USER MOD reduce.3.24.130724 H: found=0, std=0, add=1184, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1180 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 68 MET CE :methyl -161:sc= -0.224 (180deg=-0.749) USER MOD Set 1.2: B 9 HIS : no HD1:sc=-0.00993 X(o=-0.23,f=-0.23) USER MOD Set 2.1: A 105 MET CE :methyl 173:sc= -0.743 (180deg=-0.928) USER MOD Set 2.2: B 7 THR OG1 : rot 97:sc= 1.21 USER MOD Set 3.1: A 103 HIS : no HD1:sc= 0.485 K(o=0.078,f=-1.1) USER MOD Set 3.2: A 107 ASN : amide:sc= -0.407 K(o=0.078,f=-1.1) USER MOD Set 4.1: A 56 ASN : amide:sc= 1.06 K(o=1.4,f=-7.6!) USER MOD Set 4.2: A 58 THR OG1 : rot -20:sc= 0.379 USER MOD Set 5.1: A 32 MET CE :methyl 169:sc=-0.00155 (180deg=-0.191) USER MOD Set 5.2: A 47 MET CE :methyl -125:sc=-0.00338 (180deg=-0.00522) USER MOD Single : A 4 GLN : amide:sc= -0.0591 X(o=-0.059,f=-0.53) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 70:sc= 1.22 USER MOD Single : A 17 LYS NZ :NH3+ -167:sc= 1.16 (180deg=1.01) USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.0101 USER MOD Single : A 24 THR OG1 : rot -77:sc= 1.07 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 146:sc= -0.268 (180deg=-1.15!) USER MOD Single : A 30 THR OG1 : rot 82:sc= 1.27 USER MOD Single : A 34 SER OG : rot -158:sc= 0.401 USER MOD Single : A 37 GLN : amide:sc= -0.0461 X(o=-0.046,f=-0.048) USER MOD Single : A 38 ASN : amide:sc= 0.904 K(o=0.9,f=-4.6!) USER MOD Single : A 40 THR OG1 : rot -67:sc= 1 USER MOD Single : A 45 GLN : amide:sc= 0.517 K(o=0.52,f=-0.021) USER MOD Single : A 49 ASN : amide:sc= -0.12 K(o=-0.12,f=-1.9!) USER MOD Single : A 66 THR OG1 : rot -78:sc= 1 USER MOD Single : A 67 MET CE :methyl 173:sc= -0.0399 (180deg=-0.159) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl -175:sc= -0.147 (180deg=-0.237) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 ASN : amide:sc= -0.0112 K(o=-0.011,f=-4.2!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 80:sc= 0.0203 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot -69:sc= 1 USER MOD Single : A 120 MET CE :methyl 158:sc= -0.834 (180deg=-2.14!) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=-0.093) USER MOD Single : A 133 ASN : amide:sc= 0.501 K(o=0.5,f=-8.5!) USER MOD Single : A 134 TYR OH : rot 180:sc= -0.0155 USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0.05) USER MOD Single : A 140 MET CE :methyl 174:sc= -0.136 (180deg=-0.247) USER MOD Single : A 141 MET CE :methyl 175:sc= -1.43 (180deg=-1.5) USER MOD Single : A 142 THR OG1 : rot 107:sc= 1.32 USER MOD Single : B 1 ARG N :NH3+ -163:sc= 0.419 (180deg=-0.294) USER MOD Single : B 3 LYS NZ :NH3+ -175:sc= 1.89 (180deg=1.54) USER MOD Single : B 5 GLN : amide:sc= 0.661 K(o=0.66,f=-2.5!) USER MOD Single : B 6 LYS NZ :NH3+ -177:sc= 2.13 (180deg=2.02) USER MOD ----------------------------------------------------------------- ATOM 29 N GLU A 3 1.635 1.366 17.003 1.00 0.00 N ATOM 30 CA GLU A 3 0.520 1.040 16.169 1.00 0.00 C ATOM 31 C GLU A 3 0.919 0.903 14.740 1.00 0.00 C ATOM 32 O GLU A 3 0.390 0.052 14.028 1.00 0.00 O ATOM 33 CB GLU A 3 -0.649 2.012 16.398 1.00 0.00 C ATOM 34 CG GLU A 3 -1.174 2.027 17.835 1.00 0.00 C ATOM 35 CD GLU A 3 -2.229 3.107 18.028 1.00 0.00 C ATOM 36 OE1 GLU A 3 -1.909 4.290 18.320 1.00 0.00 O ATOM 37 OE2 GLU A 3 -3.436 2.745 18.033 1.00 0.00 O ATOM 0 HA GLU A 3 0.152 0.056 16.460 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -0.329 3.019 16.129 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -1.466 1.747 15.727 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -1.599 1.053 18.079 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -0.347 2.196 18.525 1.00 0.00 H new ATOM 44 N GLN A 4 1.834 1.769 14.269 1.00 0.00 N ATOM 45 CA GLN A 4 2.148 1.981 12.890 1.00 0.00 C ATOM 46 C GLN A 4 3.279 1.077 12.541 1.00 0.00 C ATOM 47 O GLN A 4 3.290 0.431 11.494 1.00 0.00 O ATOM 48 CB GLN A 4 2.348 3.441 12.450 1.00 0.00 C ATOM 49 CG GLN A 4 1.157 4.396 12.351 1.00 0.00 C ATOM 50 CD GLN A 4 0.533 4.613 13.722 1.00 0.00 C ATOM 51 OE1 GLN A 4 1.235 4.773 14.720 1.00 0.00 O ATOM 52 NE2 GLN A 4 -0.826 4.646 13.766 1.00 0.00 N ATOM 0 H GLN A 4 2.389 2.358 14.891 1.00 0.00 H new ATOM 0 HA GLN A 4 1.265 1.725 12.305 1.00 0.00 H new ATOM 0 HB2 GLN A 4 3.062 3.889 13.141 1.00 0.00 H new ATOM 0 HB3 GLN A 4 2.824 3.418 11.470 1.00 0.00 H new ATOM 0 HG2 GLN A 4 1.482 5.351 11.938 1.00 0.00 H new ATOM 0 HG3 GLN A 4 0.413 3.989 11.666 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -1.367 4.508 12.913 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -1.304 4.809 14.652 1.00 0.00 H new ATOM 61 N ILE A 5 4.255 0.812 13.428 1.00 0.00 N ATOM 62 CA ILE A 5 5.282 -0.174 13.287 1.00 0.00 C ATOM 63 C ILE A 5 4.676 -1.534 13.323 1.00 0.00 C ATOM 64 O ILE A 5 5.089 -2.401 12.554 1.00 0.00 O ATOM 65 CB ILE A 5 6.388 -0.061 14.293 1.00 0.00 C ATOM 66 CG1 ILE A 5 6.886 1.366 14.576 1.00 0.00 C ATOM 67 CG2 ILE A 5 7.544 -1.009 13.932 1.00 0.00 C ATOM 68 CD1 ILE A 5 7.203 2.292 13.403 1.00 0.00 C ATOM 0 H ILE A 5 4.331 1.324 14.307 1.00 0.00 H new ATOM 0 HA ILE A 5 5.753 0.007 12.321 1.00 0.00 H new ATOM 0 HB ILE A 5 5.945 -0.371 15.239 1.00 0.00 H new ATOM 0 HG12 ILE A 5 6.133 1.860 15.190 1.00 0.00 H new ATOM 0 HG13 ILE A 5 7.788 1.284 15.182 1.00 0.00 H new ATOM 0 HG21 ILE A 5 8.338 -0.914 14.673 1.00 0.00 H new ATOM 0 HG22 ILE A 5 7.181 -2.037 13.919 1.00 0.00 H new ATOM 0 HG23 ILE A 5 7.933 -0.749 12.948 1.00 0.00 H new ATOM 0 HD11 ILE A 5 7.540 3.257 13.782 1.00 0.00 H new ATOM 0 HD12 ILE A 5 7.988 1.848 12.791 1.00 0.00 H new ATOM 0 HD13 ILE A 5 6.307 2.433 12.798 1.00 0.00 H new ATOM 80 N ALA A 6 3.696 -1.828 14.196 1.00 0.00 N ATOM 81 CA ALA A 6 2.746 -2.896 14.220 1.00 0.00 C ATOM 82 C ALA A 6 2.090 -3.202 12.918 1.00 0.00 C ATOM 83 O ALA A 6 1.988 -4.353 12.496 1.00 0.00 O ATOM 84 CB ALA A 6 1.795 -2.810 15.425 1.00 0.00 C ATOM 0 H ALA A 6 3.555 -1.221 15.004 1.00 0.00 H new ATOM 0 HA ALA A 6 3.340 -3.796 14.381 1.00 0.00 H new ATOM 0 HB1 ALA A 6 1.094 -3.644 15.396 1.00 0.00 H new ATOM 0 HB2 ALA A 6 2.373 -2.854 16.348 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.243 -1.871 15.387 1.00 0.00 H new ATOM 90 N GLU A 7 1.459 -2.169 12.332 1.00 0.00 N ATOM 91 CA GLU A 7 0.735 -2.292 11.106 1.00 0.00 C ATOM 92 C GLU A 7 1.664 -2.531 9.966 1.00 0.00 C ATOM 93 O GLU A 7 1.398 -3.234 8.992 1.00 0.00 O ATOM 94 CB GLU A 7 -0.156 -1.045 10.980 1.00 0.00 C ATOM 95 CG GLU A 7 -1.108 -1.184 9.791 1.00 0.00 C ATOM 96 CD GLU A 7 -2.286 -0.242 9.991 1.00 0.00 C ATOM 97 OE1 GLU A 7 -3.042 -0.379 10.989 1.00 0.00 O ATOM 98 OE2 GLU A 7 -2.377 0.722 9.185 1.00 0.00 O ATOM 0 H GLU A 7 1.452 -1.226 12.720 1.00 0.00 H new ATOM 0 HA GLU A 7 0.082 -3.165 11.093 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -0.728 -0.906 11.897 1.00 0.00 H new ATOM 0 HB3 GLU A 7 0.465 -0.158 10.854 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -0.589 -0.947 8.862 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -1.458 -2.213 9.706 1.00 0.00 H new ATOM 105 N PHE A 8 2.872 -1.942 10.007 1.00 0.00 N ATOM 106 CA PHE A 8 3.836 -2.097 8.962 1.00 0.00 C ATOM 107 C PHE A 8 4.364 -3.490 8.977 1.00 0.00 C ATOM 108 O PHE A 8 4.406 -4.194 7.969 1.00 0.00 O ATOM 109 CB PHE A 8 4.982 -1.085 9.134 1.00 0.00 C ATOM 110 CG PHE A 8 5.844 -1.017 7.920 1.00 0.00 C ATOM 111 CD1 PHE A 8 5.317 -0.646 6.705 1.00 0.00 C ATOM 112 CD2 PHE A 8 7.159 -1.400 8.029 1.00 0.00 C ATOM 113 CE1 PHE A 8 6.084 -0.641 5.564 1.00 0.00 C ATOM 114 CE2 PHE A 8 7.957 -1.278 6.916 1.00 0.00 C ATOM 115 CZ PHE A 8 7.417 -0.949 5.695 1.00 0.00 C ATOM 0 H PHE A 8 3.185 -1.350 10.776 1.00 0.00 H new ATOM 0 HA PHE A 8 3.357 -1.907 8.002 1.00 0.00 H new ATOM 0 HB2 PHE A 8 4.568 -0.098 9.342 1.00 0.00 H new ATOM 0 HB3 PHE A 8 5.588 -1.365 9.996 1.00 0.00 H new ATOM 0 HD1 PHE A 8 4.279 -0.353 6.646 1.00 0.00 H new ATOM 0 HD2 PHE A 8 7.553 -1.784 8.958 1.00 0.00 H new ATOM 0 HE1 PHE A 8 5.655 -0.404 4.601 1.00 0.00 H new ATOM 0 HE2 PHE A 8 9.021 -1.443 7.002 1.00 0.00 H new ATOM 0 HZ PHE A 8 8.053 -0.932 4.822 1.00 0.00 H new ATOM 125 N LYS A 9 4.592 -4.067 10.170 1.00 0.00 N ATOM 126 CA LYS A 9 5.003 -5.403 10.470 1.00 0.00 C ATOM 127 C LYS A 9 4.021 -6.438 10.043 1.00 0.00 C ATOM 128 O LYS A 9 4.394 -7.574 9.754 1.00 0.00 O ATOM 129 CB LYS A 9 5.328 -5.496 11.971 1.00 0.00 C ATOM 130 CG LYS A 9 5.968 -6.792 12.472 1.00 0.00 C ATOM 131 CD LYS A 9 6.469 -6.892 13.914 1.00 0.00 C ATOM 132 CE LYS A 9 6.988 -8.255 14.377 1.00 0.00 C ATOM 133 NZ LYS A 9 7.690 -8.040 15.662 1.00 0.00 N ATOM 0 H LYS A 9 4.472 -3.527 11.027 1.00 0.00 H new ATOM 0 HA LYS A 9 5.898 -5.621 9.887 1.00 0.00 H new ATOM 0 HB2 LYS A 9 5.995 -4.671 12.223 1.00 0.00 H new ATOM 0 HB3 LYS A 9 4.403 -5.340 12.527 1.00 0.00 H new ATOM 0 HG2 LYS A 9 5.240 -7.590 12.326 1.00 0.00 H new ATOM 0 HG3 LYS A 9 6.814 -7.009 11.820 1.00 0.00 H new ATOM 0 HD2 LYS A 9 7.268 -6.163 14.046 1.00 0.00 H new ATOM 0 HD3 LYS A 9 5.655 -6.597 14.576 1.00 0.00 H new ATOM 0 HE2 LYS A 9 6.165 -8.959 14.501 1.00 0.00 H new ATOM 0 HE3 LYS A 9 7.664 -8.682 13.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 8.059 -8.947 16.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 8.478 -7.377 15.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 7.026 -7.645 16.358 1.00 0.00 H new ATOM 147 N GLU A 10 2.720 -6.106 9.967 1.00 0.00 N ATOM 148 CA GLU A 10 1.696 -6.902 9.363 1.00 0.00 C ATOM 149 C GLU A 10 1.954 -7.065 7.905 1.00 0.00 C ATOM 150 O GLU A 10 1.902 -8.167 7.362 1.00 0.00 O ATOM 151 CB GLU A 10 0.259 -6.420 9.624 1.00 0.00 C ATOM 152 CG GLU A 10 -0.226 -6.553 11.069 1.00 0.00 C ATOM 153 CD GLU A 10 -0.340 -7.947 11.669 1.00 0.00 C ATOM 154 OE1 GLU A 10 -1.176 -8.717 11.124 1.00 0.00 O ATOM 155 OE2 GLU A 10 0.407 -8.270 12.631 1.00 0.00 O ATOM 0 H GLU A 10 2.362 -5.231 10.350 1.00 0.00 H new ATOM 0 HA GLU A 10 1.754 -7.872 9.857 1.00 0.00 H new ATOM 0 HB2 GLU A 10 0.186 -5.373 9.329 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -0.417 -6.981 8.979 1.00 0.00 H new ATOM 0 HG2 GLU A 10 0.448 -5.974 11.700 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -1.207 -6.082 11.135 1.00 0.00 H new ATOM 162 N ALA A 11 2.328 -6.023 7.141 1.00 0.00 N ATOM 163 CA ALA A 11 2.587 -6.200 5.746 1.00 0.00 C ATOM 164 C ALA A 11 3.882 -6.909 5.550 1.00 0.00 C ATOM 165 O ALA A 11 4.022 -7.761 4.674 1.00 0.00 O ATOM 166 CB ALA A 11 2.712 -4.776 5.181 1.00 0.00 C ATOM 0 H ALA A 11 2.450 -5.070 7.483 1.00 0.00 H new ATOM 0 HA ALA A 11 1.804 -6.784 5.262 1.00 0.00 H new ATOM 0 HB1 ALA A 11 2.912 -4.826 4.111 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.782 -4.234 5.352 1.00 0.00 H new ATOM 0 HB3 ALA A 11 3.531 -4.257 5.679 1.00 0.00 H new ATOM 172 N PHE A 12 4.892 -6.562 6.368 1.00 0.00 N ATOM 173 CA PHE A 12 6.178 -7.171 6.506 1.00 0.00 C ATOM 174 C PHE A 12 6.184 -8.661 6.519 1.00 0.00 C ATOM 175 O PHE A 12 6.948 -9.308 5.805 1.00 0.00 O ATOM 176 CB PHE A 12 6.995 -6.624 7.690 1.00 0.00 C ATOM 177 CG PHE A 12 8.444 -6.578 7.348 1.00 0.00 C ATOM 178 CD1 PHE A 12 9.263 -7.652 7.610 1.00 0.00 C ATOM 179 CD2 PHE A 12 9.077 -5.445 6.895 1.00 0.00 C ATOM 180 CE1 PHE A 12 10.592 -7.735 7.269 1.00 0.00 C ATOM 181 CE2 PHE A 12 10.400 -5.455 6.522 1.00 0.00 C ATOM 182 CZ PHE A 12 11.117 -6.621 6.658 1.00 0.00 C ATOM 0 H PHE A 12 4.793 -5.768 7.000 1.00 0.00 H new ATOM 0 HA PHE A 12 6.673 -6.874 5.581 1.00 0.00 H new ATOM 0 HB2 PHE A 12 6.645 -5.625 7.950 1.00 0.00 H new ATOM 0 HB3 PHE A 12 6.842 -7.254 8.567 1.00 0.00 H new ATOM 0 HD1 PHE A 12 8.828 -8.496 8.124 1.00 0.00 H new ATOM 0 HD2 PHE A 12 8.520 -4.522 6.830 1.00 0.00 H new ATOM 0 HE1 PHE A 12 11.184 -8.616 7.468 1.00 0.00 H new ATOM 0 HE2 PHE A 12 10.868 -4.564 6.130 1.00 0.00 H new ATOM 0 HZ PHE A 12 12.125 -6.663 6.272 1.00 0.00 H new ATOM 192 N SER A 13 5.323 -9.252 7.366 1.00 0.00 N ATOM 193 CA SER A 13 5.373 -10.639 7.709 1.00 0.00 C ATOM 194 C SER A 13 4.938 -11.508 6.580 1.00 0.00 C ATOM 195 O SER A 13 5.356 -12.660 6.472 1.00 0.00 O ATOM 196 CB SER A 13 4.514 -10.951 8.946 1.00 0.00 C ATOM 197 OG SER A 13 5.038 -10.244 10.060 1.00 0.00 O ATOM 0 H SER A 13 4.566 -8.747 7.828 1.00 0.00 H new ATOM 0 HA SER A 13 6.417 -10.856 7.937 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.478 -10.661 8.769 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.515 -12.023 9.145 1.00 0.00 H new ATOM 0 HG SER A 13 4.879 -9.284 9.942 1.00 0.00 H new ATOM 203 N LEU A 14 4.218 -10.949 5.591 1.00 0.00 N ATOM 204 CA LEU A 14 3.870 -11.643 4.390 1.00 0.00 C ATOM 205 C LEU A 14 5.017 -11.912 3.478 1.00 0.00 C ATOM 206 O LEU A 14 5.087 -12.883 2.727 1.00 0.00 O ATOM 207 CB LEU A 14 2.906 -10.740 3.602 1.00 0.00 C ATOM 208 CG LEU A 14 1.644 -10.257 4.337 1.00 0.00 C ATOM 209 CD1 LEU A 14 0.910 -9.292 3.391 1.00 0.00 C ATOM 210 CD2 LEU A 14 0.699 -11.390 4.774 1.00 0.00 C ATOM 0 H LEU A 14 3.869 -9.991 5.627 1.00 0.00 H new ATOM 0 HA LEU A 14 3.454 -12.603 4.696 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.460 -9.863 3.268 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.592 -11.278 2.708 1.00 0.00 H new ATOM 0 HG LEU A 14 1.954 -9.773 5.263 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.005 -8.925 3.876 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.561 -8.451 3.153 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.643 -9.815 2.473 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.166 -10.966 5.285 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.366 -11.945 3.897 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.226 -12.063 5.451 1.00 0.00 H new ATOM 222 N PHE A 15 6.012 -11.007 3.451 1.00 0.00 N ATOM 223 CA PHE A 15 7.219 -11.114 2.692 1.00 0.00 C ATOM 224 C PHE A 15 8.221 -11.922 3.443 1.00 0.00 C ATOM 225 O PHE A 15 8.730 -12.933 2.964 1.00 0.00 O ATOM 226 CB PHE A 15 7.699 -9.668 2.480 1.00 0.00 C ATOM 227 CG PHE A 15 6.940 -8.889 1.462 1.00 0.00 C ATOM 228 CD1 PHE A 15 5.857 -8.124 1.827 1.00 0.00 C ATOM 229 CD2 PHE A 15 7.433 -8.833 0.179 1.00 0.00 C ATOM 230 CE1 PHE A 15 5.334 -7.252 0.901 1.00 0.00 C ATOM 231 CE2 PHE A 15 6.795 -8.075 -0.774 1.00 0.00 C ATOM 232 CZ PHE A 15 5.765 -7.243 -0.405 1.00 0.00 C ATOM 0 H PHE A 15 5.970 -10.145 3.995 1.00 0.00 H new ATOM 0 HA PHE A 15 7.070 -11.617 1.737 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.644 -9.141 3.432 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.749 -9.690 2.188 1.00 0.00 H new ATOM 0 HD1 PHE A 15 5.428 -8.206 2.815 1.00 0.00 H new ATOM 0 HD2 PHE A 15 8.324 -9.386 -0.080 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.566 -6.557 1.207 1.00 0.00 H new ATOM 0 HE2 PHE A 15 7.102 -8.133 -1.808 1.00 0.00 H new ATOM 0 HZ PHE A 15 5.301 -6.591 -1.130 1.00 0.00 H new ATOM 242 N ASP A 16 8.605 -11.439 4.638 1.00 0.00 N ATOM 243 CA ASP A 16 9.389 -12.207 5.556 1.00 0.00 C ATOM 244 C ASP A 16 8.811 -13.474 6.085 1.00 0.00 C ATOM 245 O ASP A 16 8.201 -13.541 7.152 1.00 0.00 O ATOM 246 CB ASP A 16 9.855 -11.196 6.618 1.00 0.00 C ATOM 247 CG ASP A 16 10.944 -11.795 7.497 1.00 0.00 C ATOM 248 OD1 ASP A 16 12.050 -12.016 6.935 1.00 0.00 O ATOM 249 OD2 ASP A 16 10.769 -11.852 8.743 1.00 0.00 O ATOM 0 H ASP A 16 8.369 -10.505 4.972 1.00 0.00 H new ATOM 0 HA ASP A 16 10.225 -12.660 5.023 1.00 0.00 H new ATOM 0 HB2 ASP A 16 10.230 -10.296 6.130 1.00 0.00 H new ATOM 0 HB3 ASP A 16 9.009 -10.895 7.235 1.00 0.00 H new ATOM 254 N LYS A 17 8.906 -14.589 5.340 1.00 0.00 N ATOM 255 CA LYS A 17 8.350 -15.881 5.598 1.00 0.00 C ATOM 256 C LYS A 17 8.802 -16.575 6.837 1.00 0.00 C ATOM 257 O LYS A 17 8.019 -17.241 7.513 1.00 0.00 O ATOM 258 CB LYS A 17 8.629 -16.843 4.431 1.00 0.00 C ATOM 259 CG LYS A 17 8.130 -16.338 3.076 1.00 0.00 C ATOM 260 CD LYS A 17 6.610 -16.367 2.906 1.00 0.00 C ATOM 261 CE LYS A 17 6.083 -16.063 1.502 1.00 0.00 C ATOM 262 NZ LYS A 17 4.726 -15.514 1.720 1.00 0.00 N ATOM 0 H LYS A 17 9.429 -14.582 4.464 1.00 0.00 H new ATOM 0 HA LYS A 17 7.292 -15.654 5.729 1.00 0.00 H new ATOM 0 HB2 LYS A 17 9.703 -17.020 4.368 1.00 0.00 H new ATOM 0 HB3 LYS A 17 8.159 -17.803 4.645 1.00 0.00 H new ATOM 0 HG2 LYS A 17 8.479 -15.315 2.933 1.00 0.00 H new ATOM 0 HG3 LYS A 17 8.582 -16.942 2.289 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.251 -17.353 3.201 1.00 0.00 H new ATOM 0 HD3 LYS A 17 6.174 -15.648 3.599 1.00 0.00 H new ATOM 0 HE2 LYS A 17 6.722 -15.346 0.986 1.00 0.00 H new ATOM 0 HE3 LYS A 17 6.052 -16.963 0.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.214 -15.486 0.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 4.211 -16.119 2.