOM 0 HG22 ILE A 117 0.330 -11.333 2.968 1.00 0.00 H new ATOM 0 HG23 ILE A 117 -0.301 -12.954 2.592 1.00 0.00 H new ATOM 0 HD11 ILE A 117 0.271 -15.434 6.708 1.00 0.00 H new ATOM 0 HD12 ILE A 117 1.809 -14.882 6.002 1.00 0.00 H new ATOM 0 HD13 ILE A 117 0.882 -13.802 7.070 1.00 0.00 H new ATOM 1876 N ARG A 118 1.835 -15.568 3.376 1.00 0.00 N ATOM 1877 CA ARG A 118 1.647 -16.734 2.520 1.00 0.00 C ATOM 1878 C ARG A 118 0.201 -16.827 2.040 1.00 0.00 C ATOM 1879 O ARG A 118 -0.700 -17.157 2.812 1.00 0.00 O ATOM 1880 CB ARG A 118 2.030 -18.011 3.270 1.00 0.00 C ATOM 1881 CG ARG A 118 3.507 -18.355 3.171 1.00 0.00 C ATOM 1882 CD ARG A 118 3.751 -19.837 3.414 1.00 0.00 C ATOM 1883 NE ARG A 118 5.034 -20.276 2.873 1.00 0.00 N ATOM 1884 CZ ARG A 118 5.553 -21.478 3.097 1.00 0.00 C ATOM 1885 NH1 ARG A 118 4.902 -22.356 3.847 1.00 0.00 N ATOM 1886 NH2 ARG A 118 6.726 -21.804 2.569 1.00 0.00 N ATOM 0 H ARG A 118 1.903 -15.782 4.371 1.00 0.00 H new ATOM 0 HA ARG A 118 2.295 -16.624 1.650 1.00 0.00 H new ATOM 0 HB2 ARG A 118 1.761 -17.900 4.320 1.00 0.00 H new ATOM 0 HB3 ARG A 118 1.445 -18.842 2.877 1.00 0.00 H new ATOM 0 HG2 ARG A 118 3.880 -18.081 2.184 1.00 0.00 H new ATOM 0 HG3 ARG A 118 4.068 -17.769 3.899 1.00 0.00 H new ATOM 0 HD2 ARG A 118 3.721 -20.039 4.485 1.00 0.00 H new ATOM 0 HD3 ARG A 118 2.948 -20.416 2.958 1.00 0.00 H new ATOM 0 HE ARG A 118 5.560 -19.624 2.291 1.00 0.00 H new ATOM 0 HH11 ARG A 118 4.000 -22.109 4.254 1.00 0.00 H new ATOM 0 HH12 ARG A 118 5.303 -23.278 4.017 1.00 0.00 H new ATOM 0 HH21 ARG A 118 7.230 -21.131 1.991 1.00 0.00 H new ATOM 0 HH22 ARG A 118 7.124 -22.727 2.741 1.00 0.00 H new ATOM 1900 N ARG A 119 -0.012 -16.534 0.761 1.00 0.00 N ATOM 1901 CA ARG A 119 -1.347 -16.584 0.179 1.00 0.00 C ATOM 1902 C ARG A 119 -2.138 -17.766 0.731 1.00 0.00 C ATOM 1903 O ARG A 119 -3.307 -17.629 1.093 1.00 0.00 O ATOM 1904 CB ARG A 119 -1.258 -16.683 -1.345 1.00 0.00 C ATOM 1905 CG ARG A 119 -1.292 -15.335 -2.047 1.00 0.00 C ATOM 1906 CD ARG A 119 -1.418 -15.494 -3.554 1.00 0.00 C ATOM 1907 NE ARG A 119 -2.654 -16.173 -3.931 1.00 0.00 N ATOM 1908 CZ ARG A 119 -2.907 -16.611 -5.159 1.00 0.00 C ATOM 1909 NH1 ARG A 119 -2.014 -16.441 -6.124 1.00 0.00 N ATOM 1910 NH2 ARG A 119 -4.056 -17.220 -5.424 1.00 0.00 N ATOM 0 H ARG A 119 0.723 -16.260 0.109 1.00 0.00 H new ATOM 0 HA ARG A 119 -1.867 -15.665 0.447 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -0.337 -17.200 -1.614 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -2.084 -17.294 -1.710 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -2.130 -14.749 -1.671 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -0.384 -14.779 -1.813 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -1.385 -14.512 -4.026 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -0.565 -16.058 -3.932 1.00 0.00 H new ATOM 0 HE ARG A 119 -3.362 -16.319 -3.212 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -1.130 -15.973 -5.924 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -2.211 -16.778 -7.066 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -4.746 -17.352 -4.684 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -4.249 -17.556 -6.367 1.00 0.00 H new ATOM 1924 N ASP A 120 -1.493 -18.926 0.791 1.00 0.00 N ATOM 1925 CA ASP A 120 -2.136 -20.132 1.299 1.00 0.00 C ATOM 1926 C ASP A 120 -2.731 -19.889 2.683 1.00 0.00 C ATOM 1927 O ASP A 120 -3.841 -20.332 2.979 1.00 0.00 O ATOM 1928 CB ASP A 120 -1.131 -21.284 1.358 1.00 0.00 C ATOM 1929 CG ASP A 120 -1.776 -22.594 1.767 1.00 0.00 C ATOM 1930 OD1 ASP A 120 -2.801 -22.554 2.479 1.00 0.00 O ATOM 1931 OD2 ASP A 120 -1.255 -23.660 1.375 1.00 0.00 O ATOM 0 H ASP A 120 -0.526 -19.056 0.494 1.00 0.00 H new ATOM 0 HA ASP A 120 -2.944 -20.398 0.618 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -0.661 -21.403 0.382 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -0.339 -21.036 2.065 1.00 0.00 H new ATOM 1936 N PHE A 121 -1.985 -19.184 3.527 1.00 0.00 N ATOM 1937 CA PHE A 121 -2.439 -18.884 4.880 1.00 0.00 C ATOM 1938 C PHE A 121 -3.688 -18.008 4.853 1.00 0.00 C ATOM 1939 O PHE A 121 -4.549 -18.109 5.728 1.00 0.00 O ATOM 1940 CB PHE A 121 -1.329 -18.185 5.669 1.00 0.00 C ATOM 1941 CG PHE A 121 -1.651 -18.005 7.125 1.00 0.00 C ATOM 1942 CD1 PHE A 121 -1.504 -19.057 8.015 1.00 0.00 C ATOM 1943 CD2 PHE A 121 -2.101 -16.785 7.603 1.00 0.00 C ATOM 1944 CE1 PHE A 121 -1.799 -18.895 9.356 1.00 0.00 C ATOM 1945 CE2 PHE A 121 -2.397 -16.617 8.943 1.00 0.00 C ATOM 1946 CZ PHE A 121 -2.247 -17.674 9.820 1.00 0.00 C ATOM 0 H PHE A 121 -1.064 -18.810 3.298 1.00 0.00 H new ATOM 0 HA PHE A 121 -2.688 -19.825 5.371 