USER MOD reduce.3.24.130724 H: found=0, std=0, add=721, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 720 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -148:sc= -0.805 (180deg=-1.1) USER MOD Single : A 4 THR OG1 : rot -35:sc= 0.336 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.125 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 13 SER OG : rot -83:sc= -1.57 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -3.73! C(o=-3.7!,f=-6.9!) USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 CYS SG : rot 84:sc= 0.513 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 MET CE :methyl -142:sc= -6.35! (180deg=-9.93!) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot -152:sc= 0.756! USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot -150:sc= -0.876 USER MOD Single : A 65 SER OG : rot 65:sc= 0.798 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : B 8 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0294) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 THR OG1 : rot 84:sc= 0.447 USER MOD Single : B 22 GLN : amide:sc= -0.112 K(o=-0.11,f=-2.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.202 -11.488 -1.615 1.00 0.00 N ATOM 2 CA MET A 1 0.873 -10.487 -1.880 1.00 0.00 C ATOM 3 C MET A 1 0.459 -9.115 -1.342 1.00 0.00 C ATOM 4 O MET A 1 1.285 -8.256 -1.104 1.00 0.00 O ATOM 5 CB MET A 1 1.012 -10.448 -3.401 1.00 0.00 C ATOM 6 CG MET A 1 -0.239 -9.815 -4.013 1.00 0.00 C ATOM 7 SD MET A 1 -0.727 -10.745 -5.488 1.00 0.00 S ATOM 8 CE MET A 1 -1.067 -9.321 -6.552 1.00 0.00 C ATOM 0 H1 MET A 1 0.225 -12.424 -1.461 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.736 -11.208 -0.768 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.845 -11.531 -2.431 1.00 0.00 H new ATOM 0 HA MET A 1 1.812 -10.749 -1.393 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.896 -9.875 -3.681 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.149 -11.457 -3.790 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.051 -9.813 -3.286 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.043 -8.775 -4.274 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.390 -9.669 -7.533 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.854 -8.713 -6.105 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.162 -8.723 -6.659 1.00 0.00 H new ATOM 18 N ALA A 2 -0.814 -8.903 -1.148 1.00 0.00 N ATOM 19 CA ALA A 2 -1.280 -7.587 -0.626 1.00 0.00 C ATOM 20 C ALA A 2 -0.640 -7.302 0.736 1.00 0.00 C ATOM 21 O ALA A 2 0.278 -7.978 1.156 1.00 0.00 O ATOM 22 CB ALA A 2 -2.795 -7.729 -0.488 1.00 0.00 C ATOM 0 H ALA A 2 -1.551 -9.584 -1.328 1.00 0.00 H new ATOM 0 HA ALA A 2 -1.007 -6.762 -1.284 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -3.215 -6.798 -0.107 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -3.230 -7.951 -1.462 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -3.023 -8.539 0.204 1.00 0.00 H new ATOM 28 N ASP A 3 -1.121 -6.308 1.430 1.00 0.00 N ATOM 29 CA ASP A 3 -0.541 -5.982 2.765 1.00 0.00 C ATOM 30 C ASP A 3 -1.660 -5.786 3.792 1.00 0.00 C ATOM 31 O ASP A 3 -2.194 -4.705 3.945 1.00 0.00 O ATOM 32 CB ASP A 3 0.232 -4.679 2.555 1.00 0.00 C ATOM 33 CG ASP A 3 -0.732 -3.579 2.108 1.00 0.00 C ATOM 34 OD1 ASP A 3 -1.561 -3.856 1.258 1.00 0.00 O ATOM 35 OD2 ASP A 3 -0.625 -2.479 2.624 1.00 0.00 O ATOM 0 H ASP A 3 -1.890 -5.707 1.132 1.00 0.00 H new ATOM 0 HA ASP A 3 0.101 -6.778 3.143 1.00 0.00 H new ATOM 0 HB2 ASP A 3 0.730 -4.387 3.479 1.00 0.00 H new ATOM 0 HB3 ASP A 3 1.010 -4.822 1.805 1.00 0.00 H new ATOM 40 N THR A 4 -2.018 -6.825 4.496 1.00 0.00 N ATOM 41 CA THR A 4 -3.103 -6.701 5.512 1.00 0.00 C ATOM 42 C THR A 4 -2.755 -7.522 6.757 1.00 0.00 C ATOM 43 O THR A 4 -3.569 -7.702 7.641 1.00 0.00 O ATOM 44 CB THR A 4 -4.350 -7.263 4.829 1.00 0.00 C ATOM 45 OG1 THR A 4 -5.486 -7.020 5.647 1.00 0.00 O ATOM 46 CG2 THR A 4 -4.185 -8.769 4.616 1.00 0.00 C ATOM 0 H THR A 4 -1.606 -7.755 4.412 1.00 0.00 H new ATOM 0 HA THR A 4 -3.248 -5.672 5.840 1.00 0.00 H new ATOM 0 HB THR A 4 -4.486 -6.776 3.863 1.00 0.00 H new ATOM 0 HG1 THR A 4 -5.229 -7.084 6.591 1.00 0.00 H new ATOM 0 HG21 THR A 4 -5.075 -9.167 4.129 1.00 0.00 H new ATOM 0 HG22 THR A 4 -3.314 -8.954 3.988 1.00 0.00 H new ATOM 0 HG23 THR A 4 -4.048 -9.260 5.580 1.00 0.00 H new ATOM 54 N ASP A 5 -1.553 -8.023 6.831 1.00 0.00 N ATOM 55 CA ASP A 5 -1.155 -8.833 8.019 1.00 0.00 C ATOM 56 C ASP A 5 0.191 -8.348 8.565 1.00 0.00 C ATOM 57 O ASP A 5 0.749 -7.376 8.096 1.00 0.00 O ATOM 58 CB ASP A 5 -1.037 -10.265 7.498 1.00 0.00 C ATOM 59 CG ASP A 5 -1.940 -11.185 8.322 1.00 0.00 C ATOM 60 OD1 ASP A 5 -3.043 -10.772 8.640 1.00 0.00 O ATOM 61 OD2 ASP A 5 -1.512 -12.288 8.620 1.00 0.00 O ATOM 0 H ASP A 5 -0.829 -7.907 6.122 1.00 0.00 H new ATOM 0 HA ASP A 5 -1.875 -8.752 8.834 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -1.322 -10.305 6.447 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -0.002 -10.602 7.561 1.00 0.00 H new ATOM 66 N THR A 6 0.716 -9.020 9.554 1.00 0.00 N ATOM 67 CA THR A 6 2.025 -8.598 10.130 1.00 0.00 C ATOM 68 C THR A 6 3.166 -9.393 9.490 1.00 0.00 C ATOM 69 O THR A 6 4.165 -8.840 9.074 1.00 0.00 O ATOM 70 CB THR A 6 1.920 -8.916 11.622 1.00 0.00 C ATOM 71 OG1 THR A 6 0.988 -9.970 11.815 1.00 0.00 O ATOM 72 CG2 THR A 6 1.450 -7.672 12.378 1.00 0.00 C ATOM 0 H THR A 6 0.296 -9.842 9.987 1.00 0.00 H new ATOM 0 HA THR A 6 2.235 -7.543 9.951 1.00 0.00 H new ATOM 0 HB THR A 6 2.896 -9.220 11.999 1.00 0.00 H new ATOM 0 HG1 THR A 6 0.921 -10.176 12.771 1.00 0.00 H new ATOM 0 HG21 THR A 6 1.375 -7.899 13.441 1.00 0.00 H new ATOM 0 HG22 THR A 6 2.166 -6.864 12.229 1.00 0.00 H new ATOM 0 HG23 THR A 6 0.473 -7.366 12.003 1.00 0.00 H new ATOM 80 N ALA A 7 3.023 -10.687 9.403 1.00 0.00 N ATOM 81 CA ALA A 7 4.097 -11.517 8.787 1.00 0.00 C ATOM 82 C ALA A 7 4.289 -11.114 7.323 1.00 0.00 C ATOM 83 O ALA A 7 5.394 -10.897 6.866 1.00 0.00 O ATOM 84 CB ALA A 7 3.594 -12.957 8.885 1.00 0.00 C ATOM 0 H ALA A 7 2.209 -11.206 9.732 1.00 0.00 H new ATOM 0 HA ALA A 7 5.058 -11.390 9.285 1.00 0.00 H new ATOM 0 HB1 ALA A 7 4.333 -13.631 8.451 1.00 0.00 H new ATOM 0 HB2 ALA A 7 3.437 -13.217 9.932 1.00 0.00 H new ATOM 0 HB3 ALA A 7 2.653 -13.052 8.343 1.00 0.00 H new ATOM 90 N GLU A 8 3.216 -11.002 6.590 1.00 0.00 N ATOM 91 CA GLU A 8 3.329 -10.602 5.160 1.00 0.00 C ATOM 92 C GLU A 8 4.109 -9.290 5.049 1.00 0.00 C ATOM 93 O GLU A 8 4.866 -9.081 4.121 1.00 0.00 O ATOM 94 CB GLU A 8 1.888 -10.417 4.684 1.00 0.00 C ATOM 95 CG GLU A 8 1.846 -10.449 3.155 1.00 0.00 C ATOM 96 CD GLU A 8 0.438 -10.091 2.676 1.00 0.00 C ATOM 97 OE1 GLU A 8 -0.185 -9.253 3.306 1.00 0.00 O ATOM 98 OE2 GLU A 8 0.007 -10.662 1.689 1.00 0.00 O ATOM 0 H GLU A 8 2.266 -11.170 6.920 1.00 0.00 H new ATOM 0 HA GLU A 8 3.859 -11.341 4.560 1.00 0.00 H new ATOM 0 HB2 GLU A 8 1.255 -11.205 5.092 1.00 0.00 H new ATOM 0 HB3 GLU A 8 1.492 -9.469 5.049 1.00 0.00 H new ATOM 0 HG2 GLU A 8 2.571 -9.745 2.746 1.00 0.00 H new ATOM 0 HG3 