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 4.799 -14.551 2.107 1.00 0.00 H new ATOM 276 N ASP A 18 10.111 -16.593 7.144 1.00 0.00 N ATOM 277 CA ASP A 18 10.776 -17.262 8.219 1.00 0.00 C ATOM 278 C ASP A 18 10.613 -16.492 9.485 1.00 0.00 C ATOM 279 O ASP A 18 10.077 -17.045 10.443 1.00 0.00 O ATOM 280 CB ASP A 18 12.240 -17.391 7.765 1.00 0.00 C ATOM 281 CG ASP A 18 12.888 -16.248 6.999 1.00 0.00 C ATOM 282 OD1 ASP A 18 12.674 -15.074 7.403 1.00 0.00 O ATOM 283 OD2 ASP A 18 13.604 -16.496 5.992 1.00 0.00 O ATOM 0 H ASP A 18 10.778 -16.077 6.570 1.00 0.00 H new ATOM 0 HA ASP A 18 10.363 -18.247 8.435 1.00 0.00 H new ATOM 0 HB2 ASP A 18 12.843 -17.572 8.654 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.312 -18.284 7.144 1.00 0.00 H new ATOM 288 N GLY A 19 11.023 -15.212 9.554 1.00 0.00 N ATOM 289 CA GLY A 19 10.911 -14.405 10.728 1.00 0.00 C ATOM 290 C GLY A 19 12.130 -13.621 11.074 1.00 0.00 C ATOM 291 O GLY A 19 12.232 -13.192 12.223 1.00 0.00 O ATOM 0 H GLY A 19 11.447 -14.723 8.765 1.00 0.00 H new ATOM 0 HA2 GLY A 19 10.078 -13.714 10.597 1.00 0.00 H new ATOM 0 HA3 GLY A 19 10.661 -15.049 11.571 1.00 0.00 H new ATOM 295 N ASP A 20 13.055 -13.401 10.123 1.00 0.00 N ATOM 296 CA ASP A 20 14.354 -12.906 10.457 1.00 0.00 C ATOM 297 C ASP A 20 14.444 -11.423 10.340 1.00 0.00 C ATOM 298 O ASP A 20 15.401 -10.775 10.762 1.00 0.00 O ATOM 299 CB ASP A 20 15.538 -13.516 9.688 1.00 0.00 C ATOM 300 CG ASP A 20 15.661 -13.434 8.174 1.00 0.00 C ATOM 301 OD1 ASP A 20 14.939 -12.736 7.414 1.00 0.00 O ATOM 302 OD2 ASP A 20 16.575 -14.135 7.662 1.00 0.00 O ATOM 0 H ASP A 20 12.905 -13.565 9.128 1.00 0.00 H new ATOM 0 HA ASP A 20 14.454 -13.228 11.494 1.00 0.00 H new ATOM 0 HB2 ASP A 20 16.441 -13.065 10.099 1.00 0.00 H new ATOM 0 HB3 ASP A 20 15.564 -14.575 9.946 1.00 0.00 H new ATOM 307 N GLY A 21 13.417 -10.775 9.763 1.00 0.00 N ATOM 308 CA GLY A 21 13.385 -9.350 9.643 1.00 0.00 C ATOM 309 C GLY A 21 13.888 -8.780 8.362 1.00 0.00 C ATOM 310 O GLY A 21 13.984 -7.574 8.139 1.00 0.00 O ATOM 0 H GLY A 21 12.599 -11.245 9.375 1.00 0.00 H new ATOM 0 HA2 GLY A 21 12.356 -9.019 9.783 1.00 0.00 H new ATOM 0 HA3 GLY A 21 13.970 -8.926 10.459 1.00 0.00 H new ATOM 314 N THR A 22 14.305 -9.690 7.464 1.00 0.00 N ATOM 315 CA THR A 22 14.986 -9.420 6.236 1.00 0.00 C ATOM 316 C THR A 22 14.299 -10.082 5.092 1.00 0.00 C ATOM 317 O THR A 22 14.266 -11.309 5.007 1.00 0.00 O ATOM 318 CB THR A 22 16.433 -9.809 6.163 1.00 0.00 C ATOM 319 OG1 THR A 22 16.890 -10.807 7.065 1.00 0.00 O ATOM 320 CG2 THR A 22 17.232 -8.593 6.662 1.00 0.00 C ATOM 0 H THR A 22 14.154 -10.688 7.608 1.00 0.00 H new ATOM 0 HA THR A 22 14.953 -8.332 6.185 1.00 0.00 H new ATOM 0 HB THR A 22 16.558 -10.162 5.139 1.00 0.00 H new ATOM 0 HG1 THR A 22 17.845 -10.970 6.916 1.00 0.00 H new ATOM 0 HG21 THR A 22 18.298 -8.820 6.631 1.00 0.00 H new ATOM 0 HG22 THR A 22 17.025 -7.735 6.023 1.00 0.00 H new ATOM 0 HG23 THR A 22 16.940 -8.362 7.686 1.00 0.00 H new ATOM 328 N ILE A 23 13.782 -9.273 4.149 1.00 0.00 N ATOM 329 CA ILE A 23 13.135 -9.741 2.963 1.00 0.00 C ATOM 330 C ILE A 23 14.187 -10.144 1.989 1.00 0.00 C ATOM 331 O ILE A 23 14.917 -9.292 1.486 1.00 0.00 O ATOM 332 CB ILE A 23 12.187 -8.771 2.321 1.00 0.00 C ATOM 333 CG1 ILE A 23 11.081 -8.367 3.309 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.557 -9.432 1.083 1.00 0.00 C ATOM 335 CD1 ILE A 23 10.235 -7.170 2.878 1.00 0.00 C ATOM 0 H ILE A 23 13.816 -8.256 4.215 1.00 0.00 H new ATOM 0 HA ILE A 23 12.507 -10.579 3.264 1.00 0.00 H new ATOM 0 HB ILE A 23 12.735 -7.875 2.028 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.422 -9.222 3.463 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.540 -8.141 4.272 1.00 0.00 H new ATOM 0 HG21 ILE A 23 10.866 -8.734 0.610 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.341 -9.702 0.376 1.00 0.00 H new ATOM 0 HG23 ILE A 23 11.016 -10.329 1.385 1.00 0.00 H new ATOM 0 HD11 ILE A 23 9.483 -6.963 3.640 1.00 0.00 H new ATOM 0 HD12 ILE A 23 10.876 -6.297 2.754 1.00 0.00 H new ATOM 0 HD13 ILE A 23 9.741 -7.395 1.933 1.00 0.00 H new ATOM 347 N THR A 24 14.403 -11.420 1.622 1.00 0.00 N ATOM 348 CA THR A 24 15.294 -11.984 0.655 1.00 0.00 C ATOM 349 C THR A 24 14.620 -11.939 -0.673 1.00 0.00 C ATOM 350 O THR A 24 13.393 -11.921 -0.756 1.00 0.00 O ATOM 351 CB THR A 24 15.700 -13.400 0.941 1.00 0.00 C ATOM 352 OG1 THR A 24 14.608 -14.268 1.205 1.00 0.00 O ATOM 353 CG2 THR A 24 16.664 -13.573 2.127 1.00 0.00 C ATOM 0 H THR A 24 13.870 -12.162 2.075 1.00 0.00 H new ATOM 0 HA THR A 24 16.210 -11.393 0.683 1.00 0.00 H new ATOM 0 HB THR A 24 16.201 -13.667 0.011 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.282 -14.116 2.117 1.00 0.00 H new ATOM 0 HG21 THR A 24 16.898 -14.630 2.254 1.00 0.00 H new ATOM 0 HG22 THR A 24 17.582 -13.018 1.933 1.00 0.00 H new ATOM 0 HG23 THR A 24 16.195 -13.194 3.035 1.00 0.00 H new ATOM 361 N THR A 25 15.419 -12.089 -1.745 1.00 0.00 N ATOM 362 CA THR A 25 15.107 -12.363 -3.113 1.00 0.00 C ATOM 363 C THR A 25 14.262 -13.573 -3.317 1.00 0.00 C ATOM 364 O THR A 25 13.398 -13.531 -4.191 1.00 0.00 O ATOM 365 CB THR A 25 16.323 -12.461 -3.986 1.00 0.00 C ATOM 366 OG1 THR A 25 17.302 -13.400 -3.566 1.00 0.00 O ATOM 367 CG2 THR A 25 16.966 -11.072 -4.136 1.00 0.00 C ATOM 0 H THR A 25 16.429 -12.005 -1.628 1.00 0.00 H new ATOM 0 HA THR A 25 14.522 -11.494 -3.415 1.00 0.00 H new ATOM 0 HB THR A 25 15.959 -12.837 -4.942 1.00 0.00 H new ATOM 0 HG1 THR A 25 18.053 -13.394 -4.196 1.00 0.00 H new ATOM 0 HG21 THR A 25 17.849 -11.146 -4.771 1.00 0.00 H new ATOM 0 HG22 THR A 25 16.250 -10.387 -4.589 1.00 0.00 H new ATOM 0 HG23 THR A 25 17.255 -10.697 -3.154 1.00 0.00 H new ATOM 375 N LYS A 26 14.539 -14.651 -2.562 1.00 0.00 N ATOM 376 CA LYS A 26 13.745 -15.838 -2.480 1.00 0.00 C ATOM 377 C LYS A 26 12.355 -15.624 -1.988 1.00 0.00 C ATOM 378 O LYS A 26 11.406 -16.185 -2.533 1.00 0.00 O ATOM 379 CB LYS A 26 14.378 -16.970 -1.654 1.00 0.00 C ATOM 380 CG LYS A 26 15.898 -16.910 -1.819 1.00 0.00 C ATOM 381 CD LYS A 26 16.542 -18.268 -1.529 1.00 0.00 C ATOM 382 CE LYS A 26 18.047 -18.208 -1.261 1.00 0.00 C ATOM 383 NZ LYS A 26 18.303 -17.182 -0.226 1.00 0.00 N ATOM 0 H LYS A 26 15.370 -14.696 -1.972 1.00 0.00 H new ATOM 0 HA LYS A 26 13.701 -16.144 -3.525 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.108 -16.867 -0.603 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.000 -17.937 -1.987 1.00 0.00 H new ATOM 0 HG2 LYS A 26 16.144 -16.598 -2.834 1.00 0.00 H new ATOM 0 HG3 LYS A 26 16.310 -16.158 -1.146 1.00 0.00 H new ATOM 0 HD2 LYS A 26 16.049 -18.714 -0.665 1.00 0.00 H new ATOM 0 HD3 LYS A 26 16.362 -18.930 -2.376 1.00 0.00 H new ATOM 0 HE2 LYS A 26 18.411 -19.180 -0.928 1.00 0.00 H new ATOM 0 HE3 LYS A 26 18.585 -17.963 -2.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 19.105 -17.479 0.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 18.527 -16.275 -0.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 17.457 -17.070 0.368 1.00 0.00 H new ATOM 397 N GLU A 27 12.195 -14.845 -0.903 1.00 0.00 N ATOM 398 CA GLU A 27 10.936 -14.486 -0.329 1.00 0.00 C ATOM 399 C GLU A 27 10.034 -13.683 -1.201 1.00 0.00 C ATOM 400 O GLU A 27 8.833 -13.908 -1.342 1.00 0.00 O ATOM 401 CB GLU A 27 11.208 -13.799 1.020 1.00 0.00 C ATOM 402 CG GLU A 27 11.684 -14.809 2.067 1.00 0.00 C ATOM 403 CD GLU A 27 12.196 -14.190 3.360 1.00 0.00 C ATOM 404 OE1 GLU A 27 13.270 -13.532 3.407 1.00 0.00 O ATOM 405 OE2 GLU A 27 11.628 -14.521 4.435 1.00 0.00 O ATOM 0 H GLU A 27 12.987 -14.445 -0.400 1.00 0.00 H new ATOM 0 HA GLU A 27 10.369 -15.407 -0.191 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.962 -13.022 0.891 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.301 -13.307 1.371 1.00 0.00 H new ATOM 0 HG2 GLU A 27 10.860 -15.482 2.304 1.00 0.00 H new ATOM 0 HG3 GLU A 27 12.477 -15.417 1.632 1.00 0.00 H new ATOM 412 N LEU A 28 10.688 -12.677 -1.810 1.00 0.00 N ATOM 413 CA LEU A 28 10.169 -11.657 -2.667 1.00 0.00 C ATOM 414 C LEU A 28 9.569 -12.274 -3.883 1.00 0.00 C ATOM 415 O LEU A 28 8.393 -12.042 -4.159 1.00 0.00 O ATOM 416 CB LEU A 28 11.360 -10.749 -3.016 1.00 0.00 C ATOM 417 CG LEU A 28 10.966 -9.582 -3.936 1.00 0.00 C ATOM 418 CD1 LEU A 28 9.949 -8.642 -3.267 1.00 0.00 C ATOM 419 CD2 LEU A 28 12.270 -8.818 -4.223 1.00 0.00 C ATOM 0 H LEU A 28 11.695 -12.570 -1.685 1.00 0.00 H new ATOM 0 HA LEU A 28 9.378 -11.079 -2.189 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.791 -10.352 -2.097 1.00 0.00 H new ATOM 0 HB3 LEU A 28 12.135 -11.343 -3.501 1.00 0.00 H new ATOM 0 HG LEU A 28 10.492 -9.956 -4.843 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.698 -7.831 -3.951 1.00 0.00 H new ATOM 0 HD12 LEU A 28 9.046 -9.200 -3.019 1.00 0.00 H new ATOM 0 HD13 LEU A 28 10.381 -8.227 -2.356 1.00 0.00 H new ATOM 0 HD21 LEU A 28 12.059 -7.971 -4.876 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.694 -8.457 -3.286 1.00 0.00 H new ATOM 0 HD23 LEU A 28 12.982 -9.484 -4.711 1.00 0.00 H new ATOM 431 N GLY A 29 10.385 -13.035 -4.634 1.00 0.00 N ATOM 432 CA GLY A 29 9.889 -13.775 -5.753 1.00 0.00 C ATOM 433 C GLY A 29 8.760 -14.691 -5.428 1.00 0.00 C ATOM 434 O GLY A 29 7.713 -14.591 -6.066 1.00 0.00 O ATOM 0 H GLY A 29 11.386 -13.138 -4.467 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.564 -13.074 -6.522 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.705 -14.359 -6.178 1.00 0.00 H new ATOM 438 N THR A 30 8.853 -15.597 -4.438 1.00 0.00 N ATOM 439 CA THR A 30 7.740 -16.329 -3.917 1.00 0.00 C ATOM 440 C THR A 30 6.449 -15.588 -3.854 1.00 0.00 C ATOM 441 O THR A 30 5.394 -16.059 -4.277 1.00 0.00 O ATOM 442 CB THR A 30 8.024 -16.960 -2.587 1.00 0.00 C ATOM 443 OG1 THR A 30 9.220 -17.725 -2.631 1.00 0.00 O ATOM 444 CG2 THR A 30 6.876 -17.880 -2.137 1.00 0.00 C ATOM 0 H THR A 30 9.736 -15.828 -3.983 1.00 0.00 H new ATOM 0 HA THR A 30 7.606 -17.109 -4.666 1.00 0.00 H new ATOM 0 HB THR A 30 8.131 -16.143 -1.873 1.00 0.00 H new ATOM 0 HG1 THR A 30 9.992 -17.132 -2.514 1.00 0.00 H new ATOM 0 HG21 THR A 30 7.119 -18.318 -1.169 1.00 0.00 H new ATOM 0 HG22 THR A 30 5.957 -17.300 -2.052 1.00 0.00 H new ATOM 0 HG23 THR A 30 6.737 -18.674 -2.871 1.00 0.00 H new ATOM 452 N VAL A 31 6.442 -14.369 -3.287 1.00 0.00 N ATOM 453 CA VAL A 31 5.268 -13.561 -3.165 1.00 0.00 C ATOM 454 C VAL A 31 4.684 -13.016 -4.422 1.00 0.00 C ATOM 455 O VAL A 31 3.535 -13.209 -4.816 1.00 0.00 O ATOM 456 CB VAL A 31 5.495 -12.422 -2.215 1.00 0.00 C ATOM 457 CG1 VAL A 31 4.435 -11.313 -2.116 1.00 0.00 C ATOM 458 CG2 VAL A 31 5.805 -13.020 -0.832 1.00 0.00 C ATOM 0 H VAL A 31 7.279 -13.931 -2.901 1.00 0.00 H new ATOM 0 HA VAL A 31 4.532 -14.272 -2.789 1.00 0.00 H new ATOM 0 HB VAL A 31 6.328 -11.866 -2.645 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.754 -10.569 -1.386 1.00 0.00 H new ATOM 0 HG12 VAL A 31 4.314 -10.837 -3.089 1.00 0.00 H new ATOM 0 HG13 VAL A 31 3.485 -11.745 -1.803 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.975 -12.215 -0.117 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.962 -13.627 -0.501 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.697 -13.643 -0.897 1.00 0.00 H new ATOM 468 N MET A 32 5.545 -12.361 -5.220 1.00 0.00 N ATOM 469 CA MET A 32 5.211 -11.831 -6.506 1.00 0.00 C ATOM 470 C MET A 32 4.734 -12.769 -7.562 1.00 0.00 C ATOM 471 O MET A 32 3.667 -12.566 -8.138 1.00 0.00 O ATOM 472 CB MET A 32 6.418 -11.055 -7.058 1.00 0.00 C ATOM 473 CG MET A 32 6.752 -9.885 -6.129 1.00 0.00 C ATOM 474 SD MET A 32 8.247 -8.946 -6.564 1.00 0.00 S ATOM 475 CE MET A 32 7.665 -8.228 -8.127 1.00 0.00 C ATOM 0 H MET A 32 6.516 -12.193 -4.958 1.00 0.00 H new ATOM 0 HA MET A 32 4.338 -11.213 -6.296 1.00 0.00 H new ATOM 0 HB2 MET A 32 7.279 -11.718 -7.146 1.00 0.00 H new ATOM 0 HB3 MET A 32 6.197 -10.685 -8.059 1.00 0.00 H new ATOM 0 HG2 MET A 32 5.904 -9.200 -6.116 1.00 0.00 H new ATOM 0 HG3 MET A 32 6.867 -10.269 -5.115 1.00 0.00 H new ATOM 0 HE1 MET A 32 8.365 -7.461 -8.458 1.00 0.00 H new ATOM 0 HE2 MET A 32 7.598 -9.010 -8.884 1.00 0.00 H new ATOM 0 HE3 MET A 32 6.682 -7.782 -7.979 1.00 0.00 H new ATOM 485 N ARG A 33 5.423 -13.913 -7.723 1.00 0.00 N ATOM 486 CA ARG A 33 4.985 -15.019 -8.517 1.00 0.00 C ATOM 487 C ARG A 33 3.674 -15.628 -8.156 1.00 0.00 C ATOM 488 O ARG A 33 2.858 -16.154 -8.910 1.00 0.00 O ATOM 489 CB ARG A 33 6.071 -16.097 -8.670 1.00 0.00 C ATOM 490 CG ARG A 33 7.377 -15.706 -9.363 1.00 0.00 C ATOM 491 CD ARG A 33 8.633 -16.508 -9.014 1.00 0.00 C ATOM 492 NE ARG A 33 9.844 -15.954 -9.681 1.00 0.00 N ATOM 493 CZ ARG A 33 11.048 -15.874 -9.042 1.00 0.00 C ATOM 494 NH1 ARG A 33 11.401 -16.511 -7.888 1.00 0.00 N ATOM 495 NH2 ARG A 33 12.037 -15.165 -9.661 1.00 0.00 N ATOM 0 H ARG A 33 6.327 -14.074 -7.279 1.00 0.00 H new ATOM 0 HA ARG A 33 4.801 -14.552 -9.485 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.318 -16.466 -7.675 1.00 0.00 H new ATOM 0 HB3 ARG A 33 5.638 -16.932 -9.221 1.00 0.00 H new ATOM 0 HG2 ARG A 33 7.221 -15.778 -10.439 1.00 0.00 H new ATOM 0 HG3 ARG A 33 7.575 -14.658 -9.139 1.00 0.00 H new ATOM 0 HD2 ARG A 33 8.779 -16.504 -7.934 1.00 0.00 H new ATOM 0 HD3 ARG A 33 8.496 -17.547 -9.313 1.00 0.00 H new ATOM 0 HE ARG A 33 9.772 -15.625 -10.644 1.00 0.00 H new ATOM 0 HH11 ARG A 33 10.732 -17.120 -7.417 1.00 0.00 H new ATOM 0 HH12 ARG A 33 12.334 -16.378 -7.497 1.00 0.00 H new ATOM 0 HH21 ARG A 33 11.859 -14.723 -10.563 1.00 0.00 H new ATOM 0 HH22 ARG A 33 12.953 -15.078 -9.222 1.00 0.00 H new ATOM 509 N SER A 34 3.419 -15.561 -6.837 1.00 0.00 N ATOM 510 CA SER A 34 2.199 -16.032 -6.257 1.00 0.00 C ATOM 511 C SER A 34 1.068 -15.193 -6.745 1.00 0.00 C ATOM 512 O SER A 34 -0.036 -15.649 -7.038 1.00 0.00 O ATOM 513 CB SER A 34 2.235 -16.052 -4.720 1.00 0.00 C ATOM 514 OG SER A 34 1.158 -16.856 -4.262 1.00 0.00 O ATOM 0 H SER A 34 4.074 -15.171 -6.159 1.00 0.00 H new ATOM 0 HA SER A 34 2.061 -17.067 -6.571 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.185 -16.453 -4.367 1.00 0.00 H new ATOM 0 HB3 SER A 34 2.149 -15.040 -4.324 1.00 0.00 H new ATOM 0 HG SER A 34 0.942 -16.617 -3.337 1.00 0.00 H new ATOM 520 N LEU A 35 1.277 -13.877 -6.929 1.00 0.00 N ATOM 521 CA LEU A 35 0.356 -12.965 -7.533 1.00 0.00 C ATOM 522 C LEU A 35 0.254 -13.122 -9.011 1.00 0.00 C ATOM 523 O LEU A 35 -0.833 -13.094 -9.586 1.00 0.00 O ATOM 524 CB LEU A 35 0.723 -11.495 -7.268 1.00 0.00 C ATOM 525 CG LEU A 35 0.689 -11.108 -5.780 1.00 0.00 C ATOM 526 CD1 LEU A 35 1.111 -9.632 -5.691 1.00 0.00 C ATOM 527 CD2 LEU A 35 -0.693 -11.279 -5.128 1.00 0.00 C ATOM 0 H LEU A 35 2.143 -13.423 -6.638 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.598 -13.214 -7.068 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.721 -11.302 -7.662 1.00 0.00 H new ATOM 0 HB3 LEU A 35 0.034 -10.853 -7.817 1.00 0.00 H new ATOM 0 HG LEU A 35 1.361 -11.774 -5.238 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.101 -9.313 -4.649 1.00 0.00 H new ATOM 0 HD12 LEU A 35 2.116 -9.516 -6.097 1.00 0.00 H new ATOM 0 HD13 LEU A 35 0.415 -9.019 -6.264 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -0.639 -10.987 -4.079 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -1.419 -10.650 -5.643 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -1.002 -12.322 -5.199 1.00 0.00 H new ATOM 539 N GLY A 36 1.367 -13.237 -9.757 1.00 0.00 N ATOM 540 CA GLY A 36 1.441 -13.502 -11.161 1.00 0.00 C ATOM 541 C GLY A 36 2.598 -12.876 -11.861 1.00 0.00 C ATOM 542 O GLY A 36 2.567 -12.850 -13.090 1.00 0.00 O ATOM 0 H GLY A 36 2.293 -13.136 -9.341 1.00 0.00 H new ATOM 0 HA2 GLY A 36 1.486 -14.581 -11.310 1.00 0.00 H new ATOM 0 HA3 GLY A 36 0.521 -13.154 -11.630 1.00 0.00 H new ATOM 546 N GLN A 37 3.767 -12.611 -11.252 1.00 0.00 N ATOM 547 CA GLN A 37 4.690 -11.738 -11.909 1.00 0.00 C ATOM 548 C GLN A 37 5.999 -12.407 -11.662 1.00 0.00 C ATOM 549 O GLN A 37 6.410 -12.542 -10.511 1.00 0.00 O ATOM 550 CB GLN A 37 4.714 -10.459 -11.056 1.00 0.00 C ATOM 551 CG GLN A 37 3.400 -9.692 -11.220 1.00 0.00 C ATOM 552 CD GLN A 37 3.058 -9.203 -12.620 1.00 0.00 C ATOM 553 OE1 GLN A 37 1.912 -9.395 -13.022 1.00 0.00 O ATOM 554 NE2 GLN A 37 4.031 -8.535 -13.294 1.00 0.00 N ATOM 0 H GLN A 37 4.065 -12.980 -10.349 1.00 0.00 H new ATOM 0 HA GLN A 37 4.469 -11.536 -12.957 1.00 0.00 H new ATOM 0 HB2 GLN A 37 4.866 -10.715 -10.007 1.00 0.00 H new ATOM 0 HB3 GLN A 37 5.552 -9.829 -11.355 1.00 0.00 H new ATOM 0 HG2 GLN A 37 2.588 -10.333 -10.877 1.00 0.00 H new ATOM 0 HG3 GLN A 37 3.426 -8.828 -10.556 1.00 0.00 H new ATOM 0 HE21 GLN A 37 4.956 -8.425 -12.878 1.00 0.00 H new ATOM 0 HE22 GLN A 37 3.836 -8.143 -14.215 1.00 0.00 H new ATOM 563 N ASN A 38 6.767 -12.694 -12.728 1.00 0.00 N ATOM 564 CA ASN A 38 7.932 -13.521 -12.670 1.00 0.00 C ATOM 565 C ASN A 38 9.261 -12.975 -13.067 1.00 0.00 C ATOM 566 O ASN A 38 9.766 -13.359 -14.120 1.00 0.00 O ATOM 567 CB ASN A 38 7.638 -14.742 -13.558 1.00 0.00 C ATOM 568 CG ASN A 38 8.491 -15.962 -13.240 1.00 0.00 C ATOM 569 OD1 ASN A 38 9.285 -16.076 -12.308 1.00 0.00 O ATOM 570 ND2 ASN A 38 8.138 -17.056 -13.967 1.00 0.00 N ATOM 0 H ASN A 38 6.570 -12.338 -13.663 1.00 0.00 H new ATOM 0 HA ASN A 38 8.070 -13.703 -11.604 1.00 0.00 H new ATOM 0 HB2 ASN A 38 6.587 -15.010 -13.453 1.00 0.00 H new ATOM 0 HB3 ASN A 38 7.793 -14.465 -14.601 1.00 0.00 H new ATOM 0 HD21 ASN A 38 8.532 -17.969 -13.739 1.00 0.00 H new ATOM 0 HD22 ASN A 38 7.480 -16.964 -14.740 1.00 0.00 H new ATOM 577 N PRO A 39 9.809 -12.044 -12.343 1.00 0.00 N ATOM 578 CA PRO A 39 11.119 -11.564 -12.675 1.00 0.00 C ATOM 579 C PRO A 39 12.156 -12.555 -12.275 1.00 0.00 C ATOM 580 O PRO A 39 11.761 -13.565 -11.694 1.00 0.00 O ATOM 581 CB PRO A 39 11.260 -10.232 -11.943 1.00 0.00 C ATOM 582 CG PRO A 39 10.343 -10.440 -10.727 1.00 0.00 C ATOM 583 CD PRO A 39 9.214 -11.369 -11.200 1.00 0.00 C ATOM 0 HA PRO A 39 11.255 -11.424 -13.747 1.00 0.00 H new ATOM 0 HB2 PRO A 39 12.291 -10.035 -11.648 1.00 0.00 H new ATOM 0 HB3 PRO A 39 10.938 -9.392 -12.558 1.00 0.00 H new ATOM 0 HG2 PRO A 39 10.892 -10.884 -9.897 1.00 0.00 H new ATOM 0 HG3 PRO A 39 9.943 -9.490 -10.373 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.918 -12.074 -10.423 1.00 0.00 H new ATOM 0 HD3 PRO A 39 8.321 -10.810 -11.480 1.00 0.00 H new ATOM 591 N THR A 40 13.429 -12.371 -12.670 1.00 0.00 N ATOM 592 CA THR A 40 14.521 -13.225 -12.318 1.00 0.00 C ATOM 593 C THR A 40 15.245 -12.675 -11.138 1.00 0.00 C ATOM 594 O THR A 40 14.944 -11.577 -10.672 1.00 0.00 O ATOM 595 CB THR A 40 15.515 -13.331 -13.437 1.00 0.00 C ATOM 596 OG1 THR A 40 16.113 -12.102 -13.821 1.00 0.00 O ATOM 597 CG2 THR A 40 14.889 -13.920 -14.712 1.00 0.00 C ATOM 0 H THR A 40 13.710 -11.590 -13.263 1.00 0.00 H new ATOM 0 HA THR A 40 14.099 -14.206 -12.099 1.00 0.00 H new ATOM 0 HB THR A 40 16.281 -13.984 -13.019 1.00 0.00 H new ATOM 0 HG1 THR A 40 15.437 -11.523 -14.232 1.00 0.00 H new ATOM 0 HG21 THR A 40 15.645 -13.978 -15.495 1.00 0.00 H new ATOM 0 HG22 THR A 40 14.507 -14.919 -14.502 1.00 0.00 H new ATOM 0 HG23 THR A 40 14.071 -13.281 -15.044 1.00 0.00 H new ATOM 605 N GLU A 41 16.174 -13.459 -10.562 1.00 0.00 N ATOM 606 CA GLU A 41 16.755 -13.264 -9.270 1.00 0.00 C ATOM 607 C GLU A 41 17.675 -12.092 -9.272 1.00 0.00 C ATOM 608 O GLU A 41 17.692 -11.376 -8.272 1.00 0.00 O ATOM 609 CB GLU A 41 17.430 -14.557 -8.783 1.00 0.00 C ATOM 610 CG GLU A 41 16.698 -15.895 -8.903 1.00 0.00 C ATOM 611 CD GLU A 41 15.384 -15.792 -8.141 1.00 0.00 C ATOM 612 OE1 GLU A 41 15.324 -15.204 -7.028 1.00 0.00 O ATOM 613 OE2 GLU A 41 14.368 -16.343 -8.643 1.00 0.00 O ATOM 0 H GLU A 41 16.544 -14.285 -11.032 1.00 0.00 H new ATOM 0 HA GLU A 41 15.965 -13.032 -8.555 1.00 0.00 H new ATOM 0 HB2 GLU A 41 18.372 -14.654 -9.322 1.00 0.00 H new ATOM 0 HB3 GLU A 41 17.678 -14.417 -7.731 1.00 0.00 H new ATOM 0 HG2 GLU A 41 16.512 -16.133 -9.950 1.00 0.00 H new ATOM 0 HG3 GLU A 41 17.310 -16.700 -8.497 1.00 0.00 H new ATOM 620 N ALA A 42 18.403 -11.821 -10.370 1.00 0.00 N ATOM 621 CA ALA A 42 19.141 -10.616 -10.591 1.00 0.00 C ATOM 622 C ALA A 42 18.325 -9.371 -10.659 1.00 0.00 C ATOM 623 O ALA A 42 18.698 -8.256 -10.298 1.00 0.00 O ATOM 624 CB ALA A 42 19.847 -10.891 -11.929 1.00 0.00 C ATOM 0 H ALA A 42 18.481 -12.479 -11.146 1.00 0.00 H new ATOM 0 HA ALA A 42 19.807 -10.411 -9.753 1.00 0.00 H new ATOM 0 HB1 ALA A 42 20.451 -10.027 -12.206 1.00 0.00 H new ATOM 0 HB2 ALA A 42 20.490 -11.766 -11.828 1.00 0.00 H new ATOM 0 HB3 ALA A 42 19.102 -11.076 -12.702 1.00 0.00 H new ATOM 630 N GLU A 43 17.175 -9.518 -11.340 