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -0.410 -18.763 5.577 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -1.137 -17.209 5.224 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -1.155 -20.014 7.657 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -2.222 -15.956 6.921 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -1.679 -19.722 10.040 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -2.745 -15.660 9.304 1.00 0.00 H new ATOM 0 HZ PHE A 121 -2.480 -17.545 10.867 1.00 0.00 H new ATOM 1956 N LEU A 122 -3.780 -17.149 3.844 1.00 0.00 N ATOM 1957 CA LEU A 122 -4.923 -16.255 3.702 1.00 0.00 C ATOM 1958 C LEU A 122 -6.158 -17.019 3.236 1.00 0.00 C ATOM 1959 O LEU A 122 -7.199 -17.000 3.894 1.00 0.00 O ATOM 1960 CB LEU A 122 -4.599 -15.134 2.713 1.00 0.00 C ATOM 1961 CG LEU A 122 -3.204 -14.519 2.829 1.00 0.00 C ATOM 1962 CD1 LEU A 122 -2.936 -13.581 1.662 1.00 0.00 C ATOM 1963 CD2 LEU A 122 -3.054 -13.783 4.152 1.00 0.00 C ATOM 0 H LEU A 122 -3.076 -17.053 3.112 1.00 0.00 H new ATOM 0 HA LEU A 122 -5.135 -15.820 4.678 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -4.720 -15.523 1.702 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -5.336 -14.341 2.840 1.00 0.00 H new ATOM 0 HG LEU A 122 -2.469 -15.324 2.798 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -1.939 -13.153 1.761 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -3.001 -14.136 0.726 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -3.676 -12.781 1.661 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -2.055 -13.352 4.217 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.797 -12.988 4.212 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -3.202 -14.481 4.976 1.00 0.00 H new ATOM 1975 N LEU A 123 -6.036 -17.692 2.097 1.00 0.00 N ATOM 1976 CA LEU A 123 -7.141 -18.466 1.543 1.00 0.00 C ATOM 1977 C LEU A 123 -7.560 -19.578 2.498 1.00 0.00 C ATOM 1978 O LEU A 123 -8.704 -20.032 2.474 1.00 0.00 O ATOM 1979 CB LEU A 123 -6.745 -19.062 0.190 1.00 0.00 C ATOM 1980 CG LEU A 123 -6.697 -18.085 -0.985 1.00 0.00 C ATOM 1981 CD1 LEU A 123 -5.884 -16.852 -0.622 1.00 0.00 C ATOM 1982 CD2 LEU A 123 -6.119 -18.763 -2.219 1.00 0.00 C ATOM 0 H LEU A 123 -5.182 -17.717 1.539 1.00 0.00 H new ATOM 0 HA LEU A 123 -7.988 -17.794 1.403 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -5.763 -19.524 0.292 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -7.448 -19.858 -0.054 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.715 -17.769 -1.212 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -5.861 -16.168 -1.471 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -6.341 -16.354 0.233 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -4.866 -17.149 -0.368 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.092 -18.053 -3.045 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -5.108 -19.108 -2.004 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -6.743 -19.614 -2.492 1.00 0.00 H new ATOM 1994 N ASP A 124 -6.628 -20.011 3.339 1.00 0.00 N ATOM 1995 CA ASP A 124 -6.901 -21.068 4.306 1.00 0.00 C ATOM 1996 C ASP A 124 -8.110 -20.717 5.168 1.00 0.00 C ATOM 1997 O ASP A 124 -8.482 -19.550 5.284 1.00 0.00 O ATOM 1998 CB ASP A 124 -5.678 -21.306 5.193 1.00 0.00 C ATOM 1999 CG ASP A 124 -5.958 -22.287 6.315 1.00 0.00 C ATOM 2000 OD1 ASP A 124 -5.816 -23.506 6.086 1.00 0.00 O ATOM 2001 OD2 ASP A 124 -6.321 -21.835 7.421 1.00 0.00 O ATOM 0 H ASP A 124 -5.676 -19.646 3.371 1.00 0.00 H new ATOM 0 HA ASP A 124 -7.123 -21.982 3.755 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.857 -21.682 4.582 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -5.350 -20.357 5.617 1.00 0.00 H new ATOM 2006 N GLU A 125 -8.717 -21.735 5.770 1.00 0.00 N ATOM 2007 CA GLU A 125 -9.885 -21.533 6.619 1.00 0.00 C ATOM 2008 C GLU A 125 -9.493 -21.547 8.094 1.00 0.00 C ATOM 2009 O GLU A 125 -10.080 -20.837 8.910 1.00 0.00 O ATOM 2010 CB GLU A 125 -10.933 -22.613 6.349 1.00 0.00 C ATOM 2011 CG GLU A 125 -10.484 -24.010 6.743 1.00 0.00 C ATOM 2012 CD GLU A 125 -10.853 -24.360 8.171 1.00 0.00 C ATOM 2013 OE1 GLU A 125 -11.865 -23.827 8.671 1.00 0.00 O ATOM 2014 OE2 GLU A 125 -10.128 -25.169 8.789 1.00 0.00 O ATOM 0 H GLU A 125 -8.419 -22.707 5.686 1.00 0.00 H new ATOM 0 HA GLU A 125 -10.310 -20.558 6.382 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -11.845 -22.367 6.893 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -11.184 -22.607 5.288 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -10.934 -24.737 6.067 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -9.404 -24.088 6.621 1.00 0.00 H new ATOM 2021 N ALA A 126 -8.498 -22.361 8.428 1.00 0.00 N