USER MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 586 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 55 THR OG1 : rot -76:sc= 2.29 USER MOD Set 1.2: A 57 SER OG : rot -17:sc= 1.12 USER MOD Set 2.1: A 7 THR OG1 : rot -69:sc= 1.31 USER MOD Set 2.2: A 9 THR OG1 : rot 41:sc= 0.525 USER MOD Single : A 1 MET CE :methyl 177:sc= -0.323 (180deg=-0.339) USER MOD Single : A 1 MET N :NH3+ -152:sc= 2.44 (180deg=2.21) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -176:sc= 1.01 (180deg=0.916) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= -0.16 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 ASN : amide:sc= -0.997! K(o=-1!,f=-0.37) USER MOD Single : A 27 LYS NZ :NH3+ -149:sc= 0.947 (180deg=0.885) USER MOD Single : A 29 LYS NZ :NH3+ 178:sc= 1.24 (180deg=1.19) USER MOD Single : A 31 GLN : amide:sc= -0.84 K(o=-0.84,f=-2.3) USER MOD Single : A 33 LYS NZ :NH3+ 163:sc= 1.33 (180deg=1.2) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 41 GLN : amide:sc= -0.167 K(o=-0.17,f=-2!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 GLN : amide:sc= -1.11 K(o=-1.1,f=0) USER MOD Single : A 59 TYR OH : rot 90:sc= 0.0722 USER MOD Single : A 60 ASN : amide:sc= -0.0037 X(o=-0.0037,f=0.47) USER MOD Single : A 62 GLN : amide:sc= -0.19 X(o=-0.19,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 94:sc= 0.501 USER MOD Single : A 66 THR OG1 : rot -84:sc= 1.17 USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.936 30.731 16.333 1.00 0.00 N ATOM 2 CA MET A 1 13.809 30.356 17.757 1.00 0.00 C ATOM 3 C MET A 1 15.096 30.738 18.491 1.00 0.00 C ATOM 4 O MET A 1 16.117 30.318 17.957 1.00 0.00 O ATOM 5 CB MET A 1 13.637 28.843 17.828 1.00 0.00 C ATOM 6 CG MET A 1 13.404 28.227 19.214 1.00 0.00 C ATOM 7 SD MET A 1 13.729 26.454 19.293 1.00 0.00 S ATOM 8 CE MET A 1 15.529 26.316 19.243 1.00 0.00 C ATOM 0 H1 MET A 1 12.993 30.929 15.941 1.00 0.00 H new ATOM 0 H2 MET A 1 14.531 31.580 16.249 1.00 0.00 H new ATOM 0 H3 MET A 1 14.373 29.948 15.806 1.00 0.00 H new ATOM 0 HA MET A 1 12.960 30.866 18.213 1.00 0.00 H new ATOM 0 HB2 MET A 1 12.796 28.569 17.191 1.00 0.00 H new ATOM 0 HB3 MET A 1 14.526 28.382 17.399 1.00 0.00 H new ATOM 0 HG2 MET A 1 14.041 28.735 19.938 1.00 0.00 H new ATOM 0 HG3 MET A 1 12.372 28.411 19.513 1.00 0.00 H new ATOM 0 HE1 MET A 1 15.816 25.269 19.340 1.00 0.00 H new ATOM 0 HE2 MET A 1 15.898 26.707 18.295 1.00 0.00 H new ATOM 0 HE3 MET A 1 15.961 26.889 20.064 1.00 0.00 H new ATOM 20 N GLN A 2 15.049 31.357 19.669 1.00 0.00 N ATOM 21 CA GLN A 2 16.240 31.754 20.403 1.00 0.00 C ATOM 22 C GLN A 2 16.814 30.700 21.340 1.00 0.00 C ATOM 23 O GLN A 2 16.163 30.118 22.208 1.00 0.00 O ATOM 24 CB GLN A 2 15.931 32.934 21.324 1.00 0.00 C ATOM 25 CG GLN A 2 15.527 34.224 20.612 1.00 0.00 C ATOM 26 CD GLN A 2 15.486 35.398 21.591 1.00 0.00 C ATOM 27 OE1 GLN A 2 15.250 35.254 22.782 1.00 0.00 O ATOM 28 NE2 GLN A 2 15.773 36.588 21.063 1.00 0.00 N ATOM 0 H GLN A 2 14.177 31.597 20.140 1.00 0.00 H new ATOM 0 HA GLN A 2 16.956 31.969 19.610 1.00 0.00 H new ATOM 0 HB2 GLN A 2 15.128 32.645 22.002 1.00 0.00 H new ATOM 0 HB3 GLN A 2 16.809 33.136 21.937 1.00 0.00 H new ATOM 0 HG2 GLN A 2 16.234 34.438 19.810 1.00 0.00 H new ATOM 0 HG3 GLN A 2 14.549 34.097 20.149 1.00 0.00 H new ATOM 0 HE21 GLN A 2 15.965 36.670 20.065 1.00 0.00 H new ATOM 0 HE22 GLN A 2 15.801 37.416 21.658 1.00 0.00 H new ATOM 37 N ILE A 3 18.119 30.542 21.151 1.00 0.00 N ATOM 38 CA ILE A 3 18.995 30.034 22.189 1.00 0.00 C ATOM 39 C ILE A 3 20.011 31.089 22.620 1.00 0.00 C ATOM 40 O ILE A 3 20.089 32.154 22.008 1.00 0.00 O ATOM 41 CB ILE A 3 19.589 28.751 21.599 1.00 0.00 C ATOM 42 CG1 ILE A 3 20.741 29.025 20.626 1.00 0.00 C ATOM 43 CG2 ILE A 3 18.642 27.723 20.980 1.00 0.00 C ATOM 44 CD1 ILE A 3 21.392 27.847 19.891 1.00 0.00 C ATOM 0 H ILE A 3 18.594 30.763 20.276 1.00 0.00 H new ATOM 0 HA ILE A 3 18.483 29.802 23.123 1.00 0.00 H new ATOM 0 HB ILE A 3 19.945 28.272 22.511 1.00 0.00 H new ATOM 0 HG12 ILE A 3 20.375 29.721 19.872 1.00 0.00 H new ATOM 0 HG13 ILE A 3 21.525 29.540 21.181 1.00 0.00 H new ATOM 0 HG21 ILE A 3 19.218 26.875 20.609 1.00 0.00 H new ATOM 0 HG22 ILE A 3 17.935 27.379 21.735 1.00 0.00 H new ATOM 0 HG23 ILE A 3 18.097 28.181 20.154 1.00 0.00 H new ATOM 0 HD11 ILE A 3 22.188 28.217 19.244 1.00 0.00 H new ATOM 0 HD12 ILE A 3 21.810 27.151 20.618 1.00 0.00 H new ATOM 0 HD13 ILE A 3 20.642 27.335 19.288 1.00 0.00 H new ATOM 56 N PHE A 4 20.798 30.769 23.641 1.00 0.00 N ATOM 57 CA PHE A 4 21.937 31.583 23.981 1.00 0.00 C ATOM 58 C PHE A 4 23.129 30.807 24.557 1.00 0.00 C ATOM 59 O PHE A 4 22.976 29.788 25.238 1.00 0.00 O ATOM 60 CB PHE A 4 21.532 32.842 24.763 1.00 0.00 C ATOM 61 CG PHE A 4 20.922 32.650 26.126 1.00 0.00 C ATOM 62 CD1 PHE A 4 21.727 32.675 27.276 1.00 0.00 C ATOM 63 CD2 PHE A 4 19.532 32.683 26.279 1.00 0.00 C ATOM 64 CE1 PHE A 4 21.182 32.912 28.547 1.00 0.00 C ATOM 65 CE2 PHE A 4 18.974 32.948 27.539 1.00 0.00 C ATOM 66 CZ PHE A 4 19.812 33.173 28.626 1.00 0.00 C ATOM 0 H PHE A 4 20.661 29.954 24.239 1.00 0.00 H new ATOM 0 HA PHE A 4 22.341 31.949 23.037 1.00 0.00 H new ATOM 0 HB2 PHE A 4 22.418 33.466 24.877 1.00 0.00 H new ATOM 0 HB3 PHE A 4 20.823 33.402 24.154 1.00 0.00 H new ATOM 0 HD1 PHE A 4 22.790 32.508 27.180 1.00 0.00 H new ATOM 0 HD2 PHE A 4 18.890 32.505 25.429 1.00 0.00 H new ATOM 0 HE1 PHE A 4 21.800 32.893 29.433 1.00 0.00 H new ATOM 0 HE2 PHE A 4 17.902 32.977 27.664 1.00 0.00 H new ATOM 0 HZ PHE A 4 19.397 33.556 29.546 1.00 0.00 H new ATOM 76 N VAL A 5 24.280 31.309 24.152 1.00 0.00 N ATOM 77 CA VAL A 5 25.590 30.693 24.047 1.00 0.00 C ATOM 78 C VAL A 5 26.439 31.356 25.134 1.00 0.00 C ATOM 79 O VAL A 5 26.909 32.477 24.949 1.00 0.00 O ATOM 80 CB VAL A 5 26.067 30.794 22.598 1.00 0.00 C ATOM 81 CG1 VAL A 5 27.418 30.093 22.507 1.00 0.00 C ATOM 82 CG2 VAL A 5 25.109 30.254 21.536 1.00 0.00 C ATOM 0 H VAL A 5 24.323 32.282 23.851 1.00 0.00 H new ATOM 0 HA VAL A 5 25.632 29.621 24.239 1.00 0.00 H new ATOM 0 HB VAL A 5 26.131 31.857 22.364 1.00 0.00 H new ATOM 0 HG11 VAL A 5 27.788 30.147 21.483 1.00 0.00 H new ATOM 0 HG12 VAL A 5 28.127 30.582 23.175 1.00 0.00 H new ATOM 0 HG13 VAL A 5 27.306 29.048 22.798 1.00 0.00 H new ATOM 0 HG21 VAL A 5 25.553 30.379 20.548 1.00 0.00 H new ATOM 0 HG22 VAL A 5 24.922 29.196 21.719 1.00 0.00 H new ATOM 0 HG23 VAL A 5 24.168 30.802 21.583 1.00 0.00 H new ATOM 92 N LYS A 6 26.622 30.727 26.291 1.00 0.00 N ATOM 93 CA LYS A 6 27.452 31.163 27.401 1.00 0.00 C ATOM 94 C LYS A 6 28.861 30.702 27.061 1.00 0.00 C ATOM 95 O LYS A 6 29.026 29.640 26.464 1.00 0.00 O ATOM 96 CB LYS A 6 26.989 30.460 28.670 1.00 0.00 C ATOM 97 CG LYS A 6 27.253 31.313 29.910 1.00 0.00 C ATOM 98 CD LYS A 6 26.848 30.530 31.166 1.00 0.00 C ATOM 99 CE LYS A 6 27.307 31.161 32.485 1.00 0.00 C ATOM 100 NZ LYS A 6 26.726 30.392 33.591 1.00 0.00 N ATOM 0 H LYS A 6 26.161 29.839 26.488 1.00 0.00 H new ATOM 0 HA LYS A 6 27.400 32.241 27.557 1.00 0.00 H new ATOM 0 HB2 LYS A 6 25.924 30.241 28.598 1.00 0.00 H new ATOM 0 HB3 LYS A 6 27.505 29.505 28.767 1.00 0.00 H new ATOM 0 HG2 LYS A 6 28.308 31.583 29.961 1.00 0.00 H new ATOM 0 HG3 LYS A 6 26.689 32.244 29.851 1.00 0.00 H new ATOM 0 HD2 LYS A 6 25.763 30.432 31.183 1.00 0.00 H new ATOM 0 HD3 LYS A 6 27.258 29.522 31.098 1.00 0.00 H new ATOM 0 HE2 LYS A 6 28.395 31.156 32.550 1.00 0.00 H new ATOM 0 HE3 LYS A 6 26.989 32.202 32.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 27.026 30.805 34.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 25.688 30.419 33.