GLU A 8 2.124 -11.439 2.794 1.00 0.00 H new ATOM 105 N GLN A 9 3.924 -8.403 5.989 1.00 0.00 N ATOM 106 CA GLN A 9 4.650 -7.101 5.940 1.00 0.00 C ATOM 107 C GLN A 9 6.163 -7.334 6.001 1.00 0.00 C ATOM 108 O GLN A 9 6.922 -6.740 5.260 1.00 0.00 O ATOM 109 CB GLN A 9 4.176 -6.339 7.177 1.00 0.00 C ATOM 110 CG GLN A 9 3.523 -5.023 6.749 1.00 0.00 C ATOM 111 CD GLN A 9 3.508 -4.053 7.932 1.00 0.00 C ATOM 112 OE1 GLN A 9 3.262 -4.448 9.054 1.00 0.00 O ATOM 113 NE2 GLN A 9 3.762 -2.789 7.726 1.00 0.00 N ATOM 0 H GLN A 9 3.302 -8.523 6.788 1.00 0.00 H new ATOM 0 HA GLN A 9 4.451 -6.552 5.020 1.00 0.00 H new ATOM 0 HB2 GLN A 9 3.464 -6.944 7.739 1.00 0.00 H new ATOM 0 HB3 GLN A 9 5.019 -6.140 7.839 1.00 0.00 H new ATOM 0 HG2 GLN A 9 4.072 -4.587 5.914 1.00 0.00 H new ATOM 0 HG3 GLN A 9 2.506 -5.205 6.401 1.00 0.00 H new ATOM 0 HE21 GLN A 9 3.969 -2.457 6.784 1.00 0.00 H new ATOM 0 HE22 GLN A 9 3.754 -2.133 8.507 1.00 0.00 H new ATOM 122 N VAL A 10 6.609 -8.194 6.876 1.00 0.00 N ATOM 123 CA VAL A 10 8.074 -8.461 6.977 1.00 0.00 C ATOM 124 C VAL A 10 8.589 -9.056 5.663 1.00 0.00 C ATOM 125 O VAL A 10 9.650 -8.705 5.185 1.00 0.00 O ATOM 126 CB VAL A 10 8.216 -9.469 8.118 1.00 0.00 C ATOM 127 CG1 VAL A 10 9.698 -9.733 8.384 1.00 0.00 C ATOM 128 CG2 VAL A 10 7.565 -8.904 9.382 1.00 0.00 C ATOM 0 H VAL A 10 6.025 -8.722 7.524 1.00 0.00 H new ATOM 0 HA VAL A 10 8.650 -7.555 7.164 1.00 0.00 H new ATOM 0 HB VAL A 10 7.724 -10.402 7.841 1.00 0.00 H new ATOM 0 HG11 VAL A 10 9.799 -10.452 9.197 1.00 0.00 H new ATOM 0 HG12 VAL A 10 10.163 -10.136 7.484 1.00 0.00 H new ATOM 0 HG13 VAL A 10 10.190 -8.800 8.660 1.00 0.00 H new ATOM 0 HG21 VAL A 10 7.666 -9.622 10.196 1.00 0.00 H new ATOM 0 HG22 VAL A 10 8.056 -7.971 9.658 1.00 0.00 H new ATOM 0 HG23 VAL A 10 6.508 -8.715 9.194 1.00 0.00 H new ATOM 138 N ILE A 11 7.842 -9.950 5.074 1.00 0.00 N ATOM 139 CA ILE A 11 8.283 -10.562 3.789 1.00 0.00 C ATOM 140 C ILE A 11 8.468 -9.471 2.734 1.00 0.00 C ATOM 141 O ILE A 11 9.469 -9.424 2.046 1.00 0.00 O ATOM 142 CB ILE A 11 7.151 -11.511 3.392 1.00 0.00 C ATOM 143 CG1 ILE A 11 7.161 -12.731 4.316 1.00 0.00 C ATOM 144 CG2 ILE A 11 7.349 -11.967 1.945 1.00 0.00 C ATOM 145 CD1 ILE A 11 5.971 -13.633 3.986 1.00 0.00 C ATOM 0 H ILE A 11 6.945 -10.283 5.428 1.00 0.00 H new ATOM 0 HA ILE A 11 9.234 -11.086 3.880 1.00 0.00 H new ATOM 0 HB ILE A 11 6.196 -10.993 3.482 1.00 0.00 H new ATOM 0 HG12 ILE A 11 8.093 -13.283 4.196 1.00 0.00 H new ATOM 0 HG13 ILE A 11 7.111 -12.412 5.357 1.00 0.00 H new ATOM 0 HG21 ILE A 11 6.542 -12.643 1.663 1.00 0.00 H new ATOM 0 HG22 ILE A 11 7.342 -11.099 1.286 1.00 0.00 H new ATOM 0 HG23 ILE A 11 8.304 -12.484 1.854 1.00 0.00 H new ATOM 0 HD11 ILE A 11 5.979 -14.502 4.645 1.00 0.00 H new ATOM 0 HD12 ILE A 11 5.044 -13.078 4.128 1.00 0.00 H new ATOM 0 HD13 ILE A 11 6.041 -13.963 2.950 1.00 0.00 H new ATOM 157 N ALA A 12 7.518 -8.585 2.609 1.00 0.00 N ATOM 158 CA ALA A 12 7.652 -7.491 1.608 1.00 0.00 C ATOM 159 C ALA A 12 8.929 -6.703 1.898 1.00 0.00 C ATOM 160 O ALA A 12 9.681 -6.365 1.005 1.00 0.00 O ATOM 161 CB ALA A 12 6.417 -6.613 1.806 1.00 0.00 C ATOM 0 H ALA A 12 6.657 -8.572 3.156 1.00 0.00 H new ATOM 0 HA ALA A 12 7.717 -7.858 0.584 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.445 -5.782 1.101 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.518 -7.205 1.634 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.406 -6.225 2.824 1.00 0.00 H new ATOM 167 N SER A 13 9.188 -6.427 3.147 1.00 0.00 N ATOM 168 CA SER A 13 10.427 -5.684 3.500 1.00 0.00 C ATOM 169 C SER A 13 11.642 -6.565 3.209 1.00 0.00 C ATOM 170 O SER A 13 12.661 -6.103 2.735 1.00 0.00 O ATOM 171 CB SER A 13 10.312 -5.399 4.998 1.00 0.00 C ATOM 172 OG SER A 13 9.312 -6.238 5.562 1.00 0.00 O ATOM 0 H SER A 13 8.595 -6.684 3.936 1.00 0.00 H new ATOM 0 HA SER A 13 10.545 -4.763 2.929 1.00 0.00 H new ATOM 0 HB2 SER A 13 11.270 -5.576 5.488 1.00 0.00 H new ATOM 0 HB3 SER A 13 10.059 -4.352 5.162 1.00 0.00 H new ATOM 0 HG SER A 13 8.430 -5.834 5.424 1.00 0.00 H new ATOM 178 N PHE A 14 11.534 -7.841 3.477 1.00 0.00 N ATOM 179 CA PHE A 14 12.678 -8.757 3.201 1.00 0.00 C ATOM 180 C PHE A 14 12.883 -8.883 1.691 1.00 0.00 C ATOM 181 O PHE A 14 13.993 -8.843 1.200 1.00 0.00 O ATOM 182 CB PHE A 14 12.269 -10.101 3.805 1.00 0.00 C ATOM 183 CG PHE A 14 12.899 -10.251 5.169 1.00 0.00 C ATOM 184 CD1 PHE A 14 14.260 -9.973 5.345 1.00 0.00 C ATOM 185 CD2 PHE A 14 12.123 -10.669 6.257 1.00 0.00 C ATOM 186 CE1 PHE A 14 14.845 -10.112 6.610 1.00 0.00 C ATOM 187 CE2 PHE A 14 12.709 -10.807 7.522 1.00 0.00 C ATOM 188 CZ PHE A 14 14.070 -10.530 7.697 1.00 0.00 C ATOM 0 H PHE A 14 10.706 -8.286 3.873 1.00 0.00 H new ATOM 0 HA PHE A 14 13.615 -8.396 3.625 1.00 0.00 H new ATOM 0 HB2 PHE A 14 11.184 -10.161 3.885 1.00 0.00 H new ATOM 0 HB3 PHE A 14 12.586 -10.916 3.154 1.00 0.00 H new ATOM 0 HD1 PHE A 14 14.859 -9.651 4.506 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.074 -10.885 6.121 1.00 0.00 H new ATOM 0 HE1 PHE A 14 15.894 -9.896 6.746 1.00 0.00 H new ATOM 0 HE2 PHE A 14 12.111 -11.127 8.362 1.00 0.00 H new ATOM 0 HZ PHE A 14 14.522 -10.639 8.672 1.00 0.00 H new ATOM 198 N ARG A 15 11.819 -9.024 0.949 1.00 0.00 N ATOM 199 CA ARG A 15 11.955 -9.140 -0.530 1.00 0.00 C ATOM 200 C ARG A 15 12.770 -7.962 -1.063 1.00 0.00 C ATOM 201 O ARG A 15 13.678 -8.127 -1.855 1.00 0.00 O ATOM 202 CB ARG A 15 10.525 -9.093 -1.069 1.00 0.00 C ATOM 203 CG ARG A 15 10.426 -9.950 -2.331 1.00 0.00 C ATOM 204 CD ARG A 15 9.147 -9.596 -3.092 1.00 0.00 C ATOM 205 NE ARG A 15 9.322 -10.204 -4.439 1.00 0.00 N ATOM 206 CZ ARG A 15 8.481 -9.928 -5.398 1.00 0.00 C ATOM 207 NH1 ARG A 15 7.476 -9.123 -5.179 1.00 0.00 N ATOM 208 NH2 ARG A 15 8.643 -10.460 -6.579 1.00 0.00 N ATOM 0 H ARG A 15 10.863 -9.064 1.302 1.00 0.00 H new ATOM 0 HA ARG A 15 12.467 -10.053 -0.833 1.00 0.00 H new ATOM 0 HB2 ARG A 15 9.829 -9.457 -0.314 1.00 0.00 H new ATOM 0 HB3 ARG A 15 10.243 -8.064 -1.293 1.00 0.00 H new ATOM 0 HG2 ARG A 15 11.297 -9.783 -2.965 1.00 0.00 H new ATOM 0 HG3 ARG A 15 10.423 -11.007 -2.066 1.00 0.00 H new ATOM 0 HD2 ARG A 15 8.265 -9.995 -2.590 1.00 0.00 H new ATOM 0 HD3 ARG A 15 9.014 -8.516 -3.160 1.00 0.00 H new ATOM 0 HE ARG A 15 10.102 -10.838 -4.613 1.00 0.00 H new ATOM 0 HH11 ARG A 15 7.347 -8.708 -4.256 1.00 0.00 H new ATOM 0 HH12 ARG A 15 6.821 -8.909 -5.931 1.00 0.00 H new ATOM 0 HH21 ARG A 15 9.426 -11.090 -6.751 1.00 0.00 H new ATOM 0 HH22 ARG A 15 7.986 -10.245 -7.330 1.00 0.00 H new ATOM 222 N ILE A 16 12.458 -6.770 -0.629 1.00 0.00 N ATOM 223 CA ILE A 16 13.222 -5.583 -1.104 1.00 0.00 C ATOM 224 C ILE A 16 14.707 -5.757 -0.770 1.00 0.00 C ATOM 225 O ILE A 16 15.571 -5.513 -1.588 1.00 0.00 O ATOM 226 CB ILE A 16 12.635 -4.399 -0.334 1.00 0.00 C ATOM 227 CG1 ILE A 16 11.279 -4.022 -0.935 1.00 0.00 C ATOM 228 CG2 ILE A 16 13.585 -3.204 -0.433 1.00 0.00 C ATOM 229 CD1 ILE A 16 10.520 -3.123 0.042 1.00 0.00 C ATOM 0 H ILE A 16 11.708 -6.568 