ATOM 2022 CA ALA A 126 -8.026 -22.467 9.804 1.00 0.00 C ATOM 2023 C ALA A 126 -7.864 -21.089 10.436 1.00 0.00 C ATOM 2024 O ALA A 126 -8.157 -20.899 11.616 1.00 0.00 O ATOM 2025 CB ALA A 126 -6.712 -23.232 9.853 1.00 0.00 C ATOM 0 H ALA A 126 -8.003 -22.957 7.765 1.00 0.00 H new ATOM 0 HA ALA A 126 -8.773 -23.015 10.378 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -6.371 -23.304 10.886 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -6.859 -24.234 9.449 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -5.963 -22.708 9.259 1.00 0.00 H new ATOM 2031 N ASN A 127 -7.393 -20.131 9.644 1.00 0.00 N ATOM 2032 CA ASN A 127 -7.191 -18.771 10.127 1.00 0.00 C ATOM 2033 C ASN A 127 -8.472 -17.952 10.004 1.00 0.00 C ATOM 2034 O ASN A 127 -8.807 -17.166 10.888 1.00 0.00 O ATOM 2035 CB ASN A 127 -6.062 -18.093 9.348 1.00 0.00 C ATOM 2036 CG ASN A 127 -4.892 -19.024 9.097 1.00 0.00 C ATOM 2037 OD1 ASN A 127 -4.204 -19.440 10.030 1.00 0.00 O ATOM 2038 ND2 ASN A 127 -4.661 -19.357 7.832 1.00 0.00 N ATOM 0 H ASN A 127 -7.144 -20.272 8.665 1.00 0.00 H new ATOM 0 HA ASN A 127 -6.916 -18.824 11.180 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -6.448 -17.733 8.394 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -5.716 -17.220 9.901 1.00 0.00 H new ATOM 0 HD21 ASN A 127 -3.888 -19.981 7.602 1.00 0.00 H new ATOM 0 HD22 ASN A 127 -5.257 -18.989 7.091 1.00 0.00 H new ATOM 2045 N GLY A 128 -9.186 -18.144 8.898 1.00 0.00 N ATOM 2046 CA GLY A 128 -10.423 -17.418 8.678 1.00 0.00 C ATOM 2047 C GLY A 128 -10.185 -15.966 8.311 1.00 0.00 C ATOM 2048 O GLY A 128 -10.921 -15.080 8.746 1.00 0.00 O ATOM 0 H GLY A 128 -8.929 -18.789 8.151 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -10.989 -17.903 7.882 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -11.034 -17.466 9.579 1.00 0.00 H new ATOM 2052 N LEU A 129 -9.155 -15.722 7.509 1.00 0.00 N ATOM 2053 CA LEU A 129 -8.821 -14.367 7.084 1.00 0.00 C ATOM 2054 C LEU A 129 -9.743 -13.906 5.960 1.00 0.00 C ATOM 2055 O LEU A 129 -9.913 -12.707 5.735 1.00 0.00 O ATOM 2056 CB LEU A 129 -7.364 -14.300 6.624 1.00 0.00 C ATOM 2057 CG LEU A 129 -6.317 -14.762 7.639 1.00 0.00 C ATOM 2058 CD1 LEU A 129 -4.928 -14.740 7.021 1.00 0.00 C ATOM 2059 CD2 LEU A 129 -6.362 -13.891 8.886 1.00 0.00 C ATOM 0 H LEU A 129 -8.537 -16.444 7.140 1.00 0.00 H new ATOM 0 HA LEU A 129 -8.957 -13.701 7.936 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -7.260 -14.906 5.724 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -7.140 -13.271 6.344 1.00 0.00 H new ATOM 0 HG LEU A 129 -6.547 -15.787 7.928 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -4.197 -15.072 7.758 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -4.903 -15.407 6.159 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -4.688 -13.726 6.702 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -5.610 -14.234 9.597 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -6.158 -12.855 8.614 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -7.350 -13.959 9.342 1.00 0.00 H new ATOM 2071 N LEU A 130 -10.337 -14.865 5.259 1.00 0.00 N ATOM 2072 CA LEU A 130 -11.244 -14.558 4.158 1.00 0.00 C ATOM 2073 C LEU A 130 -12.517 -15.393 4.253 1.00 0.00 C ATOM 2074 O LEU A 130 -12.643 -16.449 3.634 1.00 0.00 O ATOM 2075 CB LEU A 130 -10.554 -14.810 2.817 1.00 0.00 C ATOM 2076 CG LEU A 130 -9.039 -14.605 2.792 1.00 0.00 C ATOM 2077 CD1 LEU A 130 -8.467 -15.012 1.443 1.00 0.00 C ATOM 2078 CD2 LEU A 130 -8.691 -13.158 3.107 1.00 0.00 C ATOM 0 H LEU A 130 -10.207 -15.862 5.433 1.00 0.00 H new ATOM 0 HA LEU A 130 -11.516 -13.505 4.227 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -10.767 -15.833 2.508 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -11.002 -14.153 2.072 1.00 0.00 H new ATOM 0 HG LEU A 130 -8.593 -15.239 3.558 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -7.388 -14.859 1.444 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -8.684 -16.064 1.258 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -8.919 -14.405 0.658 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -7.609 -13.031 3.085 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -9.149 -12.504 2.365 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -9.066 -12.901 4.098 1.00 0.00 H new ATOM 2090 N PRO A 131 -13.485 -14.908 5.045 1.00 0.00 N ATOM 2091 CA PRO A 131 -14.767 -15.592 5.237 1.00 0.00 C ATOM 2092 C PRO A 131 -15.637 -15.556 3.985 1.00 0.00 C ATOM 2093 O PRO A 131 -16.513 -16.402 3.802 1.00 0.00 O ATOM 2094 CB PRO A 131 -15.426 -14.800 6.369 1.00 0.00 C ATOM 2095 CG PRO A 131 -14.814 -13.444 6.289 1.00 0.00 C ATOM 2096 CD PRO A 131 -13.403 -13.654 5.813 1.00 0.00 C ATOM 0 HA PRO A 131 -14.634 -16.651 5.460 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -16.508 -14.754 6.243 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -15.238 -15.263 7.338 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -15.367 -12.806 5.600 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -14.829 -12.951 7.261 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -13.060 -12.825 5.194 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -12.706 -13.738 6.647 1.00 0.00 H new ATOM 2104 N ASP A 132 -15.391 -14.572 3.128 1.00 0.00 N ATOM 2105 CA ASP A 132 -16.151 -14.426 1.892 1.00 0.00 C ATOM 2106 C ASP A 132 -15.222 -14.180 0.708 1.00 0.00 C ATOM 2107 O ASP A 132 -15.605 -13.540 -0.272 1.00 0.00 O ATOM 2108 CB ASP A 132 -17.154 -13.278 2.017 1.00 0.00 C ATOM 2109 CG ASP A 132 -18.404 -13.680 2.775 1.00 0.00 C ATOM 2110 OD1 ASP A 132 -18.350 -13.738 4.022 1.00 0.00 O ATOM 2111 OD2 ASP A 132 -19.436 -13.937 2.122 1.00 0.00 O ATOM 0 H ASP A 132 -14.671 -13.863 3.266 1.00 0.00 H new ATOM 0 HA ASP A 132 -16.694 -15.355 1.717 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -16.679 -12.438 2.525 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -17.432 -12.932 1.021 1.00 0.00 H new ATOM 2116 N ASP A 133 -14.000 -14.691 0.806 1.00 0.00 N ATOM 2117 CA ASP A 133 -13.015 -14.527 -0.257 1.00 0.00 C ATOM 2118 C ASP A 133 -12.636 -13.058 -0.424 1.00 0.00 C ATOM 2119 O ASP A 133 -12.242 -12.627 -1.508 1.00 0.00 O ATOM 2120 CB ASP A 133 -13.559 -15.079 -1.576 1.00 0.00 C ATOM 2121 CG ASP A 133 -14.089 -16.492 -1.437 1.00 0.00 C ATOM 2122 OD1 ASP A 133 -15.233 -16.653 -0.961 1.00 0.00 O ATOM 2123 OD2 ASP A 133 -13.361 -17.437 -1.804 1.00 0.00 O ATOM 0 H ASP A 133 -13.667 -15.222 1.611 1.00 0.00 H new ATOM 0 HA ASP A 133 -12.121 -15.086 0.020 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -14.356 -14.429 -1.937 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -12.769 -15.063 -2.327 1.00 0.00 H new ATOM 2128 N LYS A 134 -12.757 -12.295 0.656 1.00 0.00 N ATOM 2129 CA LYS A 134 -12.427 -10.875 0.631 1.00 0.00 C ATOM 2130 C LYS A 134 -11.201 -10.586 1.491 1.00 0.00 C ATOM 2131 O LYS A 134 -11.173 -10.907 2.680 1.00 0.00 O ATOM 2132 CB LYS A 134 -13.615 -10.045 1.123 1.00 0.00 C ATOM 2133 CG LYS A 134 -14.959 -10.717 0.902 1.00 0.00 C ATOM 2134 CD LYS A 134 -16.091 -9.918 1.527 1.00 0.00 C ATOM 2135 CE LYS A 134 -16.679 -8.921 0.540 1.00 0.00 C ATOM 2136 NZ LYS A 134 -17.683 -8.029 1.185 1.00 0.00 N ATOM 0 H LYS A 134 -13.082 -12.636 1.561 1.00 0.00 H new ATOM 0 HA LYS A 134 -12.200 -10.599 -0.399 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -13.490 -9.842 2.187 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -13.611 -9.082 0.612 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -15.139 -10.830 -0.167 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -14.940 -11.719 1.330 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -16.872 -10.597 1.869 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -15.722 -9.388 2.405 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -15.878 -8.317 0.113 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -17.147 -9.459 -0.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -18.060 -7.364 0.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -18.460 -8.603 1.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -17.230 -7.497 1.955 1.00 0.00 H new ATOM 2150 N LEU A 135 -10.188 -9.977 0.884 1.00 0.00 N ATOM 2151 CA LEU A 135 -8.959 -9.642 1.594 1.00 0.00 C ATOM 2152 C LEU A 135 -8.981 -8.193 2.069 1.00 0.00 C ATOM 2153 O LEU A 135 -8.638 -7.277 1.320 1.00 0.00 O ATOM 2154 CB LEU A 135 -7.746 -9.878 0.693 1.00 0.00 C ATOM 2155 CG LEU A 135 -6.384 -9.535 1.298 1.00 0.00 C ATOM 2156 CD1 LEU A 135 -6.105 -10.404 2.514 1.00 0.00 C ATOM 2157 CD2 LEU A 135 -5.283 -9.698 0.260 1.00 0.00 C ATOM 0 H LEU A 135 -10.194 -9.705 -0.099 1.00 0.00 H new ATOM 0 HA LEU A 135 -8.886 -10.289 2.468 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -7.736 -10.927 0.398 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -7.875 -9.292 -0.217 1.00 0.00 H new ATOM 0 HG LEU A 135 -6.403 -8.493 1.619 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -5.132 -10.145 2.931 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -6.877 -10.237 3.265 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -6.106 -11.453 2.219 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -4.321 -9.450 0.708 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -5.264 -10.730 -0.092 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -5.474 -9.032 -0.581 1.00 0.00 H new ATOM 