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 27.051 29.406 33.536 1.00 0.00 H new ATOM 114 N THR A 7 29.855 31.588 27.210 1.00 0.00 N ATOM 115 CA THR A 7 31.239 31.295 26.906 1.00 0.00 C ATOM 116 C THR A 7 31.960 30.976 28.220 1.00 0.00 C ATOM 117 O THR A 7 31.367 31.089 29.288 1.00 0.00 O ATOM 118 CB THR A 7 31.751 32.412 25.991 1.00 0.00 C ATOM 119 OG1 THR A 7 31.835 33.689 26.573 1.00 0.00 O ATOM 120 CG2 THR A 7 31.029 32.478 24.640 1.00 0.00 C ATOM 0 H THR A 7 29.706 32.538 27.550 1.00 0.00 H new ATOM 0 HA THR A 7 31.428 30.395 26.321 1.00 0.00 H new ATOM 0 HB THR A 7 32.781 32.105 25.811 1.00 0.00 H new ATOM 0 HG1 THR A 7 30.933 34.028 26.750 1.00 0.00 H new ATOM 0 HG21 THR A 7 31.444 33.292 24.045 1.00 0.00 H new ATOM 0 HG22 THR A 7 31.163 31.536 24.109 1.00 0.00 H new ATOM 0 HG23 THR A 7 29.966 32.654 24.804 1.00 0.00 H new ATOM 128 N LEU A 8 33.281 30.860 28.108 1.00 0.00 N ATOM 129 CA LEU A 8 34.305 30.753 29.122 1.00 0.00 C ATOM 130 C LEU A 8 34.718 32.074 29.778 1.00 0.00 C ATOM 131 O LEU A 8 35.524 32.146 30.706 1.00 0.00 O ATOM 132 CB LEU A 8 35.494 30.051 28.463 1.00 0.00 C ATOM 133 CG LEU A 8 36.087 30.533 27.146 1.00 0.00 C ATOM 134 CD1 LEU A 8 37.611 30.528 27.208 1.00 0.00 C ATOM 135 CD2 LEU A 8 35.610 29.609 26.030 1.00 0.00 C ATOM 0 H LEU A 8 33.703 30.837 27.180 1.00 0.00 H new ATOM 0 HA LEU A 8 33.902 30.184 29.960 1.00 0.00 H new ATOM 0 HB2 LEU A 8 36.304 30.054 29.192 1.00 0.00 H new ATOM 0 HB3 LEU A 8 35.202 29.011 28.315 1.00 0.00 H new ATOM 0 HG LEU A 8 35.759 31.555 26.954 1.00 0.00 H new ATOM 0 HD11 LEU A 8 38.015 30.876 26.257 1.00 0.00 H new ATOM 0 HD12 LEU A 8 37.945 31.189 28.008 1.00 0.00 H new ATOM 0 HD13 LEU A 8 37.964 29.515 27.404 1.00 0.00 H new ATOM 0 HD21 LEU A 8 36.027 29.942 25.079 1.00 0.00 H new ATOM 0 HD22 LEU A 8 35.940 28.591 26.235 1.00 0.00 H new ATOM 0 HD23 LEU A 8 34.522 29.634 25.977 1.00 0.00 H new ATOM 147 N THR A 9 34.148 33.130 29.190 1.00 0.00 N ATOM 148 CA THR A 9 34.325 34.520 29.553 1.00 0.00 C ATOM 149 C THR A 9 32.954 35.045 29.998 1.00 0.00 C ATOM 150 O THR A 9 32.039 34.225 30.137 1.00 0.00 O ATOM 151 CB THR A 9 34.977 35.192 28.343 1.00 0.00 C ATOM 152 OG1 THR A 9 34.521 34.671 27.115 1.00 0.00 O ATOM 153 CG2 THR A 9 36.488 35.004 28.320 1.00 0.00 C ATOM 0 H THR A 9 33.513 33.019 28.400 1.00 0.00 H new ATOM 0 HA THR A 9 34.986 34.721 30.396 1.00 0.00 H new ATOM 0 HB THR A 9 34.704 36.242 28.450 1.00 0.00 H new ATOM 0 HG1 THR A 9 33.555 34.515 27.164 1.00 0.00 H new ATOM 0 HG21 THR A 9 36.903 35.499 27.442 1.00 0.00 H new ATOM 0 HG22 THR A 9 36.922 35.438 29.221 1.00 0.00 H new ATOM 0 HG23 THR A 9 36.722 33.940 28.281 1.00 0.00 H new ATOM 161 N GLY A 10 32.806 36.358 30.061 1.00 0.00 N ATOM 162 CA GLY A 10 31.552 36.923 30.513 1.00 0.00 C ATOM 163 C GLY A 10 30.857 37.727 29.420 1.00 0.00 C ATOM 164 O GLY A 10 30.636 38.923 29.573 1.00 0.00 O ATOM 0 H GLY A 10 33.524 37.038 29.810 1.00 0.00 H new ATOM 0 HA2 GLY A 10 30.893 36.121 30.847 1.00 0.00 H new ATOM 0 HA3 GLY A 10 31.734 37.565 31.375 1.00 0.00 H new ATOM 168 N LYS A 11 30.748 37.060 28.278 1.00 0.00 N ATOM 169 CA LYS A 11 29.978 37.326 27.083 1.00 0.00 C ATOM 170 C LYS A 11 29.024 36.133 26.892 1.00 0.00 C ATOM 171 O LYS A 11 29.352 34.994 27.187 1.00 0.00 O ATOM 172 CB LYS A 11 30.969 37.192 25.925 1.00 0.00 C ATOM 173 CG LYS A 11 30.336 37.437 24.553 1.00 0.00 C ATOM 174 CD LYS A 11 31.397 37.424 23.459 1.00 0.00 C ATOM 175 CE LYS A 11 30.895 38.254 22.276 1.00 0.00 C ATOM 176 NZ LYS A 11 31.974 38.242 21.279 1.00 0.00 N ATOM 0 H LYS A 11 31.278 36.196 28.160 1.00 0.00 H new ATOM 0 HA LYS A 11 29.464 38.286 27.133 1.00 0.00 H new ATOM 0 HB2 LYS A 11 31.786 37.899 26.072 1.00 0.00 H new ATOM 0 HB3 LYS A 11 31.405 36.193 25.943 1.00 0.00 H new ATOM 0 HG2 LYS A 11 29.588 36.670 24.350 1.00 0.00 H new ATOM 0 HG3 LYS A 11 29.818 38.396 24.552 1.00 0.00 H new ATOM 0 HD2 LYS A 11 32.334 37.833 23.837 1.00 0.00 H new ATOM 0 HD3 LYS A 11 31.601 36.401 23.143 1.00 0.00 H new ATOM 0 HE2 LYS A 11 29.979 37.830 21.864 1.00 0.00 H new ATOM 0 HE3 LYS A 11 30.663 39.273 22.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 31.713 38.850 20.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 32.850 38.597 21.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 32.124 37.270 20.941 1.00 0.00 H new ATOM 190 N THR A 12 27.791 36.461 26.503 1.00 0.00 N ATOM 191 CA THR A 12 26.702 35.541 26.249 1.00 0.00 C ATOM 192 C THR A 12 26.094 35.932 24.892 1.00 0.00 C ATOM 193 O THR A 12 25.652 37.076 24.819 1.00 0.00 O ATOM 194 CB THR A 12 25.785 35.585 27.468 1.00 0.00 C ATOM 195 OG1 THR A 12 26.444 35.470 28.721 1.00 0.00 O ATOM 196 CG2 THR A 12 24.916 34.328 27.538 1.00 0.00 C ATOM 0 H THR A 12 27.519 37.432 26.351 1.00 0.00 H new ATOM 0 HA THR A 12 26.981 34.492 26.144 1.00 0.00 H new ATOM 0 HB THR A 12 25.276 36.540 27.336 1.00 0.00 H new ATOM 0 HG1 THR A 12 25.783 35.509 29.443 1.00 0.00 H new ATOM 0 HG21 THR A 12 24.270 34.380 28.415 1.00 0.00 H new ATOM 0 HG22 THR A 12 24.303 34.259 26.639 1.00 0.00 H new ATOM 0 HG23 THR A 12 25.555 33.448 27.610 1.00 0.00 H new ATOM 204 N ILE A 13 26.142 35.033 23.912 1.00 0.00 N ATOM 205 CA ILE A 13 25.783 35.375 22.544 1.00 0.00 C ATOM 206 C ILE A 13 24.359 34.841 22.387 1.00 0.00 C ATOM 207 O ILE A 13 24.160 33.645 22.574 1.00 0.00 O ATOM 208 CB ILE A 13 26.600 34.712 21.438 1.00 0.00 C ATOM 209 CG1 ILE A 13 28.098 34.922 21.642 1.00 0.00 C ATOM 210 CG2 ILE A 13 26.217 35.233 20.046 1.00 0.00 C ATOM 211 CD1 ILE A 13 29.027 33.944 20.908 1.00 0.00 C ATOM 0 H ILE A 13 26.427 34.062 24.043 1.00 0.00 H new ATOM 0 HA ILE A 13 25.940 36.447 22.425 1.00 0.00 H new ATOM 0 HB ILE A 13 26.370 33.648 21.495 1.00 0.00 H new ATOM 0 HG12 ILE A 13 28.348 35.935 21.325 1.00 0.00 H new ATOM 0 HG13 ILE A 13 28.310 34.860 22.709 1.00 0.00 H new ATOM 0 HG21 ILE A 13 26.824 34.733 19.291 1.00 0.00 H new ATOM 0 HG22 ILE A 13 25.163 35.028 19.858 1.00 0.00 H new ATOM 0 HG23 ILE A 13 26.392 36.308 19.999 1.00 0.00 H new ATOM 0 HD11 ILE A 13 30.065 34.193 21.129 1.00 0.00 H new ATOM 0 HD12 ILE A 13 28.819 32.927 21.239 1.00 0.00 H new ATOM 0 HD13 ILE A 13 28.857 34.018 19.834 1.00 0.00 H new ATOM 223 N THR A 14 23.393 35.623 21.911 1.00 0.00 N ATOM 224 CA THR A 14 22.049 35.136 21.691 1.00 0.00 C ATOM 225 C THR A 14 22.049 34.689 20.227 1.00 0.00 C ATOM 226 O THR A 14 22.720 35.323 19.419 1.00 0.00 O ATOM 227 CB THR A 14 21.025 36.220 22.031 1.00 0.00 C ATOM 228 OG1 THR A 14 21.167 36.328 23.433 1.00 0.00 O ATOM 229 CG2 THR A 14 19.575 35.870 21.716 1.00 0.00 C ATOM 0 H THR A 14 23.526 36.605 21.671 1.00 0.00 H new ATOM 0 HA THR A 14 21.762 34.304 22.334 1.00 0.00 H new ATOM 0 HB THR A 14 21.214 37.119 21.444 1.00 0.00 H new ATOM 0 HG1 THR A 14 20.549 37.009 23.773 1.00 0.00 H new ATOM 0 HG21 THR A 14 18.931 36.704 21.994 1.00 0.00 H new ATOM 0 HG22 THR A 14 19.472 35.672 20.649 1.00 0.00 H new ATOM 0 HG23 THR A 14 19.284 34.983 22.279 1.00 0.00 H new ATOM 237 N LEU A 15 21.316 33.651 19.817 1.00 0.00 N ATOM 238 CA LEU A 15 21.420 33.066 18.500 1.00 0.00 C ATOM 239 C LEU A 15 19.964 32.869 18.101 1.00 0.00 C ATOM 240 O LEU A 15 19.179 32.338 18.882 1.00 0.00 O ATOM 241 CB LEU A 15 22.192 31.754 18.614 1.00 0.00 C ATOM 242 CG LEU A 15 23.411 31.601 17.699 1.00 0.00 C ATOM 243 CD1 LEU A 15 24.625 32.384 18.186 1.00 0.00 C ATOM 244 CD2 LEU A 15 23.803 30.153 17.434 1.00 0.00 C ATOM 0 H LEU A 15 20.624 33.193 20.410 1.00 0.00 H new ATOM 0 HA LEU A 15 21.954 33.663 17.760 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.523 31.641 19.646 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.505 30.934 18.408 1.00 0.00 H new ATOM 0 HG LEU A 15 23.082 32.030 16.753 1.00 0.00 H new ATOM 0 HD11 LEU A 15 25.455 32.235 17.496 1.00 0.00 H new ATOM 0 HD12 LEU A 15 24.379 33.445 18.233 1.00 0.00 H new ATOM 0 HD13 LEU A 15 24.910 32.033 19.178 1.00 0.00 H new ATOM 0 HD21 LEU A 15 24.674 30.126 16.779 1.00 0.00 H new ATOM 0 HD22 LEU A 15 24.043 29.663 18.377 1.00 0.00 H new ATOM 0 HD23 LEU A 15 22.973 29.633 16.956 1.00 0.00 H new ATOM 256 N GLU A 16 19.605 33.388 16.929 1.00 0.00 N ATOM 257 CA GLU A 16 18.289 33.209 16.357 1.00 0.00 C ATOM 258 C GLU A 16 18.250 32.271 15.150 1.00 0.00 C ATOM 259 O GLU A 16 18.392 32.592 13.971 1.00 0.00 O ATOM 260 CB GLU A 16 17.776 34.594 15.966 1.00 0.00 C ATOM 261 CG GLU A 16 16.434 34.719 15.243 1.00 0.00 C ATOM 262 CD GLU A 16 15.274 34.264 16.111 1.00 0.00 C ATOM 263 OE1 GLU A 16 14.956 35.036 17.045 1.00 0.00 O ATOM 264 OE2 GLU A 16 14.615 33.234 15.872 1.00 0.00 O ATOM 0 H GLU A 16 20.231 33.948 16.351 1.00 0.00 H new ATOM 0 HA GLU A 16 17.657 32.729 17.105 1.00 0.00 H new ATOM 0 HB2 GLU A 16 17.714 35.189 16.877 1.00 0.00 H new ATOM 0 HB3 GLU A 16 18.533 35.057 15.333 1.00 0.00 H new ATOM 0 HG2 GLU A 16 16.278 35.756 14.945 1.00 0.00 H new ATOM 0 HG3 GLU A 16 16.458 34.125 14.330 1.00 0.00 H new ATOM 271 N