0.033 1.00 0.00 H new ATOM 0 HA ILE A 16 13.147 -5.442 -2.182 1.00 0.00 H new ATOM 0 HB ILE A 16 12.506 -4.675 0.713 1.00 0.00 H new ATOM 0 HG12 ILE A 16 11.421 -3.506 -1.885 1.00 0.00 H new ATOM 0 HG13 ILE A 16 10.699 -4.921 -1.144 1.00 0.00 H new ATOM 0 HG21 ILE A 16 13.167 -2.360 0.116 1.00 0.00 H new ATOM 0 HG22 ILE A 16 14.552 -3.471 -0.006 1.00 0.00 H new ATOM 0 HG23 ILE A 16 13.715 -2.928 -1.479 1.00 0.00 H new ATOM 0 HD11 ILE A 16 9.554 -2.854 -0.386 1.00 0.00 H new ATOM 0 HD12 ILE A 16 10.366 -3.655 0.981 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.099 -2.218 0.228 1.00 0.00 H new ATOM 241 N LEU A 17 15.005 -6.186 0.427 1.00 0.00 N ATOM 242 CA LEU A 17 16.431 -6.384 0.811 1.00 0.00 C ATOM 243 C LEU A 17 17.057 -7.468 -0.068 1.00 0.00 C ATOM 244 O LEU A 17 18.178 -7.345 -0.520 1.00 0.00 O ATOM 245 CB LEU A 17 16.389 -6.832 2.272 1.00 0.00 C ATOM 246 CG LEU A 17 16.989 -5.740 3.158 1.00 0.00 C ATOM 247 CD1 LEU A 17 16.047 -4.536 3.194 1.00 0.00 C ATOM 248 CD2 LEU A 17 17.178 -6.281 4.577 1.00 0.00 C ATOM 0 H LEU A 17 14.324 -6.407 1.153 1.00 0.00 H new ATOM 0 HA LEU A 17 17.029 -5.481 0.683 1.00 0.00 H new ATOM 0 HB2 LEU A 17 15.361 -7.034 2.572 1.00 0.00 H new ATOM 0 HB3 LEU A 17 16.945 -7.761 2.395 1.00 0.00 H new ATOM 0 HG LEU A 17 17.954 -5.434 2.753 1.00 0.00 H new ATOM 0 HD11 LEU A 17 16.475 -3.758 3.826 1.00 0.00 H new ATOM 0 HD12 LEU A 17 15.912 -4.150 2.184 1.00 0.00 H new ATOM 0 HD13 LEU A 17 15.082 -4.841 3.598 1.00 0.00 H new ATOM 0 HD21 LEU A 17 17.606 -5.503 5.209 1.00 0.00 H new ATOM 0 HD22 LEU A 17 16.213 -6.587 4.981 1.00 0.00 H new ATOM 0 HD23 LEU A 17 17.850 -7.139 4.553 1.00 0.00 H new ATOM 260 N ALA A 18 16.337 -8.528 -0.318 1.00 0.00 N ATOM 261 CA ALA A 18 16.886 -9.618 -1.174 1.00 0.00 C ATOM 262 C ALA A 18 16.851 -9.197 -2.647 1.00 0.00 C ATOM 263 O ALA A 18 17.282 -9.923 -3.521 1.00 0.00 O ATOM 264 CB ALA A 18 15.964 -10.814 -0.936 1.00 0.00 C ATOM 0 H ALA A 18 15.393 -8.686 0.033 1.00 0.00 H new ATOM 0 HA ALA A 18 17.923 -9.851 -0.933 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.304 -11.660 -1.534 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.984 -11.084 0.120 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.946 -10.552 -1.224 1.00 0.00 H new ATOM 270 N SER A 19 16.340 -8.027 -2.927 1.00 0.00 N ATOM 271 CA SER A 19 16.276 -7.557 -4.341 1.00 0.00 C ATOM 272 C SER A 19 15.289 -8.408 -5.143 1.00 0.00 C ATOM 273 O SER A 19 15.657 -9.073 -6.091 1.00 0.00 O ATOM 274 CB SER A 19 17.695 -7.725 -4.882 1.00 0.00 C ATOM 275 OG SER A 19 18.158 -6.476 -5.380 1.00 0.00 O ATOM 0 H SER A 19 15.964 -7.377 -2.237 1.00 0.00 H new ATOM 0 HA SER A 19 15.933 -6.525 -4.414 1.00 0.00 H new ATOM 0 HB2 SER A 19 18.357 -8.084 -4.094 1.00 0.00 H new ATOM 0 HB3 SER A 19 17.708 -8.473 -5.674 1.00 0.00 H new ATOM 0 HG SER A 19 19.069 -6.579 -5.726 1.00 0.00 H new ATOM 281 N ASP A 20 14.039 -8.390 -4.774 1.00 0.00 N ATOM 282 CA ASP A 20 13.028 -9.196 -5.519 1.00 0.00 C ATOM 283 C ASP A 20 13.466 -10.662 -5.595 1.00 0.00 C ATOM 284 O ASP A 20 13.664 -11.205 -6.663 1.00 0.00 O ATOM 285 CB ASP A 20 12.984 -8.576 -6.916 1.00 0.00 C ATOM 286 CG ASP A 20 12.399 -7.165 -6.829 1.00 0.00 C ATOM 287 OD1 ASP A 20 11.901 -6.816 -5.771 1.00 0.00 O ATOM 288 OD2 ASP A 20 12.456 -6.459 -7.822 1.00 0.00 O ATOM 0 H ASP A 20 13.672 -7.852 -3.989 1.00 0.00 H new ATOM 0 HA ASP A 20 12.052 -9.184 -5.034 1.00 0.00 H new ATOM 0 HB2 ASP A 20 13.987 -8.540 -7.341 1.00 0.00 H new ATOM 0 HB3 ASP A 20 12.378 -9.192 -7.580 1.00 0.00 H new ATOM 293 N LYS A 21 13.612 -11.306 -4.470 1.00 0.00 N ATOM 294 CA LYS A 21 14.030 -12.735 -4.476 1.00 0.00 C ATOM 295 C LYS A 21 13.425 -13.458 -3.273 1.00 0.00 C ATOM 296 O LYS A 21 13.324 -12.898 -2.199 1.00 0.00 O ATOM 297 CB LYS A 21 15.557 -12.704 -4.375 1.00 0.00 C ATOM 298 CG LYS A 21 16.149 -12.266 -5.716 1.00 0.00 C ATOM 299 CD LYS A 21 17.573 -12.806 -5.847 1.00 0.00 C ATOM 300 CE LYS A 21 18.528 -11.928 -5.037 1.00 0.00 C ATOM 301 NZ LYS A 21 19.838 -12.636 -5.092 1.00 0.00 N ATOM 0 H LYS A 21 13.459 -10.903 -3.545 1.00 0.00 H new ATOM 0 HA LYS A 21 13.696 -13.263 -5.369 1.00 0.00 H new ATOM 0 HB2 LYS A 21 15.866 -12.017 -3.587 1.00 0.00 H new ATOM 0 HB3 LYS A 21 15.934 -13.690 -4.104 1.00 0.00 H new ATOM 0 HG2 LYS A 21 15.532 -12.635 -6.535 1.00 0.00 H new ATOM 0 HG3 LYS A 21 16.154 -11.178 -5.785 1.00 0.00 H new ATOM 0 HD2 LYS A 21 17.617 -13.835 -5.490 1.00 0.00 H new ATOM 0 HD3 LYS A 21 17.874 -12.818 -6.895 1.00 0.00 H new ATOM 0 HE2 LYS A 21 18.602 -10.927 -5.462 1.00 0.00 H new ATOM 0 HE3 LYS A 21 18.184 -11.813 -4.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 20.548 -12.095 -4.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 19.738 -13.583 -4.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 20.143 -12.725 -6.082 1.00 0.00 H new ATOM 315 N PRO A 22 13.043 -14.686 -3.494 1.00 0.00 N ATOM 316 CA PRO A 22 12.447 -15.464 -2.377 1.00 0.00 C ATOM 317 C PRO A 22 13.519 -15.795 -1.336 1.00 0.00 C ATOM 318 O PRO A 22 13.238 -16.372 -0.303 1.00 0.00 O ATOM 319 CB PRO A 22 11.916 -16.739 -3.032 1.00 0.00 C ATOM 320 CG PRO A 22 12.590 -16.815 -4.362 1.00 0.00 C ATOM 321 CD PRO A 22 12.928 -15.408 -4.766 1.00 0.00 C ATOM 0 HA PRO A 22 11.662 -14.916 -1.856 1.00 0.00 H new ATOM 0 HB2 PRO A 22 12.144 -17.616 -2.426 1.00 0.00 H new ATOM 0 HB3 PRO A 22 10.832 -16.701 -3.143 1.00 0.00 H new ATOM 0 HG2 PRO A 22 13.491 -17.426 -4.303 1.00 0.00 H new ATOM 0 HG3 PRO A 22 11.936 -17.281 -5.099 1.00 0.00 H new ATOM 0 HD2 PRO A 22 13.859 -15.369 -5.332 1.00 0.00 H new ATOM 0 HD3 PRO A 22 12.152 -14.978 -5.399 1.00 0.00 H new ATOM 329 N TYR A 23 14.746 -15.434 -1.598 1.00 0.00 N ATOM 330 CA TYR A 23 15.834 -15.726 -0.623 1.00 0.00 C ATOM 331 C TYR A 23 16.874 -14.604 -0.642 1.00 0.00 C ATOM 332 O TYR A 23 16.977 -13.856 -1.595 1.00 0.00 O ATOM 333 CB TYR A 23 16.451 -17.042 -1.098 1.00 0.00 C ATOM 334 CG TYR A 23 16.923 -16.891 -2.523 1.00 0.00 C ATOM 335 CD1 TYR A 23 18.146 -16.265 -2.793 1.00 0.00 C ATOM 336 CD2 TYR A 23 16.139 -17.379 -3.576 1.00 0.00 C ATOM 337 CE1 TYR A 23 18.583 -16.126 -4.116 1.00 0.00 C ATOM 338 CE2 TYR A 23 16.576 -17.239 -4.897 1.00 0.00 C ATOM 339 CZ TYR A 23 17.799 -16.613 -5.168 1.00 0.00 C ATOM 340 OH TYR A 23 18.230 -16.475 -6.471 1.00 0.00 O ATOM 0 H TYR A 23 15.041 -14.949 -2.445 1.00 0.00 H new ATOM 0 HA TYR A 23 15.465 -15.798 0.400 1.00 0.00 H new ATOM 0 HB2 TYR A 23 17.286 -17.318 -0.454 1.00 0.00 H new ATOM 0 HB3 TYR A 23 15.718 -17.845 -1.030 1.00 0.00 H new ATOM 0 HD1 TYR A 23 18.752 -15.890 -1.981 1.00 0.00 H new ATOM 0 HD2 TYR A 23 15.197 -17.864 -3.368 1.00 0.00 H new ATOM 0 HE1 TYR A 23 19.526 -15.643 -4.325 1.00 0.00 H new ATOM 0 HE2 TYR A 23 15.970 -17.614 -5.709 1.00 0.00 H new ATOM 0 HH TYR A 23 17.568 -16.868 -7.078 1.00 0.00 H new ATOM 350 N ILE A 24 17.646 -14.479 0.402 1.00 0.00 N ATOM 351 CA ILE A 24 18.677 -13.403 0.441 1.00 0.00 C ATOM 352 C ILE A 24 19.999 -13.956 0.982 