2169 N THR A 136 -9.385 -7.991 3.319 1.00 0.00 N ATOM 2170 CA THR A 136 -9.450 -6.654 3.895 1.00 0.00 C ATOM 2171 C THR A 136 -8.076 -6.187 4.359 1.00 0.00 C ATOM 2172 O THR A 136 -7.646 -6.497 5.471 1.00 0.00 O ATOM 2173 CB THR A 136 -10.427 -6.601 5.085 1.00 0.00 C ATOM 2174 OG1 THR A 136 -11.728 -7.031 4.671 1.00 0.00 O ATOM 2175 CG2 THR A 136 -10.510 -5.194 5.656 1.00 0.00 C ATOM 0 H THR A 136 -9.672 -8.737 3.952 1.00 0.00 H new ATOM 0 HA THR A 136 -9.810 -5.990 3.109 1.00 0.00 H new ATOM 0 HB THR A 136 -10.054 -7.269 5.861 1.00 0.00 H new ATOM 0 HG1 THR A 136 -12.342 -6.996 5.434 1.00 0.00 H new ATOM 0 HG21 THR A 136 -11.206 -5.182 6.495 1.00 0.00 H new ATOM 0 HG22 THR A 136 -9.523 -4.882 5.998 1.00 0.00 H new ATOM 0 HG23 THR A 136 -10.860 -4.508 4.884 1.00 0.00 H new ATOM 2183 N LEU A 137 -7.390 -5.438 3.502 1.00 0.00 N ATOM 2184 CA LEU A 137 -6.062 -4.927 3.825 1.00 0.00 C ATOM 2185 C LEU A 137 -6.153 -3.555 4.486 1.00 0.00 C ATOM 2186 O LEU A 137 -6.596 -2.586 3.869 1.00 0.00 O ATOM 2187 CB LEU A 137 -5.206 -4.841 2.560 1.00 0.00 C ATOM 2188 CG LEU A 137 -4.523 -6.137 2.123 1.00 0.00 C ATOM 2189 CD1 LEU A 137 -4.076 -6.042 0.672 1.00 0.00 C ATOM 2190 CD2 LEU A 137 -3.340 -6.449 3.028 1.00 0.00 C ATOM 0 H LEU A 137 -7.731 -5.171 2.579 1.00 0.00 H new ATOM 0 HA LEU A 137 -5.594 -5.618 4.527 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -5.836 -4.492 1.742 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -4.438 -4.084 2.716 1.00 0.00 H new ATOM 0 HG LEU A 137 -5.243 -6.951 2.208 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -3.592 -6.974 0.379 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -4.943 -5.867 0.035 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -3.372 -5.217 0.561 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -2.866 -7.375 2.702 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -2.618 -5.634 2.977 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -3.687 -6.562 4.055 1.00 0.00 H new ATOM 2202 N PHE A 138 -5.729 -3.480 5.743 1.00 0.00 N ATOM 2203 CA PHE A 138 -5.761 -2.227 6.487 1.00 0.00 C ATOM 2204 C PHE A 138 -4.393 -1.551 6.473 1.00 0.00 C ATOM 2205 O PHE A 138 -3.448 -2.025 7.103 1.00 0.00 O ATOM 2206 CB PHE A 138 -6.204 -2.478 7.931 1.00 0.00 C ATOM 2207 CG PHE A 138 -6.591 -1.226 8.665 1.00 0.00 C ATOM 2208 CD1 PHE A 138 -5.629 -0.448 9.290 1.00 0.00 C ATOM 2209 CD2 PHE A 138 -7.916 -0.827 8.730 1.00 0.00 C ATOM 2210 CE1 PHE A 138 -5.982 0.705 9.966 1.00 0.00 C ATOM 2211 CE2 PHE A 138 -8.274 0.325 9.404 1.00 0.00 C ATOM 2212 CZ PHE A 138 -7.307 1.091 10.024 1.00 0.00 C ATOM 0 H PHE A 138 -5.359 -4.273 6.268 1.00 0.00 H new ATOM 0 HA PHE A 138 -6.479 -1.564 6.004 1.00 0.00 H new ATOM 0 HB2 PHE A 138 -7.050 -3.165 7.929 1.00 0.00 H new ATOM 0 HB3 PHE A 138 -5.395 -2.971 8.470 1.00 0.00 H new ATOM 0 HD1 PHE A 138 -4.592 -0.746 9.248 1.00 0.00 H new ATOM 0 HD2 PHE A 138 -8.677 -1.423 8.249 1.00 0.00 H new ATOM 0 HE1 PHE A 138 -5.223 1.303 10.448 1.00 0.00 H new ATOM 0 HE2 PHE A 138 -9.310 0.626 9.446 1.00 0.00 H new ATOM 0 HZ PHE A 138 -7.586 1.990 10.553 1.00 0.00 H new ATOM 2222 N CYS A 139 -4.297 -0.441 5.750 1.00 0.00 N ATOM 2223 CA CYS A 139 -3.045 0.301 5.651 1.00 0.00 C ATOM 2224 C CYS A 139 -3.091 1.562 6.509 1.00 0.00 C ATOM 2225 O CYS A 139 -4.156 2.142 6.719 1.00 0.00 O ATOM 2226 CB CYS A 139 -2.760 0.671 4.195 1.00 0.00 C ATOM 2227 SG CYS A 139 -1.175 1.503 3.941 1.00 0.00 S ATOM 0 H CYS A 139 -5.071 -0.035 5.224 1.00 0.00 H new ATOM 0 HA CYS A 139 -2.243 -0.339 6.019 1.00 0.00 H new ATOM 0 HB2 CYS A 139 -2.783 -0.235 3.590 1.00 0.00 H new ATOM 0 HB3 CYS A 139 -3.559 1.317 3.832 1.00 0.00 H new ATOM 0 HG CYS A 139 -0.294 0.641 3.527 1.00 0.00 H new ATOM 2233 N GLU A 140 -1.929 1.979 7.002 1.00 0.00 N ATOM 2234 CA GLU A 140 -1.838 3.170 7.838 1.00 0.00 C ATOM 2235 C GLU A 140 -0.667 4.048 7.409 1.00 0.00 C ATOM 2236 O GLU A 140 0.493 3.651 7.514 1.00 0.00 O ATOM 2237 CB GLU A 140 -1.683 2.776 9.309 1.00 0.00 C ATOM 2238 CG GLU A 140 -2.964 2.256 9.938 1.00 0.00 C ATOM 2239 CD GLU A 140 -3.006 2.470 11.439 1.00 0.00 C ATOM 2240 OE1 GLU A 140 -1.929 2.444 12.071 1.00 0.00 O ATOM 2241 OE2 GLU A 140 -4.114 2.664 11.981 1.00 0.00 O ATOM 0 H GLU A 140 -1.038 1.510 6.837 1.00 0.00 H new ATOM 0 HA GLU A 140 -2.759 3.740 7.717 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -0.911 2.011 9.392 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -1.336 3.642 9.874 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -3.818 2.755 9.480 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -3.064 1.192 9.724 1.00 0.00 H new ATOM 2248 N VAL A 141 -0.980 5.246 6.924 1.00 0.00 