VAL A 17 17.879 31.014 15.409 1.00 0.00 N ATOM 272 CA VAL A 17 17.993 29.838 14.569 1.00 0.00 C ATOM 273 C VAL A 17 16.727 28.985 14.497 1.00 0.00 C ATOM 274 O VAL A 17 15.789 29.057 15.283 1.00 0.00 O ATOM 275 CB VAL A 17 19.200 29.056 15.077 1.00 0.00 C ATOM 276 CG1 VAL A 17 20.587 29.499 14.595 1.00 0.00 C ATOM 277 CG2 VAL A 17 19.211 28.663 16.551 1.00 0.00 C ATOM 0 H VAL A 17 17.449 30.781 16.304 1.00 0.00 H new ATOM 0 HA VAL A 17 18.131 30.149 13.533 1.00 0.00 H new ATOM 0 HB VAL A 17 18.996 28.132 14.535 1.00 0.00 H new ATOM 0 HG11 VAL A 17 21.348 28.855 15.035 1.00 0.00 H new ATOM 0 HG12 VAL A 17 20.635 29.427 13.508 1.00 0.00 H new ATOM 0 HG13 VAL A 17 20.765 30.531 14.898 1.00 0.00 H new ATOM 0 HG21 VAL A 17 20.125 28.113 16.774 1.00 0.00 H new ATOM 0 HG22 VAL A 17 19.168 29.561 17.167 1.00 0.00 H new ATOM 0 HG23 VAL A 17 18.347 28.034 16.766 1.00 0.00 H new ATOM 287 N GLU A 18 16.712 28.117 13.495 1.00 0.00 N ATOM 288 CA GLU A 18 15.688 27.093 13.351 1.00 0.00 C ATOM 289 C GLU A 18 16.096 25.833 14.116 1.00 0.00 C ATOM 290 O GLU A 18 17.276 25.498 14.053 1.00 0.00 O ATOM 291 CB GLU A 18 15.471 26.792 11.870 1.00 0.00 C ATOM 292 CG GLU A 18 14.736 27.954 11.201 1.00 0.00 C ATOM 293 CD GLU A 18 14.839 27.901 9.683 1.00 0.00 C ATOM 294 OE1 GLU A 18 15.416 27.034 9.003 1.00 0.00 O ATOM 295 OE2 GLU A 18 14.216 28.845 9.137 1.00 0.00 O ATOM 0 H GLU A 18 17.414 28.104 12.755 1.00 0.00 H new ATOM 0 HA GLU A 18 14.749 27.453 13.772 1.00 0.00 H new ATOM 0 HB2 GLU A 18 16.431 26.628 11.380 1.00 0.00 H new ATOM 0 HB3 GLU A 18 14.894 25.874 11.758 1.00 0.00 H new ATOM 0 HG2 GLU A 18 13.686 27.934 11.493 1.00 0.00 H new ATOM 0 HG3 GLU A 18 15.149 28.897 11.559 1.00 0.00 H new ATOM 302 N PRO A 19 15.230 25.147 14.859 1.00 0.00 N ATOM 303 CA PRO A 19 15.613 24.032 15.721 1.00 0.00 C ATOM 304 C PRO A 19 15.686 22.694 14.995 1.00 0.00 C ATOM 305 O PRO A 19 16.172 21.687 15.506 1.00 0.00 O ATOM 306 CB PRO A 19 14.396 23.910 16.639 1.00 0.00 C ATOM 307 CG PRO A 19 13.173 24.403 15.863 1.00 0.00 C ATOM 308 CD PRO A 19 13.812 25.450 14.941 1.00 0.00 C ATOM 0 HA PRO A 19 16.588 24.219 16.171 1.00 0.00 H new ATOM 0 HB2 PRO A 19 14.257 22.876 16.954 1.00 0.00 H new ATOM 0 HB3 PRO A 19 14.539 24.502 17.543 1.00 0.00 H new ATOM 0 HG2 PRO A 19 12.689 23.602 15.304 1.00 0.00 H new ATOM 0 HG3 PRO A 19 12.417 24.837 16.517 1.00 0.00 H new ATOM 0 HD2 PRO A 19 13.355 25.421 13.952 1.00 0.00 H new ATOM 0 HD3 PRO A 19 13.656 26.455 15.334 1.00 0.00 H new ATOM 316 N SER A 20 15.297 22.825 13.730 1.00 0.00 N ATOM 317 CA SER A 20 15.461 21.857 12.657 1.00 0.00 C ATOM 318 C SER A 20 16.860 21.889 12.050 1.00 0.00 C ATOM 319 O SER A 20 16.975 20.946 11.265 1.00 0.00 O ATOM 320 CB SER A 20 14.384 22.229 11.639 1.00 0.00 C ATOM 321 OG SER A 20 14.529 23.555 11.181 1.00 0.00 O ATOM 0 H SER A 20 14.826 23.671 13.408 1.00 0.00 H new ATOM 0 HA SER A 20 15.351 20.834 13.016 1.00 0.00 H new ATOM 0 HB2 SER A 20 14.433 21.545 10.792 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.400 22.107 12.091 1.00 0.00 H new ATOM 0 HG SER A 20 13.824 23.755 10.531 1.00 0.00 H new ATOM 327 N ASP A 21 17.762 22.763 12.475 1.00 0.00 N ATOM 328 CA ASP A 21 19.122 22.815 11.983 1.00 0.00 C ATOM 329 C ASP A 21 20.030 21.903 12.807 1.00 0.00 C ATOM 330 O ASP A 21 19.670 21.627 13.952 1.00 0.00 O ATOM 331 CB ASP A 21 19.712 24.225 11.976 1.00 0.00 C ATOM 332 CG ASP A 21 20.744 24.503 10.884 1.00 0.00 C ATOM 333 OD1 ASP A 21 20.823 23.783 9.870 1.00 0.00 O ATOM 334 OD2 ASP A 21 21.310 25.614 10.883 1.00 0.00 O ATOM 0 H ASP A 21 17.560 23.467 13.185 1.00 0.00 H new ATOM 0 HA ASP A 21 19.074 22.473 10.949 1.00 0.00 H new ATOM 0 HB2 ASP A 21 18.896 24.940 11.871 1.00 0.00 H new ATOM 0 HB3 ASP A 21 20.176 24.410 12.945 1.00 0.00 H new ATOM 339 N THR A 22 21.099 21.411 12.207 1.00 0.00 N ATOM 340 CA THR A 22 22.039 20.460 12.780 1.00 0.00 C ATOM 341 C THR A 22 23.046 21.259 13.623 1.00 0.00 C ATOM 342 O THR A 22 23.399 22.402 13.342 1.00 0.00 O ATOM 343 CB THR A 22 22.658 19.591 11.689 1.00 0.00 C ATOM 344 OG1 THR A 22 23.475 20.323 10.806 1.00 0.00 O ATOM 345 CG2 THR A 22 21.721 18.692 10.885 1.00 0.00 C ATOM 0 H THR A 22 21.350 21.678 11.255 1.00 0.00 H new ATOM 0 HA THR A 22 21.549 19.746 13.442 1.00 0.00 H new ATOM 0 HB THR A 22 23.258 18.907 12.289 1.00 0.00 H new ATOM 0 HG1 THR A 22 23.847 19.720 10.129 1.00 0.00 H new ATOM 0 HG21 THR A 22 22.297 18.133 10.147 1.00 0.00 H new ATOM 0 HG22 THR A 22 21.220 17.995 11.557 1.00 0.00 H new ATOM 0 HG23 THR A 22 20.977 19.305 10.376 1.00 0.00 H new ATOM 353 N ILE A 23 23.560 20.578 14.643 1.00 0.00 N ATOM 354 CA ILE A 23 24.610 21.099 15.498 1.00 0.00 C ATOM 355 C ILE A 23 25.827 21.572 14.685 1.00 0.00 C ATOM 356 O ILE A 23 26.469 22.544 15.091 1.00 0.00 O ATOM 357 CB ILE A 23 24.903 20.133 16.648 1.00 0.00 C ATOM 358 CG1 ILE A 23 23.724 19.835 17.573 1.00 0.00 C ATOM 359 CG2 ILE A 23 26.140 20.504 17.472 1.00 0.00 C ATOM 360 CD1 ILE A 23 23.020 21.134 17.997 1.00 0.00 C ATOM 0 H ILE A 23 23.253 19.639 14.898 1.00 0.00 H new ATOM 0 HA ILE A 23 24.264 22.010 15.987 1.00 0.00 H new ATOM 0 HB ILE A 23 25.115 19.207 16.113 1.00 0.00 H new ATOM 0 HG12 ILE A 23 23.015 19.181 17.066 1.00 0.00 H new ATOM 0 HG13 ILE A 23 24.075 19.301 18.456 1.00 0.00 H new ATOM 0 HG21 ILE A 23 26.280 19.772 18.267 1.00 0.00 H new ATOM 0 HG22 ILE A 23 27.018 20.512 16.826 1.00 0.00 H new ATOM 0 HG23 ILE A 23 26.003 21.493 17.909 1.00 0.00 H new ATOM 0 HD11 ILE A 23 22.184 20.897 18.655 1.00 0.00 H new ATOM 0 HD12 ILE A 23 23.726 21.775 18.524 1.00 0.00 H new ATOM 0 HD13 ILE A 23 22.650 21.653 17.113 1.00 0.00 H new ATOM 372 N GLU A 24 26.162 20.950 13.569 1.00 0.00 N ATOM 373 CA GLU A 24 27.331 21.142 12.717 1.00 0.00 C ATOM 374 C GLU A 24 27.293 22.572 12.165 1.00 0.00 C ATOM 375 O GLU A 24 28.246 23.344 12.123 1.00 0.00 O ATOM 376 CB GLU A 24 27.230 20.017 11.690 1.00 0.00 C ATOM 377 CG GLU A 24 28.609 19.710 11.097 1.00 0.00 C ATOM 378 CD GLU A 24 28.671 18.811 9.873 1.00 0.00 C ATOM 379 OE1 GLU A 24 27.610 18.616 9.242 1.00 0.00 O ATOM 380 OE2 GLU A 24 29.791 18.486 9.428 1.00 0.00 O ATOM 0 H GLU A 24 25.559 20.218 13.194 1.00 0.00 H new ATOM 0 HA GLU A 24 28.303 21.072 13.206 1.00 0.00 H new ATOM 0 HB2 GLU A 24 26.822 19.122 12.160 1.00 0.00 H new ATOM 0 HB3 GLU A 24 26.541 20.302 10.895 1.00 0.00 H new ATOM 0 HG2 GLU A 24 29.082 20.658 10.840 1.00 0.00 H new ATOM 0 HG3 GLU A 24 29.215 19.253 11.879 1.00 0.00 H new ATOM 387 N ASN A 25 26.105 22.800 11.605 1.00 0.00 N ATOM 388 CA ASN A 25 25.798 24.016 10.889 1.00 0.00 C ATOM 389 C ASN A 25 25.508 25.210 11.805 1.00 0.00 C ATOM 390 O ASN A 25 25.723 26.334 11.371 1.00 0.00 O ATOM 391 CB ASN A 25 24.562 23.665 10.046 1.00 0.00 C ATOM 392 CG ASN A 25 24.310 24.688 8.950 1.00 0.00 C ATOM 393 OD1 ASN A 25 25.175 24.738 8.074 1.00 0.00 O ATOM 394 ND2 ASN A 25 23.162 25.354 8.950 1.00 0.00 N ATOM 0 H ASN A 25 25.331 22.136 11.641 1.00 0.00 H new ATOM 0 HA ASN A 25 26.653 24.335 10.293 1.00 0.00 H new ATOM 0 HB2 ASN A 25 24.696 22.680 9.599 1.00 0.00 H new ATOM 0 HB3 ASN A 25 23.687 23.604 10.693 1.00 0.00 H new ATOM 0 HD21 ASN A 25 22.933 25.975 8.174 1.00 0.00 H new ATOM 0 HD22 ASN A 25 22.509 25.244 9.726 1.00 0.00 H new ATOM 401 N VAL A 26 25.103 24.954 13.044 1.00 0.00 N ATOM 402 CA VAL A 26 25.081 25.812 14.212 1.00 0.00 C ATOM 403 C VAL A 26 26.481 26.326 14.537 1.00 0.00 C ATOM 404 O VAL A 26 26.681 27.533 14.699 1.00 0.00 O ATOM 405 CB VAL A 26 24.227 25.229 15.333 1.00 0.00 C ATOM 406 CG1 VAL A 26 24.422 25.874 16.708 1.00 0.00 C ATOM 407 CG2 VAL A 26 22.763 25.356 14.922 1.00 0.00 C ATOM 0 H VAL A 26 24.740 24.029 13.275 1.00 0.00 H new ATOM 0 HA VAL A 26 24.541 26.736 14.006 1.00 0.00 H new ATOM 0 HB VAL A 26 24.545 24.194 15.457 1.00 0.00 H new ATOM 0 HG11 VAL A 26 23.770 25.388 17.434 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.460 25.760 17.020 1.00 0.00 H new ATOM 0 HG13 VAL A 26 24.175 26.934 16.651 1.00 0.00 H new ATOM 0 HG21 VAL A 26 22.128 24.946 15.707 1.00 0.00 H new ATOM 0 HG22 VAL A 26 22.518 26.407 14.769 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.596 24.806 13.996 1.00 0.00 H new ATOM 417 N LYS A 27 27.378 25.351 14.587 1.00 0.00 N ATOM 418 CA LYS A 27 28.774 25.676 14.786 1.00 0.00 C ATOM 419 C LYS A 27 29.414 26.426 13.620 1.00 0.00 C ATOM 420 O LYS A 27 30.081 27.437 13.839 1.00 0.00 O ATOM 421 CB LYS A 27 29.569 24.402 15.091 1.00 0.00 C ATOM 422 CG LYS A 27 29.304 23.872 16.507 1.00 0.00 C ATOM 423 CD LYS A 27 30.126 22.624 16.809 1.00 0.00 C ATOM 424 CE LYS A 27 29.730 21.317 16.117 1.00 0.00 C ATOM 425 NZ LYS A 27 30.511 20.206 16.686 1.00 0.00 N ATOM 0 H LYS A 27 27.169 24.357 14.495 1.00 0.00 H new ATOM 0 HA LYS A 27 28.806 26.359 15.635 1.00 0.00 H new ATOM 0 HB2 LYS A 27 29.310 23.633 14.364 1.00 0.00 H new ATOM 0 HB3 LYS A 27 30.634 24.605 14.975 1.00 0.00 H new ATOM 0 HG2 LYS A 27 29.540 24.648 17.235 1.00 0.00 H new ATOM 0 HG3 LYS A 27 28.244 23.644 16.617 1.00 0.00 H new ATOM 0 HD2 LYS A 27 31.163 22.837 16.551 1.00 0.00 H new ATOM 0 HD3 LYS A 27 30.093 22.455 17.885 1.00 0.00 H new ATOM 0 HE2 LYS A 27 28.664 21.132 16.249 1.00 0.00 H new ATOM 0 HE3 LYS A 27 29.911 21.391 15.