1.00 0.00 N ATOM 631 CA GLU A 43 16.255 -8.437 -11.511 1.00 0.00 C ATOM 632 C GLU A 43 15.650 -8.107 -10.190 1.00 0.00 C ATOM 633 O GLU A 43 15.516 -6.956 -9.776 1.00 0.00 O ATOM 634 CB GLU A 43 15.074 -8.811 -12.422 1.00 0.00 C ATOM 635 CG GLU A 43 15.514 -8.868 -13.887 1.00 0.00 C ATOM 636 CD GLU A 43 14.366 -9.409 -14.727 1.00 0.00 C ATOM 637 OE1 GLU A 43 14.014 -10.618 -14.751 1.00 0.00 O ATOM 638 OE2 GLU A 43 13.790 -8.544 -15.440 1.00 0.00 O ATOM 0 H GLU A 43 16.881 -10.392 -11.775 1.00 0.00 H new ATOM 0 HA GLU A 43 16.817 -7.613 -11.950 1.00 0.00 H new ATOM 0 HB2 GLU A 43 14.669 -9.777 -12.121 1.00 0.00 H new ATOM 0 HB3 GLU A 43 14.274 -8.080 -12.306 1.00 0.00 H new ATOM 0 HG2 GLU A 43 15.799 -7.875 -14.234 1.00 0.00 H new ATOM 0 HG3 GLU A 43 16.391 -9.506 -13.992 1.00 0.00 H new ATOM 645 N LEU A 44 15.360 -9.100 -9.331 1.00 0.00 N ATOM 646 CA LEU A 44 14.919 -8.865 -7.991 1.00 0.00 C ATOM 647 C LEU A 44 15.870 -8.239 -7.030 1.00 0.00 C ATOM 648 O LEU A 44 15.481 -7.410 -6.209 1.00 0.00 O ATOM 649 CB LEU A 44 14.500 -10.188 -7.328 1.00 0.00 C ATOM 650 CG LEU A 44 13.217 -10.779 -7.937 1.00 0.00 C ATOM 651 CD1 LEU A 44 12.817 -12.147 -7.358 1.00 0.00 C ATOM 652 CD2 LEU A 44 11.972 -9.920 -7.663 1.00 0.00 C ATOM 0 H LEU A 44 15.433 -10.088 -9.573 1.00 0.00 H new ATOM 0 HA LEU A 44 14.117 -8.146 -8.157 1.00 0.00 H new ATOM 0 HB2 LEU A 44 15.310 -10.911 -7.426 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.348 -10.023 -6.261 1.00 0.00 H new ATOM 0 HG LEU A 44 13.479 -10.839 -8.993 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.903 -12.493 -7.841 1.00 0.00 H new ATOM 0 HD12 LEU A 44 13.617 -12.866 -7.537 1.00 0.00 H new ATOM 0 HD13 LEU A 44 12.648 -12.053 -6.285 1.00 0.00 H new ATOM 0 HD21 LEU A 44 11.099 -10.389 -8.118 1.00 0.00 H new ATOM 0 HD22 LEU A 44 11.819 -9.834 -6.587 1.00 0.00 H new ATOM 0 HD23 LEU A 44 12.114 -8.927 -8.090 1.00 0.00 H new ATOM 664 N GLN A 45 17.164 -8.581 -7.167 1.00 0.00 N ATOM 665 CA GLN A 45 18.271 -8.049 -6.435 1.00 0.00 C ATOM 666 C GLN A 45 18.619 -6.658 -6.840 1.00 0.00 C ATOM 667 O GLN A 45 19.184 -5.957 -6.002 1.00 0.00 O ATOM 668 CB GLN A 45 19.464 -8.976 -6.721 1.00 0.00 C ATOM 669 CG GLN A 45 20.675 -8.861 -5.792 1.00 0.00 C ATOM 670 CD GLN A 45 20.334 -9.096 -4.327 1.00 0.00 C ATOM 671 OE1 GLN A 45 20.400 -10.222 -3.836 1.00 0.00 O ATOM 672 NE2 GLN A 45 19.933 -7.997 -3.634 1.00 0.00 N ATOM 0 H GLN A 45 17.457 -9.286 -7.844 1.00 0.00 H new ATOM 0 HA GLN A 45 18.014 -8.004 -5.377 1.00 0.00 H new ATOM 0 HB2 GLN A 45 19.108 -10.006 -6.687 1.00 0.00 H new ATOM 0 HB3 GLN A 45 19.801 -8.789 -7.741 1.00 0.00 H new ATOM 0 HG2 GLN A 45 21.432 -9.582 -6.102 1.00 0.00 H new ATOM 0 HG3 GLN A 45 21.115 -7.870 -5.901 1.00 0.00 H new ATOM 0 HE21 GLN A 45 19.898 -7.088 -4.095 1.00 0.00 H new ATOM 0 HE22 GLN A 45 19.667 -8.082 -2.653 1.00 0.00 H new ATOM 681 N ASP A 46 18.193 -6.179 -8.022 1.00 0.00 N ATOM 682 CA ASP A 46 18.365 -4.789 -8.310 1.00 0.00 C ATOM 683 C ASP A 46 17.329 -3.996 -7.590 1.00 0.00 C ATOM 684 O ASP A 46 17.662 -2.960 -7.016 1.00 0.00 O ATOM 685 CB ASP A 46 18.284 -4.553 -9.827 1.00 0.00 C ATOM 686 CG ASP A 46 18.518 -3.130 -10.314 1.00 0.00 C ATOM 687 OD1 ASP A 46 17.615 -2.260 -10.442 1.00 0.00 O ATOM 688 OD2 ASP A 46 19.695 -2.849 -10.664 1.00 0.00 O ATOM 0 H ASP A 46 17.745 -6.730 -8.755 1.00 0.00 H new ATOM 0 HA ASP A 46 19.348 -4.465 -7.968 1.00 0.00 H new ATOM 0 HB2 ASP A 46 19.014 -5.202 -10.311 1.00 0.00 H new ATOM 0 HB3 ASP A 46 17.299 -4.871 -10.168 1.00 0.00 H new ATOM 693 N MET A 47 16.078 -4.490 -7.576 1.00 0.00 N ATOM 694 CA MET A 47 14.919 -4.015 -6.886 1.00 0.00 C ATOM 695 C MET A 47 15.172 -3.906 -5.422 1.00 0.00 C ATOM 696 O MET A 47 14.733 -2.940 -4.800 1.00 0.00 O ATOM 697 CB MET A 47 13.706 -4.867 -7.296 1.00 0.00 C ATOM 698 CG MET A 47 13.039 -4.510 -8.627 1.00 0.00 C ATOM 699 SD MET A 47 12.000 -5.875 -9.228 1.00 0.00 S ATOM 700 CE MET A 47 10.572 -5.558 -8.152 1.00 0.00 C ATOM 0 H MET A 47 15.856 -5.326 -8.117 1.00 0.00 H new ATOM 0 HA MET A 47 14.678 -2.993 -7.180 1.00 0.00 H new ATOM 0 HB2 MET A 47 14.021 -5.910 -7.341 1.00 0.00 H new ATOM 0 HB3 MET A 47 12.956 -4.794 -6.508 1.00 0.00 H new ATOM 0 HG2 MET A 47 12.431 -3.614 -8.503 1.00 0.00 H new ATOM 0 HG3 MET A 47 13.803 -4.277 -9.369 1.00 0.00 H new ATOM 0 HE1 MET A 47 10.332 -6.461 -7.590 1.00 0.00 H new ATOM 0 HE2 MET A 47 10.811 -4.752 -7.458 1.00 0.00 H new ATOM 0 HE3 MET A 47 9.715 -5.271 -8.761 1.00 0.00 H new ATOM 710 N ILE A 48 15.996 -4.802 -4.849 1.00 0.00 N ATOM 711 CA ILE A 48 16.535 -4.685 -3.529 1.00 0.00 C ATOM 712 C ILE A 48 17.614 -3.660 -3.472 1.00 0.00 C ATOM 713 O ILE A 48 17.498 -2.644 -2.787 1.00 0.00 O ATOM 714 CB ILE A 48 16.930 -5.933 -2.796 1.00 0.00 C ATOM 715 CG1 ILE A 48 15.790 -6.947 -2.600 1.00 0.00 C ATOM 716 CG2 ILE A 48 17.574 -5.575 -1.447 1.00 0.00 C ATOM 717 CD1 ILE A 48 16.276 -8.244 -1.954 1.00 0.00 C ATOM 0 H ILE A 48 16.301 -5.649 -5.329 1.00 0.00 H new ATOM 0 HA ILE A 48 15.661 -4.363 -2.963 1.00 0.00 H new ATOM 0 HB ILE A 48 17.655 -6.435 -3.436 1.00 0.00 H new ATOM 0 HG12 ILE A 48 15.013 -6.502 -1.978 1.00 0.00 H new ATOM 0 HG13 ILE A 48 15.336 -7.172 -3.565 1.00 0.00 H new ATOM 0 HG21 ILE A 48 17.856 -6.489 -0.925 1.00 0.00 H new ATOM 0 HG22 ILE A 48 18.462 -4.966 -1.618 1.00 0.00 H new ATOM 0 HG23 ILE A 48 16.861 -5.016 -0.841 1.00 0.00 H new ATOM 0 HD11 ILE A 48 15.436 -8.929 -1.836 1.00 0.00 H new ATOM 0 HD12 ILE A 48 17.033 -8.705 -2.588 1.00 0.00 H new ATOM 0 HD13 ILE A 48 16.706 -8.025 -0.977 1.00 0.00 H new ATOM 729 N ASN A 49 18.721 -3.750 -4.231 1.00 0.00 N ATOM 730 CA ASN A 49 19.864 -2.891 -4.218 1.00 0.00 C ATOM 731 C ASN A 49 19.611 -1.425 -4.307 1.00 0.00 C ATOM 732 O ASN A 49 20.501 -0.685 -3.891 1.00 0.00 O ATOM 733 CB ASN A 49 20.963 -3.360 -5.187 1.00 0.00 C ATOM 734 CG ASN A 49 21.624 -4.604 -4.611 1.00 0.00 C ATOM 735 OD1 ASN A 49 21.405 -5.012 -3.471 1.00 0.00 O ATOM 736 ND2 ASN A 49 22.537 -5.210 -5.417 1.00 0.00 N ATOM 0 H ASN A 49 18.823 -4.496 -4.919 1.00 0.00 H new ATOM 0 HA ASN A 49 20.235 -3.005 -3.200 1.00 0.00 H new ATOM 0 HB2 ASN A 49 20.536 -3.578 -6.166 1.00 0.00 H new ATOM 0 HB3 ASN A 49 21.702 -2.572 -5.330 1.00 0.00 H new ATOM 0 HD21 ASN A 49 23.057 -6.020 -5.080 1.00 0.00 H new ATOM 0 HD22 ASN A 49 22.702 -4.854 -6.359 1.00 0.00 H new ATOM 743 N GLU A 50 18.505 -0.965 -4.918 1.00 0.00 N ATOM 744 CA GLU A 50 17.971 0.360 -4.984 1.00 0.00 C ATOM 745 C GLU A 50 17.562 0.843 -3.635 1.00 0.00 C ATOM 746 O GLU A 50 18.028 1.918 -3.261 1.00 0.00 O ATOM 747 CB GLU A 50 16.684 0.296 -5.823 1.00 0.00 C ATOM 748 CG GLU A 50 16.050 1.607 -6.291 1.00 0.00 C ATOM 749 CD GLU A 50 17.004 2.467 -7.108 1.00 0.00 C ATOM 750 OE1 GLU A 50 17.545 2.010 -8.150 1.00 0.00 O ATOM 751 OE2 GLU A 50 17.156 3.662 -6.742 1.00 0.00 O ATOM 0 H GLU A 50 17.909 -1.613 -5.433 1.00 0.00 H new ATOM 0 HA GLU A 50 18.730 1.022 -5.401 1.00 0.00 H new ATOM 0 HB2 GLU A 50 16.895 -0.304 -6.708 1.00 0.00 H new ATOM 0 HB3 GLU A 50 15.937 -0.245 -5.242 1.00 0.00 H new ATOM 0 HG2 GLU A 50 15.166 1.384 -6.889 1.00 0.00 H new ATOM 0 HG3 GLU A 50 15.713 2.172 -5.422 1.00 0.00 H new ATOM 758 N VAL A 51 16.844 0.013 -2.856 1.00 0.00 N ATOM 759 CA VAL A 51 16.514 0.328 -1.501 1.00 0.00 C ATOM 760 C VAL A 51 17.604 -0.012 -0.545 1.00 0.00 C ATOM 761 O VAL A 51 17.490 0.669 0.473 1.00 0.00 O ATOM 762 CB VAL A 51 15.151 -0.105 -1.048 1.00 0.00 C ATOM 763 CG1 VAL A 51 14.115 0.604 -1.938 1.00 0.00 C ATOM 764 CG2 VAL A 51 14.907 -1.620 -1.141 1.00 0.00 C ATOM 0 H VAL A 51 16.488 -0.889 -3.172 1.00 0.00 H new ATOM 0 HA VAL A 51 16.434 1.415 -1.495 1.00 0.00 H new ATOM 0 HB VAL A 51 15.065 0.159 0.006 1.00 0.00 H new ATOM 0 HG11 VAL A 51 13.111 0.309 -1.633 1.00 0.00 H new ATOM 0 HG12 VAL A 51 14.224 1.684 -1.834 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.276 0.322 -2.979 1.00 0.00 H new ATOM 0 HG21 VAL A 51 13.899 -1.848 -0.795 1.00 0.00 H new ATOM 0 HG22 VAL A 51 15.017 -1.943 -2.176 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.632 -2.144 -0.518 1.00 0.00 H new ATOM 774 N ASP A 52 18.500 -1.006 -0.683 1.00 0.00 N ATOM 775 CA ASP A 52 19.556 -1.484 0.154 1.00 0.00 C ATOM 776 C ASP A 52 20.431 -0.390 0.661 1.00 0.00 C ATOM 777 O ASP A 52 21.105 0.296 -0.106 1.00 0.00 O ATOM 778 CB ASP A 52 20.254 -2.649 -0.568 1.00 0.00 C ATOM 779 CG ASP A 52 20.983 -3.509 0.455 1.00 0.00 C ATOM 780 OD1 ASP A 52 20.351 -3.801 1.505 1.00 0.00 O ATOM 781 OD2 ASP A 52 22.185 -3.807 0.224 1.00 0.00 O ATOM 0 H ASP A 52 18.470 -1.567 -1.535 1.00 0.00 H new ATOM 0 HA ASP A 52 19.162 -1.890 1.086 1.00 0.00 H new ATOM 0 HB2 ASP A 52 19.521 -3.248 -1.108 1.00 0.00 H new ATOM 0 HB3 ASP A 52 20.958 -2.265 -1.306 1.00 0.00 H new ATOM 786 N ALA A 53 20.394 -0.077 1.969 1.00 0.00 N ATOM 787 CA ALA A 53 21.181 0.932 2.607 1.00 0.00 C ATOM 788 C ALA A 53 22.459 0.373 3.129 1.00 0.00 C ATOM 789 O ALA A 53 23.559 0.820 2.806 1.00 0.00 O ATOM 790 CB ALA A 53 20.377 1.507 3.785 1.00 0.00 C ATOM 0 H ALA A 53 19.775 -0.559 2.621 1.00 0.00 H new ATOM 0 HA ALA A 53 21.416 1.704 1.875 1.00 0.00 H new ATOM 0 HB1 ALA A 53 20.963 2.279 4.283 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.448 1.940 3.414 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.149 0.710 4.493 1.00 0.00 H new ATOM 796 N ASP A 54 22.411 -0.687 3.956 1.00 0.00 N ATOM 797 CA ASP A 54 23.548 -1.327 4.539 1.00 0.00 C ATOM 798 C ASP A 54 24.644 -1.895 3.703 1.00 0.00 C ATOM 799 O ASP A 54 25.760 -1.378 3.699 1.00 0.00 O ATOM 800 CB ASP A 54 23.272 -2.248 5.740 1.00 0.00 C ATOM 801 CG ASP A 54 22.132 -3.184 5.364 1.00 0.00 C ATOM 802 OD1 ASP A 54 22.197 -3.957 4.371 1.00 0.00 O ATOM 803 OD2 ASP A 54 21.053 -3.178 6.015 1.00 0.00 O ATOM 0 H ASP A 54 21.530 -1.120 4.232 1.00 0.00 H new ATOM 0 HA ASP A 54 23.975 -0.381 4.873 1.00 0.00 H new ATOM 0 HB2 ASP A 54 24.165 -2.819 5.995 1.00 0.00 H new ATOM 0 HB3 ASP A 54 23.008 -1.659 6.619 1.00 0.00 H new ATOM 808 N GLY A 55 24.200 -2.816 2.830 1.00 0.00 N ATOM 809 CA GLY A 55 25.034 -3.412 1.832 1.00 0.00 C ATOM 810 C GLY A 55 24.996 -4.896 1.703 1.00 0.00 C ATOM 811 O GLY A 55 25.756 -5.546 0.987 1.00 0.00 O ATOM 0 H GLY A 55 23.238 -3.155 2.817 1.00 0.00 H new ATOM 0 HA2 GLY A 55 24.764 -2.983 0.867 1.00 0.00 H new ATOM 0 HA3 GLY A 55 26.064 -3.118 2.034 1.00 0.00 H new ATOM 815 N ASN A 56 23.988 -5.455 2.396 1.00 0.00 N ATOM 816 CA ASN A 56 23.792 -6.850 2.642 1.00 0.00 C ATOM 817 C ASN A 56 23.090 -7.605 1.566 1.00 0.00 C ATOM 818 O ASN A 56 23.460 -8.743 1.282 1.00 0.00 O ATOM 819 CB ASN A 56 23.335 -7.251 4.055 1.00 0.00 C ATOM 820 CG ASN A 56 21.871 -6.974 4.365 1.00 0.00 C ATOM 821 OD1 ASN A 56 21.116 -6.509 3.511 1.00 0.00 O ATOM 822 ND2 ASN A 56 21.423 -7.154 5.636 1.00 0.00 N ATOM 0 H ASN A 56 23.253 -4.886 2.817 1.00 0.00 H new ATOM 0 HA ASN A 56 24.826 -7.191 2.602 1.00 0.00 H new ATOM 0 HB2 ASN A 56 23.524 -8.316 4.192 1.00 0.00 H new ATOM 0 HB3 ASN A 56 23.950 -6.722 4.783 1.00 0.00 H new ATOM 0 HD21 ASN A 56 20.464 -6.904 5.879 1.00 0.00 H new ATOM 0 HD22 ASN A 56 22.045 -7.539 6.346 1.00 0.00 H new ATOM 829 N GLY A 57 22.161 -6.963 0.835 1.00 0.00 N ATOM 830 CA GLY A 57 21.459 -7.472 -0.302 1.00 0.00 C ATOM 831 C GLY A 57 20.099 -7.951 0.076 1.00 0.00 C ATOM 832 O GLY A 57 19.477 -8.583 -0.777 1.00 0.00 O ATOM 0 H GLY A 57 21.879 -6.009 1.060 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.376 -6.693 -1.060 1.00 0.00 H new ATOM 0 HA3 GLY A 57 22.025 -8.290 -0.746 1.00 0.00 H new ATOM 836 N THR A 58 19.684 -7.707 1.331 1.00 0.00 N ATOM 837 CA THR A 58 18.321 -7.883 1.726 1.00 0.00 C ATOM 838 C THR A 58 17.736 -6.538 1.991 1.00 0.00 C ATOM 839 O THR A 58 18.364 -5.575 2.429 1.00 0.00 O ATOM 840 CB THR A 58 18.242 -8.747 2.950 1.00 0.00 C ATOM 841 OG1 THR A 58 18.849 -8.232 4.125 1.00 0.00 O ATOM 842 CG2 THR A 58 18.955 -10.071 2.625 1.00 0.00 C ATOM 0 H THR A 58 20.298 -7.385 2.079 1.00 0.00 H new ATOM 0 HA THR A 58 17.760 -8.379 0.934 1.00 0.00 H new ATOM 0 HB THR A 58 17.179 -8.835 3.174 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.499 -7.540 3.881 1.00 0.00 H new ATOM 0 HG21 THR A 58 18.918 -10.727 3.495 1.00 0.00 H new ATOM 0 HG22 THR A 58 18.458 -10.555 1.784 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.995 -9.870 2.366 1.00 0.00 H new ATOM 850 N ILE A 59 16.393 -6.588 2.013 1.00 0.00 N ATOM 851 CA ILE A 59 15.661 -5.447 2.470 1.00 0.00 C ATOM 852 C ILE A 59 15.337 -5.805 3.880 1.00 0.00 C ATOM 853 O ILE A 59 14.673 -6.778 4.236 1.00 0.00 O ATOM 854 CB ILE A 59 14.364 -5.192 1.762 1.00 0.00 C ATOM 855 CG1 ILE A 59 14.228 -5.678 0.309 1.00 0.00 C ATOM 856 CG2 ILE A 59 14.022 -3.707 1.967 1.00 0.00 C ATOM 857 CD1 ILE A 59 12.845 -5.682 -0.339 1.00 0.00 C ATOM 0 H ILE A 59 15.829 -7.388 1.726 1.00 0.00 H new ATOM 0 HA ILE A 59 16.253 -4.546 2.310 1.00 0.00 H new ATOM 0 HB ILE A 59 13.616 -5.840 2.220 1.00 0.00 H new ATOM 0 HG12 ILE A 59 14.880 -5.060 -0.308 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.617 -6.695 0.263 1.00 0.00 H new ATOM 0 HG21 ILE A 59 13.082 -3.478 1.466 1.00 0.00 H new ATOM 0 HG22 ILE A 59 13.925 -3.500 3.033 1.00 0.00 H new ATOM 0 HG23 ILE A 59 14.816 -3.089 1.548 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.923 -6.052 -1.361 1.00 0.00 H new ATOM 0 HD12 ILE A 59 12.178 -6.329 0.231 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.445 -4.668 -0.350 1.00 0.00 H new ATOM 869 N ASP A 60 15.867 -4.959 4.780 1.00 0.00 N ATOM 870 CA ASP A 60 15.661 -4.980 6.195 1.00 0.00 C ATOM 871 C ASP A 60 14.490 -4.124 6.534 1.00 0.00 C ATOM 872 O ASP A 60 13.818 -3.513 5.705 1.00 0.00 O ATOM 873 CB ASP A 60 16.879 -4.439 6.963 1.00 0.00 C ATOM 874 CG ASP A 60 18.143 -5.258 6.741 1.00 0.00 C ATOM 875 OD1 ASP A 60 18.663 -5.329 5.596 1.00 0.00 O ATOM 876 OD2 ASP A 60 18.668 -5.806 7.747 1.00 0.00 O ATOM 0 H ASP A 60 16.488 -4.202 4.495 1.00 0.00 H new ATOM 0 HA ASP A 60 15.496 -6.018 6.485 1.00 0.00 H new ATOM 0 HB2 ASP A 60 17.064 -3.409 6.658 1.00 0.00 H new ATOM 0 HB3 ASP A 60 16.649 -4.420 8.028 1.00 0.00 H new ATOM 881 N PHE A 61 14.148 -4.104 7.835 1.00 0.00 N ATOM 882 CA PHE A 61 13.014 -3.382 8.323 1.00 0.00 C ATOM 883 C PHE A 61 12.967 -1.901 8.167 1.00 0.00 C ATOM 884 O PHE A 61 11.960 -1.469 7.607 1.00 0.00 O ATOM 885 CB PHE A 61 12.813 -3.850 9.774 1.00 0.00 C ATOM 886 CG PHE A 61 11.392 -3.885 10.222 1.00 0.00 C ATOM 887 CD1 PHE A 61 10.897 -2.689 10.687 1.00 0.00 C ATOM 888 CD2 PHE A 61 10.537 -4.955 10.097 1.00 0.00 C ATOM 889 CE1 PHE A 61 9.606 -2.601 11.151 1.00 0.00 C ATOM 890 CE2 PHE A 61 9.255 -4.912 10.591 1.00 0.00 C ATOM 891 CZ PHE A 61 8.804 -3.717 11.101 1.00 0.00 C ATOM 0 H PHE A 61 14.668 -4.598 8.561 1.00 0.00 H new ATOM 0 HA PHE A 61 12.180 -3.626 7.665 1.00 0.00 H new ATOM 0 HB2 PHE A 61 13.240 -4.847 9.883 1.00 0.00 H new ATOM 0 HB3 PHE A 61 13.373 -3.190 10.436 1.00 0.00 H new ATOM 0 HD1 PHE A 61 11.527 -1.812 10.688 1.00 0.00 H new ATOM 0 HD2 PHE A 61 10.881 -5.850 9.599 1.00 0.00 H new ATOM 0 HE1 PHE A 61 9.228 -1.671 11.548 1.00 0.00 H new ATOM 0 HE2 PHE A 61 8.623 -5.788 10.579 1.00 0.00 H new ATOM 0 HZ PHE A 61 7.792 -3.653 11.473 1.00 0.00 H new ATOM 901 N PRO A 62 13.881 -1.026 8.462 1.00 0.00 N ATOM 902 CA PRO A 62 13.870 0.372 8.142 1.00 0.00 C ATOM 903 C PRO A 62 14.103 0.774 6.726 1.00 0.00 C ATOM 904 O PRO A 62 13.894 1.939 6.392 1.00 0.00 O ATOM 905 CB PRO A 62 14.950 0.885 9.092 1.00 0.00 C ATOM 906 CG PRO A 62 16.056 -0.177 8.978 1.00 0.00 C ATOM 907 CD PRO A 62 15.181 -1.441 8.967 1.00 0.00 C ATOM 0 HA PRO A 62 12.872 0.795 8.262 1.00 0.00 H new ATOM 0 HB2 PRO A 62 15.308 1.872 8.798 1.00 0.00 H new ATOM 0 HB3 PRO A 62 14.579 0.971 10.113 1.00 0.00 H new ATOM 0 HG2 PRO A 62 16.650 -0.069 8.071 1.00 0.00 H new ATOM 0 HG3 PRO A 62 16.750 -0.153 9.818 1.00 0.00 H new ATOM 0 HD2 PRO A 62 15.618 -2.212 8.332 1.00 0.00 H new ATOM 0 HD3 PRO A 62 15.094 -1.864 9.968 1.00 0.00 H new ATOM 915 N GLU A 63 14.612 -0.190 5.938 1.00 0.00 N ATOM 916 CA GLU A 63 14.955 0.105 4.581 1.00 0.00 C ATOM 917 C GLU A 63 13.714 0.172 3.760 1.00 0.00 C ATOM 918 O GLU A 63 13.486 1.022 2.900 1.00 0.00 O ATOM 919 CB GLU A 63 15.934 -0.969 4.078 1.00 0.00 C ATOM 920 CG GLU A 63 17.340 -0.707 4.622 1.00 0.00 C ATOM 921 CD GLU A 63 18.288 -1.770 4.084 1.00 0.00 C ATOM 922 OE1 GLU A 63 17.810 -2.848 3.641 1.00 0.00 O ATOM 923 OE2 GLU A 63 19.542 -1.658 4.143 1.00 0.00 O ATOM 0 H GLU A 63 14.783 -1.152 6.231 1.00 0.00 H new ATOM 0 HA GLU A 63 15.447 1.074 4.502 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.594 -1.956 4.392 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.953 -0.971 2.988 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.680 0.285 4.324 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.331 -0.727 5.712 1.00 0.00 H new ATOM 930 N PHE A 64 12.783 -0.769 3.996 1.00 0.00 N ATOM 931 CA PHE A 64 11.474 -0.945 3.446 1.00 0.00 C ATOM 932 C PHE A 64 10.490 0.104 3.835 1.00 0.00 C ATOM 933 O PHE A 64 9.793 0.660 2.988 1.00 0.00 O ATOM 934 CB PHE A 64 11.060 -2.355 3.899 1.00 0.00 C ATOM 935 CG PHE A 64 9.961 -2.890 3.045 1.00 0.00 C ATOM 936 CD1 PHE A 64 10.145 -2.944 1.684 1.00 0.00 C ATOM 937 CD2 PHE A 64 8.815 -3.413 3.596 1.00 0.00 C ATOM 938 CE1 PHE A 64 9.102 -3.386 0.904 1.00 0.00 C ATOM 939 CE2 PHE A 64 7.827 -3.900 2.774 1.00 0.00 C ATOM 940 CZ PHE A 64 7.932 -3.909 1.403 1.00 0.00 C ATOM 0 H PHE A 64 12.982 -1.509 4.669 1.00 0.00 H new ATOM 0 HA PHE A 64 11.491 -0.841 2.361 1.00 0.00 H new ATOM 0 HB2 PHE A 64 11.920 -3.023 3.852 1.00 0.00 H new ATOM 0 HB3 PHE A 64 10.736 -2.326 4.939 1.00 0.00 H new ATOM 0 HD1 PHE A 64 11.083 -2.647 1.239 1.00 0.00 H new ATOM 0 HD2 PHE A 64 8.692 -3.441 4.669 1.00 0.00 H new ATOM 0 HE1 PHE A 64 9.209 -3.318 -0.169 1.00 0.00 H new ATOM 0 HE2 PHE A 64 6.928 -4.293 3.225 1.00 0.00 H new ATOM 0 HZ PHE A 64 7.153 -4.298 0.765 1.00 0.00 H new ATOM 950 N LEU A 65 10.514 0.359 5.155 1.00 0.00 N ATOM 951 CA LEU A 65 9.857 1.418 5.856 1.00 0.00 C ATOM 952 C LEU A 65 9.978 2.765 5.230 1.00 0.00 C ATOM 953 O LEU A 65 8.956 3.368 4.908 1.00 0.00 O ATOM 954 CB LEU A 65 10.420 1.576 7.278 1.00 0.00 C ATOM 955 CG LEU A 65 9.662 2.486 8.260 1.00 0.00 C ATOM 956 CD1 LEU A 65 8.147 2.235 8.333 1.00 0.00 C ATOM 957 CD2 LEU A 65 10.300 2.248 9.639 1.00 0.00 C ATOM 0 H LEU A 65 11.046 -0.235 5.791 1.00 0.00 H new ATOM 0 HA LEU A 65 8.811 1.111 5.839 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.483 0.583 7.724 1.00 0.00 H new ATOM 0 HB3 LEU A 65 11.439 1.953 7.193 1.00 0.00 H new ATOM 0 HG LEU A 65 