N ATOM 2249 CA VAL A 141 0.046 6.182 6.479 1.00 0.00 C ATOM 2250 C VAL A 141 0.199 7.337 7.462 1.00 0.00 C ATOM 2251 O VAL A 141 -0.787 7.853 7.989 1.00 0.00 O ATOM 2252 CB VAL A 141 -0.279 6.749 5.084 1.00 0.00 C ATOM 2253 CG1 VAL A 141 0.884 7.577 4.560 1.00 0.00 C ATOM 2254 CG2 VAL A 141 -0.622 5.624 4.119 1.00 0.00 C ATOM 0 H VAL A 141 -1.935 5.591 6.829 1.00 0.00 H new ATOM 0 HA VAL A 141 0.982 5.626 6.428 1.00 0.00 H new ATOM 0 HB VAL A 141 -1.148 7.401 5.169 1.00 0.00 H new ATOM 0 HG11 VAL A 141 0.636 7.969 3.574 1.00 0.00 H new ATOM 0 HG12 VAL A 141 1.077 8.405 5.242 1.00 0.00 H new ATOM 0 HG13 VAL A 141 1.773 6.951 4.488 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -0.849 6.042 3.138 1.00 0.00 H new ATOM 0 HG22 VAL A 141 0.226 4.944 4.036 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -1.489 5.078 4.490 1.00 0.00 H new ATOM 2264 N SER A 142 1.443 7.739 7.705 1.00 0.00 N ATOM 2265 CA SER A 142 1.726 8.832 8.627 1.00 0.00 C ATOM 2266 C SER A 142 2.596 9.894 7.961 1.00 0.00 C ATOM 2267 O SER A 142 3.788 9.686 7.736 1.00 0.00 O ATOM 2268 CB SER A 142 2.423 8.301 9.882 1.00 0.00 C ATOM 2269 OG SER A 142 1.824 7.095 10.325 1.00 0.00 O ATOM 0 H SER A 142 2.270 7.324 7.276 1.00 0.00 H new ATOM 0 HA SER A 142 0.778 9.289 8.911 1.00 0.00 H new ATOM 0 HB2 SER A 142 3.479 8.131 9.671 1.00 0.00 H new ATOM 0 HB3 SER A 142 2.373 9.048 10.674 1.00 0.00 H new ATOM 0 HG SER A 142 2.288 6.775 11.127 1.00 0.00 H new ATOM 2275 N VAL A 143 1.989 11.035 7.646 1.00 0.00 N ATOM 2276 CA VAL A 143 2.706 12.131 7.007 1.00 0.00 C ATOM 2277 C VAL A 143 3.364 13.036 8.042 1.00 0.00 C ATOM 2278 O VAL A 143 2.684 13.753 8.777 1.00 0.00 O ATOM 2279 CB VAL A 143 1.768 12.976 6.124 1.00 0.00 C ATOM 2280 CG1 VAL A 143 2.548 14.070 5.411 1.00 0.00 C ATOM 2281 CG2 VAL A 143 1.039 12.091 5.124 1.00 0.00 C ATOM 0 H VAL A 143 1.002 11.223 7.823 1.00 0.00 H new ATOM 0 HA VAL A 143 3.476 11.682 6.380 1.00 0.00 H new ATOM 0 HB VAL A 143 1.025 13.452 6.764 1.00 0.00 H new ATOM 0 HG11 VAL A 143 1.869 14.657 4.792 1.00 0.00 H new ATOM 0 HG12 VAL A 143 3.020 14.720 6.148 1.00 0.00 H new ATOM 0 HG13 VAL A 143 3.315 13.619 4.781 1.00 0.00 H new ATOM 0 HG21 VAL A 143 0.381 12.704 4.508 1.00 0.00 H new ATOM 0 HG22 VAL A 143 1.766 11.586 4.487 1.00 0.00 H new ATOM 0 HG23 VAL A 143 0.448 11.348 5.659 1.00 0.00 H new ATOM 2291 N VAL A 144 4.691 12.999 8.095 1.00 0.00 N ATOM 2292 CA VAL A 144 5.442 13.818 9.040 1.00 0.00 C ATOM 2293 C VAL A 144 5.308 15.300 8.710 1.00 0.00 C ATOM 2294 O VAL A 144 5.752 15.753 7.656 1.00 0.00 O ATOM 2295 CB VAL A 144 6.935 13.438 9.049 1.00 0.00 C ATOM 2296 CG1 VAL A 144 7.108 11.957 9.352 1.00 0.00 C ATOM 2297 CG2 VAL A 144 7.584 13.797 7.721 1.00 0.00 C ATOM 0 H VAL A 144 5.269 12.411 7.495 1.00 0.00 H new ATOM 0 HA VAL A 144 5.021 13.629 10.027 1.00 0.00 H new ATOM 0 HB VAL A 144 7.431 14.006 9.836 1.00 0.00 H new ATOM 0 HG11 VAL A 144 8.169 11.708 9.354 1.00 0.00 H new ATOM 0 HG12 VAL A 144 6.681 11.733 10.330 1.00 0.00 H new ATOM 0 HG13 VAL A 144 6.598 11.368 8.590 1.00 0.00 H new ATOM 0 HG21 VAL A 144 8.638 13.522 7.745 1.00 0.00 H new ATOM 0 HG22 VAL A 144 7.086 13.257 6.915 1.00 0.00 H new ATOM 0 HG23 VAL A 144 7.493 14.870 7.550 1.00 0.00 H new ATOM 2307 N GLN A 145 4.694 16.049 9.620 1.00 0.00 N ATOM 2308 CA GLN A 145 4.501 17.482 9.425 1.00 0.00 C ATOM 2309 C GLN A 145 5.319 18.283 10.432 1.00 0.00 C ATOM 2310 O GLN A 145 5.648 17.790 11.512 1.00 0.00 O ATOM 2311 CB GLN A 145 3.020 17.840 9.552 1.00 0.00 C ATOM 2312 CG GLN A 145 2.152 17.240 8.458 1.00 0.00 C ATOM 2313 CD GLN A 145 2.420 17.855 7.098 1.00 0.00 C ATOM 2314 OE1 GLN A 145 3.433 18.524 6.895 1.00 0.00 O ATOM 2315 NE2 GLN A 145 1.510 17.631 6.157 1.00 0.00 N ATOM 0 H GLN A 145 4.322 15.688 10.499 1.00 0.00 H new ATOM 0 HA GLN A 145 4.844 17.737 8.422 1.00 0.00 H new ATOM 0 HB2 GLN A 145 2.655 17.500 10.521 1.00 0.00 H new ATOM 0 HB3 GLN A 145 2.914 18.925 9.534 1.00 0.00 H new ATOM 0 HG2 GLN A 145 2.328 16.166 8.408 1.00 0.00 H new ATOM 0 HG3 GLN A 145 1.102 17.379 8.715 1.00 0.00 H new ATOM 0 HE21 GLN A 145 0.685 17.070 6.369 1.00 0.00 H new ATOM 0 HE22 GLN A 145 1.636 18.020 5.222 1.00 0.00 H new ATOM 2324 N ASP A 146 5.644 19.520 10.073 1.00 0.00 N ATOM 2325 CA ASP A 146 6.423 20.390 10.946 1.00 0.00 C ATOM 2326 C ASP A 146 5.733 20.565 12.295 1.00 0.00 C ATOM 2327 O ASP A 146 4.592 20.142 12.479 1.00 0.00 O ATOM 2328 CB ASP A 146 6.634 21.754 10.286 1.00 0.00 C ATOM 2329 CG ASP A 146 7.783 21.747 9.297 1.00 0.00 C ATOM 2330 OD1 ASP A 146 8.855 21.204 9.637 1.00 0.00 O ATOM 2331 OD2 ASP A 146 7.610 22.285 8.183 1.00 0.00 O ATOM 0 H ASP A 146 5.380 19.943 9.183 