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 30.667 19.482 15.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 31.429 20.563 17.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 29.990 19.788 17.483 1.00 0.00 H new ATOM 439 N ALA A 28 29.124 26.137 12.360 1.00 0.00 N ATOM 440 CA ALA A 28 29.431 27.041 11.264 1.00 0.00 C ATOM 441 C ALA A 28 28.641 28.350 11.188 1.00 0.00 C ATOM 442 O ALA A 28 29.092 29.306 10.568 1.00 0.00 O ATOM 443 CB ALA A 28 29.125 26.180 10.035 1.00 0.00 C ATOM 0 H ALA A 28 28.670 25.271 12.070 1.00 0.00 H new ATOM 0 HA ALA A 28 30.453 27.404 11.372 1.00 0.00 H new ATOM 0 HB1 ALA A 28 29.319 26.756 9.130 1.00 0.00 H new ATOM 0 HB2 ALA A 28 29.759 25.294 10.045 1.00 0.00 H new ATOM 0 HB3 ALA A 28 28.078 25.877 10.055 1.00 0.00 H new ATOM 449 N LYS A 29 27.648 28.624 12.026 1.00 0.00 N ATOM 450 CA LYS A 29 27.000 29.925 11.970 1.00 0.00 C ATOM 451 C LYS A 29 27.749 30.787 12.987 1.00 0.00 C ATOM 452 O LYS A 29 27.949 31.937 12.602 1.00 0.00 O ATOM 453 CB LYS A 29 25.525 29.765 12.317 1.00 0.00 C ATOM 454 CG LYS A 29 24.654 29.498 11.087 1.00 0.00 C ATOM 455 CD LYS A 29 23.271 28.880 11.312 1.00 0.00 C ATOM 456 CE LYS A 29 22.558 28.500 10.016 1.00 0.00 C ATOM 457 NZ LYS A 29 21.147 28.105 10.065 1.00 0.00 N ATOM 0 H LYS A 29 27.284 27.984 12.731 1.00 0.00 H new ATOM 0 HA LYS A 29 27.035 30.387 10.983 1.00 0.00 H new ATOM 0 HB2 LYS A 29 25.409 28.944 13.024 1.00 0.00 H new ATOM 0 HB3 LYS A 29 25.174 30.668 12.817 1.00 0.00 H new ATOM 0 HG2 LYS A 29 24.517 30.443 10.562 1.00 0.00 H new ATOM 0 HG3 LYS A 29 25.210 28.840 10.419 1.00 0.00 H new ATOM 0 HD2 LYS A 29 23.375 27.991 11.935 1.00 0.00 H new ATOM 0 HD3 LYS A 29 22.652 29.586 11.865 1.00 0.00 H new ATOM 0 HE2 LYS A 29 22.638 29.349 9.337 1.00 0.00 H new ATOM 0 HE3 LYS A 29 23.113 27.678 9.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 20.807 27.912 9.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 21.046 27.248 10.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.586 28.874 10.483 1.00 0.00 H new ATOM 471 N ILE A 30 28.089 30.304 14.177 1.00 0.00 N ATOM 472 CA ILE A 30 29.005 30.778 15.195 1.00 0.00 C ATOM 473 C ILE A 30 30.393 31.151 14.668 1.00 0.00 C ATOM 474 O ILE A 30 31.019 32.131 15.041 1.00 0.00 O ATOM 475 CB ILE A 30 29.015 29.823 16.397 1.00 0.00 C ATOM 476 CG1 ILE A 30 27.650 29.593 17.040 1.00 0.00 C ATOM 477 CG2 ILE A 30 30.123 30.168 17.397 1.00 0.00 C ATOM 478 CD1 ILE A 30 27.585 28.507 18.115 1.00 0.00 C ATOM 0 H ILE A 30 27.656 29.435 14.490 1.00 0.00 H new ATOM 0 HA ILE A 30 28.624 31.735 15.553 1.00 0.00 H new ATOM 0 HB ILE A 30 29.265 28.844 15.988 1.00 0.00 H new ATOM 0 HG12 ILE A 30 27.316 30.532 17.481 1.00 0.00 H new ATOM 0 HG13 ILE A 30 26.939 29.340 16.254 1.00 0.00 H new ATOM 0 HG21 ILE A 30 30.092 29.466 18.231 1.00 0.00 H new ATOM 0 HG22 ILE A 30 31.092 30.102 16.903 1.00 0.00 H new ATOM 0 HG23 ILE A 30 29.974 31.181 17.770 1.00 0.00 H new ATOM 0 HD11 ILE A 30 26.567 28.435 18.498 1.00 0.00 H new ATOM 0 HD12 ILE A 30 27.879 27.550 17.684 1.00 0.00 H new ATOM 0 HD13 ILE A 30 28.262 28.761 18.930 1.00 0.00 H new ATOM 490 N GLN A 31 30.885 30.338 13.728 1.00 0.00 N ATOM 491 CA GLN A 31 32.117 30.497 12.990 1.00 0.00 C ATOM 492 C GLN A 31 32.402 31.891 12.413 1.00 0.00 C ATOM 493 O GLN A 31 33.528 32.388 12.401 1.00 0.00 O ATOM 494 CB GLN A 31 32.229 29.315 12.025 1.00 0.00 C ATOM 495 CG GLN A 31 33.316 29.418 10.955 1.00 0.00 C ATOM 496 CD GLN A 31 33.693 28.249 10.049 1.00 0.00 C ATOM 497 OE1 GLN A 31 32.813 27.413 9.866 1.00 0.00 O ATOM 498 NE2 GLN A 31 34.890 28.123 9.490 1.00 0.00 N ATOM 0 H GLN A 31 30.386 29.492 13.451 1.00 0.00 H new ATOM 0 HA GLN A 31 32.953 30.461 13.688 1.00 0.00 H new ATOM 0 HB2 GLN A 31 32.407 28.412 12.609 1.00 0.00 H new ATOM 0 HB3 GLN A 31 31.268 29.188 11.526 1.00 0.00 H new ATOM 0 HG2 GLN A 31 33.030 30.240 10.299 1.00 0.00 H new ATOM 0 HG3 GLN A 31 34.229 29.722 11.467 1.00 0.00 H new ATOM 0 HE21 GLN A 31 35.607 28.829 9.655 1.00 0.00 H new ATOM 0 HE22 GLN A 31 35.093 27.320 8.895 1.00 0.00 H new ATOM 507 N ASP A 32 31.348 32.427 11.820 1.00 0.00 N ATOM 508 CA ASP A 32 31.340 33.790 11.322 1.00 0.00 C ATOM 509 C ASP A 32 31.539 34.797 12.465 1.00 0.00 C ATOM 510 O ASP A 32 32.276 35.778 12.349 1.00 0.00 O ATOM 511 CB ASP A 32 30.054 33.998 10.524 1.00 0.00 C ATOM 512 CG ASP A 32 29.537 35.417 10.309 1.00 0.00 C ATOM 513 OD1 ASP A 32 30.227 36.253 9.681 1.00 0.00 O ATOM 514 OD2 ASP A 32 28.439 35.734 10.799 1.00 0.00 O ATOM 0 H ASP A 32 30.472 31.926 11.671 1.00 0.00 H new ATOM 0 HA ASP A 32 32.180 33.966 10.650 1.00 0.00 H new ATOM 0 HB2 ASP A 32 30.200 33.549 9.542 1.00 0.00 H new ATOM 0 HB3 ASP A 32 29.265 33.432 11.019 1.00 0.00 H new ATOM 519 N LYS A 33 30.869 34.500 13.572 1.00 0.00 N ATOM 520 CA LYS A 33 30.766 35.447 14.667 1.00 0.00 C ATOM 521 C LYS A 33 32.054 35.523 15.483 1.00 0.00 C ATOM 522 O LYS A 33 32.609 36.606 15.683 1.00 0.00 O ATOM 523 CB LYS A 33 29.644 35.026 15.617 1.00 0.00 C ATOM 524 CG LYS A 33 28.263 34.766 15.025 1.00 0.00 C ATOM 525 CD LYS A 33 27.779 35.886 14.101 1.00 0.00 C ATOM 526 CE LYS A 33 26.436 35.655 13.416 1.00 0.00 C ATOM 527 NZ LYS A 33 26.275 36.503 12.226 1.00 0.00 N ATOM 0 H LYS A 33 30.392 33.613 13.732 1.00 0.00 H new ATOM 0 HA LYS A 33 30.565 36.421 14.222 1.00 0.00 H new ATOM 0 HB2 LYS A 33 29.964 34.119 16.129 1.00 0.00 H new ATOM 0 HB3 LYS A 33 29.541 35.801 16.376 1.00 0.00 H new ATOM 0 HG2 LYS A 33 28.285 33.829 14.468 1.00 0.00 H new ATOM 0 HG3 LYS A 33 27.546 34.638 15.836 1.00 0.00 H new ATOM 0 HD2 LYS A 33 27.715 36.806 14.681 1.00 0.00 H new ATOM 0 HD3 LYS A 33 28.534 36.047 13.331 1.00 0.00 H new ATOM 0 HE2 LYS A 33 26.350 34.607 13.129 1.00 0.00 H new ATOM 0 HE3 LYS A 33 25.629 35.860 14.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 25.507 36.128 11.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 26.044 37.473 12.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 27.161 36.508 11.681 1.00 0.00 H new ATOM 541 N GLU A 34 32.459 34.342 15.925 1.00 0.00 N ATOM 542 CA GLU A 34 33.573 34.182 16.853 1.00 0.00 C ATOM 543 C GLU A 34 34.884 33.733 16.205 1.00 0.00 C ATOM 544 O GLU A 34 35.936 33.988 16.787 1.00 0.00 O ATOM 545 CB GLU A 34 33.199 33.244 17.993 1.00 0.00 C ATOM 546 CG GLU A 34 32.293 33.903 19.039 1.00 0.00 C ATOM 547 CD GLU A 34 32.826 35.100 19.805 1.00 0.00 C ATOM 548 OE1 GLU A 34 34.022 35.141 20.179 1.00 0.00 O ATOM 549 OE2 GLU A 34 32.094 36.098 19.926 1.00 0.00 O ATOM 0 H GLU A 34 32.023 33.462 15.650 1.00 0.00 H new ATOM 0 HA GLU A 34 33.763 35.182 17.242 1.00 0.00 H new ATOM 0 HB2 GLU A 34 32.695 32.368 17.585 1.00 0.00 H new ATOM 0 HB3 GLU A 34 34.109 32.891 18.479 1.00 0.00 H new ATOM 0 HG2 GLU A 34 31.376 34.212 18.537 1.00 0.00 H new ATOM 0 HG3 GLU A 34 32.016 33.140 19.766 1.00 0.00 H new ATOM 556 N GLY A 35 34.811 33.442 14.910 1.00 0.00 N ATOM 557 CA GLY A 35 36.011 33.313 14.105 1.00 0.00 C ATOM 558 C GLY A 35 36.821 32.021 14.084 1.00 0.00 C ATOM 559 O GLY A 35 37.888 31.895 13.497 1.00 0.00 O ATOM 0 H GLY A 35 33.939 33.293 14.403 1.00 0.00 H new ATOM 0 HA2 GLY A 35 35.726 33.525 13.075 1.00 0.00 H new ATOM 0 HA3 GLY A 35 36.689 34.107 14.418 1.00 0.00 H new ATOM 563 N ILE A 36 36.226 31.038 