9.750 3.516 7.914 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.698 2.922 9.050 1.00 0.00 H new ATOM 0 HD12 LEU A 65 7.704 2.396 7.350 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.963 1.209 8.650 1.00 0.00 H new ATOM 0 HD21 LEU A 65 9.802 2.870 10.383 1.00 0.00 H new ATOM 0 HD22 LEU A 65 10.193 1.198 9.913 1.00 0.00 H new ATOM 0 HD23 LEU A 65 11.358 2.507 9.600 1.00 0.00 H new ATOM 969 N THR A 66 11.220 3.267 5.106 1.00 0.00 N ATOM 970 CA THR A 66 11.538 4.464 4.392 1.00 0.00 C ATOM 971 C THR A 66 11.230 4.610 2.941 1.00 0.00 C ATOM 972 O THR A 66 11.163 5.730 2.437 1.00 0.00 O ATOM 973 CB THR A 66 12.976 4.849 4.577 1.00 0.00 C ATOM 974 OG1 THR A 66 13.886 3.802 4.275 1.00 0.00 O ATOM 975 CG2 THR A 66 13.301 5.219 6.034 1.00 0.00 C ATOM 0 H THR A 66 12.037 2.819 5.521 1.00 0.00 H new ATOM 0 HA THR A 66 10.814 5.124 4.871 1.00 0.00 H new ATOM 0 HB THR A 66 13.095 5.690 3.894 1.00 0.00 H new ATOM 0 HG1 THR A 66 13.917 3.170 5.023 1.00 0.00 H new ATOM 0 HG21 THR A 66 14.354 5.490 6.114 1.00 0.00 H new ATOM 0 HG22 THR A 66 12.684 6.064 6.341 1.00 0.00 H new ATOM 0 HG23 THR A 66 13.095 4.366 6.681 1.00 0.00 H new ATOM 983 N MET A 67 10.979 3.516 2.200 1.00 0.00 N ATOM 984 CA MET A 67 10.357 3.547 0.913 1.00 0.00 C ATOM 985 C MET A 67 8.927 3.926 1.085 1.00 0.00 C ATOM 986 O MET A 67 8.407 4.904 0.549 1.00 0.00 O ATOM 987 CB MET A 67 10.394 2.236 0.110 1.00 0.00 C ATOM 988 CG MET A 67 9.955 2.388 -1.348 1.00 0.00 C ATOM 989 SD MET A 67 9.987 0.826 -2.278 1.00 0.00 S ATOM 990 CE MET A 67 8.682 -0.141 -1.467 1.00 0.00 C ATOM 0 H MET A 67 11.218 2.574 2.509 1.00 0.00 H new ATOM 0 HA MET A 67 10.940 4.268 0.339 1.00 0.00 H new ATOM 0 HB2 MET A 67 11.407 1.835 0.134 1.00 0.00 H new ATOM 0 HB3 MET A 67 9.750 1.504 0.598 1.00 0.00 H new ATOM 0 HG2 MET A 67 8.945 2.798 -1.375 1.00 0.00 H new ATOM 0 HG3 MET A 67 10.605 3.110 -1.842 1.00 0.00 H new ATOM 0 HE1 MET A 67 8.517 -1.066 -2.020 1.00 0.00 H new ATOM 0 HE2 MET A 67 8.985 -0.377 -0.447 1.00 0.00 H new ATOM 0 HE3 MET A 67 7.759 0.439 -1.446 1.00 0.00 H new ATOM 1000 N MET A 68 8.225 3.172 1.949 1.00 0.00 N ATOM 1001 CA MET A 68 6.811 3.155 2.165 1.00 0.00 C ATOM 1002 C MET A 68 6.270 4.367 2.841 1.00 0.00 C ATOM 1003 O MET A 68 5.382 5.047 2.327 1.00 0.00 O ATOM 1004 CB MET A 68 6.301 1.870 2.838 1.00 0.00 C ATOM 1005 CG MET A 68 6.470 0.766 1.792 1.00 0.00 C ATOM 1006 SD MET A 68 5.470 0.983 0.290 1.00 0.00 S ATOM 1007 CE MET A 68 3.853 0.478 0.945 1.00 0.00 C ATOM 0 H MET A 68 8.700 2.506 2.558 1.00 0.00 H new ATOM 0 HA MET A 68 6.409 3.169 1.152 1.00 0.00 H new ATOM 0 HB2 MET A 68 6.871 1.647 3.740 1.00 0.00 H new ATOM 0 HB3 MET A 68 5.258 1.971 3.137 1.00 0.00 H new ATOM 0 HG2 MET A 68 7.521 0.712 1.508 1.00 0.00 H new ATOM 0 HG3 MET A 68 6.213 -0.190 2.248 1.00 0.00 H new ATOM 0 HE1 MET A 68 3.190 0.221 0.119 1.00 0.00 H new ATOM 0 HE2 MET A 68 3.978 -0.389 1.593 1.00 0.00 H new ATOM 0 HE3 MET A 68 3.419 1.299 1.516 1.00 0.00 H new ATOM 1017 N ALA A 69 6.784 4.691 4.041 1.00 0.00 N ATOM 1018 CA ALA A 69 6.456 5.853 4.808 1.00 0.00 C ATOM 1019 C ALA A 69 6.987 7.144 4.287 1.00 0.00 C ATOM 1020 O ALA A 69 6.826 8.194 4.908 1.00 0.00 O ATOM 1021 CB ALA A 69 7.026 5.657 6.223 1.00 0.00 C ATOM 0 H ALA A 69 7.475 4.101 4.506 1.00 0.00 H new ATOM 0 HA ALA A 69 5.370 5.936 4.769 1.00 0.00 H new ATOM 0 HB1 ALA A 69 6.792 6.529 6.834 1.00 0.00 H new ATOM 0 HB2 ALA A 69 6.583 4.769 6.674 1.00 0.00 H new ATOM 0 HB3 ALA A 69 8.108 5.534 6.166 1.00 0.00 H new ATOM 1027 N ARG A 70 7.566 7.187 3.074 1.00 0.00 N ATOM 1028 CA ARG A 70 7.949 8.369 2.366 1.00 0.00 C ATOM 1029 C ARG A 70 6.724 8.893 1.701 1.00 0.00 C ATOM 1030 O ARG A 70 5.925 8.170 1.107 1.00 0.00 O ATOM 1031 CB ARG A 70 8.836 8.023 1.158 1.00 0.00 C ATOM 1032 CG ARG A 70 9.338 9.146 0.249 1.00 0.00 C ATOM 1033 CD ARG A 70 9.975 8.512 -0.989 1.00 0.00 C ATOM 1034 NE ARG A 70 10.740 9.622 -1.624 1.00 0.00 N ATOM 1035 CZ ARG A 70 11.840 9.298 -2.365 1.00 0.00 C ATOM 1036 NH1 ARG A 70 12.159 8.108 -2.952 1.00 0.00 N ATOM 1037 NH2 ARG A 70 12.577 10.358 -2.808 1.00 0.00 N ATOM 0 H ARG A 70 7.781 6.337 2.553 1.00 0.00 H new ATOM 0 HA ARG A 70 8.441 9.039 3.071 1.00 0.00 H new ATOM 0 HB2 ARG A 70 9.710 7.492 1.535 1.00 0.00 H new ATOM 0 HB3 ARG A 70 8.281 7.321 0.535 1.00 0.00 H new ATOM 0 HG2 ARG A 70 8.514 9.798 -0.040 1.00 0.00 H new ATOM 0 HG3 ARG A 70 10.065 9.765 0.775 1.00 0.00 H new ATOM 0 HD2 ARG A 70 10.629 7.683 -0.719 1.00 0.00 H new ATOM 0 HD3 ARG A 70 9.218 8.114 -1.665 1.00 0.00 H new ATOM 0 HE ARG A 70 10.451 10.593 -1.509 1.00 0.00 H new ATOM 0 HH11 ARG A 70 11.530 7.310 -2.862 1.00 0.00 H new ATOM 0 HH12 ARG A 70 13.026 8.016 -3.481 1.00 0.00 H new ATOM 0 HH21 ARG A 70 12.291 11.310 -2.579 1.00 0.00 H new ATOM 0 HH22 ARG A 70 13.414 10.198 -3.368 1.00 0.00 H new ATOM 1051 N LYS A 71 6.503 10.219 1.731 1.00 0.00 N ATOM 1052 CA LYS A 71 5.402 10.857 1.080 1.00 0.00 C ATOM 1053 C LYS A 71 5.644 11.255 -0.335 1.00 0.00 C ATOM 1054 O LYS A 71 6.532 12.038 -0.669 1.00 0.00 O ATOM 1055 CB LYS A 71 4.909 12.060 1.902 1.00 0.00 C ATOM 1056 CG LYS A 71 3.501 12.530 1.531 1.00 0.00 C ATOM 1057 CD LYS A 71 2.852 13.342 2.653 1.00 0.00 C ATOM 1058 CE LYS A 71 1.428 13.763 2.282 1.00 0.00 C ATOM 1059 NZ LYS A 71 0.788 14.419 3.445 1.00 0.00 N ATOM 0 H LYS A 71 7.113 10.870 2.226 1.00 0.00 H new ATOM 0 HA LYS A 71 4.626 10.093 1.029 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.926 11.796 2.960 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.605 12.888 1.768 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.548 13.136 0.626 1.00 0.00 H new ATOM 0 HG3 LYS A 71 2.878 11.665 1.303 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.832 12.750 3.568 1.00 0.00 H new ATOM 0 HD3 LYS A 71 3.453 14.227 2.859 1.00 0.00 H new ATOM 0 HE2 LYS A 71 1.449 14.445 1.432 1.00 0.00 H new ATOM 0 HE3 LYS A 71 0.848 12.892 1.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -0.180 14.705 3.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 0.756 13.754 4.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 1.338 15.259 3.716 1.00 0.00 H new ATOM 1073 N MET A 72 4.754 10.765 -1.217 1.00 0.00 N ATOM 1074 CA MET A 72 4.743 11.116 -2.603 1.00 0.00 C ATOM 1075 C MET A 72 4.067 12.409 -2.906 1.00 0.00 C ATOM 1076 O MET A 72 3.637 13.106 -1.988 1.00 0.00 O ATOM 1077 CB MET A 72 4.150 9.863 -3.270 1.00 0.00 C ATOM 1078 CG MET A 72 4.931 8.570 -3.025 1.00 0.00 C ATOM 1079 SD MET A 72 4.724 7.362 -4.368 1.00 0.00 S ATOM 1080 CE MET A 72 3.112 6.850 -3.706 1.00 0.00 C ATOM 0 H MET A 72 4.021 10.105 -0.958 1.00 0.00 H new ATOM 0 HA MET A 72 5.733 11.345 -2.999 1.00 0.00 H new ATOM 0 HB2 MET A 72 3.130 9.727 -2.911 1.00 0.00 H new ATOM 0 HB3 MET A 72 4.090 10.036 -4.345 1.00 0.00 H new ATOM 0 HG2 MET A 72 5.989 8.805 -2.913 1.00 0.00 H new ATOM 0 HG3 MET A 72 4.602 8.124 -2.086 1.00 0.00 H new ATOM 0 HE1 MET A 72 2.730 6.010 -4.287 1.00 0.00 H new ATOM 0 HE2 MET A 72 3.225 6.549 -2.664 1.00 0.00 H new ATOM 0 HE3 MET A 72 2.412 7.683 -3.769 1.00 0.00 H new ATOM 1090 N LYS A 73 4.129 12.727 -4.211 1.00 0.00 N ATOM 1091 CA LYS A 73 3.252 13.727 -4.735 1.00 0.00 C ATOM 1092 C LYS A 73 1.912 13.170 -5.073 1.00 0.00 C ATOM 1093 O LYS A 73 1.545 12.006 -4.918 1.00 0.00 O ATOM 1094 CB LYS A 73 3.878 14.395 -5.971 1.00 0.00 C ATOM 1095 CG LYS A 73 5.180 15.093 -5.573 1.00 0.00 C ATOM 1096 CD LYS A 73 5.716 15.982 -6.698 1.00 0.00 C ATOM 1097 CE LYS A 73 6.113 17.369 -6.190 1.00 0.00 C ATOM 1098 NZ LYS A 73 4.969 18.271 -5.928 1.00 0.00 N ATOM 0 H LYS A 73 4.767 12.306 -4.887 1.00 0.00 H new ATOM 0 HA LYS A 73 3.110 14.476 -3.956 1.00 0.00 H new ATOM 0 HB2 LYS A 73 4.074 13.648 -6.740 1.00 0.00 H new ATOM 0 HB3 LYS A 73 3.182 15.117 -6.398 1.00 0.00 H new ATOM 0 HG2 LYS A 73 5.011 15.697 -4.682 1.00 0.00 H new ATOM 0 HG3 LYS A 73 5.929 14.345 -5.313 1.00 0.00 H new ATOM 0 HD2 LYS A 73 6.580 15.503 -7.158 1.00 0.00 H new ATOM 0 HD3 LYS A 73 4.957 16.083 -7.474 1.00 0.00 H new ATOM 0 HE2 LYS A 73 6.689 17.256 -5.272 1.00 0.00 H new ATOM 0 HE3 LYS A 73 6.770 17.837 -6.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 5.321 19.188 -5.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 4.429 18.411 -6.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 4.351 17.848 -5.206 1.00 0.00 H new ATOM 1112 N ASP A 74 1.038 14.058 -5.579 1.00 0.00 N ATOM 1113 CA ASP A 74 -0.369 13.961 -5.816 1.00 0.00 C ATOM 1114 C ASP A 74 -0.767 12.922 -6.807 1.00 0.00 C ATOM 1115 O ASP A 74 -1.504 11.981 -6.516 1.00 0.00 O ATOM 1116 CB ASP A 74 -0.951 15.317 -6.250 1.00 0.00 C ATOM 1117 CG ASP A 74 -0.680 16.364 -5.178 1.00 0.00 C ATOM 1118 OD1 ASP A 74 -1.249 16.175 -4.070 1.00 0.00 O ATOM 1119 OD2 ASP A 74 0.100 17.309 -5.471 1.00 0.00 O ATOM 0 H ASP A 74 1.375 14.978 -5.862 1.00 0.00 H new ATOM 0 HA ASP A 74 -0.784 13.652 -4.857 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -0.506 15.628 -7.195 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -2.024 15.225 -6.418 1.00 0.00 H new ATOM 1124 N THR A 75 -0.216 12.969 -8.032 1.00 0.00 N ATOM 1125 CA THR A 75 -0.548 12.019 -9.049 1.00 0.00 C ATOM 1126 C THR A 75 0.002 10.664 -8.767 1.00 0.00 C ATOM 1127 O THR A 75 -0.763 9.706 -8.864 1.00 0.00 O ATOM 1128 CB THR A 75 -0.101 12.318 -10.449 1.00 0.00 C ATOM 1129 OG1 THR A 75 -0.533 13.590 -10.910 1.00 0.00 O ATOM 1130 CG2 THR A 75 -0.715 11.327 -11.451 1.00 0.00 C ATOM 0 H THR A 75 0.465 13.671 -8.321 1.00 0.00 H new ATOM 0 HA THR A 75 -1.636 12.075 -9.009 1.00 0.00 H new ATOM 0 HB THR A 75 0.987 12.262 -10.402 1.00 0.00 H new ATOM 0 HG1 THR A 75 -0.213 13.732 -11.825 1.00 0.00 H new ATOM 0 HG21 THR A 75 -0.373 11.568 -12.457 1.00 0.00 H new ATOM 0 HG22 THR A 75 -0.406 10.313 -11.196 1.00 0.00 H new ATOM 0 HG23 THR A 75 -1.802 11.396 -11.411 1.00 0.00 H new ATOM 1138 N ASP A 76 1.238 10.537 -8.252 1.00 0.00 N ATOM 1139 CA ASP A 76 1.689 9.276 -7.751 1.00 0.00 C ATOM 1140 C ASP A 76 0.798 8.599 -6.768 1.00 0.00 C ATOM 1141 O ASP A 76 0.438 7.430 -6.904 1.00 0.00 O ATOM 1142 CB ASP A 76 3.055 9.377 -7.051 1.00 0.00 C ATOM 1143 CG ASP A 76 4.153 9.621 -8.077 1.00 0.00 C ATOM 1144 OD1 ASP A 76 4.517 8.732 -8.893 1.00 0.00 O ATOM 1145 OD2 ASP A 76 4.633 10.786 -8.083 1.00 0.00 O ATOM 0 H ASP A 76 1.917 11.295 -8.183 1.00 0.00 H new ATOM 0 HA ASP A 76 1.720 8.686 -8.667 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.040 10.188 -6.323 1.00 0.00 H new ATOM 0 HB3 ASP A 76 3.259 8.459 -6.500 1.00 0.00 H new ATOM 1150 N SER A 77 0.560 9.316 -5.656 1.00 0.00 N ATOM 1151 CA SER A 77 -0.356 8.905 -4.637 1.00 0.00 C ATOM 1152 C SER A 77 -1.687 8.363 -5.027 1.00 0.00 C ATOM 1153 O SER A 77 -2.148 7.247 -4.791 1.00 0.00 O ATOM 1154 CB SER A 77 -0.468 10.020 -3.584 1.00 0.00 C ATOM 1155 OG SER A 77 -1.287 9.654 -2.483 1.00 0.00 O ATOM 0 H SER A 77 1.017 10.206 -5.459 1.00 0.00 H new ATOM 0 HA SER A 77 0.099 8.001 -4.233 1.00 0.00 H new ATOM 0 HB2 SER A 77 0.528 10.274 -3.222 1.00 0.00 H new ATOM 0 HB3 SER A 77 -0.875 10.916 -4.052 1.00 0.00 H new ATOM 0 HG SER A 77 -1.324 10.395 -1.843 1.00 0.00 H new ATOM 1161 N GLU A 78 -2.308 9.167 -5.908 1.00 0.00 N ATOM 1162 CA GLU A 78 -3.544 8.839 -6.549 1.00 0.00 C ATOM 1163 C GLU A 78 -3.450 7.633 -7.419 1.00 0.00 C ATOM 1164 O GLU A 78 -4.304 6.749 -7.383 1.00 0.00 O ATOM 1165 CB GLU A 78 -4.197 10.060 -7.220 1.00 0.00 C ATOM 1166 CG GLU A 78 -5.660 9.819 -7.598 1.00 0.00 C ATOM 1167 CD GLU A 78 -6.404 10.951 -8.292 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -6.663 12.050 -7.732 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -6.704 10.767 -9.502 1.00 0.00 O ATOM 0 H GLU A 78 -1.937 10.076 -6.184 1.00 0.00 H new ATOM 0 HA GLU A 78 -4.237 8.545 -5.761 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -4.137 10.914 -6.546 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -3.634 10.321 -8.116 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -5.700 8.944 -8.246 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -6.205 9.567 -6.688 1.00 0.00 H new ATOM 1176 N GLU A 79 -2.408 7.508 -8.260 1.00 0.00 N ATOM 1177 CA GLU A 79 -2.210 6.338 -9.057 1.00 0.00 C ATOM 1178 C GLU A 79 -1.860 5.112 -8.285 1.00 0.00 C ATOM 1179 O GLU A 79 -2.280 3.998 -8.592 1.00 0.00 O ATOM 1180 CB GLU A 79 -1.164 6.489 -10.175 1.00 0.00 C ATOM 1181 CG GLU A 79 -1.452 7.439 -11.339 1.00 0.00 C ATOM 1182 CD GLU A 79 -2.742 7.090 -12.066 1.00 0.00 C ATOM 1183 OE1 GLU A 79 -2.719 6.110 -12.858 1.00 0.00 O ATOM 1184 OE2 GLU A 79 -3.743 7.798 -11.776 1.00 0.00 O ATOM 0 H GLU A 79 -1.695 8.226 -8.388 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.198 6.218 -9.501 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -0.231 6.811 -9.711 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -0.986 5.499 -10.595 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -1.514 8.461 -10.964 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -0.621 7.408 -12.044 1.00 0.00 H new ATOM 1191 N GLU A 80 -1.127 5.266 -7.167 1.00 0.00 N ATOM 1192 CA GLU A 80 -0.857 4.171 -6.289 1.00 0.00 C ATOM 1193 C GLU A 80 -1.955 3.357 -5.696 1.00 0.00 C ATOM 1194 O GLU A 80 -2.052 2.152 -5.927 1.00 0.00 O ATOM 1195 CB GLU A 80 0.044 4.697 -5.158 1.00 0.00 C ATOM 1196 CG GLU A 80 0.749 3.779 -4.158 1.00 0.00 C ATOM 1197 CD GLU A 80 0.980 4.377 -2.777 1.00 0.00 C ATOM 1198 OE1 GLU A 80 0.522 5.482 -2.382 1.00 0.00 O ATOM 1199 OE2 GLU A 80 1.491 3.619 -1.910 1.00 0.00 O ATOM 0 H GLU A 80 -0.720 6.153 -6.871 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.414 3.439 -6.965 1.00 0.00 H new ATOM 0 HB2 GLU A 80 0.823 5.291 -5.635 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.566 5.383 -4.571 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.160 2.869 -4.048 1.00 0.00 H new ATOM 0 HG3 GLU A 80 1.713 3.487 -4.575 1.00 0.00 H new ATOM 1206 N ILE A 81 -2.914 4.014 -5.020 1.00 0.00 N ATOM 1207 CA ILE A 81 -4.129 3.364 -4.637 1.00 0.00 C ATOM 1208 C ILE A 81 -5.031 2.963 -5.753 1.00 0.00 C ATOM 1209 O ILE A 81 -5.691 1.930 -5.652 1.00 0.00 O ATOM 1210 CB ILE A 81 -4.782 4.350 -3.714 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -5.827 3.663 -2.819 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -5.254 5.636 -4.413 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -5.266 2.622 -1.851 1.00 0.00 C ATOM 0 H ILE A 81 -2.849 4.992 -4.739 1.00 0.00 H new ATOM 0 HA ILE A 81 -3.910 2.400 -4.178 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.015 4.723 -3.035 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -6.349 4.428 -2.244 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -6.569 3.182 -3.456 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -5.715 6.299 -3.681 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -4.400 6.137 -4.869 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.982 5.385 -5.185 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -6.079 2.195 -1.265 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -4.770 1.831 -2.414 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -4.547 3.097 -1.183 1.00 0.00 H new ATOM 1225 N ARG A 82 -5.001 3.592 -6.941 1.00 0.00 N ATOM 1226 CA ARG A 82 -5.827 3.275 -8.064 1.00 0.00 C ATOM 1227 C ARG A 82 -5.386 2.034 -8.762 1.00 0.00 C ATOM 1228 O ARG A 82 -6.199 1.136 -8.973 1.00 0.00 O ATOM 1229 CB ARG A 82 -5.845 4.451 -9.055 1.00 0.00 C ATOM 1230 CG ARG A 82 -6.603 4.250 -10.369 1.00 0.00 C ATOM 1231 CD ARG A 82 -6.488 5.431 -11.335 1.00 0.00 C ATOM 1232 NE ARG A 82 -7.417 6.441 -10.753 1.00 0.00 N ATOM 1233 CZ ARG A 82 -7.212 7.736 -10.376 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -6.073 8.459 -10.585 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -8.267 8.537 -10.046 1.00 0.00 N ATOM 0 H ARG A 82 -4.364 4.366 -7.128 1.00 0.00 H new ATOM 0 HA ARG A 82 -6.832 3.096 -7.683 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -6.275 5.314 -8.546 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -4.813 4.704 -9.296 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -6.227 3.353 -10.861 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -7.656 4.075 -10.147 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -5.467 5.808 -11.390 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -6.780 5.152 -12.348 1.00 0.00 H new ATOM 0 HE ARG A 82 -8.370 6.106 -10.612 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -5.279 8.033 -11.062 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -6.016 9.426 -10.264 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -9.217 8.168 -10.080 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -8.105 9.504 -9.765 1.00 0.00 H new ATOM 1249 N GLU A 83 -4.080 1.913 -9.056 1.00 0.00 N ATOM 1250 CA GLU A 83 -3.582 0.794 -9.793 1.00 0.00 C ATOM 1251 C GLU A 83 -3.346 -0.392 -8.922 1.00 0.00 C ATOM 1252 O GLU A 83 -3.116 -1.490 -9.424 1.00 0.00 O ATOM 1253 CB GLU A 83 -2.316 1.239 -10.544 1.00 0.00 C ATOM 1254 CG GLU A 83 -2.581 2.280 -11.634 1.00 0.00 C ATOM 1255 CD GLU A 83 -3.308 1.616 -12.794 1.00 0.00 C ATOM 1256 OE1 GLU A 83 -4.564 1.550 -12.860 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -2.536 1.058 -13.620 1.00 0.00 O ATOM 0 H GLU A 83 -3.368 2.591 -8.783 1.00 0.00 H new ATOM 0 HA GLU A 83 -4.330 0.468 -10.516 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -1.605 1.649 -9.827 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -1.846 0.365 -10.995 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -3.180 3.098 -11.234 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -1.641 2.712 -11.978 1.00 0.00 H new ATOM 1264 N ALA A 84 -3.601 -0.260 -7.608 1.00 0.00 N ATOM 1265 CA ALA A 84 -3.699 -1.426 -6.786 1.00 0.00 C ATOM 1266 C ALA A 84 -5.078 -1.990 -6.793 1.00 0.00 C ATOM 1267 O ALA A 84 -5.228 -3.171 -6.481 1.00 0.00 O ATOM 1268 CB ALA A 84 -3.239 -1.098 -5.356 1.00 0.00 C ATOM 0 H ALA A 84 -3.736 0.628 -7.125 1.00 0.00 H new ATOM 0 HA ALA A 84 -3.042 -2.192 -7.199 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -3.316 -1.991 -4.735 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.203 -0.758 -5.376 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.871 -0.312 -4.942 1.00 0.00 H new ATOM 1274 N PHE A 85 -6.107 -1.231 -7.210 1.00 0.00 N ATOM 1275 CA PHE A 85 -7.438 -1.743 -7.117 1.00 0.00 C ATOM 1276 C PHE A 85 -7.693 -2.764 -8.172 1.00 0.00 C ATOM 1277 O PHE A 85 -8.411 -3.744 -7.982 1.00 0.00 O ATOM 1278 CB PHE A 85 -8.381 -0.528 -7.076 1.00 0.00 C ATOM 1279 CG PHE A 85 -9.809 -0.901 -6.876 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -10.225 -1.148 -5.589 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -10.644 -1.267 -7.905 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -11.517 -1.542 -5.331 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -11.913 -1.742 -7.671 1.00 0.00 C ATOM 1284 CZ PHE A 85 -12.332 -1.915 -6.373 1.00 0.00 C ATOM 0 H PHE A 85 -6.024 -0.292 -7.600 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.618 -2.309 -6.203 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -8.070 0.138 -6.271 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -8.285 0.030 -8.007 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -9.529 -1.031 -4.771 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -10.294 -1.179 -8.923 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -11.889 -1.558 -4.317 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -12.571 -1.976 -8.495 1.00 0.00 H new ATOM 0 HZ PHE A 85 -13.302 -2.344 -6.172 1.00 0.00 H new ATOM 1294 N ARG A 86 -6.964 -2.651 -9.297 1.00 0.00 N ATOM 1295 CA ARG A 86 -6.815 -3.646 -10.314 1.00 0.00 C ATOM 1296 C ARG A 86 -6.080 -4.887 -9.941 1.00 0.00 C ATOM 1297 O ARG A 86 -5.968 -5.854 -10.693 1.00 0.00 O ATOM 1298 CB ARG A 86 -6.227 -3.143 -11.643 1.00 0.00 C ATOM 1299 CG ARG A 86 -7.023 -1.995 -12.266 1.00 0.00 C ATOM 1300 CD ARG A 86 -6.595 -1.530 -13.659 1.00 0.00 C ATOM 1301 NE ARG A 86 -5.154 -1.175 -13.524 1.00 0.00 N ATOM 1302 CZ ARG A 86 -4.239 -1.840 -14.287 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -4.456 -3.088 -14.796 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -2.973 -1.341 -14.399 1.00 0.00 N ATOM 0 H ARG A 86 -6.441 -1.802 -9.510 1.00 0.00 H new ATOM 0 HA ARG A 86 -7.866 -3.904 -10.446 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -5.201 -2.815 -11.476 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -6.186 -3.972 -12.350 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -8.069 -2.296 -12.316 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -6.969 -1.140 -11.592 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -6.739 -2.317 -14.399 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -7.183 -0.673 -13.986 1.00 0.00 H new ATOM 0 HE ARG A 86 -4.857 -0.448 -12.873 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -5.337 -3.568 -14.611 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -3.737 -3.540 -15.361 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -2.720 -0.480 -13.915 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -2.281 -1.830 -14.967 1.00 0.00 H new ATOM 1318 N VAL A 87 -5.430 -5.033 -8.772 1.00 0.00 N ATOM 1319 CA VAL A 87 -4.795 -6.267 -8.429 1.00 0.00 C ATOM 1320 C VAL A 87 -5.791 -7.117 -7.719 1.00 0.00 C ATOM 1321 O VAL A 87 -5.898 -8.327 -7.913 1.00 0.00 O ATOM 1322 CB VAL A 87 -3.542 -6.133 -7.616 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -2.859 -7.498 -7.425 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -2.581 -5.160 -8.321 1.00 0.00 C ATOM 0 H VAL A 87 -5.345 -4.300 -8.068 1.00 0.00 H new ATOM 0 HA VAL A 87 -4.463 -6.724 -9.361 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.804 -5.746 -6.631 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.953 -7.372 -6.832 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.539 -8.176 -6.909 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.600 -7.915 -8.398 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -1.669 -5.060 -7.733 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -2.335 -5.545 -9.311 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -3.058 -4.185 -8.420 1.00 0.00 H new ATOM 1334 N PHE A 88 -6.673 -6.439 -6.963 1.00 0.00 N ATOM 1335 CA PHE A 88 -7.820 -6.980 -6.302 1.00 0.00 C ATOM 1336 C PHE A 88 -8.927 -7.437 -7.189 1.00 0.00 C ATOM 1337 O PHE A 88 -9.309 -8.605 -7.214 1.00 0.00 O ATOM 1338 CB PHE A 88 -8.514 -5.990 -5.351 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.815 -6.058 -4.036 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -6.691 -5.268 -3.975 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -8.029 -6.728 -2.855 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -5.829 -5.139 -2.912 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -7.306 -6.528 -1.702 1.00 0.00 C ATOM 1344 CZ PHE A 88 -6.159 -5.770 -1.736 1.00 0.00 C ATOM 0 H PHE A 88 -6.576 -5.436 -6.803 1.00 0.00 H new ATOM 0 HA PHE A 88 -7.359 -7.822 -5.785 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -8.472 -4.978 -5.755 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -9.568 -6.244 -5.237 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -6.461 -4.687 -4.856 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -8.820 -7.463 -2.831 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -4.921 -4.560 -2.998 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -7.638 -6.965 -0.772 1.00 0.00 H new ATOM 0 HZ PHE A 88 -5.533 -5.673 -0.861 1.00 0.00 H new ATOM 1354 N ASP A 89 -9.370 -6.498 -8.044 1.00 0.00 N ATOM 1355 CA ASP A 89 -10.439 -6.529 -8.994 1.00 0.00 C ATOM 1356 C ASP A 89 -9.950 -7.166 -10.249 1.00 0.00 C ATOM 1357 O ASP A 89 -9.199 -6.607 -11.047 1.00 0.00 O ATOM 1358 CB ASP A 89 -10.936 -5.081 -9.138 1.00 0.00 C ATOM 1359 CG ASP A 89 -12.351 -5.020 -9.697 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -13.155 -5.921 -9.340 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -12.604 -4.143 -10.566 1.00 0.00 O ATOM 0 H ASP A 89 -8.908 -5.589 -8.068 1.00 0.00 H new ATOM 0 HA ASP A 89 -11.291 -7.136 -8.686 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -10.908 -4.589 -8.166 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -10.262 -4.529 -9.794 1.00 0.00 H new ATOM 1366 N LYS A 90 -10.425 -8.403 -10.480 1.00 0.00 N ATOM 1367 CA LYS A 90 -9.953 -9.295 -11.493 1.00 0.00 C ATOM 1368 C LYS A 90 -10.576 -8.989 -12.811 1.00 0.00 C ATOM 1369 O LYS A 90 -9.850 -8.652 -13.745 1.00 0.00 O ATOM 1370 CB LYS A 90 -10.206 -10.751 -11.068 1.00 0.00 C ATOM 1371 CG LYS A 90 -9.701 -11.763 -12.099 1.00 0.00 C ATOM 1372 CD LYS A 90 -8.196 -11.747 -12.372 1.00 0.00 C ATOM 1373 CE LYS A 90 -7.261 -12.258 -11.274 1.00 0.00 C ATOM 1374 NZ LYS A 90 -5.911 -12.106 -11.859 1.00 0.00 N ATOM 0 H LYS A 90 -11.183 -8.803 -9.927 1.00 0.00 H new ATOM 0 HA LYS A 90 -8.878 -9.157 -11.611 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.716 -10.937 -10.112 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -11.275 -10.899 -10.912 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -9.979 -12.762 -11.764 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -10.223 -11.585 -13.039 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -8.013 -12.339 -13.269 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -7.910 -10.721 -12.604 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -7.367 -11.678 -10.357 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -7.472 -13.297 -11.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -5.198 -12.432 -11.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -5.843 -12.673 -12.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -5.741 -11.105 -12.085 1.00 0.00 H new ATOM 1388 N ASP A 91 -11.916 -9.076 -12.883 1.00 0.00 N ATOM 1389 CA ASP A 91 -12.787 -8.741 -13.967 1.00 0.00 C ATOM 1390 C ASP A 91 -12.478 -7.352 -14.409 1.00 0.00 C ATOM 1391 O ASP A 91 -12.265 -7.178 -15.608 1.00 0.00 O ATOM 1392 CB ASP A 91 -14.291 -8.873 -13.671 1.00 0.00 C ATOM 1393 CG ASP A 91 -14.570 -8.515 -12.218 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -14.510 -7.296 -11.903 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -14.875 -9.307 -11.286 1.00 0.00 O ATOM 0 H ASP A 91 -12.448 -9.423 -12.085 1.00 0.00 H new ATOM 0 HA ASP A 91 -12.594 -9.474 -14.750 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -14.859 -8.217 -14.331 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -14.622 -9.892 -13.873 1.00 0.00 H new ATOM 1400 N GLY A 92 -12.587 -6.326 -13.547 1.00 0.00 N ATOM 1401 CA GLY A 92 -12.530 -4.946 -13.919 1.00 0.00 C ATOM 1402 C GLY A 92 -13.815 -4.205 -13.779 1.00 0.00 C ATOM 1403 O GLY A 92 -13.962 -3.062 -14.211 1.00 0.00 O ATOM 0 H GLY A 92 -12.721 -6.464 -12.545 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -11.774 -4.451 -13.309 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -12.199 -4.877 -14.955 1.00 0.00 H new ATOM 1407 N ASN A 93 -14.823 -4.759 -13.082 1.00 0.00 N ATOM 1408 CA ASN A 93 -16.098 -4.126 -12.947 1.00 0.00 C ATOM 1409 C ASN A 93 -16.071 -2.959 -12.021 1.00 0.00 C ATOM 1410 O ASN A 93 -16.871 -2.062 -12.283 1.00 0.00 O ATOM 1411 CB ASN A 93 -17.218 -5.126 -12.615 1.00 0.00 C ATOM 1412 CG ASN A 93 -17.113 -5.892 -11.304 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -16.277 -5.658 -10.432 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -18.006 -6.915 -11.220 1.00 0.00 N ATOM 0 H ASN A 93 -14.752 -5.658 -12.606 1.00 0.00 H new ATOM 0 HA ASN A 93 -16.338 -3.717 -13.928 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -18.163 -4.583 -12.612 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -17.271 -5.853 -13.426 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -18.002 -7.530 -10.406 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -18.680 -7.067 -11.971 1.00 0.00 H new ATOM 1421 N GLY A 94 -15.139 -2.924 -11.052 1.00 0.00 N ATOM 1422 CA GLY A 94 -14.997 -1.862 -10.105 1.00 0.00 C ATOM 1423 C GLY A 94 -15.321 -2.251 -8.704 1.00 0.00 C ATOM 1424 O GLY A 94 -15.614 -1.363 -7.905 1.00 0.00 O ATOM 0 H GLY A 94 -14.454 -3.669 -10.923 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -13.972 -1.492 -10.141 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -15.644 -1.036 -10.401 1.00 0.00 H new ATOM 1428 N TYR A 95 -15.442 -3.578 -8.516 1.00 0.00 N ATOM 1429 CA TYR A 95 -16.158 -4.074 -7.382 1.00 0.00 C ATOM 1430 C TYR A 95 -15.495 -5.291 -6.834 1.00 0.00 C ATOM 1431 O TYR A 95 -15.305 -6.286 -7.531 1.00 0.00 O ATOM 1432 CB TYR A 95 -17.646 -4.402 -7.593 1.00 0.00 C ATOM 1433 CG TYR A 95 -18.554 -3.255 -7.873 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -18.888 -2.348 -6.895 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -19.121 -3.083 -9.114 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -19.812 -1.359 -7.136 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -19.885 -1.985 -9.430 1.00 0.00 C ATOM 1438 CZ TYR A 95 -20.252 -1.129 -8.419 1.00 0.00 C ATOM 1439 OH TYR A 95 -21.195 -0.115 -8.690 1.00 0.00 O ATOM 0 H TYR A 95 -15.054 -4.292 -9.133 1.00 0.00 H new ATOM 0 HA TYR A 95 -16.131 -3.233 -6.689 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -17.724 -5.107 -8.421 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -18.010 -4.914 -6.702 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -18.418 -2.413 -5.925 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -18.960 -3.839 -9.868 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -20.192 -0.763 -6.319 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -20.190 -1.799 -10.449 1.00 0.00 H new ATOM 0 HH TYR A 95 -21.388 -0.096 -9.651 1.00 0.00 H new ATOM 1449 N ILE A 96 -14.995 -5.370 -5.588 1.00 0.00 N ATOM 1450 CA ILE A 96 -14.244 -6.434 -4.996 1.00 0.00 C ATOM 1451 C ILE A 96 -15.137 -7.425 -4.332 1.00 0.00 C ATOM 1452 O ILE A 96 -15.717 -7.022 -3.325 1.00 0.00 O ATOM 1453 CB ILE A 96 -13.080 -6.109 -4.107 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -12.155 -4.989 -4.610 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -12.252 -7.403 -4.046 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -11.223 -4.594 -3.465 1.00 0.00 C ATOM 0 H ILE A 96 -15.133 -4.605 -4.927 1.00 0.00 H new ATOM 0 HA ILE A 96 -13.753 -6.850 -5.876 1.00 0.00 H new ATOM 0 HB ILE A 96 -13.474 -5.752 -3.155 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -11.578 -5.329 -5.470 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -12.741 -4.130 -4.938 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -11.379 -7.247 -3.412 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -12.862 -8.206 -3.632 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -11.927 -7.675 -5.050 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -10.555 -3.799 -3.797 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -11.814 -4.242 -2.620 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -10.634 -5.459 -3.160 1.00 0.00 H new ATOM 1468 N SER A 97 -15.187 -8.689 -4.789 1.00 0.00 N ATOM 1469 CA SER A 97 -15.966 -9.769 -4.269 1.00 0.00 C ATOM 1470 C SER A 97 -15.271 -10.667 -3.304 1.00 0.00 C ATOM 1471 O SER A 97 -14.051 -10.695 -3.151 1.00 0.00 O ATOM 1472 CB SER A 97 -16.534 -10.678 -5.372 1.00 0.00 C ATOM 1473 OG SER A 97 -15.672 -11.435 -6.210 1.00 0.00 O ATOM 0 H SER A 97 -14.632 -8.979 -5.594 1.00 0.00 H new ATOM 0 HA SER A 97 -16.752 -9.232 -3.738 1.00 0.00 H new ATOM 0 HB2 SER A 97 -17.210 -11.383 -4.888 1.00 0.00 H new ATOM 0 HB3 SER A 97 -17.142 -10.049 -6.023 1.00 0.00 H new ATOM 0 HG SER A 97 -16.207 -11.952 -6.848 1.00 0.00 H new ATOM 1479 N ALA A 98 -15.992 -11.545 -2.586 1.00 0.00 N ATOM 1480 CA ALA A 98 -15.306 -12.272 -1.563 1.00 0.00 C ATOM 1481 C ALA A 98 -14.345 -13.324 -1.996 1.00 0.00 C ATOM 1482 O ALA A 98 -13.418 -13.771 -1.322 1.00 0.00 O ATOM 1483 CB ALA A 98 -16.312 -12.829 -0.541 1.00 0.00 C ATOM 0 H ALA A 98 -16.986 -11.745 -2.699 1.00 0.00 H new ATOM 0 HA ALA A 98 -14.655 -11.525 -1.108 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -15.777 -13.380 0.232 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -16.862 -12.005 -0.085 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -17.011 -13.497 -1.045 1.00 0.00 H new ATOM 1489 N ALA A 99 -14.532 -13.759 -3.255 1.00 0.00 N ATOM 1490 CA ALA A 99 -13.725 -14.673 -4.002 1.00 0.00 C ATOM 1491 C ALA A 99 -12.535 -14.043 -4.640 1.00 0.00 C ATOM 1492 O ALA A 99 -11.460 -14.630 -4.760 1.00 0.00 O ATOM 1493 CB ALA A 99 -14.659 -15.343 -5.024 1.00 0.00 C ATOM 0 H ALA A 99 -15.330 -13.436 -3.802 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.286 -15.411 -3.330 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -14.091 -16.054 -5.624 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -15.457 -15.867 -4.498 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.091 -14.583 -5.675 1.00 0.00 H new ATOM 1499 N GLU A 100 -12.692 -12.831 -5.200 1.00 0.00 N ATOM 1500 CA GLU A 100 -11.584 -12.004 -5.564 1.00 0.00 C ATOM 1501 C GLU A 100 -10.698 -11.639 -4.422 1.00 0.00 C ATOM 1502 O GLU A 100 -9.490 -11.868 -4.470 1.00 0.00 O ATOM 1503 CB GLU A 100 -12.074 -10.693 -6.201 1.00 0.00 C ATOM 1504 CG GLU A 100 -12.638 -10.964 -7.597 1.00 0.00 C ATOM 1505 CD GLU A 100 -13.340 -9.753 -8.195 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -14.205 -9.082 -7.570 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -12.903 -9.286 -9.280 1.00 0.00 O ATOM 0 H GLU A 100 -13.602 -12.418 -5.403 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.006 -12.605 -6.266 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -12.840 -10.239 -5.573 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -11.251 -9.981 -6.265 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.828 -11.271 -8.258 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -13.340 -11.796 -7.545 1.00 0.00 H new ATOM 1514 N LEU A 101 -11.319 -11.327 -3.271 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.632 -10.988 -2.064 1.00 0.00 C ATOM 1516 C LEU A 101 -9.786 -12.114 -1.576 1.00 0.00 C ATOM 1517 O LEU A 101 -8.624 -11.928 -1.218 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.694 -10.511 -1.059 1.00 0.00 C ATOM 1519 CG LEU A 101 -11.139 -9.954 0.263 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -10.023 -8.899 0.188 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -12.317 -9.566 1.172 1.00 0.00 C ATOM 0 H LEU A 101 -12.335 -11.310 -3.177 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.918 -10.181 -2.226 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -12.300 -9.740 -1.534 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -12.358 -11.345 -0.833 1.00 0.00 H new ATOM 0 HG LEU A 101 -10.572 -10.769 0.712 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.735 -8.602 1.196 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -9.159 -9.319 -0.327 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -10.383 -8.027 -0.358 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.935 -9.170 2.113 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.923 -8.807 0.678 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -12.929 -10.446 1.371 1.00 0.00 H new ATOM 1533 N ARG A 102 -10.359 -13.330 -1.548 1.00 0.00 N ATOM 1534 CA ARG A 102 -9.756 -14.490 -0.967 1.00 0.00 C ATOM 1535 C ARG A 102 -8.526 -15.030 -1.613 1.00 0.00 C ATOM 1536 O ARG A 102 -7.468 -15.338 -1.066 1.00 0.00 O ATOM 1537 CB ARG A 102 -10.851 -15.560 -0.821 1.00 0.00 C ATOM 1538 CG ARG A 102 -10.461 -16.793 -0.004 1.00 0.00 C ATOM 1539 CD ARG A 102 -11.486 -17.914 0.183 1.00 0.00 C ATOM 1540 NE ARG A 102 -11.177 -18.682 1.422 1.00 0.00 N ATOM 1541 CZ ARG A 102 -12.158 -19.196 2.220 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -13.456 -19.310 1.813 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -11.856 -19.533 3.507 1.00 0.00 N ATOM 0 H ARG A 102 -11.280 -13.513 -1.946 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.357 -14.170 -0.004 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.724 -15.100 -0.358 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.152 -15.886 -1.817 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -9.577 -17.230 -0.469 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.164 -16.450 0.987 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -12.490 -17.494 0.246 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -11.472 -18.579 -0.681 1.00 0.00 H new ATOM 0 HE ARG A 102 -10.202 -18.828 1.682 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -13.726 -19.005 0.878 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -14.156 -19.701 2.444 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -10.908 -19.400 3.860 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -12.578 -19.918 4.116 1.00 0.00 H new ATOM 1557 N HIS A 103 -8.596 -15.008 -2.956 1.00 0.00 N ATOM 1558 CA HIS A 103 -7.542 -15.276 -3.885 1.00 0.00 C ATOM 1559 C HIS A 103 -6.316 -14.473 -3.616 1.00 0.00 C ATOM 1560 O HIS A 103 -5.219 -15.028 -3.644 1.00 0.00 O ATOM 1561 CB HIS A 103 -8.024 -15.091 -5.334 1.00 0.00 C ATOM 1562 CG HIS A 103 -7.001 -15.393 -6.388 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -6.549 -16.624 -6.819 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -6.253 -14.453 -7.026 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -5.542 -16.371 -7.697 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -5.320 -15.076 -7.829 1.00 0.00 N ATOM 0 H HIS A 103 -9.469 -14.782 -3.432 1.00 0.00 H new ATOM 0 HA HIS A 103 -7.261 -16.320 -3.747 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -8.891 -15.732 -5.497 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -8.360 -14.062 -5.460 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -6.371 -13.385 -6.920 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -4.991 -17.136 -8.223 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -4.607 -14.629 -8.405 1.00 0.00 H new ATOM 1574 N VAL A 104 -6.423 -13.135 -3.532 1.00 0.00 N ATOM 1575 CA VAL A 104 -5.284 -12.287 -3.363 1.00 0.00 C ATOM 1576 C VAL A 104 -4.591 -12.523 -2.065 1.00 0.00 C ATOM 1577 O VAL A 104 -3.365 -12.605 -2.028 1.00 0.00 O ATOM 1578 CB VAL A 104 -5.560 -10.857 -3.723 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -6.308 -9.965 -2.718 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -4.194 -10.197 -3.975 1.00 0.00 C ATOM 0 H VAL A 104 -7.311 -12.635 -3.582 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.539 -12.579 -4.104 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.241 -10.922 -4.571 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -6.424 -8.965 -3.135 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -7.291 -10.390 -2.516 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -5.740 -9.907 -1.790 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -4.339 -9.150 -4.242 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -3.587 -10.260 -3.072 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -3.686 -10.712 -4.790 1.00 0.00 H new ATOM 1590 N MET A 105 -5.360 -12.702 -0.976 1.00 0.00 N ATOM 1591 CA MET A 105 -4.987 -12.904 0.390 1.00 0.00 C ATOM 1592 C MET A 105 -4.101 -14.098 0.495 1.00 0.00 C ATOM 1593 O MET A 105 -3.035 -14.052 1.106 1.00 0.00 O ATOM 1594 CB MET A 105 -6.217 -13.166 1.275 1.00 0.00 C ATOM 1595 CG MET A 105 -5.902 -13.258 2.769 1.00 0.00 C ATOM 1596 SD MET A 105 -5.309 -11.681 3.453 1.00 0.00 S ATOM 1597 CE MET A 105 -6.955 -10.914 3.426 1.00 0.00 C ATOM 0 H MET A 105 -6.376 -12.705 -1.071 1.00 0.00 H new ATOM 0 HA MET A 105 -4.479 -12.000 0.727 1.00 0.00 H new ATOM 0 HB2 MET A 105 -6.943 -12.368 1.116 1.00 0.00 H new ATOM 0 HB3 MET A 105 -6.690 -14.095 0.956 1.00 0.00 H new ATOM 0 HG2 MET A 105 -6.797 -13.570 3.307 1.00 0.00 H new ATOM 0 HG3 MET A 105 -5.147 -14.028 2.931 1.00 0.00 H new ATOM 0 HE1 MET A 105 -6.913 -9.944 3.922 1.00 0.00 H new ATOM 0 HE2 MET A 105 -7.277 -10.780 2.393 1.00 0.00 H new ATOM 0 HE3 MET A 105 -7.665 -11.557 3.947 1.00 0.00 H new ATOM 1607 N THR A 106 -4.611 -15.256 0.040 1.00 0.00 N ATOM 1608 CA THR A 106 -3.831 -16.455 0.048 1.00 0.00 C ATOM 1609 C THR A 106 -2.541 -16.466 -0.697 1.00 0.00 C ATOM 1610 O THR A 106 -1.522 -16.993 -0.256 1.00 0.00 O ATOM 1611 CB THR A 106 -4.677 -17.582 -0.466 1.00 0.00 C ATOM 1612 OG1 THR A 106 -5.884 -17.858 0.230 1.00 0.00 O ATOM 1613 CG2 THR A 106 -3.891 -18.899 -0.346 1.00 0.00 C ATOM 0 H THR A 106 -5.555 -15.363 -0.331 1.00 0.00 H new ATOM 0 HA THR A 106 -3.532 -16.553 1.092 1.00 0.00 H new ATOM 0 HB THR A 106 -4.926 -17.251 -1.474 1.00 0.00 H new ATOM 0 HG1 THR A 106 -6.574 -17.218 -0.045 1.00 0.00 H new ATOM 0 HG21 THR A 106 -4.501 -19.722 -0.718 1.00 0.00 H new ATOM 0 HG22 THR A 106 -2.976 -18.831 -0.934 1.00 0.00 H new ATOM 0 HG23 THR A 106 -3.639 -19.078 0.699 1.00 0.00 H new ATOM 1621 N ASN A 107 -2.541 -15.740 -1.830 1.00 0.00 N ATOM 1622 CA ASN A 107 -1.395 -15.489 -2.647 1.00 0.00 C ATOM 1623 C ASN A 107 -0.314 -14.883 -1.819 1.00 0.00 C ATOM 1624 O ASN A 107 0.838 -15.314 -1.816 1.00 0.00 O ATOM 1625 CB ASN A 107 -1.674 -14.623 -3.887 1.00 0.00 C ATOM 1626 CG ASN A 107 -2.696 -15.176 -4.870 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -3.081 -16.344 -4.898 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -3.123 -14.255 -5.775 1.00 0.00 N ATOM 0 H ASN A 107 -3.388 -15.305 -2.195 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.081 -16.457 -3.038 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.014 -13.643 -3.552 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -0.734 -14.470 -4.418 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -3.782 -14.525 -6.505 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -2.784 -13.294 -5.724 1.00 0.00 H new ATOM 1635 N LEU A 108 -0.597 -13.795 -1.081 1.00 0.00 N ATOM 1636 CA LEU A 108 0.404 -13.193 -0.257 1.00 0.00 C ATOM 1637 C LEU A 108 1.102 -13.825 0.898 1.00 0.00 C ATOM 1638 O LEU A 108 2.290 -13.635 1.158 1.00 0.00 O ATOM 1639 CB LEU A 108 -0.083 -11.789 0.138 1.00 0.00 C ATOM 1640 CG LEU A 108 -0.489 -10.849 -1.010 1.00 0.00 C ATOM 1641 CD1 LEU A 108 -0.714 -9.453 -0.406 1.00 0.00 C ATOM 1642 CD2 LEU A 108 0.752 -10.709 -1.908 1.00 0.00 C ATOM 0 H LEU A 108 -1.508 -13.337 -1.054 1.00 0.00 H new ATOM 0 HA LEU A 108 1.239 -13.296 -0.950 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -0.938 -11.901 0.805 1.00 0.00 H new ATOM 0 HB3 LEU A 108 0.707 -11.304 0.711 1.00 0.00 H new ATOM 0 HG LEU A 108 -1.368 -11.218 -1.538 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -1.004 -8.758 -1.194 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -1.505 -9.504 0.343 1.00 0.00 H new ATOM 0 HD13 LEU A 108 0.207 -9.106 0.062 1.00 0.00 H new ATOM 0 HD21 LEU A 108 0.523 -10.049 -2.745 1.00 0.00 H new ATOM 0 HD22 LEU A 108 1.574 -10.289 -1.329 1.00 0.00 H new ATOM 0 HD23 LEU A 108 1.039 -11.690 -2.287 1.00 0.00 H new ATOM 1654 N GLY A 109 0.280 -14.682 1.530 1.00 0.00 N ATOM 1655 CA GLY A 109 0.790 -15.602 2.498 1.00 0.00 C ATOM 1656 C GLY A 109 0.036 -15.651 3.783 1.00 0.00 C ATOM 1657 O GLY A 109 0.487 -16.078 4.845 1.00 0.00 O ATOM 0 H GLY A 109 -0.726 -14.738 1.373 1.00 0.00 H new ATOM 0 HA2 GLY A 109 0.796 -16.600 2.060 1.00 0.00 H new ATOM 0 HA3 GLY A 109 1.827 -15.342 2.713 1.00 0.00 H new ATOM 1661 N GLU A 110 -1.190 -15.107 3.695 1.00 0.00 N ATOM 1662 CA GLU A 110 -2.053 -14.971 4.827 1.00 0.00 C ATOM 1663 C GLU A 110 -3.109 -16.020 4.757 1.00 0.00 C ATOM 1664 O GLU A 110 -3.606 -16.533 3.756 1.00 0.00 O ATOM 1665 CB GLU A 110 -2.718 -13.586 4.893 1.00 0.00 C ATOM 1666 CG GLU A 110 -2.150 -12.793 6.072 1.00 0.00 C ATOM 1667 CD GLU A 110 -2.758 -13.140 7.423 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -2.570 -14.302 7.871 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -3.270 -12.189 8.073 1.00 0.00 O ATOM 0 H GLU A 110 -1.589 -14.756 2.824 1.00 0.00 H new ATOM 0 HA GLU A 110 -1.446 -15.086 5.725 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -2.546 -13.045 3.963 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -3.797 -13.696 5.003 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -1.074 -12.959 6.120 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -2.300 -11.730 5.883 1.00 0.00 H new ATOM 1676 N LYS A 111 -3.655 -16.316 5.950 1.00 0.00 N ATOM 1677 CA LYS A 111 -4.736 -17.201 6.257 1.00 0.00 C ATOM 1678 C LYS A 111 -5.989 -16.426 6.482 1.00 0.00 C ATOM 1679 O LYS A 111 -6.006 -15.222 6.732 1.00 0.00 O ATOM 1680 CB LYS A 111 -4.376 -17.992 7.526 1.00 0.00 C ATOM 1681 CG LYS A 111 -3.084 -18.812 7.502 1.00 0.00 C ATOM 1682 CD LYS A 111 -2.872 -19.595 8.799 1.00 0.00 C ATOM 1683 CE LYS A 111 -2.634 -18.729 10.038 1.00 0.00 C ATOM 1684 NZ LYS A 111 -1.917 -19.615 10.982 1.00 0.00 N ATOM 0 H LYS A 111 -3.292 -15.881 6.798 1.00 0.00 H new ATOM 0 HA LYS A 111 -4.899 -17.884 5.424 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -4.312 -17.288 8.355 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -5.201 -18.670 7.746 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -3.111 -19.505 6.661 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -2.236 -18.146 7.339 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -3.745 -20.224 8.974 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -2.020 -20.262 8.669 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -2.043 -17.846 9.796 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -3.574 -18.377 10.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -1.715 -19.096 11.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -2.508 -20.444 11.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -1.023 -19.929 10.553 1.00 0.00 H new ATOM 1698 N LEU A 112 -7.131 -17.128 6.377 1.00 0.00 N ATOM 1699 CA LEU A 112 -8.411 -16.493 6.315 1.00 0.00 C ATOM 1700 C LEU A 112 -9.424 -17.586 6.274 1.00 0.00 C ATOM 1701 O LEU A 112 -9.454 -18.434 5.384 1.00 0.00 O ATOM 1702 CB LEU A 112 -8.714 -15.516 5.167 1.00 0.00 C ATOM 1703 CG LEU A 112 -9.826 -14.522 5.540 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -9.260 -13.489 6.530 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -10.174 -13.688 4.296 1.00 0.00 C ATOM 0 H LEU A 112 -7.167 -18.146 6.335 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.433 -15.844 7.190 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.808 -14.967 4.908 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -9.011 -16.077 4.281 1.00 0.00 H new ATOM 0 HG LEU A 112 -10.674 -15.078 5.940 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.041 -12.779 6.801 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -8.907 -13.999 7.426 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.431 -12.956 6.065 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -10.962 -12.977 4.543 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.289 -13.147 3.962 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -10.518 -14.348 3.500 1.00 0.00 H new ATOM 1717 N THR A 113 -10.239 -17.583 7.344 1.00 0.00 N ATOM 1718 CA THR A 113 -11.371 -18.455 7.407 1.00 0.00 C ATOM 1719 C THR A 113 -12.612 -17.824 6.876 1.00 0.00 C ATOM 1720 O THR A 113 -12.747 -16.640 6.573 1.00 0.00 O ATOM 1721 CB THR A 113 -11.609 -18.878 8.826 1.00 0.00 C ATOM 1722 OG1 THR A 113 -11.990 -17.821 9.694 1.00 0.00 O ATOM 1723 CG2 THR A 113 -10.313 -19.420 9.454 1.00 0.00 C ATOM 0 H THR A 113 -10.116 -16.982 8.159 1.00 0.00 H new ATOM 0 HA THR A 113 -11.141 -19.317 6.781 1.00 0.00 H new ATOM 0 HB THR A 113 -12.409 -19.614 8.746 1.00 0.00 H new ATOM 0 HG1 THR A 113 -11.230 -17.217 9.827 1.00 0.00 H new ATOM 0 HG21 THR A 113 -10.506 -19.722 10.483 1.00 0.00 H new ATOM 0 HG22 THR A 113 -9.964 -20.280 8.883 1.00 0.00 H new ATOM 0 HG23 THR A 113 -9.549 -18.642 9.441 1.00 0.00 H new ATOM 1731 N ASP A 114 -13.704 -18.607 6.818 1.00 0.00 N ATOM 1732 CA ASP A 114 -15.013 -18.174 6.439 1.00 0.00 C ATOM 1733 C ASP A 114 -15.825 -17.281 7.313 1.00 0.00 C ATOM 1734 O ASP A 114 -16.784 -16.678 6.832 1.00 0.00 O ATOM 1735 CB ASP A 114 -15.785 -19.422 5.978 1.00 0.00 C ATOM 1736 CG ASP A 114 -15.226 -19.899 4.646 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -14.170 -20.584 4.588 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -15.810 -19.487 3.608 1.00 0.00 O ATOM 0 H ASP A 114 -13.671 -19.600 7.049 1.00 0.00 H new ATOM 0 HA ASP A 114 -14.826 -17.441 5.654 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -15.700 -20.212 6.724 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -16.845 -19.191 5.878 1.00 0.00 H new ATOM 1743 N GLU A 115 -15.393 -17.234 8.586 1.00 0.00 N ATOM 1744 CA GLU A 115 -15.780 -16.323 9.618 1.00 0.00 C ATOM 1745 C GLU A 115 -15.227 -14.962 9.370 1.00 0.00 C ATOM 1746 O GLU A 115 -15.845 -13.941 9.666 1.00 0.00 O ATOM 1747 CB GLU A 115 -15.240 -16.760 10.990 1.00 0.00 C ATOM 1748 CG GLU A 115 -15.430 -18.254 11.256 1.00 0.00 C ATOM 1749 CD GLU A 115 -15.064 -18.804 12.627 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -15.691 -18.249 13.568 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -14.122 -19.615 12.833 1.00 0.00 O ATOM 0 H GLU A 115 -14.702 -17.904 8.924 1.00 0.00 H new ATOM 0 HA GLU A 115 -16.870 -16.315 9.614 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -14.179 -16.517 11.051 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -15.743 -16.190 11.771 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -16.478 -18.492 11.073 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -14.846 -18.799 10.514 1.00 0.00 H new ATOM 1758 N GLU A 116 -13.961 -14.990 8.917 1.00 0.00 N ATOM 1759 CA GLU A 116 -13.174 -13.816 8.701 1.00 0.00 C ATOM 1760 C GLU A 116 -13.401 -13.236 7.348 1.00 0.00 C ATOM 1761 O GLU A 116 -13.378 -12.010 7.244 1.00 0.00 O ATOM 1762 CB GLU A 116 -11.680 -14.103 8.931 1.00 0.00 C ATOM 1763 CG GLU A 116 -11.296 -14.468 10.367 1.00 0.00 C ATOM 1764 CD GLU A 116 -9.940 -15.149 10.485 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -9.697 -16.224 9.876 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -9.068 -14.586 11.200 1.00 0.00 O ATOM 0 H GLU A 116 -13.470 -15.856 8.694 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.496 -13.073 9.431 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.379 -14.919 8.274 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.108 -13.225 8.632 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.292 -13.562 10.974 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -12.060 -15.126 10.782 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.715 -14.000 6.286 1.00 0.00 N ATOM 1774 CA VAL A 117 -14.148 -13.500 5.019 1.00 0.00 C ATOM 1775 C VAL A 117 -15.250 -12.515 5.210 1.00 0.00 C ATOM 1776 O VAL A 117 -15.132 -11.346 4.845 1.00 0.00 O ATOM 1777 CB VAL A 117 -14.616 -14.549 4.053 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -15.223 -14.011 2.746 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -13.397 -15.379 3.618 1.00 0.00 C ATOM 0 H VAL A 117 -13.664 -15.018 6.314 1.00 0.00 H new ATOM 0 HA VAL A 117 -13.262 -13.041 4.580 1.00 0.00 H new ATOM 0 HB VAL A 117 -15.389 -15.103 4.585 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -15.530 -14.846 2.117 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -16.090 -13.392 2.975 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -14.480 -13.413 2.219 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -13.713 -16.149 2.914 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -12.666 -14.728 3.139 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -12.946 -15.849 4.492 1.00 0.00 H new ATOM 1789 N ASP A 118 -16.364 -12.941 5.830 1.00 0.00 N ATOM 1790 CA ASP A 118 -17.563 -12.195 6.055 1.00 0.00 C ATOM 1791 C ASP A 118 -17.400 -11.020 6.957 1.00 0.00 C ATOM 1792 O ASP A 118 -17.980 -9.952 6.768 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.555 -13.200 6.665 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.974 -12.648 6.691 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -20.513 -12.470 5.566 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -20.544 -12.559 7.811 1.00 0.00 O ATOM 0 H ASP A 118 -16.430 -13.887 6.205 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.901 -11.764 5.113 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -18.535 -14.125 6.089 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -18.243 -13.449 7.679 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.515 -11.157 7.960 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.109 -10.000 8.697 1.00 0.00 C ATOM 1803 C GLU A 119 -15.461 -8.883 7.953 1.00 0.00 C ATOM 1804 O GLU A 119 -15.759 -7.698 8.096 1.00 0.00 O ATOM 1805 CB GLU A 119 -15.081 -10.338 9.790 1.00 0.00 C ATOM 1806 CG GLU A 119 -14.803 -9.211 10.787 1.00 0.00 C ATOM 1807 CD GLU A 119 -14.219 -9.688 12.110 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -12.986 -9.923 12.214 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -14.987 -10.012 13.054 1.00 0.00 O ATOM 0 H GLU A 119 -16.092 -12.037 8.255 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.083 -9.668 9.058 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -15.432 -11.211 10.340 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.143 -10.619 9.311 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -14.114 -8.499 10.333 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -15.732 -8.675 10.983 1.00 0.00 H new ATOM 1816 N MET A 120 -14.600 -9.286 7.002 1.00 0.00 N ATOM 1817 CA MET A 120 -13.774 -8.384 6.260 1.00 0.00 C ATOM 1818 C MET A 120 -14.641 -7.659 5.290 1.00 0.00 C ATOM 1819 O MET A 120 -14.465 -6.447 5.179 1.00 0.00 O ATOM 1820 CB MET A 120 -12.761 -9.059 5.320 1.00 0.00 C ATOM 1821 CG MET A 120 -11.498 -9.519 6.052 1.00 0.00 C ATOM 1822 SD MET A 120 -10.249 -10.105 4.868 1.00 0.00 S ATOM 1823 CE MET A 120 -9.840 -8.407 4.372 1.00 0.00 C ATOM 0 H MET A 120 -14.474 -10.264 6.742 1.00 0.00 H new ATOM 0 HA MET A 120 -13.263 -7.790 7.018 1.00 0.00 H new ATOM 0 HB2 MET A 120 -13.232 -9.917 4.840 1.00 0.00 H new ATOM 0 HB3 MET A 120 -12.485 -8.363 4.528 1.00 0.00 H new ATOM 0 HG2 MET A 120 -11.092 -8.696 6.640 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.747 -10.317 6.751 1.00 0.00 H new ATOM 0 HE1 MET A 120 -8.841 -8.386 3.935 1.00 0.00 H new ATOM 0 HE2 MET A 120 -10.565 -8.058 3.637 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.868 -7.756 5.246 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.577 -8.363 4.628 1.00 0.00 N ATOM 1834 CA ILE A 121 -16.465 -7.760 3.684 1.00 0.00 C ATOM 1835 C ILE A 121 -17.412 -6.787 4.298 1.00 0.00 C ATOM 1836 O ILE A 121 -17.538 -5.625 3.916 1.00 0.00 O ATOM 1837 CB ILE A 121 -17.249 -8.703 2.820 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -16.407 -9.696 2.002 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -18.353 -8.143 1.907 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -15.804 -9.188 0.693 1.00 0.00 C ATOM 0 H ILE A 121 -15.719 -9.366 4.750 1.00 0.00 H new ATOM 0 HA ILE A 121 -15.762 -7.239 3.034 1.00 0.00 H new ATOM 0 HB ILE A 121 -17.769 -9.214 3.630 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -15.593 -10.049 2.634 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -17.031 -10.560 1.774 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -18.817 -8.960 1.354 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -19.107 -7.641 2.513 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.919 -7.431 1.206 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -15.236 -9.989 0.219 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -16.603 -8.865 0.025 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -15.142 -8.347 0.900 1.00 0.00 H new ATOM 1852 N ARG A 122 -18.092 -7.124 5.408 1.00 0.00 