1.00 0.00 C ATOM 353 O ILE A 24 20.023 -14.918 1.724 1.00 0.00 O ATOM 354 CB ILE A 24 18.109 -12.349 1.391 1.00 0.00 C ATOM 355 CG1 ILE A 24 19.051 -11.143 1.431 1.00 0.00 C ATOM 356 CG2 ILE A 24 17.982 -12.941 2.795 1.00 0.00 C ATOM 357 CD1 ILE A 24 18.494 -10.093 2.394 1.00 0.00 C ATOM 0 H ILE A 24 17.608 -15.075 1.229 1.00 0.00 H new ATOM 0 HA ILE A 24 18.886 -12.993 -0.547 1.00 0.00 H new ATOM 0 HB ILE A 24 17.126 -12.035 1.040 1.00 0.00 H new ATOM 0 HG12 ILE A 24 20.045 -11.455 1.751 1.00 0.00 H new ATOM 0 HG13 ILE A 24 19.157 -10.717 0.433 1.00 0.00 H new ATOM 0 HG21 ILE A 24 17.577 -12.189 3.472 1.00 0.00 H new ATOM 0 HG22 ILE A 24 17.314 -13.802 2.768 1.00 0.00 H new ATOM 0 HG23 ILE A 24 18.964 -13.255 3.148 1.00 0.00 H new ATOM 0 HD11 ILE A 24 19.164 -9.234 2.423 1.00 0.00 H new ATOM 0 HD12 ILE A 24 17.509 -9.773 2.054 1.00 0.00 H new ATOM 0 HD13 ILE A 24 18.411 -10.522 3.392 1.00 0.00 H new ATOM 369 N LEU A 25 21.099 -13.358 0.615 1.00 0.00 N ATOM 370 CA LEU A 25 22.418 -13.852 1.109 1.00 0.00 C ATOM 371 C LEU A 25 22.684 -13.328 2.521 1.00 0.00 C ATOM 372 O LEU A 25 22.495 -12.162 2.808 1.00 0.00 O ATOM 373 CB LEU A 25 23.449 -13.290 0.131 1.00 0.00 C ATOM 374 CG LEU A 25 23.423 -14.102 -1.165 1.00 0.00 C ATOM 375 CD1 LEU A 25 24.398 -13.489 -2.172 1.00 0.00 C ATOM 376 CD2 LEU A 25 23.840 -15.545 -0.868 1.00 0.00 C ATOM 0 H LEU A 25 21.143 -12.549 -0.005 1.00 0.00 H new ATOM 0 HA LEU A 25 22.455 -14.940 1.159 1.00 0.00 H new ATOM 0 HB2 LEU A 25 23.232 -12.243 -0.080 1.00 0.00 H new ATOM 0 HB3 LEU A 25 24.444 -13.326 0.575 1.00 0.00 H new ATOM 0 HG LEU A 25 22.416 -14.090 -1.581 1.00 0.00 H new ATOM 0 HD11 LEU A 25 24.379 -14.068 -3.095 1.00 0.00 H new ATOM 0 HD12 LEU A 25 24.105 -12.460 -2.383 1.00 0.00 H new ATOM 0 HD13 LEU A 25 25.406 -13.501 -1.757 1.00 0.00 H new ATOM 0 HD21 LEU A 25 23.822 -16.126 -1.790 1.00 0.00 H new ATOM 0 HD22 LEU A 25 24.848 -15.554 -0.453 1.00 0.00 H new ATOM 0 HD23 LEU A 25 23.147 -15.983 -0.150 1.00 0.00 H new ATOM 388 N ALA A 26 23.128 -14.178 3.404 1.00 0.00 N ATOM 389 CA ALA A 26 23.411 -13.723 4.795 1.00 0.00 C ATOM 390 C ALA A 26 24.392 -12.552 4.769 1.00 0.00 C ATOM 391 O ALA A 26 24.259 -11.599 5.510 1.00 0.00 O ATOM 392 CB ALA A 26 24.032 -14.933 5.495 1.00 0.00 C ATOM 0 H ALA A 26 23.307 -15.166 3.224 1.00 0.00 H new ATOM 0 HA ALA A 26 22.514 -13.378 5.310 1.00 0.00 H new ATOM 0 HB1 ALA A 26 24.268 -14.675 6.527 1.00 0.00 H new ATOM 0 HB2 ALA A 26 23.326 -15.763 5.481 1.00 0.00 H new ATOM 0 HB3 ALA A 26 24.945 -15.225 4.976 1.00 0.00 H new ATOM 398 N GLU A 27 25.375 -12.614 3.914 1.00 0.00 N ATOM 399 CA GLU A 27 26.360 -11.503 3.832 1.00 0.00 C ATOM 400 C GLU A 27 25.649 -10.212 3.429 1.00 0.00 C ATOM 401 O GLU A 27 25.952 -9.144 3.922 1.00 0.00 O ATOM 402 CB GLU A 27 27.348 -11.937 2.752 1.00 0.00 C ATOM 403 CG GLU A 27 28.441 -12.802 3.381 1.00 0.00 C ATOM 404 CD GLU A 27 29.738 -12.647 2.586 1.00 0.00 C ATOM 405 OE1 GLU A 27 29.669 -12.676 1.368 1.00 0.00 O ATOM 406 OE2 GLU A 27 30.776 -12.500 3.208 1.00 0.00 O ATOM 0 H GLU A 27 25.538 -13.387 3.269 1.00 0.00 H new ATOM 0 HA GLU A 27 26.858 -11.310 4.782 1.00 0.00 H new ATOM 0 HB2 GLU A 27 26.830 -12.496 1.973 1.00 0.00 H new ATOM 0 HB3 GLU A 27 27.790 -11.062 2.276 1.00 0.00 H new ATOM 0 HG2 GLU A 27 28.601 -12.507 4.418 1.00 0.00 H new ATOM 0 HG3 GLU A 27 28.131 -13.847 3.391 1.00 0.00 H new ATOM 413 N GLU A 28 24.693 -10.304 2.546 1.00 0.00 N ATOM 414 CA GLU A 28 23.952 -9.082 2.124 1.00 0.00 C ATOM 415 C GLU A 28 23.104 -8.579 3.292 1.00 0.00 C ATOM 416 O GLU A 28 23.060 -7.400 3.583 1.00 0.00 O ATOM 417 CB GLU A 28 23.064 -9.535 0.965 1.00 0.00 C ATOM 418 CG GLU A 28 23.056 -8.459 -0.122 1.00 0.00 C ATOM 419 CD GLU A 28 21.635 -8.290 -0.665 1.00 0.00 C ATOM 420 OE1 GLU A 28 20.788 -9.091 -0.309 1.00 0.00 O ATOM 421 OE2 GLU A 28 21.419 -7.361 -1.425 1.00 0.00 O ATOM 0 H GLU A 28 24.393 -11.171 2.099 1.00 0.00 H new ATOM 0 HA GLU A 28 24.612 -8.268 1.825 1.00 0.00 H new ATOM 0 HB2 GLU A 28 23.432 -10.476 0.557 1.00 0.00 H new ATOM 0 HB3 GLU A 28 22.049 -9.716 1.320 1.00 0.00 H new ATOM 0 HG2 GLU A 28 23.416 -7.514 0.285 1.00 0.00 H new ATOM 0 HG3 GLU A 28 23.734 -8.737 -0.929 1.00 0.00 H new ATOM 428 N LEU A 29 22.443 -9.474 3.972 1.00 0.00 N ATOM 429 CA LEU A 29 21.609 -9.072 5.136 1.00 0.00 C ATOM 430 C LEU A 29 22.512 -8.495 6.226 1.00 0.00 C ATOM 431 O LEU A 29 22.183 -7.522 6.877 1.00 0.00 O ATOM 432 CB LEU A 29 20.943 -10.382 5.584 1.00 0.00 C ATOM 433 CG LEU A 29 20.752 -10.404 7.104 1.00 0.00 C ATOM 434 CD1 LEU A 29 19.977 -9.164 7.547 1.00 0.00 C ATOM 435 CD2 LEU A 29 19.972 -11.660 7.499 1.00 0.00 C ATOM 0 H LEU A 29 22.446 -10.474 3.769 1.00 0.00 H new ATOM 0 HA LEU A 29 20.870 -8.304 4.907 1.00 0.00 H new ATOM 0 HB2 LEU A 29 19.977 -10.492 5.090 1.00 0.00 H new ATOM 0 HB3 LEU A 29 21.556 -11.230 5.278 1.00 0.00 H new ATOM 0 HG LEU A 29 21.728 -10.410 7.590 1.00 0.00 H new ATOM 0 HD11 LEU A 29 19.844 -9.185 8.629 1.00 0.00 H new ATOM 0 HD12 LEU A 29 20.532 -8.269 7.267 1.00 0.00 H new ATOM 0 HD13 LEU A 29 19.001 -9.152 7.062 1.00 0.00 H new ATOM 0 HD21 LEU A 29 19.835 -11.678 8.580 1.00 0.00 H new ATOM 0 HD22 LEU A 29 18.998 -11.652 7.010 1.00 0.00 H new ATOM 0 HD23 LEU A 29 20.527 -12.545 7.189 1.00 0.00 H new ATOM 447 N ARG A 30 23.653 -9.092 6.422 1.00 0.00 N ATOM 448 CA ARG A 30 24.593 -8.590 7.463 1.00 0.00 C ATOM 449 C ARG A 30 24.966 -7.131 7.181 1.00 0.00 C ATOM 450 O ARG A 30 25.159 -6.345 8.088 1.00 0.00 O ATOM 451 CB ARG A 30 25.822 -9.491 7.348 1.00 0.00 C ATOM 452 CG ARG A 30 26.128 -10.111 8.712 1.00 0.00 C ATOM 453 CD ARG A 30 27.417 -9.504 9.264 1.00 0.00 C ATOM 454 NE ARG A 30 27.365 -9.753 10.732 1.00 0.00 N ATOM 455 CZ ARG A 30 28.455 -9.677 11.446 1.00 0.00 C ATOM 456 NH1 ARG A 30 29.594 -9.391 10.876 1.00 0.00 N ATOM 457 NH2 ARG A 30 28.406 -9.888 12.734 1.00 0.00 N ATOM 0 H ARG A 30 23.977 -9.909 5.905 1.00 0.00 H new ATOM 0 HA ARG A 30 24.158 -8.617 8.462 1.00 0.00 H new ATOM 0 HB2 ARG A 30 25.644 -10.275 6.612 1.00 0.00 H new ATOM 0 HB3 ARG A 30 26.678 -8.914 6.998 1.00 0.00 H new ATOM 0 HG2 ARG A 30 25.303 -9.929 9.400 1.00 0.00 H new ATOM 0 HG3 ARG A 30 26.232 -11.192 8.618 1.00 0.00 H new ATOM 0 HD2 ARG A 30 28.295 -9.969 8.816 1.00 0.00 H new ATOM 0 HD3 ARG A 30 27.475 -8.437 9.047 1.00 0.00 H new ATOM 0 HE ARG A 30 26.478 -9.983 11.179 1.00 0.00 H new ATOM 0 HH11 ARG A 30 29.634 -9.226 9.870 1.00 0.00 H new ATOM 0 HH12 ARG A 30 30.444 -9.332 11.436 1.00 0.00 H new ATOM 0 HH21 ARG A 30 27.517 -10.112 13.181 1.00 0.00 H new ATOM 0 HH22 ARG A 30 29.257 -9.829 13.293 1.00 0.00 H new ATOM 471 N ARG A 31 25.071 -6.764 5.933 1.00 0.00 N ATOM 472 CA ARG A 31 25.433 -5.356 5.598 1.00 0.00 C ATOM 473 C ARG A 31 24.170 -4.514 5.389 1.00 0.00 C ATOM 474 O ARG A 31 24.209 -3.301 5.429 1.00 0.00 O ATOM 475 CB ARG A 31 26.234 -5.450 4.300 1.00 0.00 C ATOM 476 CG ARG A 31 27.526 -4.642 4.433 1.00 0.00 C ATOM 477 CD ARG A 31 28.092 -4.352 3.041 1.00 