14.764 1.00 0.00 N ATOM 564 CA ILE A 36 36.764 29.759 15.197 1.00 0.00 C ATOM 565 C ILE A 36 36.182 28.846 14.121 1.00 0.00 C ATOM 566 O ILE A 36 35.001 28.908 13.788 1.00 0.00 O ATOM 567 CB ILE A 36 36.171 29.548 16.593 1.00 0.00 C ATOM 568 CG1 ILE A 36 36.571 28.180 17.145 1.00 0.00 C ATOM 569 CG2 ILE A 36 34.701 29.867 16.891 1.00 0.00 C ATOM 570 CD1 ILE A 36 37.992 27.972 17.675 1.00 0.00 C ATOM 0 H ILE A 36 35.252 31.136 15.052 1.00 0.00 H new ATOM 0 HA ILE A 36 37.842 29.623 15.283 1.00 0.00 H new ATOM 0 HB ILE A 36 36.637 30.375 17.129 1.00 0.00 H new ATOM 0 HG12 ILE A 36 35.881 27.939 17.954 1.00 0.00 H new ATOM 0 HG13 ILE A 36 36.405 27.447 16.355 1.00 0.00 H new ATOM 0 HG21 ILE A 36 34.486 29.647 17.937 1.00 0.00 H new ATOM 0 HG22 ILE A 36 34.511 30.922 16.696 1.00 0.00 H new ATOM 0 HG23 ILE A 36 34.060 29.259 16.253 1.00 0.00 H new ATOM 0 HD11 ILE A 36 38.103 26.946 18.027 1.00 0.00 H new ATOM 0 HD12 ILE A 36 38.709 28.161 16.877 1.00 0.00 H new ATOM 0 HD13 ILE A 36 38.177 28.660 18.500 1.00 0.00 H new ATOM 582 N PRO A 37 36.971 27.867 13.685 1.00 0.00 N ATOM 583 CA PRO A 37 36.499 26.794 12.838 1.00 0.00 C ATOM 584 C PRO A 37 35.576 25.805 13.548 1.00 0.00 C ATOM 585 O PRO A 37 35.603 25.726 14.769 1.00 0.00 O ATOM 586 CB PRO A 37 37.802 26.105 12.398 1.00 0.00 C ATOM 587 CG PRO A 37 38.799 26.234 13.545 1.00 0.00 C ATOM 588 CD PRO A 37 38.359 27.617 14.020 1.00 0.00 C ATOM 0 HA PRO A 37 35.888 27.173 12.018 1.00 0.00 H new ATOM 0 HB2 PRO A 37 37.621 25.056 12.164 1.00 0.00 H new ATOM 0 HB3 PRO A 37 38.195 26.570 11.494 1.00 0.00 H new ATOM 0 HG2 PRO A 37 38.682 25.461 14.305 1.00 0.00 H new ATOM 0 HG3 PRO A 37 39.838 26.203 13.217 1.00 0.00 H new ATOM 0 HD2 PRO A 37 38.496 27.695 15.099 1.00 0.00 H new ATOM 0 HD3 PRO A 37 38.990 28.380 13.563 1.00 0.00 H new ATOM 596 N PRO A 38 34.793 25.022 12.806 1.00 0.00 N ATOM 597 CA PRO A 38 33.657 24.375 13.431 1.00 0.00 C ATOM 598 C PRO A 38 33.908 23.067 14.191 1.00 0.00 C ATOM 599 O PRO A 38 33.047 22.506 14.870 1.00 0.00 O ATOM 600 CB PRO A 38 32.732 24.128 12.241 1.00 0.00 C ATOM 601 CG PRO A 38 33.645 24.003 11.006 1.00 0.00 C ATOM 602 CD PRO A 38 34.752 24.994 11.360 1.00 0.00 C ATOM 0 HA PRO A 38 33.275 25.010 14.230 1.00 0.00 H new ATOM 0 HB2 PRO A 38 32.146 23.220 12.385 1.00 0.00 H new ATOM 0 HB3 PRO A 38 32.025 24.949 12.121 1.00 0.00 H new ATOM 0 HG2 PRO A 38 34.025 22.990 10.875 1.00 0.00 H new ATOM 0 HG3 PRO A 38 33.130 24.272 10.084 1.00 0.00 H new ATOM 0 HD2 PRO A 38 35.709 24.678 10.946 1.00 0.00 H new ATOM 0 HD3 PRO A 38 34.539 25.983 10.954 1.00 0.00 H new ATOM 610 N ASP A 39 35.096 22.481 14.092 1.00 0.00 N ATOM 611 CA ASP A 39 35.484 21.232 14.710 1.00 0.00 C ATOM 612 C ASP A 39 36.209 21.420 16.048 1.00 0.00 C ATOM 613 O ASP A 39 36.892 20.538 16.559 1.00 0.00 O ATOM 614 CB ASP A 39 36.398 20.491 13.733 1.00 0.00 C ATOM 615 CG ASP A 39 37.673 21.266 13.412 1.00 0.00 C ATOM 616 OD1 ASP A 39 37.576 22.447 13.027 1.00 0.00 O ATOM 617 OD2 ASP A 39 38.760 20.650 13.372 1.00 0.00 O ATOM 0 H ASP A 39 35.852 22.894 13.546 1.00 0.00 H new ATOM 0 HA ASP A 39 34.578 20.666 14.928 1.00 0.00 H new ATOM 0 HB2 ASP A 39 36.664 19.522 14.155 1.00 0.00 H new ATOM 0 HB3 ASP A 39 35.854 20.297 12.809 1.00 0.00 H new ATOM 622 N GLN A 40 36.187 22.684 16.463 1.00 0.00 N ATOM 623 CA GLN A 40 36.853 23.222 17.625 1.00 0.00 C ATOM 624 C GLN A 40 35.938 23.859 18.678 1.00 0.00 C ATOM 625 O GLN A 40 36.371 24.095 19.802 1.00 0.00 O ATOM 626 CB GLN A 40 38.013 24.122 17.216 1.00 0.00 C ATOM 627 CG GLN A 40 39.251 23.372 16.739 1.00 0.00 C ATOM 628 CD GLN A 40 40.476 24.256 16.558 1.00 0.00 C ATOM 629 OE1 GLN A 40 40.752 25.175 17.333 1.00 0.00 O ATOM 630 NE2 GLN A 40 41.287 24.027 15.530 1.00 0.00 N ATOM 0 H GLN A 40 35.666 23.400 15.956 1.00 0.00 H new ATOM 0 HA GLN A 40 37.258 22.358 18.153 1.00 0.00 H new ATOM 0 HB2 GLN A 40 37.678 24.788 16.421 1.00 0.00 H new ATOM 0 HB3 GLN A 40 38.287 24.750 18.064 1.00 0.00 H new ATOM 0 HG2 GLN A 40 39.486 22.585 17.456 1.00 0.00 H new ATOM 0 HG3 GLN A 40 39.025 22.883 15.791 1.00 0.00 H new ATOM 0 HE21 GLN A 40 41.080 23.273 14.875 1.00 0.00 H new ATOM 0 HE22 GLN A 40 42.116 24.606 15.396 1.00 0.00 H new ATOM 639 N GLN A 41 34.643 23.930 18.382 1.00 0.00 N ATOM 640 CA GLN A 41 33.547 24.390 19.221 1.00 0.00 C ATOM 641 C GLN A 41 32.909 23.109 19.759 1.00 0.00 C ATOM 642 O GLN A 41 32.804 22.095 19.077 1.00 0.00 O ATOM 643 CB GLN A 41 32.680 25.133 18.199 1.00 0.00 C ATOM 644 CG GLN A 41 33.140 26.436 17.563 1.00 0.00 C ATOM 645 CD GLN A 41 32.213 27.127 16.566 1.00 0.00 C ATOM 646 OE1 GLN A 41 31.017 27.262 16.798 1.00 0.00 O ATOM 647 NE2 GLN A 41 32.686 27.333 15.339 1.00 0.00 N ATOM 0 H GLN A 41 34.307 23.640 17.464 1.00 0.00 H new ATOM 0 HA GLN A 41 33.767 25.031 20.075 1.00 0.00 H new ATOM 0 HB2 GLN A 41 32.483 24.436 17.385 1.00 0.00 H new ATOM 0 HB3 GLN A 41 31.725 25.337 18.683 1.00 0.00 H new ATOM 0 HG2 GLN A 41 33.348 27.142 18.367 1.00 0.00 H new ATOM 0 HG3 GLN A 41 34.086 26.242 17.057 1.00 0.00 H new ATOM 0 HE21 GLN A 41 33.682 27.219 15.151 1.00 0.00 H new ATOM 0 HE22 GLN A 41 32.052 27.604 14.587 1.00 0.00 H new ATOM 656 N ARG A 42 32.561 23.126 21.048 1.00 0.00 N ATOM 657 CA ARG A 42 31.840 22.100 21.769 1.00 0.00 C ATOM 658 C ARG A 42 30.721 22.885 22.470 1.00 0.00 C ATOM 659 O ARG A 42 30.979 23.717 23.338 1.00 0.00 O ATOM 660 CB ARG A 42 32.613 21.370 22.874 1.00 0.00 C ATOM 661 CG ARG A 42 34.110 21.175 22.641 1.00 0.00 C ATOM 662 CD ARG A 42 34.867 20.532 23.799 1.00 0.00 C ATOM 663 NE ARG A 42 36.218 21.072 24.003 1.00 0.00 N ATOM 664 CZ ARG A 42 37.042 20.880 25.040 1.00 0.00 C ATOM 665 NH1 ARG A 42 36.581 20.303 26.164 1.00 0.00 N ATOM 666 NH2 ARG A 42 38.331 21.253 24.994 1.00 0.00 N ATOM 0 H ARG A 42 32.797 23.917 21.648 1.00 0.00 H new ATOM 0 HA ARG A 42 31.554 21.323 21.060 1.00 0.00 H new ATOM 0 HB2 ARG A 42 32.481 21.922 23.805 1.00 0.00 H new ATOM 0 HB3 ARG A 42 32.159 20.389 23.018 1.00 0.00 H new ATOM 0 HG2 ARG A 42 34.246 20.559 21.752 1.00 0.00 H new ATOM 0 HG3 ARG A 42 34.558 22.146 22.429 1.00 0.00 H new ATOM 0 HD2 ARG A 42 34.291 20.666 24.715 1.00 0.00 H new ATOM 0 HD3 ARG A 42 34.939 19.459 23.621 1.00 0.00 H new ATOM 0 HE ARG A 42 36.574 21.671 23.258 1.00 0.00 H new ATOM 0 HH11 ARG A 42 35.605 20.013 26.225 1.00 0.00 H new ATOM 0 HH12 ARG A 42 37.207 20.156 26.955 1.00 0.00 H new ATOM 0 HH21 ARG A 42 38.704 21.695 24.154 1.00 0.00 H new ATOM 0 HH22 ARG A 42 38.937 21.095 25.799 1.00 0.00 H new ATOM 680 N LEU A 43 29.498 22.822 21.956 1.00 0.00 N ATOM 681 CA LEU A 43 28.303 23.310 22.610 1.00 0.00 C ATOM 682 C LEU A 43 27.852 22.242 23.592 1.00 0.00 C ATOM 683 O LEU A 43 27.657 21.082 23.229 1.00 0.00 O ATOM 684 CB LEU A 43 27.183 23.563 21.595 1.00 0.00 C ATOM 685 CG LEU A 43 27.400 24.674 20.565 1.00 0.00 C ATOM 686 CD1 LEU A 43 26.484 24.541 19.344 1.00 0.00 C ATOM 687 CD2 LEU A 43 27.259 26.053 21.198 1.00 0.00 C ATOM 0 H LEU A 43 29.311 22.414 21.040 1.00 0.00 H new ATOM 0 HA LEU A 43 28.520 24.252 23.114 1.00 0.00 H new ATOM 0 HB2 LEU A 43 27.003 22.634 21.054 1.00 0.00 H new ATOM 0 HB3 LEU A 43 26.272 23.791 22.149 1.00 0.00 H new ATOM 0 HG LEU A 43 28.423 24.561 20.207 1.00 0.00 H new ATOM 0 HD11 LEU A 43 26.684 25.357 18.649 1.00 0.00 H new ATOM 0 HD12 LEU A 43 26.673 23.588 18.849 1.00 0.00 H new ATOM 0 HD13 LEU A 43 25.443 24.584 19.664 1.00 0.00 H new ATOM 0 HD21 LEU A 43 27.419 26.819 20.440 1.00 0.00 H new ATOM 0 HD22 LEU A 43 26.259 26.160 21.617 1.00 0.00 H new ATOM 0 HD23 LEU A 43 27.999 26.167 21.991 1.00 0.00 H new ATOM 699 N ILE A 44 27.628 22.637 24.840 1.00 0.00 N ATOM 700 CA ILE A 44 27.125 21.940 26.009 1.00 0.00 C ATOM 701 C ILE A 44 25.762 22.561 26.349 1.00 0.00 C ATOM 702 O ILE A 44 25.754 23.650 26.920 1.00 0.00 O ATOM 703 CB ILE A 44 28.103 21.832 27.177 1.00 0.00 C ATOM 704 CG1 ILE A 44 29.208 20.854 26.769 1.00 0.00 C ATOM 705 CG2 ILE A 44 27.463 21.674 28.556 1.00 0.00 C ATOM 706 CD1 ILE A 44 30.596 21.271 27.260 1.00 0.00 C ATOM 0 H ILE A 44 27.829 23.606 25.086 1.00 0.00 H new ATOM 0 HA ILE A 44 26.996 20.883 25.775 1.00 0.00 H new ATOM 0 HB ILE A 44 28.585 22.792 27.362 1.00 0.00 H new ATOM 0 HG12 ILE A 44 28.973 19.865 27.163 1.00 0.00 