1.00 0.00 H new ATOM 0 HA ASP A 146 7.393 19.922 11.113 1.00 0.00 H new ATOM 0 HB2 ASP A 146 5.719 22.052 9.774 1.00 0.00 H new ATOM 0 HB3 ASP A 146 6.826 22.501 11.056 1.00 0.00 H new ATOM 2336 N SER A 147 6.434 21.190 13.236 1.00 0.00 N ATOM 2337 CA SER A 147 5.891 21.416 14.570 1.00 0.00 C ATOM 2338 C SER A 147 5.217 22.782 14.658 1.00 0.00 C ATOM 2339 O SER A 147 5.886 23.816 14.693 1.00 0.00 O ATOM 2340 CB SER A 147 6.999 21.313 15.619 1.00 0.00 C ATOM 2341 OG SER A 147 6.457 21.216 16.925 1.00 0.00 O ATOM 0 H SER A 147 7.379 21.549 13.099 1.00 0.00 H new ATOM 0 HA SER A 147 5.143 20.648 14.766 1.00 0.00 H new ATOM 0 HB2 SER A 147 7.619 20.440 15.413 1.00 0.00 H new ATOM 0 HB3 SER A 147 7.647 22.187 15.555 1.00 0.00 H new ATOM 0 HG SER A 147 7.185 21.150 17.577 1.00 0.00 H new ATOM 2347 N VAL A 148 3.888 22.779 14.692 1.00 0.00 N ATOM 2348 CA VAL A 148 3.123 24.017 14.777 1.00 0.00 C ATOM 2349 C VAL A 148 2.109 23.960 15.914 1.00 0.00 C ATOM 2350 O VAL A 148 1.264 23.067 15.961 1.00 0.00 O ATOM 2351 CB VAL A 148 2.383 24.311 13.458 1.00 0.00 C ATOM 2352 CG1 VAL A 148 3.335 24.908 12.433 1.00 0.00 C ATOM 2353 CG2 VAL A 148 1.732 23.046 12.920 1.00 0.00 C ATOM 0 H VAL A 148 3.319 21.933 14.662 1.00 0.00 H new ATOM 0 HA VAL A 148 3.837 24.817 14.971 1.00 0.00 H new ATOM 0 HB VAL A 148 1.598 25.040 13.657 1.00 0.00 H new ATOM 0 HG11 VAL A 148 2.794 25.109 11.508 1.00 0.00 H new ATOM 0 HG12 VAL A 148 3.750 25.839 12.820 1.00 0.00 H new ATOM 0 HG13 VAL A 148 4.144 24.205 12.235 1.00 0.00 H new ATOM 0 HG21 VAL A 148 1.214 23.272 11.988 1.00 0.00 H new ATOM 0 HG22 VAL A 148 2.498 22.293 12.736 1.00 0.00 H new ATOM 0 HG23 VAL A 148 1.017 22.666 13.650 1.00 0.00 H new ATOM 2363 N ASN A 149 2.199 24.920 16.829 1.00 0.00 N ATOM 2364 CA ASN A 149 1.288 24.978 17.967 1.00 0.00 C ATOM 2365 C ASN A 149 0.840 26.412 18.231 1.00 0.00 C ATOM 2366 O ASN A 149 1.610 27.232 18.731 1.00 0.00 O ATOM 2367 CB ASN A 149 1.962 24.405 19.215 1.00 0.00 C ATOM 2368 CG ASN A 149 0.959 23.874 20.221 1.00 0.00 C ATOM 2369 OD1 ASN A 149 0.871 24.366 21.346 1.00 0.00 O ATOM 2370 ND2 ASN A 149 0.196 22.864 19.819 1.00 0.00 N ATOM 0 H ASN A 149 2.893 25.668 16.805 1.00 0.00 H new ATOM 0 HA ASN A 149 0.409 24.379 17.729 1.00 0.00 H new ATOM 0 HB2 ASN A 149 2.639 23.602 18.923 1.00 0.00 H new ATOM 0 HB3 ASN A 149 2.569 25.179 19.685 1.00 0.00 H new ATOM 0 HD21 ASN A 149 -0.497 22.465 20.452 1.00 0.00 H new ATOM 0 HD22 ASN A 149 0.303 22.487 18.877 1.00 0.00 H new ATOM 2377 N ILE A 150 -0.411 26.707 17.891 1.00 0.00 N ATOM 2378 CA ILE A 150 -0.962 28.041 18.093 1.00 0.00 C ATOM 2379 C ILE A 150 -0.574 28.595 19.460 1.00 0.00 C ATOM 2380 O ILE A 150 -0.611 27.883 20.463 1.00 0.00 O ATOM 2381 CB ILE A 150 -2.497 28.040 17.969 1.00 0.00 C ATOM 2382 CG1 ILE A 150 -2.919 27.537 16.587 1.00 0.00 C ATOM 2383 CG2 ILE A 150 -3.050 29.435 18.221 1.00 0.00 C ATOM 2384 CD1 ILE A 150 -4.325 26.980 16.549 1.00 0.00 C ATOM 0 H ILE A 150 -1.061 26.040 17.475 1.00 0.00 H new ATOM 0 HA ILE A 150 -0.543 28.677 17.314 1.00 0.00 H new ATOM 0 HB ILE A 150 -2.906 27.366 18.721 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -2.842 28.356 15.872 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -2.222 26.764 16.262 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -4.136 29.418 18.130 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -2.775 29.759 19.225 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -2.635 30.128 17.489 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -4.556 26.643 15.538 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -4.402 26.139 17.239 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -5.032 27.756 16.842 1.00 0.00 H new ATOM 2396 N SER A 151 -0.204 29.872 19.492 1.00 0.00 N ATOM 2397 CA SER A 151 0.192 30.522 20.735 1.00 0.00 C ATOM 2398 C SER A 151 -0.845 31.556 21.162 1.00 0.00 C ATOM 2399 O SER A 151 -1.042 32.568 20.490 1.00 0.00 O ATOM 2400 CB SER A 151 1.559 31.190 20.573 1.00 0.00 C ATOM 2401 OG SER A 151 1.485 32.295 19.689 1.00 0.00 O ATOM 0 H SER A 151 -0.170 30.476 18.671 1.00 0.00 H new ATOM 0 HA SER A 151 0.258 29.759 21.510 1.00 0.00 H new ATOM 0 HB2 SER A 151 1.923 31.522 21.545 1.00 0.00 H new ATOM 0 HB3 SER A 151 2.279 30.465 20.194 1.00 0.00 H new ATOM 0 HG SER A 151 0.597 32.705 19.752 1.00 0.00 H new ATOM 2407 N GLY A 152 -1.505 31.294 22.286 1.00 0.00 N ATOM 2408 CA GLY A 152 -2.514 32.210 22.784 1.00 0.00 C ATOM 2409 C GLY A 152 -3.723 31.491 23.349 1.00 0.00 C ATOM 2410 O GLY A 152 -4.548 30.969 22.600 1.00 0.00 O ATOM 0 H GLY A 152 -1.359 30.464 22.860 1.00 0.00 H new ATOM 0 HA2 GLY A 152 -2.077 32.842 23.557 