0.00 C ATOM 478 NE ARG A 31 29.111 -3.286 3.247 1.00 0.00 N ATOM 479 CZ ARG A 31 30.293 -3.589 3.714 1.00 0.00 C ATOM 480 NH1 ARG A 31 30.583 -4.826 4.019 1.00 0.00 N ATOM 481 NH2 ARG A 31 31.188 -2.652 3.876 1.00 0.00 N ATOM 0 H ARG A 31 24.922 -7.377 5.131 1.00 0.00 H new ATOM 0 HA ARG A 31 26.002 -4.878 6.396 1.00 0.00 H new ATOM 0 HB2 ARG A 31 26.466 -6.492 4.079 1.00 0.00 H new ATOM 0 HB3 ARG A 31 25.641 -5.072 3.467 1.00 0.00 H new ATOM 0 HG2 ARG A 31 27.331 -3.708 4.960 1.00 0.00 H new ATOM 0 HG3 ARG A 31 28.254 -5.196 5.025 1.00 0.00 H new ATOM 0 HD2 ARG A 31 28.539 -5.245 2.604 1.00 0.00 H new ATOM 0 HD3 ARG A 31 27.309 -4.021 2.359 1.00 0.00 H new ATOM 0 HE ARG A 31 28.886 -2.317 3.023 1.00 0.00 H new ATOM 0 HH11 ARG A 31 29.885 -5.559 3.893 1.00 0.00 H new ATOM 0 HH12 ARG A 31 31.507 -5.058 4.383 1.00 0.00 H new ATOM 0 HH21 ARG A 31 30.964 -1.686 3.638 1.00 0.00 H new ATOM 0 HH22 ARG A 31 32.111 -2.886 4.240 1.00 0.00 H new ATOM 495 N GLU A 32 23.050 -5.147 5.168 1.00 0.00 N ATOM 496 CA GLU A 32 21.789 -4.379 4.955 1.00 0.00 C ATOM 497 C GLU A 32 21.098 -4.108 6.294 1.00 0.00 C ATOM 498 O GLU A 32 20.314 -3.189 6.423 1.00 0.00 O ATOM 499 CB GLU A 32 20.918 -5.281 4.081 1.00 0.00 C ATOM 500 CG GLU A 32 20.962 -4.788 2.633 1.00 0.00 C ATOM 501 CD GLU A 32 22.391 -4.899 2.099 1.00 0.00 C ATOM 502 OE1 GLU A 32 23.184 -4.023 2.403 1.00 0.00 O ATOM 503 OE2 GLU A 32 22.668 -5.857 1.397 1.00 0.00 O ATOM 0 H GLU A 32 22.953 -6.162 5.126 1.00 0.00 H new ATOM 0 HA GLU A 32 21.973 -3.410 4.490 1.00 0.00 H new ATOM 0 HB2 GLU A 32 21.272 -6.310 4.136 1.00 0.00 H new ATOM 0 HB3 GLU A 32 19.891 -5.277 4.446 1.00 0.00 H new ATOM 0 HG2 GLU A 32 20.285 -5.379 2.016 1.00 0.00 H new ATOM 0 HG3 GLU A 32 20.622 -3.754 2.579 1.00 0.00 H new ATOM 510 N LEU A 33 21.374 -4.906 7.288 1.00 0.00 N ATOM 511 CA LEU A 33 20.727 -4.701 8.609 1.00 0.00 C ATOM 512 C LEU A 33 21.786 -4.534 9.701 1.00 0.00 C ATOM 513 O LEU A 33 22.822 -5.169 9.664 1.00 0.00 O ATOM 514 CB LEU A 33 19.934 -5.982 8.832 1.00 0.00 C ATOM 515 CG LEU A 33 18.536 -5.832 8.230 1.00 0.00 C ATOM 516 CD1 LEU A 33 17.771 -7.148 8.382 1.00 0.00 C ATOM 517 CD2 LEU A 33 17.783 -4.717 8.957 1.00 0.00 C ATOM 0 H LEU A 33 22.022 -5.692 7.240 1.00 0.00 H new ATOM 0 HA LEU A 33 20.104 -3.807 8.639 1.00 0.00 H new ATOM 0 HB2 LEU A 33 20.450 -6.825 8.373 1.00 0.00 H new ATOM 0 HB3 LEU A 33 19.861 -6.195 9.898 1.00 0.00 H new ATOM 0 HG LEU A 33 18.622 -5.582 7.173 1.00 0.00 H new ATOM 0 HD11 LEU A 33 16.775 -7.041 7.953 1.00 0.00 H new ATOM 0 HD12 LEU A 33 18.307 -7.942 7.862 1.00 0.00 H new ATOM 0 HD13 LEU A 33 17.686 -7.399 9.439 1.00 0.00 H new ATOM 0 HD21 LEU A 33 16.787 -4.611 8.527 1.00 0.00 H new ATOM 0 HD22 LEU A 33 17.697 -4.965 10.015 1.00 0.00 H new ATOM 0 HD23 LEU A 33 18.327 -3.779 8.848 1.00 0.00 H new ATOM 529 N PRO A 34 21.485 -3.685 10.645 1.00 0.00 N ATOM 530 CA PRO A 34 22.455 -3.466 11.750 1.00 0.00 C ATOM 531 C PRO A 34 22.961 -4.812 12.274 1.00 0.00 C ATOM 532 O PRO A 34 22.229 -5.781 12.309 1.00 0.00 O ATOM 533 CB PRO A 34 21.653 -2.733 12.824 1.00 0.00 C ATOM 534 CG PRO A 34 20.461 -2.176 12.120 1.00 0.00 C ATOM 535 CD PRO A 34 20.186 -3.072 10.945 1.00 0.00 C ATOM 0 HA PRO A 34 23.332 -2.899 11.437 1.00 0.00 H new ATOM 0 HB2 PRO A 34 21.355 -3.412 13.623 1.00 0.00 H new ATOM 0 HB3 PRO A 34 22.244 -1.940 13.283 1.00 0.00 H new ATOM 0 HG2 PRO A 34 19.600 -2.141 12.788 1.00 0.00 H new ATOM 0 HG3 PRO A 34 20.650 -1.155 11.790 1.00 0.00 H new ATOM 0 HD2 PRO A 34 19.437 -3.826 11.186 1.00 0.00 H new ATOM 0 HD3 PRO A 34 19.807 -2.507 10.094 1.00 0.00 H new ATOM 543 N PRO A 35 24.205 -4.825 12.664 1.00 0.00 N ATOM 544 CA PRO A 35 24.786 -6.090 13.187 1.00 0.00 C ATOM 545 C PRO A 35 23.786 -6.795 14.109 1.00 0.00 C ATOM 546 O PRO A 35 23.646 -8.002 14.082 1.00 0.00 O ATOM 547 CB PRO A 35 26.021 -5.646 13.968 1.00 0.00 C ATOM 548 CG PRO A 35 25.794 -4.203 14.276 1.00 0.00 C ATOM 549 CD PRO A 35 24.913 -3.652 13.190 1.00 0.00 C ATOM 0 HA PRO A 35 25.030 -6.798 12.395 1.00 0.00 H new ATOM 0 HB2 PRO A 35 26.140 -6.229 14.881 1.00 0.00 H new ATOM 0 HB3 PRO A 35 26.929 -5.785 13.381 1.00 0.00 H new ATOM 0 HG2 PRO A 35 25.321 -4.087 15.251 1.00 0.00 H new ATOM 0 HG3 PRO A 35 26.741 -3.664 14.315 1.00 0.00 H new ATOM 0 HD2 PRO A 35 24.217 -2.910 13.581 1.00 0.00 H new ATOM 0 HD3 PRO A 35 25.499 -3.161 12.414 1.00 0.00 H new ATOM 557 N ASP A 36 23.093 -6.052 14.927 1.00 0.00 N ATOM 558 CA ASP A 36 22.104 -6.678 15.852 1.00 0.00 C ATOM 559 C ASP A 36 20.949 -7.305 15.062 1.00 0.00 C ATOM 560 O ASP A 36 20.553 -8.425 15.312 1.00 0.00 O ATOM 561 CB ASP A 36 21.597 -5.529 16.725 1.00 0.00 C ATOM 562 CG ASP A 36 22.392 -5.491 18.031 1.00 0.00 C ATOM 563 OD1 ASP A 36 23.069 -6.464 18.318 1.00 0.00 O ATOM 564 OD2 ASP A 36 22.310 -4.489 18.722 1.00 0.00 O ATOM 0 H ASP A 36 23.168 -5.037 14.996 1.00 0.00 H new ATOM 0 HA ASP A 36 22.547 -7.478 16.445 1.00 0.00 H new ATOM 0 HB2 ASP A 36 21.702 -4.582 16.195 1.00 0.00 H new ATOM 0 HB3 ASP A 36 20.536 -5.660 16.937 1.00 0.00 H new ATOM 569 N GLN A 37 20.405 -6.591 14.115 1.00 0.00 N ATOM 570 CA GLN A 37 19.275 -7.150 13.316 1.00 0.00 C ATOM 571 C GLN A 37 19.772 -8.283 12.414 1.00 0.00 C ATOM 572 O GLN A 37 19.141 -9.315 12.293 1.00 0.00 O ATOM 573 CB GLN A 37 18.767 -5.979 12.474 1.00 0.00 C ATOM 574 CG GLN A 37 17.377 -5.563 12.960 1.00 0.00 C ATOM 575 CD GLN A 37 17.514 -4.552 14.101 1.00 0.00 C ATOM 576 OE1 GLN A 37 18.111 -3.507 13.933 1.00 0.00 O ATOM 577 NE2 GLN A 37 16.983 -4.822 15.262 1.00 0.00 N ATOM 0 H GLN A 37 20.693 -5.646 13.859 1.00 0.00 H new ATOM 0 HA GLN A 37 18.492 -7.568 13.948 1.00 0.00 H new ATOM 0 HB2 GLN A 37 19.456 -5.138 12.549 1.00 0.00 H new ATOM 0 HB3 GLN A 37 18.726 -6.265 11.423 1.00 0.00 H new ATOM 0 HG2 GLN A 37 16.809 -5.125 12.139 1.00 0.00 H new ATOM 0 HG3 GLN A 37 16.823 -6.438 13.300 1.00 0.00 H new ATOM 0 HE21 GLN A 37 16.482 -5.699 15.402 1.00 0.00 H new ATOM 0 HE22 GLN A 37 17.069 -4.156 16.029 1.00 0.00 H new ATOM 586 N ALA A 38 20.894 -8.094 11.775 1.00 0.00 N ATOM 587 CA ALA A 38 21.429 -9.156 10.874 1.00 0.00 C ATOM 588 C ALA A 38 21.711 -10.436 11.663 1.00 0.00 C ATOM 589 O ALA A 38 21.326 -11.518 11.267 1.00 0.00 O ATOM 590 CB ALA A 38 22.726 -8.577 10.313 1.00 0.00 C ATOM 0 H ALA A 38 21.464 -7.250 11.837 1.00 0.00 H new ATOM 0 HA ALA A 38 20.723 -9.422 10.087 1.00 0.00 H new ATOM 0 HB1 ALA A 38 23.185 -9.299 9.638 1.00 0.00 H new ATOM 0 HB2 ALA A 38 22.509 -7.658 9.769 1.00 0.00 H new ATOM 0 HB3 ALA A 38 23.412 -8.360 11.132 1.00 0.00 H new ATOM 596 N GLN A 39 22.382 -10.324 12.776 1.00 0.00 N ATOM 597 CA GLN A 39 22.686 -11.539 13.584 1.00 0.00 C ATOM 598 C GLN A 39 21.390 -12.258 13.960 1.00 0.00 C ATOM 599 O GLN A 39 21.266 -13.458 13.806 1.00 0.00 O ATOM 600 CB GLN A 39 23.393 -11.014 14.834 1.00 0.00 C ATOM 601 CG GLN A 39 24.436 -12.034 15.294 1.00 0.00 C ATOM 602 CD GLN A 39 25.098 -11.540 16.582 1.00 0.00 C ATOM 603 OE1 GLN A 39 24.431 -11.294 17.566 1.00 0.00 O ATOM 604 NE2 GLN A 39 26.393 -11.385 16.615 1.00 0.00 N ATOM 0 H GLN A 39 22.732 -9.446 13.160 1.00 0.00 H new ATOM 0 HA GLN A 39 23.300 -12.257 13.040 1.00 0.00 H new ATOM 0 HB2 GLN A 39 23.872 -10.059 14.620 1.00 0.00 H new ATOM 0 HB3 GLN A 39 22.668 -10.836 15.628 1.00 0.00 H new ATOM 0 HG2 GLN A 39 23.964 -13.002 15.463 1.00 0.00 H new ATOM 0 HG3 GLN A 39 25.188 -12.177 14.518 1.00 0.00 H new ATOM 0 HE21 GLN A 39 26.953 -11.592 15.788 1.00 0.00 H new ATOM 0 HE22 GLN A 39 26.846 -11.057 17.468 1.00 0.00 H new ATOM 613 N TYR A 40 20.422 -11.535 14.452 1.00 0.00 N ATOM 614 CA TYR A 40 19.132 -12.176 14.837 1.00 0.00 C ATOM 615 C TYR A 40 18.442 -12.763 13.601 1.00 0.00 C ATOM 616 O TYR A 40 17.897 -13.848 13.640 1.00 0.00 O ATOM 617 CB TYR A 40 18.293 -11.047 15.434 1.00 0.00 C ATOM 618 CG TYR A 40 18.117 -11.279 16.917 1.00 0.00 C ATOM 619 CD1 TYR A 40 19.236 -11.482 17.732 1.00 0.00 C ATOM 620 CD2 TYR A 40 16.832 -11.292 17.474 1.00 0.00 C ATOM 621 CE1 TYR A 40 19.071 -11.699 19.106 1.00 0.00 C ATOM 622 CE2 TYR A 40 16.668 -11.508 18.847 1.00 0.00 C ATOM 623 CZ TYR A 40 17.787 -11.711 19.663 1.00 0.00 C ATOM 624 OH TYR A 40 17.624 -11.923 21.017 1.00 0.00 O ATOM 0 H TYR A 40 20.468 -10.527 14.604 1.00 0.00 H new ATOM 0 HA TYR A 40 19.272 -12.996 15.541 1.00 0.00 H new ATOM 0 HB2 TYR A 40 18.780 -10.087 15.261 1.00 0.00 H new ATOM 0 HB3 TYR A 40 17.320 -11.004 14.944 1.00 0.00 H new ATOM 0 HD1 TYR A 40 20.227 -11.471 17.302 1.00 0.00 H new ATOM 0 HD2 TYR A 40 15.968 -11.135 16.845 1.00 0.00 H new ATOM 0 HE1 TYR A 40 19.934 -11.857 19.735 1.00 0.00 H new ATOM 0 HE2 TYR A 40 15.677 -11.518 19.277 1.00 0.00 H new ATOM 0 HH TYR A 40 16.670 -11.899 21.239 1.00 0.00 H new ATOM 634 N CYS A 41 18.460 -12.054 12.505 1.00 0.00 N ATOM 635 CA CYS A 41 17.803 -12.574 11.271 1.00 0.00 C ATOM 636 C CYS A 41 18.513 -13.840 10.786 1.00 0.00 C ATOM 637 O CYS A 41 17.892 -14.855 10.539 1.00 0.00 O ATOM 638 CB CYS A 41 17.947 -11.453 10.242 1.00 0.00 C ATOM 639 SG CYS A 41 16.834 -10.093 10.671 1.00 0.00 S ATOM 0 H CYS A 41 18.900 -11.139 12.410 1.00 0.00 H new ATOM 0 HA CYS A 41 16.760 -12.840 11.441 1.00 0.00 H new ATOM 0 HB2 CYS A 41 18.978 -11.099 10.216 1.00 0.00 H new ATOM 0 HB3 CYS A 41 17.713 -11.828 9.245 1.00 0.00 H new ATOM 0 HG CYS A 41 17.403 -9.330 11.557 1.00 0.00 H new ATOM 645 N ILE A 42 19.810 -13.790 10.652 1.00 0.00 N ATOM 646 CA ILE A 42 20.556 -14.993 10.188 1.00 0.00 C ATOM 647 C ILE A 42 20.474 -16.098 11.244 1.00 0.00 C ATOM 648 O ILE A 42 20.779 -17.245 10.986 1.00 0.00 O ATOM 649 CB ILE A 42 21.998 -14.519 10.013 1.00 0.00 C ATOM 650 CG1 ILE A 42 22.033 -13.345 9.031 1.00 0.00 C ATOM 651 CG2 ILE A 42 22.850 -15.666 9.466 1.00 0.00 C ATOM 652 CD1 ILE A 42 23.391 -12.646 9.120 1.00 0.00 C ATOM 0 H ILE A 42 20.384 -12.969 10.844 1.00 0.00 H new ATOM 0 HA ILE A 42 20.150 -15.405 9.264 1.00 0.00 H new ATOM 0 HB ILE A 42 22.395 -14.200 10.977 1.00 0.00 H new ATOM 0 HG12 ILE A 42 21.861 -13.701 8.015 1.00 0.00 H new ATOM 0 HG13 ILE A 42 21.234 -12.641 9.261 1.00 0.00 H new ATOM 0 HG21 ILE A 42 23.879 -15.328 9.341 1.00 0.00 H new ATOM 0 HG22 ILE A 42 22.825 -16.503 10.164 1.00 0.00 H new ATOM 0 HG23 ILE A 42 22.454 -15.986 8.502 1.00 0.00 H new ATOM 0 HD11 ILE A 42 23.416 -11.810 8.421 1.00 0.00 H new ATOM 0 HD12 ILE A 42 23.544 -12.276 10.134 1.00 0.00 H new ATOM 0 HD13 ILE A 42 24.181 -13.353 8.869 1.00 0.00 H new ATOM 664 N LYS A 43 20.062 -15.756 12.433 1.00 0.00 N ATOM 665 CA LYS A 43 19.954 -16.778 13.513 1.00 0.00 C ATOM 666 C LYS A 43 18.749 -17.686 13.264 1.00 0.00 C ATOM 667 O LYS A 43 18.629 -18.746 13.844 1.00 0.00 O ATOM 668 CB LYS A 43 19.751 -15.972 14.796 1.00 0.00 C ATOM 669 CG LYS A 43 19.968 -16.876 16.010 1.00 0.00 C ATOM 670 CD LYS A 43 19.188 -16.319 17.202 1.00 0.00 C ATOM 671 CE LYS A 43 19.268 -17.301 18.372 1.00 0.00 C ATOM 672 NZ LYS A 43 20.249 -16.695 19.315 1.00 0.00 N ATOM 0 H LYS A 43 19.794 -14.810 12.705 1.00 0.00 H new ATOM 0 HA LYS A 43 20.834 -17.420 13.563 1.00 0.00 H new ATOM 0 HB2 LYS A 43 20.447 -15.134 14.825 1.00 0.00 H new ATOM 0 HB3 LYS A 43 18.746 -15.552 14.818 1.00 0.00 H new ATOM 0 HG2 LYS A 43 19.637 -17.890 15.786 1.00 0.00 H new ATOM 0 HG3 LYS A 43 21.030 -16.933 16.250 1.00 0.00 H new ATOM 0 HD2 LYS A 43 19.596 -15.352 17.497 1.00 0.00 H new ATOM 0 HD3 LYS A 43 18.147 -16.154 16.923 1.00 0.00 H new ATOM 0 HE2 LYS A 43 18.295 -17.432 18.845 1.00 0.00 H new ATOM 0 HE3 LYS A 43 19.596 -18.286 18.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 20.359 -17.311 20.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 21.168 -16.588 18.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 19.907 -15.761 19.620 1.00 0.00 H new ATOM 686 N ARG A 44 17.852 -17.273 12.413 1.00 0.00 N ATOM 687 CA ARG A 44 16.653 -18.112 12.138 1.00 0.00 C ATOM 688 C ARG A 44 16.602 -18.513 10.662 1.00 0.00 C ATOM 689 O ARG A 44 16.581 -19.683 10.344 1.00 0.00 O ATOM 690 CB ARG A 44 15.462 -17.227 12.502 1.00 0.00 C ATOM 691 CG ARG A 44 15.207 -17.307 14.009 1.00 0.00 C ATOM 692 CD ARG A 44 15.961 -16.182 14.720 1.00 0.00 C ATOM 693 NE ARG A 44 15.799 -16.470 16.174 1.00 0.00 N ATOM 694 CZ ARG A 44 15.917 -15.510 17.053 1.00 0.00 C ATOM 695 NH1 ARG A 44 16.199 -14.295 16.668 1.00 0.00 N ATOM 696 NH2 ARG A 44 15.761 -15.769 18.323 1.00 0.00 N ATOM 0 H ARG A 44 17.897 -16.394 11.898 1.00 0.00 H new ATOM 0 HA ARG A 44 16.661 -19.040 12.709 1.00 0.00 H new ATOM 0 HB2 ARG A 44 15.659 -16.195 12.210 1.00 0.00 H new ATOM 0 HB3 ARG A 44 14.576 -17.549 11.955 1.00 0.00 H new ATOM 0 HG2 ARG A 44 14.139 -17.227 14.212 1.00 0.00 H new ATOM 0 HG3 ARG A 44 15.532 -18.274 14.392 1.00 0.00 H new ATOM 0 HD2 ARG A 44 17.013 -16.170 14.435 1.00 0.00 H new ATOM 0 HD3 ARG A 44 15.549 -15.206 14.462 1.00 0.00 H new ATOM 0 HE ARG A 44 15.595 -17.420 16.484 1.00 0.00 H new ATOM 0 HH11 ARG A 44 16.328 -14.091 15.677 1.00 0.00 H new ATOM 0 HH12 ARG A 44 16.290 -13.549 17.358 1.00 0.00 H new ATOM 0 HH21 ARG A 44 15.548 -16.719 18.627 1.00 0.00 H new ATOM 0 HH22 ARG A 44 15.853 -15.022 19.011 1.00 0.00 H new ATOM 710 N MET A 45 16.574 -17.547 9.768 1.00 0.00 N ATOM 711 CA MET A 45 16.516 -17.849 8.301 1.00 0.00 C ATOM 712 C MET A 45 17.142 -19.211 7.982 1.00 0.00 C ATOM 713 O MET A 45 18.328 -19.307 7.739 1.00 0.00 O ATOM 714 CB MET A 45 17.322 -16.727 7.639 1.00 0.00 C ATOM 715 CG MET A 45 16.597 -16.267 6.374 1.00 0.00 C ATOM 716 SD MET A 45 17.008 -14.539 6.028 1.00 0.00 S ATOM 717 CE MET A 45 16.099 -13.811 7.412 1.00 0.00 C ATOM 0 H MET A 45 16.589 -16.553 9.997 1.00 0.00 H new ATOM 0 HA MET A 45 15.487 -17.897 7.943 1.00 0.00 H new ATOM 0 HB2 MET A 45 17.440 -15.892 8.329 1.00 0.00 H new ATOM 0 HB3 MET A 45 18.323 -17.080 7.391 1.00 0.00 H new ATOM 0 HG2 MET A 45 16.884 -16.895 5.530 1.00 0.00 H new ATOM 0 HG3 MET A 45 15.520 -16.376 6.501 1.00 0.00 H new ATOM 0 HE1 MET A 45 15.637 -12.877 7.093 1.00 0.00 H new ATOM 0 HE2 MET A 45 15.325 -14.503 