H new ATOM 0 HG13 ILE A 44 29.225 20.768 25.683 1.00 0.00 H new ATOM 0 HG21 ILE A 44 28.244 21.606 29.314 1.00 0.00 H new ATOM 0 HG22 ILE A 44 26.829 22.536 28.764 1.00 0.00 H new ATOM 0 HG23 ILE A 44 26.859 20.767 28.575 1.00 0.00 H new ATOM 0 HD11 ILE A 44 31.332 20.535 26.937 1.00 0.00 H new ATOM 0 HD12 ILE A 44 30.851 22.246 26.845 1.00 0.00 H new ATOM 0 HD13 ILE A 44 30.595 21.329 28.348 1.00 0.00 H new ATOM 718 N PHE A 45 24.702 21.761 26.335 1.00 0.00 N ATOM 719 CA PHE A 45 23.542 22.058 27.159 1.00 0.00 C ATOM 720 C PHE A 45 23.699 21.019 28.274 1.00 0.00 C ATOM 721 O PHE A 45 23.841 19.823 28.013 1.00 0.00 O ATOM 722 CB PHE A 45 22.256 21.768 26.401 1.00 0.00 C ATOM 723 CG PHE A 45 20.961 21.993 27.140 1.00 0.00 C ATOM 724 CD1 PHE A 45 20.404 21.032 28.004 1.00 0.00 C ATOM 725 CD2 PHE A 45 20.437 23.294 27.131 1.00 0.00 C ATOM 726 CE1 PHE A 45 19.339 21.365 28.841 1.00 0.00 C ATOM 727 CE2 PHE A 45 19.353 23.543 27.979 1.00 0.00 C ATOM 728 CZ PHE A 45 18.753 22.635 28.857 1.00 0.00 C ATOM 0 H PHE A 45 24.624 20.915 25.771 1.00 0.00 H new ATOM 0 HA PHE A 45 23.489 23.097 27.486 1.00 0.00 H new ATOM 0 HB2 PHE A 45 22.245 22.386 25.503 1.00 0.00 H new ATOM 0 HB3 PHE A 45 22.283 20.729 26.073 1.00 0.00 H new ATOM 0 HD1 PHE A 45 20.804 20.029 28.019 1.00 0.00 H new ATOM 0 HD2 PHE A 45 20.851 24.066 26.500 1.00 0.00 H new ATOM 0 HE1 PHE A 45 18.950 20.609 29.506 1.00 0.00 H new ATOM 0 HE2 PHE A 45 18.936 24.539 27.953 1.00 0.00 H new ATOM 0 HZ PHE A 45 17.915 22.891 29.489 1.00 0.00 H new ATOM 738 N ALA A 46 23.647 21.433 29.530 1.00 0.00 N ATOM 739 CA ALA A 46 23.593 20.649 30.750 1.00 0.00 C ATOM 740 C ALA A 46 24.955 20.001 31.033 1.00 0.00 C ATOM 741 O ALA A 46 25.929 20.677 31.328 1.00 0.00 O ATOM 742 CB ALA A 46 22.325 19.810 30.862 1.00 0.00 C ATOM 0 H ALA A 46 23.641 22.431 29.740 1.00 0.00 H new ATOM 0 HA ALA A 46 23.454 21.293 31.618 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.343 19.246 31.795 1.00 0.00 H new ATOM 0 HB2 ALA A 46 21.453 20.464 30.850 1.00 0.00 H new ATOM 0 HB3 ALA A 46 22.271 19.118 30.021 1.00 0.00 H new ATOM 748 N GLY A 47 25.015 18.687 30.849 1.00 0.00 N ATOM 749 CA GLY A 47 26.236 17.914 30.745 1.00 0.00 C ATOM 750 C GLY A 47 26.209 16.947 29.549 1.00 0.00 C ATOM 751 O GLY A 47 27.045 16.048 29.447 1.00 0.00 O ATOM 0 H GLY A 47 24.177 18.112 30.765 1.00 0.00 H new ATOM 0 HA2 GLY A 47 27.085 18.590 30.645 1.00 0.00 H new ATOM 0 HA3 GLY A 47 26.386 17.348 31.665 1.00 0.00 H new ATOM 755 N LYS A 48 25.377 17.249 28.559 1.00 0.00 N ATOM 756 CA LYS A 48 25.311 16.705 27.228 1.00 0.00 C ATOM 757 C LYS A 48 26.035 17.637 26.245 1.00 0.00 C ATOM 758 O LYS A 48 25.625 18.743 25.920 1.00 0.00 O ATOM 759 CB LYS A 48 23.850 16.702 26.758 1.00 0.00 C ATOM 760 CG LYS A 48 22.844 16.138 27.755 1.00 0.00 C ATOM 761 CD LYS A 48 21.407 16.402 27.308 1.00 0.00 C ATOM 762 CE LYS A 48 20.307 16.075 28.320 1.00 0.00 C ATOM 763 NZ LYS A 48 18.985 16.212 27.684 1.00 0.00 N ATOM 0 H LYS A 48 24.658 17.960 28.695 1.00 0.00 H new ATOM 0 HA LYS A 48 25.752 15.708 27.250 1.00 0.00 H new ATOM 0 HB2 LYS A 48 23.562 17.725 26.516 1.00 0.00 H new ATOM 0 HB3 LYS A 48 23.784 16.125 25.835 1.00 0.00 H new ATOM 0 HG2 LYS A 48 23.001 15.065 27.865 1.00 0.00 H new ATOM 0 HG3 LYS A 48 23.010 16.586 28.735 1.00 0.00 H new ATOM 0 HD2 LYS A 48 21.321 17.455 27.039 1.00 0.00 H new ATOM 0 HD3 LYS A 48 21.220 15.825 26.402 1.00 0.00 H new ATOM 0 HE2 LYS A 48 20.436 15.060 28.696 1.00 0.00 H new ATOM 0 HE3 LYS A 48 20.379 16.744 29.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 18.242 15.989 28.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 18.862 17.188 27.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 18.917 15.556 26.880 1.00 0.00 H new ATOM 777 N GLN A 49 27.192 17.168 25.788 1.00 0.00 N ATOM 778 CA GLN A 49 28.008 17.782 24.764 1.00 0.00 C ATOM 779 C GLN A 49 27.380 17.376 23.433 1.00 0.00 C ATOM 780 O GLN A 49 27.288 16.191 23.142 1.00 0.00 O ATOM 781 CB GLN A 49 29.429 17.267 25.007 1.00 0.00 C ATOM 782 CG GLN A 49 30.387 17.664 23.886 1.00 0.00 C ATOM 783 CD GLN A 49 31.848 17.337 24.181 1.00 0.00 C ATOM 784 OE1 GLN A 49 32.756 17.615 23.411 1.00 0.00 O ATOM 785 NE2 GLN A 49 32.138 16.826 25.380 1.00 0.00 N ATOM 0 H GLN A 49 27.601 16.304 26.145 1.00 0.00 H new ATOM 0 HA GLN A 49 28.058 18.871 24.769 1.00 0.00 H new ATOM 0 HB2 GLN A 49 29.799 17.660 25.954 1.00 0.00 H new ATOM 0 HB3 GLN A 49 29.409 16.181 25.098 1.00 0.00 H new ATOM 0 HG2 GLN A 49 30.089 17.156 22.969 1.00 0.00 H new ATOM 0 HG3 GLN A 49 30.294 18.734 23.703 1.00 0.00 H new ATOM 0 HE21 GLN A 49 31.387 16.591 26.029 1.00 0.00 H new ATOM 0 HE22 GLN A 49 33.110 16.671 25.647 1.00 0.00 H new ATOM 794 N LEU A 50 26.755 18.353 22.777 1.00 0.00 N ATOM 795 CA LEU A 50 25.760 18.120 21.747 1.00 0.00 C ATOM 796 C LEU A 50 26.412 17.483 20.525 1.00 0.00 C ATOM 797 O LEU A 50 27.554 17.809 20.198 1.00 0.00 O ATOM 798 CB LEU A 50 25.162 19.441 21.272 1.00 0.00 C ATOM 799 CG LEU A 50 24.600 20.247 22.433 1.00 0.00 C ATOM 800 CD1 LEU A 50 23.843 21.453 21.875 1.00 0.00 C ATOM 801 CD2 LEU A 50 23.600 19.494 23.316 1.00 0.00 C ATOM 0 H LEU A 50 26.933 19.342 22.954 1.00 0.00 H new ATOM 0 HA LEU A 50 24.994 17.474 22.175 1.00 0.00 H new ATOM 0 HB2 LEU A 50 25.927 20.024 20.759 1.00 0.00 H new ATOM 0 HB3 LEU A 50 24.372 19.244 20.548 1.00 0.00 H new ATOM 0 HG LEU A 50 25.464 20.505 23.045 1.00 0.00 H new ATOM 0 HD11 LEU A 50 23.435 22.039 22.698 1.00 0.00 H new ATOM 0 HD12 LEU A 50 24.524 22.072 21.291 1.00 0.00 H new ATOM 0 HD13 LEU A 50 23.029 21.108 21.237 1.00 0.00 H new ATOM 0 HD21 LEU A 50 23.255 20.150 24.116 1.00 0.00 H new ATOM 0 HD22 LEU A 50 22.749 19.178 22.713 1.00 0.00 H new ATOM 0 HD23 LEU A 50 24.084 18.618 23.748 1.00 0.00 H new ATOM 813 N GLU A 51 25.672 16.615 19.837 1.00 0.00 N ATOM 814 CA GLU A 51 26.159 15.721 18.798 1.00 0.00 C ATOM 815 C GLU A 51 25.798 16.316 17.436 1.00 0.00 C ATOM 816 O GLU A 51 24.675 16.799 17.276 1.00 0.00 O ATOM 817 CB GLU A 51 25.380 14.408 18.925 1.00 0.00 C ATOM 818 CG GLU A 51 25.723 13.401 20.021 1.00 0.00 C ATOM 819 CD GLU A 51 24.851 12.167 19.999 1.00 0.00 C ATOM 820 OE1 GLU A 51 24.413 11.695 18.931 1.00 0.00 O ATOM 821 OE2 GLU A 51 24.528 11.625 21.084 1.00 0.00 O ATOM 0 H GLU A 51 24.670 16.514 20.000 1.00 0.00 H new ATOM 0 HA GLU A 51 27.235 15.575 18.891 1.00 0.00 H new ATOM 0 HB2 GLU A 51 24.329 14.669 19.047 1.00 0.00 H new ATOM 0 HB3 GLU A 51 25.471 13.888 17.972 1.00 0.00 H new ATOM 0 HG2 GLU A 51 26.766 13.102 19.915 1.00 0.00 H new ATOM 0 HG3 GLU A 51 25.628 13.886 20.992 1.00 0.00 H new ATOM 828 N ASP A 52 26.737 16.330 16.492 1.00 0.00 N ATOM 829 CA ASP A 52 26.938 17.157 15.328 1.00 0.00 C ATOM 830 C ASP A 52 25.781 17.170 14.330 1.00 0.00 C ATOM 831 O ASP A 52 25.365 18.132 13.677 1.00 0.00 O ATOM 832 CB ASP A 52 28.230 16.861 14.563 1.00 0.00 C ATOM 833 CG ASP A 52 29.454 17.271 15.367 1.00 0.00 C ATOM 834 OD1 ASP A 52 29.735 16.651 16.412 1.00 0.00 O ATOM 835 OD2 ASP A 52 30.080 18.339 15.130 1.00 0.00 O ATOM 0 H ASP A 52 27.490 15.644 16.549 1.00 0.00 H new ATOM 0 HA ASP A 52 27.006 18.147 15.779 1.00 0.00 H new ATOM 0 HB2 ASP A 52 28.283 15.797 14.333 1.00 0.00 H new ATOM 0 HB3 ASP A 52 28.222 17.393 13.612 1.00 0.00 H new ATOM 840 N GLY A 53 25.187 15.987 14.187 1.00 0.00 N ATOM 841 CA GLY A 53 24.218 15.646 13.167 1.00 0.00 C ATOM 842 C GLY A 53 22.794 15.580 13.726 1.00 0.00 C ATOM 843 O GLY A 53 21.821 15.648 12.976 1.00 0.00 O ATOM 0 H GLY A 53 25.383 15.207 14.814 1.00 0.00 H new ATOM 0 HA2 GLY A 53 24.259 16.385 12.367 1.00 0.00 H new ATOM 0 HA3 GLY A 53 24.479 14.684 12.726 1.00 0.00 H new ATOM 847 N ARG A 54 22.595 15.551 15.034 1.00 0.00 N ATOM 848 CA ARG A 54 21.313 15.761 15.683 1.00 0.00 C ATOM 849 C ARG A 54 20.933 17.233 15.511 1.00 0.00 C ATOM 850 O ARG A 54 21.795 18.049 15.196 1.00 0.00 O ATOM 851 CB ARG A 54 21.241 15.363 17.159 1.00 0.00 C ATOM 852 CG ARG A 54 20.955 13.886 17.433 1.00 0.00 C ATOM 853 CD ARG A 54 21.163 13.415 18.872 1.00 0.00 C ATOM 854 NE ARG A 54 21.585 12.015 18.894 1.00 0.00 N ATOM 855 CZ ARG A 54 20.801 10.943 19.055 1.00 0.00 C ATOM 856 NH1 ARG A 54 19.507 10.998 19.363 1.00 0.00 N ATOM 857 NH2 ARG A 54 21.362 9.736 