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -2.832 32.869 21.976 1.00 0.00 H new ATOM 2414 N GLN A 153 -3.826 31.461 24.674 1.00 0.00 N ATOM 2415 CA GLN A 153 -4.942 30.798 25.338 1.00 0.00 C ATOM 2416 C GLN A 153 -6.268 31.444 24.951 1.00 0.00 C ATOM 2417 O GLN A 153 -6.643 32.486 25.488 1.00 0.00 O ATOM 2418 CB GLN A 153 -4.762 30.846 26.856 1.00 0.00 C ATOM 2419 CG GLN A 153 -5.976 30.356 27.629 1.00 0.00 C ATOM 2420 CD GLN A 153 -6.028 30.905 29.041 1.00 0.00 C ATOM 2421 OE1 GLN A 153 -5.213 31.744 29.425 1.00 0.00 O ATOM 2422 NE2 GLN A 153 -6.991 30.432 29.825 1.00 0.00 N ATOM 0 H GLN A 153 -3.151 31.888 25.308 1.00 0.00 H new ATOM 0 HA GLN A 153 -4.957 29.757 25.014 1.00 0.00 H new ATOM 0 HB2 GLN A 153 -3.898 30.240 27.130 1.00 0.00 H new ATOM 0 HB3 GLN A 153 -4.541 31.871 27.155 1.00 0.00 H new ATOM 0 HG2 GLN A 153 -6.882 30.646 27.097 1.00 0.00 H new ATOM 0 HG3 GLN A 153 -5.963 29.267 27.667 1.00 0.00 H new ATOM 0 HE21 GLN A 153 -7.646 29.737 29.466 1.00 0.00 H new ATOM 0 HE22 GLN A 153 -7.076 30.764 30.786 1.00 0.00 H new ATOM 2431 N SER A 154 -6.975 30.819 24.014 1.00 0.00 N ATOM 2432 CA SER A 154 -8.258 31.335 23.552 1.00 0.00 C ATOM 2433 C SER A 154 -9.292 30.218 23.460 1.00 0.00 C ATOM 2434 O SER A 154 -8.975 29.045 23.657 1.00 0.00 O ATOM 2435 CB SER A 154 -8.098 32.011 22.189 1.00 0.00 C ATOM 2436 OG SER A 154 -7.556 33.313 22.326 1.00 0.00 O ATOM 0 H SER A 154 -6.680 29.954 23.560 1.00 0.00 H new ATOM 0 HA SER A 154 -8.608 32.071 24.276 1.00 0.00 H new ATOM 0 HB2 SER A 154 -7.448 31.408 21.555 1.00 0.00 H new ATOM 0 HB3 SER A 154 -9.066 32.067 21.692 1.00 0.00 H new ATOM 0 HG SER A 154 -7.462 33.723 21.441 1.00 0.00 H new ATOM 2442 N GLY A 155 -10.532 30.591 23.159 1.00 0.00 N ATOM 2443 CA GLY A 155 -11.595 29.609 23.046 1.00 0.00 C ATOM 2444 C GLY A 155 -12.097 29.459 21.624 1.00 0.00 C ATOM 2445 O GLY A 155 -11.359 29.658 20.658 1.00 0.00 O ATOM 0 H GLY A 155 -10.820 31.555 22.991 1.00 0.00 H new ATOM 0 HA2 GLY A 155 -11.234 28.645 23.404 1.00 0.00 H new ATOM 0 HA3 GLY A 155 -12.424 29.899 23.692 1.00 0.00 H new ATOM 2449 N PRO A 156 -13.381 29.098 21.480 1.00 0.00 N ATOM 2450 CA PRO A 156 -14.009 28.911 20.168 1.00 0.00 C ATOM 2451 C PRO A 156 -14.194 30.228 19.422 1.00 0.00 C ATOM 2452 O PRO A 156 -14.929 31.108 19.869 1.00 0.00 O ATOM 2453 CB PRO A 156 -15.367 28.295 20.510 1.00 0.00 C ATOM 2454 CG PRO A 156 -15.652 28.752 21.899 1.00 0.00 C ATOM 2455 CD PRO A 156 -14.318 28.844 22.587 1.00 0.00 C ATOM 0 HA PRO A 156 -13.400 28.293 19.508 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -16.139 28.629 19.817 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -15.334 27.207 20.450 1.00 0.00 H new ATOM 0 HG2 PRO A 156 -16.157 29.718 21.896 1.00 0.00 H new ATOM 0 HG3 PRO A 156 -16.309 28.051 22.413 1.00 0.00 H new ATOM 0 HD2 PRO A 156 -14.299 29.649 23.322 1.00 0.00 H new ATOM 0 HD3 PRO A 156 -14.074 27.923 23.117 1.00 0.00 H new ATOM 2463 N SER A 157 -13.522 30.357 18.282 1.00 0.00 N ATOM 2464 CA SER A 157 -13.610 31.568 17.475 1.00 0.00 C ATOM 2465 C SER A 157 -14.809 31.508 16.534 1.00 0.00 C ATOM 2466 O SER A 157 -15.360 30.436 16.280 1.00 0.00 O ATOM 2467 CB SER A 157 -12.325 31.764 16.670 1.00 0.00 C ATOM 2468 OG SER A 157 -11.189 31.778 17.517 1.00 0.00 O ATOM 0 H SER A 157 -12.911 29.637 17.897 1.00 0.00 H new ATOM 0 HA SER A 157 -13.741 32.415 18.149 1.00 0.00 H new ATOM 0 HB2 SER A 157 -12.226 30.963 15.937 1.00 0.00 H new ATOM 0 HB3 SER A 157 -12.380 32.700 16.114 1.00 0.00 H new ATOM 0 HG SER A 157 -10.380 31.903 16.978 1.00 0.00 H new ATOM 2474 N SER A 158 -15.209 32.666 16.020 1.00 0.00 N ATOM 2475 CA SER A 158 -16.345 32.747 15.109 1.00 0.00 C ATOM 2476 C SER A 158 -16.030 33.659 13.927 1.00 0.00 C ATOM 2477 O SER A 158 -15.862 34.867 14.088 1.00 0.00 O ATOM 2478 CB SER A 158 -17.582 33.261 15.848 1.00 0.00 C ATOM 2479 OG SER A 158 -18.250 32.206 16.519 1.00 0.00 O ATOM 0 H SER A 158 -14.763 33.562 16.219 1.00 0.00 H new ATOM 0 HA SER A 158 -16.547 31.745 14.729 1.00 0.00 H new ATOM 0 HB2 SER A 158 -17.288 34.025 16.567 1.00 0.00 H new ATOM 0 HB3 SER A 158 -18.262 33.734 15.140 1.00 0.00 H new ATOM 0 HG SER A 158 -19.036 32.560 16.985 1.00 0.00 H new ATOM 2485 N GLY A 159 -15.952 33.069 12.738 1.00 0.00 N ATOM 2486 CA GLY A 159 -15.657 33.842 11.545 1.00 0.00 C ATOM 2487 C GLY A 159 -16.714 34.890 11.257 1.00 0.00 C ATOM 2488 O GLY A 159 -17.831 34.810 11.768 1.00 0.00 O ATOM 0 H GLY A 159 -16.088 32.071 12.579 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -14.689 34.329 11.662 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -15.574 33.169 10.691 1.00 0.00 H new TER 2492 GLY A 159