N ATOM 1853 CA ARG A 122 -19.157 -6.331 5.938 1.00 0.00 C ATOM 1854 C ARG A 122 -18.647 -5.152 6.693 1.00 0.00 C ATOM 1855 O ARG A 122 -19.282 -4.099 6.703 1.00 0.00 O ATOM 1856 CB ARG A 122 -20.019 -7.193 6.875 1.00 0.00 C ATOM 1857 CG ARG A 122 -20.858 -8.184 6.066 1.00 0.00 C ATOM 1858 CD ARG A 122 -21.326 -9.400 6.868 1.00 0.00 C ATOM 1859 NE ARG A 122 -22.369 -8.919 7.817 1.00 0.00 N ATOM 1860 CZ ARG A 122 -22.758 -9.660 8.895 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -22.461 -10.985 9.040 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -23.667 -9.142 9.772 1.00 0.00 N ATOM 0 H ARG A 122 -17.897 -7.966 5.949 1.00 0.00 H new ATOM 0 HA ARG A 122 -19.750 -5.966 5.099 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -19.380 -7.733 7.573 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -20.672 -6.554 7.469 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -21.731 -7.666 5.668 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -20.274 -8.527 5.212 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -21.730 -10.166 6.206 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -20.493 -9.851 7.407 1.00 0.00 H new ATOM 0 HE ARG A 122 -22.804 -8.011 7.657 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -21.923 -11.469 8.321 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -22.777 -11.491 9.867 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -24.049 -8.209 9.619 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -23.964 -9.688 10.581 1.00 0.00 H new ATOM 1876 N GLU A 123 -17.442 -5.209 7.287 1.00 0.00 N ATOM 1877 CA GLU A 123 -16.699 -4.152 7.900 1.00 0.00 C ATOM 1878 C GLU A 123 -16.309 -3.110 6.909 1.00 0.00 C ATOM 1879 O GLU A 123 -16.420 -1.905 7.127 1.00 0.00 O ATOM 1880 CB GLU A 123 -15.569 -4.566 8.858 1.00 0.00 C ATOM 1881 CG GLU A 123 -14.211 -4.792 8.190 1.00 0.00 C ATOM 1882 CD GLU A 123 -12.976 -4.862 9.077 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -12.406 -3.806 9.458 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -12.492 -5.983 9.388 1.00 0.00 O ATOM 0 H GLU A 123 -16.936 -6.093 7.342 1.00 0.00 H new ATOM 0 HA GLU A 123 -17.403 -3.696 8.596 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -15.459 -3.796 9.621 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -15.863 -5.482 9.370 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -14.268 -5.723 7.625 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -14.057 -3.990 7.468 1.00 0.00 H new ATOM 1891 N ALA A 124 -15.883 -3.538 5.707 1.00 0.00 N ATOM 1892 CA ALA A 124 -15.565 -2.608 4.667 1.00 0.00 C ATOM 1893 C ALA A 124 -16.677 -1.873 4.003 1.00 0.00 C ATOM 1894 O ALA A 124 -16.502 -0.759 3.511 1.00 0.00 O ATOM 1895 CB ALA A 124 -14.896 -3.365 3.507 1.00 0.00 C ATOM 0 H ALA A 124 -15.759 -4.519 5.456 1.00 0.00 H new ATOM 0 HA ALA A 124 -14.961 -1.875 5.202 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -14.650 -2.664 2.709 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -13.984 -3.844 3.863 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -15.579 -4.124 3.125 1.00 0.00 H new ATOM 1901 N ASP A 125 -17.861 -2.502 3.887 1.00 0.00 N ATOM 1902 CA ASP A 125 -18.948 -2.165 3.021 1.00 0.00 C ATOM 1903 C ASP A 125 -19.737 -1.067 3.646 1.00 0.00 C ATOM 1904 O ASP A 125 -19.913 -1.089 4.864 1.00 0.00 O ATOM 1905 CB ASP A 125 -19.711 -3.460 2.697 1.00 0.00 C ATOM 1906 CG ASP A 125 -20.834 -3.251 1.691 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -20.575 -2.501 0.712 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -21.968 -3.738 1.947 1.00 0.00 O ATOM 0 H ASP A 125 -18.074 -3.323 4.454 1.00 0.00 H new ATOM 0 HA ASP A 125 -18.634 -1.762 2.058 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -19.012 -4.199 2.305 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -20.126 -3.871 3.617 1.00 0.00 H new ATOM 1913 N ILE A 126 -20.010 0.016 2.898 1.00 0.00 N ATOM 1914 CA ILE A 126 -20.632 1.163 3.484 1.00 0.00 C ATOM 1915 C ILE A 126 -22.099 1.157 3.223 1.00 0.00 C ATOM 1916 O ILE A 126 -22.883 1.332 4.154 1.00 0.00 O ATOM 1917 CB ILE A 126 -19.950 2.468 3.199 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -18.666 2.534 4.043 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -20.868 3.691 3.363 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -17.762 3.710 3.674 1.00 0.00 C ATOM 0 H ILE A 126 -19.804 0.099 1.902 1.00 0.00 H new ATOM 0 HA ILE A 126 -20.500 1.074 4.562 1.00 0.00 H new ATOM 0 HB ILE A 126 -19.679 2.508 2.144 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -18.935 2.608 5.097 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -18.110 1.604 3.920 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -20.307 4.599 3.141 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -21.711 3.608 2.677 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -21.237 3.734 4.388 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -16.874 3.699 4.306 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -17.464 3.626 2.629 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -18.302 4.645 3.824 1.00 0.00 H new ATOM 1932 N ASP A 127 -22.383 1.015 1.916 1.00 0.00 N ATOM 1933 CA ASP A 127 -23.700 1.006 1.360 1.00 0.00 C ATOM 1934 C ASP A 127 -24.562 -0.147 1.746 1.00 0.00 C ATOM 1935 O ASP A 127 -25.378 -0.088 2.665 1.00 0.00 O ATOM 1936 CB ASP A 127 -23.653 1.343 -0.140 1.00 0.00 C ATOM 1937 CG ASP A 127 -22.805 0.419 -1.001 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -23.017 -0.810 -1.184 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -21.759 0.855 -1.552 1.00 0.00 O ATOM 0 H ASP A 127 -21.655 0.901 1.211 1.00 0.00 H new ATOM 0 HA ASP A 127 -24.250 1.814 1.842 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -24.672 1.335 -0.527 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -23.277 2.360 -0.253 1.00 0.00 H new ATOM 1944 N GLY A 128 -24.365 -1.321 1.121 1.00 0.00 N ATOM 1945 CA GLY A 128 -24.885 -2.545 1.649 1.00 0.00 C ATOM 1946 C GLY A 128 -25.073 -3.609 0.624 1.00 0.00 C ATOM 1947 O GLY A 128 -25.932 -4.473 0.793 1.00 0.00 O ATOM 0 H GLY A 128 -23.845 -1.424 0.249 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -24.210 -2.913 2.421 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -25.842 -2.345 2.131 1.00 0.00 H new ATOM 1951 N ASP A 129 -24.270 -3.655 -0.454 1.00 0.00 N ATOM 1952 CA ASP A 129 -24.301 -4.689 -1.441 1.00 0.00 C ATOM 1953 C ASP A 129 -23.451 -5.880 -1.159 1.00 0.00 C ATOM 1954 O ASP A 129 -23.721 -6.983 -1.632 1.00 0.00 O ATOM 1955 CB ASP A 129 -24.034 -4.131 -2.849 1.00 0.00 C ATOM 1956 CG ASP A 129 -22.710 -3.385 -2.939 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -21.944 -3.244 -1.949 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -22.377 -3.045 -4.105 1.00 0.00 O ATOM 0 H ASP A 129 -23.568 -2.940 -0.646 1.00 0.00 H new ATOM 0 HA ASP A 129 -25.321 -5.071 -1.393 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -24.035 -4.951 -3.567 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -24.845 -3.460 -3.130 1.00 0.00 H new ATOM 1963 N GLY A 130 -22.399 -5.692 -0.344 1.00 0.00 N ATOM 1964 CA GLY A 130 -21.540 -6.789 -0.021 1.00 0.00 C ATOM 1965 C GLY A 130 -20.284 -6.740 -0.821 1.00 0.00 C ATOM 1966 O GLY A 130 -19.422 -7.616 -0.767 1.00 0.00 O ATOM 0 H GLY A 130 -22.146 -4.801 0.084 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -21.299 -6.766 1.042 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -22.059 -7.729 -0.210 1.00 0.00 H new ATOM 1970 N GLN A 131 -20.161 -5.719 -1.688 1.00 0.00 N ATOM 1971 CA GLN A 131 -18.963 -5.610 -2.462 1.00 0.00 C ATOM 1972 C GLN A 131 -18.313 -4.290 -2.231 1.00 0.00 C ATOM 1973 O GLN A 131 -18.944 -3.244 -2.083 1.00 0.00 O ATOM 1974 CB GLN A 131 -19.239 -5.850 -3.956 1.00 0.00 C ATOM 1975 CG GLN A 131 -19.129 -7.319 -4.370 1.00 0.00 C ATOM 1976 CD GLN A 131 -19.140 -7.442 -5.887 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -18.163 -7.702 -6.587 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -20.354 -7.256 -6.471 1.00 0.00 N ATOM 0 H GLN A 131 -20.861 -4.995 -1.850 1.00 0.00 H new ATOM 0 HA GLN A 131 -18.273 -6.388 -2.135 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -20.239 -5.487 -4.195 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -18.537 -5.261 -4.546 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -18.211 -7.749 -3.970 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -19.958 -7.886 -3.946 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -21.169 -7.040 -5.896 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -20.450 -7.332 -7.484 1.00 0.00 H new ATOM 1987 N VAL A 132 -16.974 -4.326 -2.114 1.00 0.00 N ATOM 1988 CA VAL A 132 -16.116 -3.219 -1.822 1.00 0.00 C ATOM 1989 C VAL A 132 -15.974 -2.508 -3.123 1.00 0.00 C ATOM 1990 O VAL A 132 -15.478 -3.074 -4.097 1.00 0.00 O ATOM 1991 CB VAL A 132 -14.852 -3.789 -1.248 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -13.733 -2.737 -1.185 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -15.285 -4.215 0.165 1.00 0.00 C ATOM 0 H VAL A 132 -16.453 -5.195 -2.233 1.00 0.00 H new ATOM 0 HA VAL A 132 -16.475 -2.501 -1.084 1.00 0.00 H new ATOM 0 HB VAL A 132 -14.442 -4.604 -1.845 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -12.834 -3.187 -0.764 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -13.520 -2.372 -2.190 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -14.051 -1.905 -0.557 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -14.435 -4.652 0.690 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -15.642 -3.344 0.714 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -16.085 -4.952 0.094 1.00 0.00 H new ATOM 2003 N ASN A 133 -16.342 -1.221 -3.247 1.00 0.00 N ATOM 2004 CA ASN A 133 -16.179 -0.498 -4.471 1.00 0.00 C ATOM 2005 C ASN A 133 -14.875 0.207 -4.323 1.00 0.00 C ATOM 2006 O ASN A 133 -14.091 -0.018 -3.402 1.00 0.00 O ATOM 2007 CB ASN A 133 -17.439 0.318 -4.804 1.00 0.00 C ATOM 2008 CG ASN A 133 -17.780 1.410 -3.801 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -16.863 2.009 -3.242 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -19.080 1.755 -3.597 1.00 0.00 N ATOM 0 H ASN A 133 -16.757 -0.676 -2.491 1.00 0.00 H new ATOM 0 HA ASN A 133 -16.108 -1.107 -5.372 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -17.310 0.774 -5.785 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -18.286 -0.364 -4.879 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -19.311 2.525 -2.969 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -19.824 1.244 -4.072 1.00 0.00 H new ATOM 2017 N TYR A 134 -14.557 1.155 -5.223 1.00 0.00 N ATOM 2018 CA TYR A 134 -13.436 2.041 -5.187 1.00 0.00 C ATOM 2019 C TYR A 134 -13.447 2.970 -4.023 1.00 0.00 C ATOM 2020 O TYR A 134 -12.518 3.005 -3.218 1.00 0.00 O ATOM 2021 CB TYR A 134 -13.401 2.801 -6.523 1.00 0.00 C ATOM 2022 CG TYR A 134 -12.118 3.517 -6.766 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -11.008 2.881 -7.271 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -12.014 4.871 -6.547 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -9.808 3.525 -7.460 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -10.832 5.534 -6.782 1.00 0.00 C ATOM 2027 CZ TYR A 134 -9.697 4.867 -7.178 1.00 0.00 C ATOM 2028 OH TYR A 134 -8.487 5.572 -7.347 1.00 0.00 O ATOM 0 H TYR A 134 -15.137 1.313 -6.047 1.00 0.00 H new ATOM 0 HA TYR A 134 -12.528 1.453 -5.054 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -13.575 2.097 -7.337 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -14.219 3.521 -6.544 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -11.082 1.835 -7.529 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -12.871 5.420 -6.186 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -8.953 2.978 -7.830 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -10.795 6.606 -6.652 1.00 0.00 H new ATOM 0 HH TYR A 134 -8.617 6.510 -7.094 1.00 0.00 H new ATOM 2038 N GLU A 135 -14.581 3.655 -3.790 1.00 0.00 N ATOM 2039 CA GLU A 135 -14.610 4.574 -2.694 1.00 0.00 C ATOM 2040 C GLU A 135 -14.542 3.959 -1.339 1.00 0.00 C ATOM 2041 O GLU A 135 -13.869 4.490 -0.457 1.00 0.00 O ATOM 2042 CB GLU A 135 -15.916 5.385 -2.736 1.00 0.00 C ATOM 2043 CG GLU A 135 -15.905 6.398 -3.882 1.00 0.00 C ATOM 2044 CD GLU A 135 -16.994 7.431 -3.634 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -16.831 8.287 -2.724 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -18.017 7.407 -4.370 1.00 0.00 O ATOM 0 H GLU A 135 -15.442 3.580 -4.332 1.00 0.00 H new ATOM 0 HA GLU A 135 -13.713 5.179 -2.827 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -16.763 4.709 -2.854 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -16.054 5.906 -1.789 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -14.932 6.884 -3.947 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -16.073 5.893 -4.833 1.00 0.00 H new ATOM 2053 N GLU A 136 -15.151 2.774 -1.153 1.00 0.00 N ATOM 2054 CA GLU A 136 -15.019 2.026 0.059 1.00 0.00 C ATOM 2055 C GLU A 136 -13.648 1.509 0.329 1.00 0.00 C ATOM 2056 O GLU A 136 -13.215 1.430 1.478 1.00 0.00 O ATOM 2057 CB GLU A 136 -15.918 0.787 0.210 1.00 0.00 C ATOM 2058 CG GLU A 136 -17.374 1.244 0.312 1.00 0.00 C ATOM 2059 CD GLU A 136 -18.444 0.261 -0.143 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -18.144 -0.581 -1.031 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -19.665 0.363 0.148 1.00 0.00 O ATOM 0 H GLU A 136 -15.743 2.329 -1.854 1.00 0.00 H new ATOM 0 HA GLU A 136 -15.320 2.804 0.761 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -15.790 0.122 -0.644 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -15.636 0.222 1.099 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -17.574 1.505 1.351 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -17.483 2.157 -0.273 1.00 0.00 H new ATOM 2068 N PHE A 137 -12.869 1.157 -0.708 1.00 0.00 N ATOM 2069 CA PHE A 137 -11.488 0.788 -0.666 1.00 0.00 C ATOM 2070 C PHE A 137 -10.609 1.949 -0.350 1.00 0.00 C ATOM 2071 O PHE A 137 -9.898 1.971 0.654 1.00 0.00 O ATOM 2072 CB PHE A 137 -11.001 0.016 -1.904 1.00 0.00 C ATOM 2073 CG PHE A 137 -9.651 -0.605 -2.011 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -8.661 0.169 -2.570 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -9.416 -1.931 -1.731 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -7.402 -0.341 -2.787 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -8.161 -2.432 -1.987 1.00 0.00 C ATOM 2078 CZ PHE A 137 -7.171 -1.679 -2.572 1.00 0.00 C ATOM 0 H PHE A 137 -13.239 1.129 -1.658 1.00 0.00 H new ATOM 0 HA PHE A 137 -11.410 0.079 0.158 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -11.721 -0.786 -2.067 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -11.091 0.701 -2.747 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -8.875 1.192 -2.842 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -10.193 -2.560 -1.323 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -6.603 0.303 -3.123 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -7.945 -3.456 -1.718 1.00 0.00 H new ATOM 0 HZ PHE A 137 -6.231 -2.129 -2.857 1.00 0.00 H new ATOM 2088 N VAL A 138 -10.596 2.967 -1.229 1.00 0.00 N ATOM 2089 CA VAL A 138 -9.731 4.105 -1.261 1.00 0.00 C ATOM 2090 C VAL A 138 -9.731 4.831 0.041 1.00 0.00 C ATOM 2091 O VAL A 138 -8.675 5.301 0.460 1.00 0.00 O ATOM 2092 CB VAL A 138 -9.942 4.988 -2.455 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -9.187 6.320 -2.310 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -9.501 4.237 -3.723 1.00 0.00 C ATOM 0 H VAL A 138 -11.265 2.992 -1.999 1.00 0.00 H new ATOM 0 HA VAL A 138 -8.718 3.725 -1.396 1.00 0.00 H new ATOM 0 HB VAL A 138 -11.002 5.231 -2.531 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -9.362 6.935 -3.193 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -9.544 6.846 -1.424 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -8.119 6.124 -2.210 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -9.652 4.874 -4.594 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -8.446 3.976 -3.643 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -10.092 3.328 -3.831 1.00 0.00 H new ATOM 2104 N GLN A 139 -10.885 4.918 0.727 1.00 0.00 N ATOM 2105 CA GLN A 139 -11.028 5.510 2.021 1.00 0.00 C ATOM 2106 C GLN A 139 -10.346 4.829 3.157 1.00 0.00 C ATOM 2107 O GLN A 139 -9.582 5.435 3.906 1.00 0.00 O ATOM 2108 CB GLN A 139 -12.474 5.417 2.535 1.00 0.00 C ATOM 2109 CG GLN A 139 -12.926 5.974 3.886 1.00 0.00 C ATOM 2110 CD GLN A 139 -12.649 7.470 3.913 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -11.547 7.939 4.193 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -13.750 8.208 3.609 1.00 0.00 N ATOM 0 H GLN A 139 -11.765 4.556 0.359 1.00 0.00 H new ATOM 0 HA GLN A 139 -10.621 6.500 1.817 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -13.099 5.895 1.781 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -12.731 4.358 2.538 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -13.989 5.783 4.037 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -12.394 5.476 4.697 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -14.630 7.743 3.387 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -13.695 9.227 3.603 1.00 0.00 H new ATOM 2121 N MET A 140 -10.499 3.505 3.343 1.00 0.00 N ATOM 2122 CA MET A 140 -10.060 2.787 4.499 1.00 0.00 C ATOM 2123 C MET A 140 -8.604 2.471 4.457 1.00 0.00 C ATOM 2124 O MET A 140 -7.941 2.227 5.464 1.00 0.00 O ATOM 2125 CB MET A 140 -10.788 1.450 4.714 1.00 0.00 C ATOM 2126 CG MET A 140 -10.652 0.303 3.710 1.00 0.00 C ATOM 2127 SD MET A 140 -11.205 -1.359 4.198 1.00 0.00 S ATOM 2128 CE MET A 140 -11.741 -1.600 2.479 1.00 0.00 C ATOM 0 H MET A 140 -10.952 2.906 2.652 1.00 0.00 H new ATOM 0 HA MET A 140 -10.291 3.468 5.318 1.00 0.00 H new ATOM 0 HB2 MET A 140 -10.468 1.065 5.682 1.00 0.00 H new ATOM 0 HB3 MET A 140 -11.851 1.676 4.797 1.00 0.00 H new ATOM 0 HG2 MET A 140 -11.203 0.583 2.812 1.00 0.00 H new ATOM 0 HG3 MET A 140 -9.601 0.232 3.430 1.00 0.00 H new ATOM 0 HE1 MET A 140 -12.076 -2.628 2.343 1.00 0.00 H new ATOM 0 HE2 MET A 140 -12.562 -0.919 2.255 1.00 0.00 H new ATOM 0 HE3 MET A 140 -10.908 -1.398 1.806 1.00 0.00 H new ATOM 2138 N MET A 141 -8.074 2.485 3.221 1.00 0.00 N ATOM 2139 CA MET A 141 -6.676 2.359 2.947 1.00 0.00 C ATOM 2140 C MET A 141 -5.951 3.650 3.110 1.00 0.00 C ATOM 2141 O MET A 141 -4.761 3.684 3.419 1.00 0.00 O ATOM 2142 CB MET A 141 -6.325 1.908 1.519 1.00 0.00 C ATOM 2143 CG MET A 141 -6.813 0.515 1.114 