18.832 1.00 0.00 N ATOM 0 H ARG A 54 23.350 15.374 15.696 1.00 0.00 H new ATOM 0 HA ARG A 54 20.606 15.090 15.195 1.00 0.00 H new ATOM 0 HB2 ARG A 54 22.186 15.625 17.634 1.00 0.00 H new ATOM 0 HB3 ARG A 54 20.466 15.960 17.640 1.00 0.00 H new ATOM 0 HG2 ARG A 54 19.923 13.678 17.150 1.00 0.00 H new ATOM 0 HG3 ARG A 54 21.591 13.287 16.781 1.00 0.00 H new ATOM 0 HD2 ARG A 54 21.915 14.036 19.360 1.00 0.00 H new ATOM 0 HD3 ARG A 54 20.238 13.532 19.437 1.00 0.00 H new ATOM 0 HE ARG A 54 22.582 11.837 18.774 1.00 0.00 H new ATOM 0 HH11 ARG A 54 19.051 11.901 19.492 1.00 0.00 H new ATOM 0 HH12 ARG A 54 18.971 10.137 19.470 1.00 0.00 H new ATOM 0 HH21 ARG A 54 22.341 9.672 18.554 1.00 0.00 H new ATOM 0 HH22 ARG A 54 20.807 8.887 18.941 1.00 0.00 H new ATOM 871 N THR A 55 19.624 17.476 15.520 1.00 0.00 N ATOM 872 CA THR A 55 18.967 18.774 15.554 1.00 0.00 C ATOM 873 C THR A 55 18.965 19.374 16.956 1.00 0.00 C ATOM 874 O THR A 55 19.495 18.779 17.893 1.00 0.00 O ATOM 875 CB THR A 55 17.605 18.733 14.857 1.00 0.00 C ATOM 876 OG1 THR A 55 16.736 17.856 15.525 1.00 0.00 O ATOM 877 CG2 THR A 55 17.819 18.179 13.443 1.00 0.00 C ATOM 0 H THR A 55 18.948 16.712 15.502 1.00 0.00 H new ATOM 0 HA THR A 55 19.555 19.477 14.964 1.00 0.00 H new ATOM 0 HB THR A 55 17.176 19.735 14.847 1.00 0.00 H new ATOM 0 HG1 THR A 55 16.975 16.931 15.308 1.00 0.00 H new ATOM 0 HG21 THR A 55 16.864 18.138 12.920 1.00 0.00 H new ATOM 0 HG22 THR A 55 18.504 18.829 12.897 1.00 0.00 H new ATOM 0 HG23 THR A 55 18.242 17.176 13.505 1.00 0.00 H new ATOM 885 N LEU A 56 18.414 20.564 17.149 1.00 0.00 N ATOM 886 CA LEU A 56 18.126 21.036 18.491 1.00 0.00 C ATOM 887 C LEU A 56 16.764 20.487 18.940 1.00 0.00 C ATOM 888 O LEU A 56 16.574 20.118 20.095 1.00 0.00 O ATOM 889 CB LEU A 56 18.093 22.560 18.582 1.00 0.00 C ATOM 890 CG LEU A 56 19.320 23.331 18.107 1.00 0.00 C ATOM 891 CD1 LEU A 56 19.108 24.840 17.994 1.00 0.00 C ATOM 892 CD2 LEU A 56 20.512 23.032 19.022 1.00 0.00 C ATOM 0 H LEU A 56 18.161 21.211 16.402 1.00 0.00 H new ATOM 0 HA LEU A 56 18.928 20.680 19.138 1.00 0.00 H new ATOM 0 HB2 LEU A 56 17.235 22.911 18.008 1.00 0.00 H new ATOM 0 HB3 LEU A 56 17.912 22.829 19.623 1.00 0.00 H new ATOM 0 HG LEU A 56 19.521 22.983 17.094 1.00 0.00 H new ATOM 0 HD11 LEU A 56 20.028 25.312 17.650 1.00 0.00 H new ATOM 0 HD12 LEU A 56 18.308 25.043 17.282 1.00 0.00 H new ATOM 0 HD13 LEU A 56 18.836 25.243 18.969 1.00 0.00 H new ATOM 0 HD21 LEU A 56 21.384 23.586 18.676 1.00 0.00 H new ATOM 0 HD22 LEU A 56 20.272 23.333 20.042 1.00 0.00 H new ATOM 0 HD23 LEU A 56 20.729 21.964 19.000 1.00 0.00 H new ATOM 904 N SER A 57 15.836 20.181 18.033 1.00 0.00 N ATOM 905 CA SER A 57 14.543 19.549 18.195 1.00 0.00 C ATOM 906 C SER A 57 14.712 18.076 18.567 1.00 0.00 C ATOM 907 O SER A 57 13.794 17.517 19.173 1.00 0.00 O ATOM 908 CB SER A 57 13.771 19.727 16.891 1.00 0.00 C ATOM 909 OG SER A 57 14.303 19.006 15.801 1.00 0.00 O ATOM 0 H SER A 57 16.002 20.401 17.051 1.00 0.00 H new ATOM 0 HA SER A 57 13.983 20.011 19.008 1.00 0.00 H new ATOM 0 HB2 SER A 57 12.738 19.417 17.048 1.00 0.00 H new ATOM 0 HB3 SER A 57 13.750 20.787 16.636 1.00 0.00 H new ATOM 0 HG SER A 57 15.222 18.733 16.006 1.00 0.00 H new ATOM 915 N ASP A 58 15.832 17.402 18.284 1.00 0.00 N ATOM 916 CA ASP A 58 16.148 16.092 18.801 1.00 0.00 C ATOM 917 C ASP A 58 16.593 16.169 20.265 1.00 0.00 C ATOM 918 O ASP A 58 16.406 15.184 20.982 1.00 0.00 O ATOM 919 CB ASP A 58 17.347 15.402 18.134 1.00 0.00 C ATOM 920 CG ASP A 58 17.185 14.865 16.722 1.00 0.00 C ATOM 921 OD1 ASP A 58 16.333 13.963 16.551 1.00 0.00 O ATOM 922 OD2 ASP A 58 17.813 15.414 15.796 1.00 0.00 O ATOM 0 H ASP A 58 16.556 17.775 17.670 1.00 0.00 H new ATOM 0 HA ASP A 58 15.224 15.541 18.624 1.00 0.00 H new ATOM 0 HB2 ASP A 58 18.174 16.112 18.125 1.00 0.00 H new ATOM 0 HB3 ASP A 58 17.647 14.571 18.772 1.00 0.00 H new ATOM 927 N TYR A 59 17.198 17.265 20.692 1.00 0.00 N ATOM 928 CA TYR A 59 17.650 17.498 22.056 1.00 0.00 C ATOM 929 C TYR A 59 16.515 18.176 22.817 1.00 0.00 C ATOM 930 O TYR A 59 16.591 18.308 24.032 1.00 0.00 O ATOM 931 CB TYR A 59 18.842 18.453 22.016 1.00 0.00 C ATOM 932 CG TYR A 59 20.087 17.602 21.953 1.00 0.00 C ATOM 933 CD1 TYR A 59 20.420 16.697 22.972 1.00 0.00 C ATOM 934 CD2 TYR A 59 20.943 17.819 20.861 1.00 0.00 C ATOM 935 CE1 TYR A 59 21.627 15.994 22.829 1.00 0.00 C ATOM 936 CE2 TYR A 59 22.097 17.047 20.681 1.00 0.00 C ATOM 937 CZ TYR A 59 22.480 16.220 21.746 1.00 0.00 C ATOM 938 OH TYR A 59 23.606 15.462 21.633 1.00 0.00 O ATOM 0 H TYR A 59 17.396 18.051 20.072 1.00 0.00 H new ATOM 0 HA TYR A 59 17.933 16.560 22.535 1.00 0.00 H new ATOM 0 HB2 TYR A 59 18.780 19.111 21.149 1.00 0.00 H new ATOM 0 HB3 TYR A 59 18.855 19.091 22.900 1.00 0.00 H new ATOM 0 HD1 TYR A 59 19.777 16.548 23.827 1.00 0.00 H new ATOM 0 HD2 TYR A 59 20.707 18.595 20.148 1.00 0.00 H new ATOM 0 HE1 TYR A 59 21.902 15.262 23.573 1.00 0.00 H new ATOM 0 HE2 TYR A 59 22.666 17.087 19.764 1.00 0.00 H new ATOM 0 HH TYR A 59 23.408 14.658 21.108 1.00 0.00 H new ATOM 948 N ASN A 60 15.378 18.496 22.193 1.00 0.00 N ATOM 949 CA ASN A 60 14.195 19.142 22.727 1.00 0.00 C ATOM 950 C ASN A 60 14.401 20.541 23.323 1.00 0.00 C ATOM 951 O ASN A 60 13.807 20.951 24.317 1.00 0.00 O ATOM 952 CB ASN A 60 13.363 18.175 23.571 1.00 0.00 C ATOM 953 CG ASN A 60 11.900 18.585 23.589 1.00 0.00 C ATOM 954 OD1 ASN A 60 11.433 19.502 24.254 1.00 0.00 O ATOM 955 ND2 ASN A 60 11.061 17.811 22.907 1.00 0.00 N ATOM 0 H ASN A 60 15.261 18.284 21.202 1.00 0.00 H new ATOM 0 HA ASN A 60 13.581 19.393 21.862 1.00 0.00 H new ATOM 0 HB2 ASN A 60 13.456 17.165 23.171 1.00 0.00 H new ATOM 0 HB3 ASN A 60 13.750 18.151 24.590 1.00 0.00 H new ATOM 0 HD21 ASN A 60 10.057 17.988 22.946 1.00 0.00 H new ATOM 0 HD22 ASN A 60 11.421 17.040 22.345 1.00 0.00 H new ATOM 962 N ILE A 61 15.267 21.276 22.634 1.00 0.00 N ATOM 963 CA ILE A 61 15.732 22.605 22.964 1.00 0.00 C ATOM 964 C ILE A 61 14.629 23.614 22.606 1.00 0.00 C ATOM 965 O ILE A 61 14.345 23.912 21.446 1.00 0.00 O ATOM 966 CB ILE A 61 16.998 22.854 22.146 1.00 0.00 C ATOM 967 CG1 ILE A 61 18.164 22.034 22.684 1.00 0.00 C ATOM 968 CG2 ILE A 61 17.451 24.306 21.979 1.00 0.00 C ATOM 969 CD1 ILE A 61 18.670 22.376 24.097 1.00 0.00 C ATOM 0 H ILE A 61 15.687 20.929 21.772 1.00 0.00 H new ATOM 0 HA ILE A 61 15.956 22.711 24.025 1.00 0.00 H new ATOM 0 HB ILE A 61 16.700 22.536 21.147 1.00 0.00 H new ATOM 0 HG12 ILE A 61 17.872 20.984 22.675 1.00 0.00 H new ATOM 0 HG13 ILE A 61 18.999 22.139 21.991 1.00 0.00 H new ATOM 0 HG21 ILE A 61 18.360 24.337 21.378 1.00 0.00 H new ATOM 0 HG22 ILE A 61 16.667 24.877 21.481 1.00 0.00 H new ATOM 0 HG23 ILE A 61 17.649 24.740 22.959 1.00 0.00 H new ATOM 0 HD11 ILE A 61 19.500 21.718 24.355 1.00 0.00 H new ATOM 0 HD12 ILE A 61 19.007 23.412 24.122 1.00 0.00 H new ATOM 0 HD13 ILE A 61 17.862 22.240 24.816 1.00 0.00 H new ATOM 981 N GLN A 62 13.979 24.103 23.655 1.00 0.00 N ATOM 982 CA GLN A 62 12.913 25.074 23.805 1.00 0.00 C ATOM 983 C GLN A 62 13.502 26.493 23.839 1.00 0.00 C ATOM 984 O GLN A 62 14.728 26.663 23.807 1.00 0.00 O ATOM 985 CB GLN A 62 12.291 24.718 25.155 1.00 0.00 C ATOM 986 CG GLN A 62 11.017 25.528 25.423 1.00 0.00 C ATOM 987 CD GLN A 62 9.752 25.160 24.675 1.00 0.00 C ATOM 988 OE1 GLN A 62 8.778 25.871 24.880 1.00 0.00 O ATOM 989 NE2 GLN A 62 9.726 24.102 23.863 1.00 0.00 N ATOM 0 H GLN A 62 14.242 23.760 24.579 1.00 0.00 H new ATOM 0 HA GLN A 62 12.190 25.053 22.990 1.00 0.00 H new ATOM 0 HB2 GLN A 62 12.057 23.654 25.179 1.00 0.00 H new ATOM 0 HB3 GLN A 62 13.014 24.903 25.949 1.00 0.00 H new ATOM 0 HG2 GLN A 62 10.802 25.463 26.490 1.00 0.00 H new ATOM 0 HG3 GLN A 62 11.238 26.573 25.206 1.00 0.00 H new ATOM 0 HE21 GLN A 62 10.568 23.542 23.727 1.00 0.00 H new ATOM 0 HE22 GLN A 62 8.864 23.853 23.378 1.00 0.00 H new ATOM 998 N LYS A 63 12.661 27.500 23.702 1.00 0.00 N ATOM 999 CA LYS A 63 12.999 28.911 23.568 1.00 0.00 C ATOM 1000 C LYS A 63 13.737 29.399 24.815 1.00 0.00 C ATOM 1001 O LYS A 63 13.248 29.063 25.887 1.00 0.00 O ATOM 1002 CB LYS A 63 11.827 29.807 23.188 1.00 0.00 C ATOM 1003 CG LYS A 63 10.543 29.768 24.025 1.00 0.00 C ATOM 1004 CD LYS A 63 9.265 30.129 23.260 1.00 0.00 C ATOM 1005 CE LYS A 63 7.920 30.245 23.981 1.00 0.00 C ATOM 1006 NZ LYS A 63 6.948 30.915 23.107 1.00 0.00 N ATOM 0 H LYS A 63 11.653 27.347 23.679 1.00 0.00 H new ATOM 0 HA LYS A 63 13.672 28.990 22.714 1.00 0.00 H new ATOM 0 HB2 LYS A 63 12.188 30.836 23.192 1.00 0.00 H new ATOM 0 HB3 LYS A 63 11.554 29.569 22.160 1.00 0.00 H new ATOM 0 HG2 LYS A 63 10.429 28.768 24.443 1.00 0.00 H new ATOM 0 HG3 LYS A 63 10.653 30.454 24.865 1.00 0.00 H new ATOM 0 HD2 LYS A 63 9.447 31.085 22.768 1.00 0.00 H new ATOM 0 HD3 LYS A 63 9.142 29.384 22.474 1.00 0.00 H new ATOM 0 HE2 LYS A 63 7.556 29.255 24.254 1.00 0.00 H new ATOM 0 HE3 LYS A 63 8.040 30.807 24.