1.00 0.00 C ATOM 2144 SD MET A 141 -6.578 -0.809 2.337 1.00 0.00 S ATOM 2145 CE MET A 141 -7.423 -2.090 1.368 1.00 0.00 C ATOM 0 H MET A 141 -8.641 2.588 2.380 1.00 0.00 H new ATOM 0 HA MET A 141 -6.374 1.599 3.668 1.00 0.00 H new ATOM 0 HB2 MET A 141 -6.739 2.634 0.819 1.00 0.00 H new ATOM 0 HB3 MET A 141 -5.241 1.938 1.406 1.00 0.00 H new ATOM 0 HG2 MET A 141 -7.876 0.580 0.880 1.00 0.00 H new ATOM 0 HG3 MET A 141 -6.301 0.227 0.196 1.00 0.00 H new ATOM 0 HE1 MET A 141 -7.336 -3.049 1.879 1.00 0.00 H new ATOM 0 HE2 MET A 141 -8.476 -1.830 1.261 1.00 0.00 H new ATOM 0 HE3 MET A 141 -6.965 -2.162 0.382 1.00 0.00 H new ATOM 2155 N THR A 142 -6.627 4.805 2.979 1.00 0.00 N ATOM 2156 CA THR A 142 -6.008 6.090 3.080 1.00 0.00 C ATOM 2157 C THR A 142 -6.184 6.709 4.459 1.00 0.00 C ATOM 2158 O THR A 142 -5.240 6.561 5.280 1.00 0.00 O ATOM 2159 CB THR A 142 -6.356 7.006 1.945 1.00 0.00 C ATOM 2160 OG1 THR A 142 -6.307 6.298 0.715 1.00 0.00 O ATOM 2161 CG2 THR A 142 -5.420 8.214 1.772 1.00 0.00 C ATOM 0 H THR A 142 -7.630 4.847 2.798 1.00 0.00 H new ATOM 0 HA THR A 142 -4.936 5.927 2.972 1.00 0.00 H new ATOM 0 HB THR A 142 -7.351 7.374 2.197 1.00 0.00 H new ATOM 0 HG1 THR A 142 -7.219 6.144 0.390 1.00 0.00 H new ATOM 0 HG21 THR A 142 -5.754 8.815 0.926 1.00 0.00 H new ATOM 0 HG22 THR A 142 -5.437 8.820 2.678 1.00 0.00 H new ATOM 0 HG23 THR A 142 -4.404 7.864 1.589 1.00 0.00 H new ATOM 2170 N ARG B 1 -10.113 -4.876 10.248 1.00 0.00 N ATOM 2171 CA ARG B 1 -9.089 -3.948 9.718 1.00 0.00 C ATOM 2172 C ARG B 1 -7.948 -4.617 9.033 1.00 0.00 C ATOM 2173 O ARG B 1 -7.761 -4.514 7.821 1.00 0.00 O ATOM 2174 CB ARG B 1 -8.577 -2.875 10.694 1.00 0.00 C ATOM 2175 CG ARG B 1 -7.533 -1.913 10.124 1.00 0.00 C ATOM 2176 CD ARG B 1 -6.860 -0.934 11.089 1.00 0.00 C ATOM 2177 NE ARG B 1 -5.834 -0.132 10.366 1.00 0.00 N ATOM 2178 CZ ARG B 1 -6.046 0.986 9.613 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -7.271 1.539 9.375 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -4.913 1.707 9.365 1.00 0.00 N ATOM 0 H1 ARG B 1 -10.989 -4.351 10.444 1.00 0.00 H new ATOM 0 H2 ARG B 1 -10.305 -5.619 9.546 1.00 0.00 H new ATOM 0 H3 ARG B 1 -9.766 -5.311 11.127 1.00 0.00 H new ATOM 0 HA ARG B 1 -9.665 -3.412 8.964 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -9.428 -2.293 11.046 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -8.150 -3.374 11.564 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -6.751 -2.509 9.653 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -8.010 -1.331 9.335 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -7.607 -0.273 11.529 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -6.395 -1.481 11.909 1.00 0.00 H new ATOM 0 HE ARG B 1 -4.869 -0.453 10.442 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -8.109 1.113 9.772 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -7.349 2.378 8.800 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -4.016 1.391 9.734 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -4.963 2.562 8.810 1.00 0.00 H new ATOM 2193 N ARG B 2 -7.025 -5.272 9.759 1.00 0.00 N ATOM 2194 CA ARG B 2 -5.653 -5.409 9.377 1.00 0.00 C ATOM 2195 C ARG B 2 -5.434 -6.202 8.135 1.00 0.00 C ATOM 2196 O ARG B 2 -4.505 -5.963 7.365 1.00 0.00 O ATOM 2197 CB ARG B 2 -4.812 -6.066 10.484 1.00 0.00 C ATOM 2198 CG ARG B 2 -4.615 -5.109 11.661 1.00 0.00 C ATOM 2199 CD ARG B 2 -3.741 -5.718 12.759 1.00 0.00 C ATOM 2200 NE ARG B 2 -3.068 -4.640 13.536 1.00 0.00 N ATOM 2201 CZ ARG B 2 -2.246 -4.996 14.566 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -1.952 -6.295 14.866 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -1.778 -3.973 15.339 1.00 0.00 N ATOM 0 H ARG B 2 -7.242 -5.724 10.647 1.00 0.00 H new ATOM 0 HA ARG B 2 -5.338 -4.382 9.195 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -5.304 -6.976 10.828 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -3.842 -6.360 10.083 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -4.157 -4.186 11.304 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -5.586 -4.843 12.078 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -4.352 -6.329 13.424 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -2.995 -6.378 12.316 1.00 0.00 H new ATOM 0 HE ARG B 2 -3.218 -3.658 13.304 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -2.353 -7.050 14.310 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -1.332 -6.510 15.646 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -2.047 -3.012 15.130 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -1.159 -4.170 16.125 1.00 0.00 H new ATOM 2217 N LYS B 3 -6.287 -7.217 7.911 1.00 0.00 N ATOM 2218 CA LYS B 3 -6.232 -8.074 6.768 1.00 0.00 C ATOM 2219 C LYS B 3 -6.450 -7.357 5.480 1.00 0.00 C ATOM 2220 O LYS B 3 -5.826 -7.654 4.462 1.00 0.00 O ATOM 2221 CB LYS B 3 -7.439 -9.015 6.923 1.00 0.00 C ATOM 2222 CG LYS B 3 -7.200 -9.978 8.088 1.00 0.00 C ATOM 2223 CD LYS B 3 -6.420 -11.244 7.732 1.00 0.00 C ATOM 2224 CE LYS B 3 -6.603 -12.263 8.858 1.00 0.00 C ATOM 2225 NZ LYS B 3 -5.658 -13.394 8.716 1.00 0.00 N ATOM 0 H LYS B 3 -7.045 -7.450 8.552 1.00 0.00 H new ATOM 0 HA LYS B 3 -5.251 -8.548 6.732 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -8.344 -8.434 7.099 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -7.595 -9.576 6.002 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -6.662 -9.447 8.874 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -8.165 -10.269 8.503 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -6.777 -11.655 6.788 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -5.363 -11.012 7.599 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -6.449 -11.776 9.821 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -7.627 -12.638 8.850 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -5.861 -14.110 9.443 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -5.764 -13.819 7.773 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -4.684 -13.049 8.833 1.00 0.00 H new ATOM 2239 N TRP B 4 -7.244 -6.271 5.474 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.306 -5.412 4.333 1.00 0.00 C ATOM 2241 C TRP B 4 -6.038 -4.691 4.031 1.00 0.00 C ATOM 2242 O TRP B 4 -5.588 -4.511 2.900 1.00 0.00 O ATOM 2243 CB TRP B 4 -8.387 -4.322 4.429 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.817 -4.806 4.377 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.732 -5.130 5.337 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -10.419 -5.020 3.087 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.907 -5.486 4.729 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -11.698 -5.514 3.370 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -10.012 -4.952 1.782 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -12.520 -5.901 2.348 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -10.864 -5.408 0.804 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -12.102 -5.958 1.039 1.00 0.00 C ATOM 0 H TRP B 4 -7.839 -5.989 6.253 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.537 -6.124 3.541 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -8.242 -3.775 5.361 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -8.234 -3.613 3.616 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -10.558 -5.109 6.403 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.786 -5.694 5.203 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -9.043 -4.549 1.526 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -13.539 -6.173 2.578 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -10.537 -5.328 -0.222 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -12.700 -6.401 0.256 1.00 0.00 H new ATOM 2263 N GLN B 5 -5.468 -4.122 5.108 1.00 0.00 N ATOM 2264 CA GLN B 5 -4.354 -3.228 5.029 1.00 0.00 C ATOM 2265 C GLN B 5 -3.115 -3.892 4.534 1.00 0.00 C ATOM 2266 O GLN B 5 -2.518 -3.486 3.539 1.00 0.00 O ATOM 2267 CB GLN B 5 -4.095 -2.626 6.420 1.00 0.00 C ATOM 2268 CG GLN B 5 -5.324 -1.914 6.989 1.00 0.00 C ATOM 2269 CD GLN B 5 -5.819 -0.733 6.166 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -5.166 -0.223 5.258 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -7.086 -0.339 6.466 1.00 0.00 N ATOM 0 H GLN B 5 -5.791 -4.288 6.061 1.00 0.00 H new ATOM 0 HA GLN B 5 -4.607 -2.450 4.309 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -3.789 -3.418 7.104 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -3.267 -1.920 6.358 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -6.134 -2.637 7.083 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -5.090 -1.565 7.995 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -7.593 -0.789 7.228 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -7.529 0.406 5.929 1.00 0.00 H new ATOM 2280 N LYS B 6 -2.645 -4.895 5.297 1.00 0.00 N ATOM 2281 CA LYS B 6 -1.459 -5.647 5.025 1.00 0.00 C ATOM 2282 C LYS B 6 -1.342 -6.198 3.646 1.00 0.00 C ATOM 2283 O LYS B 6 -0.319 -6.389 2.989 1.00 0.00 O ATOM 2284 CB LYS B 6 -1.275 -6.720 6.111 1.00 0.00 C ATOM 2285 CG LYS B 6 -2.173 -7.949 5.956 1.00 0.00 C ATOM 2286 CD LYS B 6 -2.296 -8.802 7.221 1.00 0.00 C ATOM 2287 CE LYS B 6 -1.063 -9.575 7.694 1.00 0.00 C ATOM 2288 NZ LYS B 6 -1.325 -10.262 8.978 1.00 0.00 N ATOM 0 H LYS B 6 -3.118 -5.197 6.149 1.00 0.00 H new ATOM 0 HA LYS B 6 -0.633 -4.937 5.063 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -0.235 -7.045 6.109 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -1.466 -6.268 7.085 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -3.168 -7.622 5.654 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -1.783 -8.570 5.149 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -2.611 -8.148 8.034 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -3.099 -9.522 7.061 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -0.777 -10.307 6.938 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -0.223 -8.890 7.809 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -0.458 -10.736 9.301 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -1.624 -9.565 9.690 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -2.077 -10.968 8.847 1.00 0.00 H new ATOM 2302 N THR B 7 -2.512 -6.552 3.085 1.00 0.00 N ATOM 2303 CA THR B 7 -2.776 -7.004 1.754 1.00 0.00 C ATOM 2304 C THR B 7 -2.398 -5.940 0.782 1.00 0.00 C ATOM 2305 O THR B 7 -1.514 -6.248 -0.015 1.00 0.00 O ATOM 2306 CB THR B 7 -4.154 -7.507 1.439 1.00 0.00 C ATOM 2307 OG1 THR B 7 -4.420 -8.616 2.285 1.00 0.00 O ATOM 2308 CG2 THR B 7 -4.161 -8.087 0.015 1.00 0.00 C ATOM 0 H THR B 7 -3.372 -6.516 3.632 1.00 0.00 H new ATOM 0 HA THR B 7 -2.158 -7.898 1.666 1.00 0.00 H new ATOM 0 HB THR B 7 -4.871 -6.695 1.558 1.00 0.00 H new ATOM 0 HG1 THR B 7 -4.932 -8.317 3.065 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.159 -8.455 -0.223 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.882 -7.309 -0.696 1.00 0.00 H new ATOM 0 HG23 THR B 7 -3.447 -8.908 -0.047 1.00 0.00 H new ATOM 2316 N GLY B 8 -3.149 -4.824 0.772 1.00 0.00 N ATOM 2317 CA GLY B 8 -3.026 -3.644 -0.025 1.00 0.00 C ATOM 2318 C GLY B 8 -1.664 -3.051 0.095 1.00 0.00 C ATOM 2319 O GLY B 8 -1.165 -2.569 -0.920 1.00 0.00 O ATOM 0 H GLY B 8 -3.944 -4.744 1.407 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -3.230 -3.884 -1.068 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -3.772 -2.913 0.286 1.00 0.00 H new ATOM 2323 N HIS B 9 -1.083 -2.956 1.304 1.00 0.00 N ATOM 2324 CA HIS B 9 0.231 -2.425 1.501 1.00 0.00 C ATOM 2325 C HIS B 9 1.317 -3.122 0.755 1.00 0.00 C ATOM 2326 O HIS B 9 2.156 -2.500 0.107 1.00 0.00 O ATOM 2327 CB HIS B 9 0.572 -2.437 3.000 1.00 0.00 C ATOM 2328 CG HIS B 9 1.220 -1.159 3.446 1.00 0.00 C ATOM 2329 ND1 HIS B 9 0.469 -0.019 3.648 1.00 0.00 N ATOM 2330 CD2 HIS B 9 2.461 -0.899 3.937 1.00 0.00 C ATOM 2331 CE1 HIS B 9 1.294 0.939 4.149 1.00 0.00 C ATOM 2332 NE2 HIS B 9 2.490 0.418 4.350 1.00 0.00 N ATOM 0 H HIS B 9 -1.537 -3.256 2.167 1.00 0.00 H new ATOM 0 HA HIS B 9 0.193 -1.413 1.098 1.00 0.00 H new ATOM 0 HB2 HIS B 9 -0.339 -2.601 3.576 1.00 0.00 H new ATOM 0 HB3 HIS B 9 1.238 -3.273 3.212 1.00 0.00 H new ATOM 0 HD2 HIS B 9 3.281 -1.600 3.994 1.00 0.00 H new ATOM 0 HE1 HIS B 9 1.015 1.963 4.350 1.00 0.00 H new ATOM 0 HE2 HIS B 9 3.296 0.904 4.743 1.00 0.00 H new ATOM 2340 N ALA B 10 1.333 -4.466 0.796 1.00 0.00 N ATOM 2341 CA ALA B 10 2.294 -5.268 0.103 1.00 0.00 C ATOM 2342 C ALA B 10 2.210 -5.000 -1.360 1.00 0.00 C ATOM 2343 O ALA B 10 3.244 -4.975 -2.026 1.00 0.00 O ATOM 2344 CB ALA B 10 1.992 -6.748 0.393 1.00 0.00 C ATOM 0 H ALA B 10 0.656 -5.013 1.328 1.00 0.00 H new ATOM 0 HA ALA B 10 3.302 -5.026 0.440 1.00 0.00 H new ATOM 0 HB1 ALA B 10 2.715 -7.376 -0.128 1.00 0.00 H new ATOM 0 HB2 ALA B 10 2.059 -6.930 1.466 1.00 0.00 H new ATOM 0 HB3 ALA B 10 0.987 -6.989 0.047 1.00 0.00 H new ATOM 2350 N VAL B 11 1.018 -4.684 -1.897 1.00 0.00 N ATOM 2351 CA VAL B 11 0.753 -4.478 -3.287 1.00 0.00 C ATOM 2352 C VAL B 11 1.346 -3.163 -3.662 1.00 0.00 C ATOM 2353 O VAL B 11 2.098 -2.969 -4.617 1.00 0.00 O ATOM 2354 CB VAL B 11 -0.717 -4.423 -3.578 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -0.959 -4.120 -5.066 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -1.380 -5.795 -3.368 1.00 0.00 C ATOM 0 H VAL B 11 0.185 -4.565 -1.321 1.00 0.00 H new ATOM 0 HA VAL B 11 1.178 -5.308 -3.851 1.00 0.00 H new ATOM 0 HB VAL B 11 -1.125 -3.661 -2.914 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -2.031 -4.084 -5.260 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -0.511 -3.159 -5.319 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -0.506 -4.903 -5.675 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -2.445 -5.722 -3.587 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -0.922 -6.526 -4.034 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -1.243 -6.111 -2.334 1.00 0.00 H new ATOM 2366 N ARG B 12 0.987 -2.083 -2.946 1.00 0.00 N ATOM 2367 CA ARG B 12 1.549 -0.782 -3.138 1.00 0.00 C ATOM 2368 C ARG B 12 3.024 -0.671 -2.958 1.00 0.00 C ATOM 2369 O ARG B 12 3.706 0.021 -3.713 1.00 0.00 O ATOM 2370 CB ARG B 12 0.876 0.064 -2.044 1.00 0.00 C ATOM 2371 CG ARG B 12 -0.592 0.395 -2.321 1.00 0.00 C ATOM 2372 CD ARG B 12 -1.227 0.886 -1.018 1.00 0.00 C ATOM 2373 NE ARG B 12 -0.548 2.166 -0.670 1.00 0.00 N ATOM 2374 CZ ARG B 12 -0.953 3.023 0.313 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -1.877 2.614 1.230 1.00 0.00 N ATOM 2376 NH2 ARG B 12 -0.449 4.289 0.391 1.00 0.00 N ATOM 0 H ARG B 12 0.282 -2.116 -2.209 1.00 0.00 H new ATOM 0 HA ARG B 12 1.379 -0.477 -4.171 1.00 0.00 H new ATOM 0 HB2 ARG B 12 0.944 -0.469 -1.095 1.00 0.00 H new ATOM 0 HB3 ARG B 12 1.431 0.995 -1.927 1.00 0.00 H new ATOM 0 HG2 ARG B 12 -0.670 1.160 -3.093 1.00 0.00 H new ATOM 0 HG3 ARG B 12 -1.117 -0.486 -2.691 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -2.299 1.037 -1.142 1.00 0.00 H new ATOM 0 HD3 ARG B 12 -1.099 0.151 -0.223 1.00 0.00 H new ATOM 0 HE ARG B 12 0.281 2.421 -1.206 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -2.263 1.671 1.180 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -2.182 3.251 1.966 1.00 0.00 H new ATOM 0 HH21 ARG B 12 0.240 4.607 -0.291 1.00 0.00 H new ATOM 0 HH22 ARG B 12 -0.761 4.918 1.131 1.00 0.00 H new ATOM 2390 N ALA B 13 3.638 -1.441 -2.043 1.00 0.00 N ATOM 2391 CA ALA B 13 5.052 -1.648 -1.983 1.00 0.00 C ATOM 2392 C ALA B 13 5.683 -2.282 -3.175 1.00 0.00 C ATOM 2393 O ALA B 13 6.689 -1.826 -3.716 1.00 0.00 O ATOM 2394 CB ALA B 13 5.310 -2.456 -0.700 1.00 0.00 C ATOM 0 H ALA B 13 3.128 -1.940 -1.314 1.00 0.00 H new ATOM 0 HA ALA B 13 5.534 -0.670 -1.974 1.00 0.00 H new ATOM 0 HB1 ALA B 13 6.378 -2.646 -0.599 1.00 0.00 H new ATOM 0 HB2 ALA B 13 4.959 -1.890 0.163 1.00 0.00 H new ATOM 0 HB3 ALA B 13 4.776 -3.405 -0.754 1.00 0.00 H new ATOM 2400 N ILE B 14 5.142 -3.387 -3.719 1.00 0.00 N ATOM 2401 CA ILE B 14 5.579 -4.049 -4.909 1.00 0.00 C ATOM 2402 C ILE B 14 5.655 -3.088 -6.045 1.00 0.00 C ATOM 2403 O ILE B 14 6.639 -3.044 -6.781 1.00 0.00 O ATOM 2404 CB ILE B 14 4.666 -5.224 -5.098 1.00 0.00 C ATOM 2405 CG1 ILE B 14 5.253 -6.373 -4.261 1.00 0.00 C ATOM 2406 CG2 ILE B 14 4.549 -5.596 -6.586 1.00 0.00 C ATOM 2407 CD1 ILE B 14 4.371 -7.615 -4.144 1.00 0.00 C ATOM 0 H ILE B 14 4.339 -3.851 -3.294 1.00 0.00 H new ATOM 0 HA ILE B 14 6.597 -4.432 -4.842 1.00 0.00 H new ATOM 0 HB ILE B 14 3.652 -4.996 -4.769 1.00 0.00 H new ATOM 0 HG12 ILE B 14 6.208 -6.666 -4.697 1.00 0.00 H new ATOM 0 HG13 ILE B 14 5.461 -6.000 -3.258 1.00 0.00 H new ATOM 0 HG21 ILE B 14 3.882 -6.451 -6.696 1.00 0.00 H new ATOM 0 HG22 ILE B 14 4.148 -4.749 -7.142 1.00 0.00 H new ATOM 0 HG23 ILE B 14 5.534 -5.853 -6.975 1.00 0.00 H new ATOM 0 HD11 ILE B 14 4.876 -8.364 -3.535 1.00 0.00 H new ATOM 0 HD12 ILE B 14 3.424 -7.346 -3.677 1.00 0.00 H new ATOM 0 HD13 ILE B 14 4.183 -8.022 -5.137 1.00 0.00 H new ATOM 2419 N GLY B 15 4.604 -2.285 -6.295 1.00 0.00 N ATOM 2420 CA GLY B 15 4.576 -1.409 -7.425 1.00 0.00 C ATOM 2421 C GLY B 15 5.502 -0.248 -7.302 1.00 0.00 C ATOM 2422 O GLY B 15 5.848 0.302 -8.346 1.00 0.00 O ATOM 0 H GLY B 15 3.769 -2.243 -5.710 1.00 0.00 H new ATOM 0 HA2 GLY B 15 4.834 -1.975 -8.320 1.00 0.00 H new ATOM 0 HA3 GLY B 15 3.560 -1.040 -7.563 1.00 0.00 H new ATOM 2426 N ARG B 16 5.948 0.128 -6.090 1.00 0.00 N ATOM 2427 CA ARG B 16 6.820 1.221 -5.793 1.00 0.00 C ATOM 2428 C ARG B 16 8.195 0.648 -5.849 1.00 0.00 C ATOM 2429 O ARG B 16 9.037 1.340 -6.418 1.00 0.00 O ATOM 2430 CB ARG B 16 6.503 1.650 -4.350 1.00 0.00 C ATOM 2431 CG ARG B 16 5.364 2.663 -4.223 1.00 0.00 C ATOM 2432 CD ARG B 16 4.742 2.991 -2.865 1.00 0.00 C ATOM 2433 NE ARG B 16 5.532 4.030 -2.145 1.00 0.00 N ATOM 2434 CZ ARG B 16 5.074 4.839 -1.145 1.00 0.00 C ATOM 2435 NH1 ARG B 16 3.780 4.854 -0.710 1.00 0.00 N ATOM 2436 NH2 ARG B 16 5.891 5.708 -0.482 1.00 0.00 N ATOM 0 H ARG B 16 5.674 -0.377 -5.247 1.00 0.00 H new ATOM 0 HA ARG B 16 6.716 2.070 -6.469 1.00 0.00 H new ATOM 0 HB2 ARG B 16 6.250 0.763 -3.769 1.00 0.00 H new ATOM 0 HB3 ARG B 16 7.402 2.076 -3.906 1.00 0.00 H new ATOM 0 HG2 ARG B 16 5.725 3.602 -4.643 1.00 0.00 H new ATOM 0 HG3 ARG B 16 4.556 2.316 -4.867 1.00 0.00 H new ATOM 0 HD2 ARG B 16 3.719 3.341 -3.006 1.00 0.00 H new ATOM 0 HD3 ARG B 16 4.689 2.087 -2.259 1.00 0.00 H new ATOM 0 HE ARG B 16 6.506 4.148 -2.426 1.00 0.00 H new ATOM 0 HH11 ARG B 16 3.091 4.235 -1.138 1.00 0.00 H new ATOM 0 HH12 ARG B 16 3.502 5.484 0.043 1.00 0.00 H new ATOM 0 HH21 ARG B 16 6.879 5.768 -0.729 1.00 0.00 H new ATOM 0 HH22 ARG B 16 5.514 6.297 0.260 1.00 0.00 H new