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 6.035 30.993 23.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 7.294 31.866 22.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 6.826 30.361 22.235 1.00 0.00 H new ATOM 1020 N GLU A 64 14.819 30.165 24.709 1.00 0.00 N ATOM 1021 CA GLU A 64 15.661 30.789 25.720 1.00 0.00 C ATOM 1022 C GLU A 64 16.493 29.822 26.555 1.00 0.00 C ATOM 1023 O GLU A 64 16.823 30.059 27.718 1.00 0.00 O ATOM 1024 CB GLU A 64 14.825 31.780 26.536 1.00 0.00 C ATOM 1025 CG GLU A 64 14.205 32.963 25.801 1.00 0.00 C ATOM 1026 CD GLU A 64 13.574 33.955 26.764 1.00 0.00 C ATOM 1027 OE1 GLU A 64 12.972 33.521 27.765 1.00 0.00 O ATOM 1028 OE2 GLU A 64 13.585 35.164 26.434 1.00 0.00 O ATOM 0 H GLU A 64 15.172 30.392 23.779 1.00 0.00 H new ATOM 0 HA GLU A 64 16.439 31.349 25.201 1.00 0.00 H new ATOM 0 HB2 GLU A 64 14.019 31.224 27.014 1.00 0.00 H new ATOM 0 HB3 GLU A 64 15.456 32.174 27.332 1.00 0.00 H new ATOM 0 HG2 GLU A 64 14.970 33.466 25.210 1.00 0.00 H new ATOM 0 HG3 GLU A 64 13.449 32.602 25.103 1.00 0.00 H new ATOM 1035 N SER A 65 16.764 28.688 25.905 1.00 0.00 N ATOM 1036 CA SER A 65 17.499 27.590 26.486 1.00 0.00 C ATOM 1037 C SER A 65 18.945 28.064 26.357 1.00 0.00 C ATOM 1038 O SER A 65 19.398 28.203 25.223 1.00 0.00 O ATOM 1039 CB SER A 65 17.354 26.256 25.754 1.00 0.00 C ATOM 1040 OG SER A 65 16.174 25.568 26.100 1.00 0.00 O ATOM 0 H SER A 65 16.469 28.516 24.944 1.00 0.00 H new ATOM 0 HA SER A 65 17.141 27.383 27.495 1.00 0.00 H new ATOM 0 HB2 SER A 65 17.363 26.434 24.679 1.00 0.00 H new ATOM 0 HB3 SER A 65 18.215 25.627 25.980 1.00 0.00 H new ATOM 0 HG SER A 65 15.468 25.786 25.457 1.00 0.00 H new ATOM 1046 N THR A 66 19.574 28.272 27.511 1.00 0.00 N ATOM 1047 CA THR A 66 20.962 28.594 27.750 1.00 0.00 C ATOM 1048 C THR A 66 21.788 27.331 27.498 1.00 0.00 C ATOM 1049 O THR A 66 21.303 26.255 27.806 1.00 0.00 O ATOM 1050 CB THR A 66 21.033 29.053 29.209 1.00 0.00 C ATOM 1051 OG1 THR A 66 20.020 30.021 29.401 1.00 0.00 O ATOM 1052 CG2 THR A 66 22.343 29.786 29.499 1.00 0.00 C ATOM 0 H THR A 66 19.060 28.210 28.390 1.00 0.00 H new ATOM 0 HA THR A 66 21.353 29.376 27.099 1.00 0.00 H new ATOM 0 HB THR A 66 20.937 28.174 29.847 1.00 0.00 H new ATOM 0 HG1 THR A 66 20.349 30.899 29.117 1.00 0.00 H new ATOM 0 HG21 THR A 66 22.362 30.099 30.543 1.00 0.00 H new ATOM 0 HG22 THR A 66 23.183 29.120 29.305 1.00 0.00 H new ATOM 0 HG23 THR A 66 22.419 30.663 28.856 1.00 0.00 H new ATOM 1060 N LEU A 67 22.940 27.434 26.832 1.00 0.00 N ATOM 1061 CA LEU A 67 23.929 26.377 26.762 1.00 0.00 C ATOM 1062 C LEU A 67 25.315 27.005 26.928 1.00 0.00 C ATOM 1063 O LEU A 67 25.469 28.203 26.751 1.00 0.00 O ATOM 1064 CB LEU A 67 23.610 25.545 25.522 1.00 0.00 C ATOM 1065 CG LEU A 67 23.421 26.260 24.185 1.00 0.00 C ATOM 1066 CD1 LEU A 67 24.722 26.851 23.653 1.00 0.00 C ATOM 1067 CD2 LEU A 67 22.803 25.257 23.197 1.00 0.00 C ATOM 0 H LEU A 67 23.209 28.274 26.319 1.00 0.00 H new ATOM 0 HA LEU A 67 23.912 25.645 27.569 1.00 0.00 H new ATOM 0 HB2 LEU A 67 24.412 24.818 25.397 1.00 0.00 H new ATOM 0 HB3 LEU A 67 22.699 24.983 25.727 1.00 0.00 H new ATOM 0 HG LEU A 67 22.753 27.111 24.320 1.00 0.00 H new ATOM 0 HD11 LEU A 67 24.534 27.348 22.701 1.00 0.00 H new ATOM 0 HD12 LEU A 67 25.113 27.574 24.369 1.00 0.00 H new ATOM 0 HD13 LEU A 67 25.451 26.054 23.508 1.00 0.00 H new ATOM 0 HD21 LEU A 67 22.656 25.741 22.231 1.00 0.00 H new ATOM 0 HD22 LEU A 67 23.472 24.405 23.078 1.00 0.00 H new ATOM 0 HD23 LEU A 67 21.842 24.914 23.580 1.00 0.00 H new ATOM 1079 N HIS A 68 26.424 26.270 26.966 1.00 0.00 N ATOM 1080 CA HIS A 68 27.794 26.659 27.236 1.00 0.00 C ATOM 1081 C HIS A 68 28.607 26.232 26.021 1.00 0.00 C ATOM 1082 O HIS A 68 28.681 25.068 25.624 1.00 0.00 O ATOM 1083 CB HIS A 68 28.306 25.970 28.502 1.00 0.00 C ATOM 1084 CG HIS A 68 29.704 26.175 29.012 1.00 0.00 C ATOM 1085 ND1 HIS A 68 30.288 27.442 28.995 1.00 0.00 N ATOM 1086 CD2 HIS A 68 30.633 25.219 29.316 1.00 0.00 C ATOM 1087 CE1 HIS A 68 31.539 27.209 29.373 1.00 0.00 C ATOM 1088 NE2 HIS A 68 31.738 25.934 29.744 1.00 0.00 N ATOM 0 H HIS A 68 26.369 25.268 26.785 1.00 0.00 H new ATOM 0 HA HIS A 68 27.876 27.733 27.404 1.00 0.00 H new ATOM 0 HB2 HIS A 68 27.632 26.256 29.310 1.00 0.00 H new ATOM 0 HB3 HIS A 68 28.182 24.898 28.348 1.00 0.00 H new ATOM 0 HD2 HIS A 68 30.528 24.147 29.239 1.00 0.00 H new ATOM 0 HE1 HIS A 68 32.312 27.963 29.381 1.00 0.00 H new ATOM 0 HE2 HIS A 68 32.546 25.564 30.244 1.00 0.00 H new ATOM 1096 N LEU A 69 29.285 27.197 25.400 1.00 0.00 N ATOM 1097 CA LEU A 69 30.242 26.943 24.339 1.00 0.00 C ATOM 1098 C LEU A 69 31.633 26.950 24.979 1.00 0.00 C ATOM 1099 O LEU A 69 32.035 27.820 25.737 1.00 0.00 O ATOM 1100 CB LEU A 69 30.303 28.057 23.307 1.00 0.00 C ATOM 1101 CG LEU A 69 31.308 28.027 22.149 1.00 0.00 C ATOM 1102 CD1 LEU A 69 31.252 26.826 21.208 1.00 0.00 C ATOM 1103 CD2 LEU A 69 31.166 29.314 21.339 1.00 0.00 C ATOM 0 H LEU A 69 29.179 28.186 25.627 1.00 0.00 H new ATOM 0 HA LEU A 69 29.946 26.010 23.859 1.00 0.00 H new ATOM 0 HB2 LEU A 69 29.311 28.131 22.862 1.00 0.00 H new ATOM 0 HB3 LEU A 69 30.477 28.984 23.853 1.00 0.00 H new ATOM 0 HG LEU A 69 32.280 27.933 22.634 1.00 0.00 H new ATOM 0 HD11 LEU A 69 32.015 26.932 20.437 1.00 0.00 H new ATOM 0 HD12 LEU A 69 31.433 25.912 21.774 1.00 0.00 H new ATOM 0 HD13 LEU A 69 30.268 26.775 20.741 1.00 0.00 H new ATOM 0 HD21 LEU A 69 31.876 29.304 20.512 1.00 0.00 H new ATOM 0 HD22 LEU A 69 30.152 29.386 20.945 1.00 0.00 H new ATOM 0 HD23 LEU A 69 31.368 30.172 21.980 1.00 0.00 H new ATOM 1115 N VAL A 70 32.428 25.938 24.635 1.00 0.00 N ATOM 1116 CA VAL A 70 33.858 25.803 24.791 1.00 0.00 C ATOM 1117 C VAL A 70 34.374 26.213 23.412 1.00 0.00 C ATOM 1118 O VAL A 70 33.830 25.680 22.440 1.00 0.00 O ATOM 1119 CB VAL A 70 34.366 24.389 25.087 1.00 0.00 C ATOM 1120 CG1 VAL A 70 35.889 24.303 25.124 1.00 0.00 C ATOM 1121 CG2 VAL A 70 33.750 23.763 26.338 1.00 0.00 C ATOM 0 H VAL A 70 32.033 25.108 24.193 1.00 0.00 H new ATOM 0 HA VAL A 70 34.193 26.391 25.646 1.00 0.00 H new ATOM 0 HB VAL A 70 34.023 23.793 24.241 1.00 0.00 H new ATOM 0 HG11 VAL A 70 36.190 23.278 25.338 1.00 0.00 H new ATOM 0 HG12 VAL A 70 36.294 24.607 24.159 1.00 0.00 H new ATOM 0 HG13 VAL A 70 36.272 24.963 25.902 1.00 0.00 H new ATOM 0 HG21 VAL A 70 34.158 22.763 26.483 1.00 0.00 H new ATOM 0 HG22 VAL A 70 33.984 24.379 27.206 1.00 0.00 H new ATOM 0 HG23 VAL A 70 32.668 23.700 26.218 1.00 0.00 H new ATOM 1131 N LEU A 71 35.325 27.130 23.267 1.00 0.00 N ATOM 1132 CA LEU A 71 36.088 27.385 22.054 1.00 0.00 C ATOM 1133 C LEU A 71 37.533 27.682 22.426 1.00 0.00 C ATOM 1134 O LEU A 71 37.850 27.785 23.609 1.00 0.00 O ATOM 1135 CB LEU A 71 35.460 28.498 21.221 1.00 0.00 C ATOM 1136 CG LEU A 71 35.466 29.936 21.755 1.00 0.00 C ATOM 1137 CD1 LEU A 71 35.198 30.915 20.623 1.00 0.00 C ATOM 1138 CD2 LEU A 71 34.264 30.162 22.679 1.00 0.00 C ATOM 0 H LEU A 71 35.597 27.746 24.033 1.00 0.00 H new ATOM 0 HA LEU A 71 36.072 26.496 21.423 1.00 0.00 H new ATOM 0 HB2 LEU A 71 35.964 28.506 20.254 1.00 0.00 H new ATOM 0 HB3 LEU A 71 34.422 28.222 21.037 1.00 0.00 H new ATOM 0 HG LEU A 71 36.429 30.082 22.244 1.00 0.00 H new ATOM 0 HD11 LEU A 71 35.204 31.933 21.013 1.00 0.00 H new ATOM 0 HD12 LEU A 71 35.972 30.813 19.863 1.00 0.00 H new ATOM 0 HD13 LEU A 71 34.225 30.702 20.181 1.00 0.00 H new ATOM 0 HD21 LEU A 71 34.279 31.186 23.052 1.00 0.00 H new ATOM 0 HD22 LEU A 71 33.341 29.991 22.124 1.00 0.00 H new ATOM 0 HD23 LEU A 71 34.316 29.469 23.519 1.00 0.00 H new