7.743 1.00 0.00 H new ATOM 0 HE3 MET A 45 16.786 -13.614 8.235 1.00 0.00 H new ATOM 727 N PRO A 46 16.313 -20.219 7.995 1.00 0.00 N ATOM 728 CA PRO A 46 16.830 -21.583 7.697 1.00 0.00 C ATOM 729 C PRO A 46 17.281 -21.669 6.238 1.00 0.00 C ATOM 730 O PRO A 46 17.425 -20.668 5.563 1.00 0.00 O ATOM 731 CB PRO A 46 15.640 -22.509 7.948 1.00 0.00 C ATOM 732 CG PRO A 46 14.437 -21.627 7.923 1.00 0.00 C ATOM 733 CD PRO A 46 14.887 -20.258 8.349 1.00 0.00 C ATOM 0 HA PRO A 46 17.693 -21.847 8.309 1.00 0.00 H new ATOM 0 HB2 PRO A 46 15.576 -23.282 7.182 1.00 0.00 H new ATOM 0 HB3 PRO A 46 15.734 -23.018 8.907 1.00 0.00 H new ATOM 0 HG2 PRO A 46 14.002 -21.596 6.924 1.00 0.00 H new ATOM 0 HG3 PRO A 46 13.667 -22.006 8.595 1.00 0.00 H new ATOM 0 HD2 PRO A 46 14.328 -19.477 7.834 1.00 0.00 H new ATOM 0 HD3 PRO A 46 14.738 -20.105 9.418 1.00 0.00 H new ATOM 741 N ALA A 47 17.505 -22.856 5.745 1.00 0.00 N ATOM 742 CA ALA A 47 17.947 -23.003 4.330 1.00 0.00 C ATOM 743 C ALA A 47 16.773 -22.753 3.380 1.00 0.00 C ATOM 744 O ALA A 47 15.680 -23.245 3.585 1.00 0.00 O ATOM 745 CB ALA A 47 18.434 -24.447 4.212 1.00 0.00 C ATOM 0 H ALA A 47 17.401 -23.730 6.261 1.00 0.00 H new ATOM 0 HA ALA A 47 18.727 -22.288 4.066 1.00 0.00 H new ATOM 0 HB1 ALA A 47 18.777 -24.633 3.194 1.00 0.00 H new ATOM 0 HB2 ALA A 47 19.256 -24.612 4.908 1.00 0.00 H new ATOM 0 HB3 ALA A 47 17.616 -25.127 4.449 1.00 0.00 H new ATOM 751 N TYR A 48 16.991 -21.993 2.343 1.00 0.00 N ATOM 752 CA TYR A 48 15.892 -21.710 1.378 1.00 0.00 C ATOM 753 C TYR A 48 15.106 -22.988 1.066 1.00 0.00 C ATOM 754 O TYR A 48 15.512 -24.080 1.411 1.00 0.00 O ATOM 755 CB TYR A 48 16.594 -21.176 0.124 1.00 0.00 C ATOM 756 CG TYR A 48 17.192 -22.312 -0.682 1.00 0.00 C ATOM 757 CD1 TYR A 48 17.617 -23.491 -0.054 1.00 0.00 C ATOM 758 CD2 TYR A 48 17.328 -22.174 -2.069 1.00 0.00 C ATOM 759 CE1 TYR A 48 18.171 -24.530 -0.813 1.00 0.00 C ATOM 760 CE2 TYR A 48 17.885 -23.212 -2.827 1.00 0.00 C ATOM 761 CZ TYR A 48 18.305 -24.389 -2.199 1.00 0.00 C ATOM 762 OH TYR A 48 18.853 -25.413 -2.945 1.00 0.00 O ATOM 0 H TYR A 48 17.885 -21.555 2.122 1.00 0.00 H new ATOM 0 HA TYR A 48 15.170 -20.995 1.773 1.00 0.00 H new ATOM 0 HB2 TYR A 48 15.882 -20.624 -0.490 1.00 0.00 H new ATOM 0 HB3 TYR A 48 17.378 -20.475 0.411 1.00 0.00 H new ATOM 0 HD1 TYR A 48 17.517 -23.598 1.016 1.00 0.00 H new ATOM 0 HD2 TYR A 48 17.003 -21.266 -2.555 1.00 0.00 H new ATOM 0 HE1 TYR A 48 18.495 -25.440 -0.329 1.00 0.00 H new ATOM 0 HE2 TYR A 48 17.990 -23.103 -3.896 1.00 0.00 H new ATOM 0 HH TYR A 48 18.873 -25.155 -3.890 1.00 0.00 H new ATOM 772 N SER A 49 13.981 -22.858 0.417 1.00 0.00 N ATOM 773 CA SER A 49 13.168 -24.063 0.084 1.00 0.00 C ATOM 774 C SER A 49 13.051 -24.215 -1.434 1.00 0.00 C ATOM 775 O SER A 49 13.023 -25.310 -1.958 1.00 0.00 O ATOM 776 CB SER A 49 11.798 -23.800 0.705 1.00 0.00 C ATOM 777 OG SER A 49 11.499 -24.831 1.637 1.00 0.00 O ATOM 0 H SER A 49 13.590 -21.970 0.103 1.00 0.00 H new ATOM 0 HA SER A 49 13.615 -24.982 0.462 1.00 0.00 H new ATOM 0 HB2 SER A 49 11.792 -22.831 1.203 1.00 0.00 H new ATOM 0 HB3 SER A 49 11.035 -23.764 -0.072 1.00 0.00 H new ATOM 0 HG SER A 49 10.621 -24.664 2.039 1.00 0.00 H new ATOM 783 N GLY A 50 12.983 -23.122 -2.144 1.00 0.00 N ATOM 784 CA GLY A 50 12.870 -23.205 -3.627 1.00 0.00 C ATOM 785 C GLY A 50 14.198 -23.686 -4.212 1.00 0.00 C ATOM 786 O GLY A 50 15.249 -23.196 -3.853 1.00 0.00 O ATOM 0 H GLY A 50 13.001 -22.177 -1.761 1.00 0.00 H new ATOM 0 HA2 GLY A 50 12.069 -23.890 -3.904 1.00 0.00 H new ATOM 0 HA3 GLY A 50 12.611 -22.229 -4.038 1.00 0.00 H new ATOM 790 N PRO A 51 14.103 -24.639 -5.097 1.00 0.00 N ATOM 791 CA PRO A 51 15.345 -25.172 -5.718 1.00 0.00 C ATOM 792 C PRO A 51 16.028 -24.084 -6.550 1.00 0.00 C ATOM 793 O PRO A 51 15.414 -23.110 -6.941 1.00 0.00 O ATOM 794 CB PRO A 51 14.867 -26.317 -6.614 1.00 0.00 C ATOM 795 CG PRO A 51 13.488 -26.641 -6.141 1.00 0.00 C ATOM 796 CD PRO A 51 12.921 -25.382 -5.550 1.00 0.00 C ATOM 0 HA PRO A 51 16.073 -25.506 -4.979 1.00 0.00 H new ATOM 0 HB2 PRO A 51 14.863 -26.020 -7.663 1.00 0.00 H new ATOM 0 HB3 PRO A 51 15.525 -27.182 -6.530 1.00 0.00 H new ATOM 0 HG2 PRO A 51 12.869 -26.992 -6.967 1.00 0.00 H new ATOM 0 HG3 PRO A 51 13.512 -27.439 -5.399 1.00 0.00 H new ATOM 0 HD2 PRO A 51 12.352 -24.816 -6.287 1.00 0.00 H new ATOM 0 HD3 PRO A 51 12.245 -25.599 -4.723 1.00 0.00 H new ATOM 804 N GLY A 52 17.293 -24.241 -6.824 1.00 0.00 N ATOM 805 CA GLY A 52 18.014 -23.216 -7.630 1.00 0.00 C ATOM 806 C GLY A 52 18.794 -22.288 -6.696 1.00 0.00 C ATOM 807 O GLY A 52 19.835 -22.646 -6.181 1.00 0.00 O ATOM 0 H GLY A 52 17.859 -25.035 -6.525 1.00 0.00 H new ATOM 0 HA2 GLY A 52 18.695 -23.701 -8.330 1.00 0.00 H new ATOM 0 HA3 GLY A 52 17.304 -22.639 -8.223 1.00 0.00 H new ATOM 811 N SER A 53 18.294 -21.102 -6.472 1.00 0.00 N ATOM 812 CA SER A 53 18.986 -20.148 -5.577 1.00 0.00 C ATOM 813 C SER A 53 20.496 -20.219 -5.779 1.00 0.00 C ATOM 814 O SER A 53 20.984 -20.622 -6.816 1.00 0.00 O ATOM 815 CB SER A 53 18.596 -20.589 -4.170 1.00 0.00 C ATOM 816 OG SER A 53 19.711 -21.192 -3.527 1.00 0.00 O ATOM 0 H SER A 53 17.425 -20.756 -6.879 1.00 0.00 H new ATOM 0 HA SER A 53 18.704 -19.113 -5.773 1.00 0.00 H new ATOM 0 HB2 SER A 53 18.252 -19.731 -3.592 1.00 0.00 H new ATOM 0 HB3 SER A 53 17.767 -21.295 -4.217 1.00 0.00 H new ATOM 0 HG SER A 53 19.395 -21.842 -2.865 1.00 0.00 H new ATOM 822 N VAL A 54 21.233 -19.828 -4.790 1.00 0.00 N ATOM 823 CA VAL A 54 22.720 -19.863 -4.898 1.00 0.00 C ATOM 824 C VAL A 54 23.322 -20.608 -3.705 1.00 0.00 C ATOM 825 O VAL A 54 22.608 -21.080 -2.842 1.00 0.00 O ATOM 826 CB VAL A 54 23.151 -18.397 -4.891 1.00 0.00 C ATOM 827 CG1 VAL A 54 22.787 -17.752 -6.228 1.00 0.00 C ATOM 828 CG2 VAL A 54 22.433 -17.661 -3.757 1.00 0.00 C ATOM 0 H VAL A 54 20.873 -19.481 -3.901 1.00 0.00 H new ATOM 0 HA VAL A 54 23.057 -20.382 -5.795 1.00 0.00 H new ATOM 0 HB VAL A 54 24.229 -18.335 -4.740 1.00 0.00 H new ATOM 0 HG11 VAL A 54 23.094 -16.706 -6.223 1.00 0.00 H new ATOM 0 HG12 VAL A 54 23.297 -18.276 -7.036 1.00 0.00 H new ATOM 0 HG13 VAL A 54 21.709 -17.813 -6.380 1.00 0.00 H new ATOM 0 HG21 VAL A 54 22.739 -16.615 -3.751 1.00 0.00 H new ATOM 0 HG22 VAL A 54 21.355 -17.722 -3.908 1.00 0.00 H new ATOM 0 HG23 VAL A 54 22.692 -18.121 -2.803 1.00 0.00 H new ATOM 838 N PRO A 55 24.625 -20.690 -3.700 1.00 0.00 N ATOM 839 CA PRO A 55 25.301 -21.399 -2.580 1.00 0.00 C ATOM 840 C PRO A 55 25.359 -20.501 -1.342 1.00 0.00 C ATOM 841 O PRO A 55 26.277 -19.724 -1.167 1.00 0.00 O ATOM 842 CB PRO A 55 26.710 -21.689 -3.101 1.00 0.00 C ATOM 843 CG PRO A 55 26.639 -21.491 -4.580 1.00 0.00 C ATOM 844 CD PRO A 55 25.531 -20.511 -4.838 1.00 0.00 C ATOM 0 HA PRO A 55 24.776 -22.308 -2.284 1.00 0.00 H new ATOM 0 HB2 PRO A 55 27.441 -21.018 -2.650 1.00 0.00 H new ATOM 0 HB3 PRO A 55 27.017 -22.706 -2.856 1.00 0.00 H new ATOM 0 HG2 PRO A 55 27.586 -21.113 -4.964 1.00 0.00 H new ATOM 0 HG3 PRO A 55 26.444 -22.436 -5.087 1.00 0.00 H new ATOM 0 HD2 PRO A 55 25.907 -19.489 -4.892 1.00 0.00 H new ATOM 0 HD3 PRO A 55 25.029 -20.716 -5.784 1.00 0.00 H new ATOM 852 N GLY A 56 24.383 -20.600 -0.481 1.00 0.00 N ATOM 853 CA GLY A 56 24.382 -19.752 0.745 1.00 0.00 C ATOM 854 C GLY A 56 23.108 -18.907 0.783 1.00 0.00 C ATOM 855 O GLY A 56 23.072 -17.846 1.372 1.00 0.00 O ATOM 0 H GLY A 56 23.587 -21.231 -0.573 1.00 0.00 H new ATOM 0 HA2 GLY A 56 24.441 -20.380 1.634 1.00 0.00 H new ATOM 0 HA3 GLY A 56 25.260 -19.106 0.753 1.00 0.00 H new ATOM 859 N ALA A 57 22.059 -19.370 0.158 1.00 0.00 N ATOM 860 CA ALA A 57 20.787 -18.594 0.159 1.00 0.00 C ATOM 861 C ALA A 57 19.944 -18.962 1.383 1.00 0.00 C ATOM 862 O ALA A 57 19.920 -20.097 1.814 1.00 0.00 O ATOM 863 CB ALA A 57 20.072 -19.005 -1.127 1.00 0.00 C ATOM 0 H ALA A 57 22.029 -20.252 -0.353 1.00 0.00 H new ATOM 0 HA ALA A 57 20.959 -17.519 0.204 1.00 0.00 H new ATOM 0 HB1 ALA A 57 19.122 -18.475 -1.201 1.00 0.00 H new ATOM 0 HB2 ALA A 57 20.695 -18.755 -1.986 1.00 0.00 H new ATOM 0 HB3 ALA A 57 19.888 -20.079 -1.113 1.00 0.00 H new ATOM 869 N LEU A 58 19.251 -18.009 1.946 1.00 0.00 N ATOM 870 CA LEU A 58 18.410 -18.303 3.141 1.00 0.00 C ATOM 871 C LEU A 58 16.997 -17.752 2.935 1.00 0.00 C ATOM 872 O LEU A 58 16.775 -16.886 2.113 1.00 0.00 O ATOM 873 CB LEU A 58 19.101 -17.582 4.299 1.00 0.00 C ATOM 874 CG LEU A 58 20.529 -18.109 4.449 1.00 0.00 C ATOM 875 CD1 LEU A 58 21.325 -17.173 5.359 1.00 0.00 C ATOM 876 CD2 LEU A 58 20.491 -19.508 5.067 1.00 0.00 C ATOM 0 H LEU A 58 19.231 -17.040 1.630 1.00 0.00 H new ATOM 0 HA LEU A 58 18.313 -19.373 3.327 1.00 0.00 H new ATOM 0 HB2 LEU A 58 19.116 -16.508 4.115 1.00 0.00 H new ATOM 0 HB3 LEU A 58 18.545 -17.740 5.223 1.00 0.00 H new ATOM 0 HG LEU A 58 21.005 -18.155 3.469 1.00 0.00 H new ATOM 0 HD11 LEU A 58 22.343 -17.548 5.466 1.00 0.00 H new ATOM 0 HD12 LEU A 58 21.350 -16.175 4.922 1.00 0.00 H new ATOM 0 HD13 LEU A 58 20.850 -17.128 6.339 1.00 0.00 H new ATOM 0 HD21 LEU A 58 21.508 -19.886 5.175 1.00 0.00 H new ATOM 0 HD22 LEU A 58 20.016 -19.460 6.047 1.00 0.00 H new ATOM 0 HD23 LEU A 58 19.922 -20.176 4.420 1.00 0.00 H new ATOM 888 N ASP A 59 16.037 -18.244 3.673 1.00 0.00 N ATOM 889 CA ASP A 59 14.644 -17.733 3.505 1.00 0.00 C ATOM 890 C ASP A 59 14.188 -16.984 4.758 1.00 0.00 C ATOM 891 O ASP A 59 13.967 -17.571 5.800 1.00 0.00 O ATOM 892 CB ASP A 59 13.779 -18.979 3.292 1.00 0.00 C ATOM 893 CG ASP A 59 14.193 -20.069 4.282 1.00 0.00 C ATOM 894 OD1 ASP A 59 13.960 -19.887 5.465 1.00 0.00 O ATOM 895 OD2 ASP A 59 14.735 -21.067 3.839 1.00 0.00 O ATOM 0 H ASP A 59 16.155 -18.971 4.379 1.00 0.00 H new ATOM 0 HA ASP A 59 14.571 -17.033 2.672 1.00 0.00 H new ATOM 0 HB2 ASP A 59 12.727 -18.731 3.429 1.00 0.00 H new ATOM 0 HB3 ASP A 59 13.891 -19.341 2.270 1.00 0.00 H new ATOM 900 N TYR A 60 14.034 -15.692 4.663 1.00 0.00 N ATOM 901 CA TYR A 60 13.577 -14.902 5.839 1.00 0.00 C ATOM 902 C TYR A 60 12.092 -15.168 6.087 1.00 0.00 C ATOM 903 O TYR A 60 11.610 -15.084 7.199 1.00 0.00 O ATOM 904 CB TYR A 60 13.799 -13.443 5.434 1.00 0.00 C ATOM 905 CG TYR A 60 13.127 -13.182 4.107 1.00 0.00 C ATOM 906 CD1 TYR A 60 11.736 -13.041 4.040 1.00 0.00 C ATOM 907 CD2 TYR A 60 13.898 -13.080 2.943 1.00 0.00 C ATOM 908 CE1 TYR A 60 11.116 -12.799 2.809 1.00 0.00 C ATOM 909 CE2 TYR A 60 13.277 -12.838 1.711 1.00 0.00 C ATOM 910 CZ TYR A 60 11.887 -12.698 1.644 1.00 0.00 C ATOM 911 OH TYR A 60 11.276 -12.458 0.431 1.00 0.00 O ATOM 0 H TYR A 60 14.206 -15.148 3.817 1.00 0.00 H new ATOM 0 HA TYR A 60 14.110 -15.157 6.755 1.00 0.00 H new ATOM 0 HB2 TYR A 60 13.394 -12.777 6.196 1.00 0.00 H new ATOM 0 HB3 TYR A 60 14.866 -13.233 5.361 1.00 0.00 H new ATOM 0 HD1 TYR A 60 11.141 -13.119 4.938 1.00 0.00 H new ATOM 0 HD2 TYR A 60 14.971 -13.188 2.995 1.00 0.00 H new ATOM 0 HE1 TYR A 60 10.043 -12.690 2.757 1.00 0.00 H new ATOM 0 HE2 TYR A 60 13.872 -12.760 0.813 1.00 0.00 H new ATOM 0 HH TYR A 60 11.955 -12.416 -0.275 1.00 0.00 H new ATOM 921 N ALA A 61 11.365 -15.495 5.052 1.00 0.00 N ATOM 922 CA ALA A 61 9.912 -15.774 5.218 1.00 0.00 C ATOM 923 C ALA A 61 9.710 -16.878 6.255 1.00 0.00 C ATOM 924 O ALA A 61 8.848 -16.792 7.108 1.00 0.00 O ATOM 925 CB ALA A 61 9.439 -16.238 3.841 1.00 0.00 C ATOM 0 H ALA A 61 11.717 -15.581 4.098 1.00 0.00 H new ATOM 0 HA ALA A 61 9.357 -14.902 5.565 1.00 0.00 H new ATOM 0 HB1 ALA A 61 8.373 -16.464 3.880 1.00 0.00 H new ATOM 0 HB2 ALA A 61 9.616 -15.449 3.110 1.00 0.00 H new ATOM 0 HB3 ALA A 61 9.990 -17.132 3.549 1.00 0.00 H new ATOM 931 N ALA A 62 10.502 -17.913 6.195 1.00 0.00 N ATOM 932 CA ALA A 62 10.353 -19.017 7.185 1.00 0.00 C ATOM 933 C ALA A 62 10.619 -18.489 8.592 1.00 0.00 C ATOM 934 O ALA A 62 10.029 -18.928 9.559 1.00 0.00 O ATOM 935 CB ALA A 62 11.402 -20.055 6.788 1.00 0.00 C ATOM 0 H ALA A 62 11.243 -18.042 5.506 1.00 0.00 H new ATOM 0 HA ALA A 62 9.350 -19.443 7.187 1.00 0.00 H new ATOM 0 HB1 ALA A 62 11.354 -20.901 7.473 1.00 0.00 H new ATOM 0 HB2 ALA A 62 11.207 -20.399 5.772 1.00 0.00 H new ATOM 0 HB3 ALA A 62 12.394 -19.606 6.835 1.00 0.00 H new ATOM 941 N PHE A 63 11.502 -17.544 8.705 1.00 0.00 N ATOM 942 CA PHE A 63 11.822 -16.964 10.042 1.00 0.00 C ATOM 943 C PHE A 63 10.662 -16.093 10.532 1.00 0.00 C ATOM 944 O PHE A 63 10.378 -16.024 11.711 1.00 0.00 O ATOM 945 CB PHE A 63 13.070 -16.111 9.814 1.00 0.00 C ATOM 946 CG PHE A 63 13.369 -15.312 11.061 1.00 0.00 C ATOM 947 CD1 PHE A 63 13.042 -15.830 12.320 1.00 0.00 C ATOM 948 CD2 PHE A 63 13.977 -14.055 10.957 1.00 0.00 C ATOM 949 CE1 PHE A 63 13.324 -15.091 13.475 1.00 0.00 C ATOM 950 CE2 PHE A 63 14.257 -13.316 12.113 1.00 0.00 C ATOM 951 CZ PHE A 63 13.931 -13.834 13.371 1.00 0.00 C ATOM 0 H PHE A 63 12.023 -17.142 7.925 1.00 0.00 H new ATOM 0 HA PHE A 63 11.984 -17.733 10.797 1.00 0.00 H new ATOM 0 HB2 PHE A 63 13.919 -16.748 9.565 1.00 0.00 H new ATOM 0 HB3 PHE A 63 12.916 -15.441 8.968 1.00 0.00 H new ATOM 0 HD1 PHE A 63 12.572 -16.799 12.400 1.00 0.00 H new ATOM 0 HD2 PHE A 63 14.230 -13.656 9.986 1.00 0.00 H new ATOM 0 HE1 PHE A 63 13.073 -15.491 14.446 1.00 0.00 H new ATOM 0 HE2 PHE A 63 14.725 -12.346 12.033 1.00 0.00 H new ATOM 0 HZ PHE A 63 14.148 -13.264 14.262 1.00 0.00 H new ATOM 961 N SER A 64 9.993 -15.423 9.634 1.00 0.00 N ATOM 962 CA SER A 64 8.856 -14.551 10.044 1.00 0.00 C ATOM 963 C SER A 64 7.750 -15.387 10.694 1.00 0.00 C ATOM 964 O SER A 64 7.264 -15.069 11.761 1.00 0.00 O ATOM 965 CB SER A 64 8.355 -13.915 8.747 1.00 0.00 C ATOM 966 OG SER A 64 9.357 -14.040 7.745 1.00 0.00 O ATOM 0 H SER A 64 10.185 -15.442 8.632 1.00 0.00 H new ATOM 0 HA SER A 64 9.157 -13.802 10.776 1.00 0.00 H new ATOM 0 HB2 SER A 64 7.436 -14.402 8.421 1.00 0.00 H new ATOM 0 HB3 SER A 64 8.118 -12.864 8.912 1.00 0.00 H new ATOM 0 HG SER A 64 9.291 -13.287 7.121 1.00 0.00 H new ATOM 972 N SER A 65 7.347 -16.454 10.059 1.00 0.00 N ATOM 973 CA SER A 65 6.272 -17.306 10.642 1.00 0.00 C ATOM 974 C SER A 65 6.689 -17.815 12.025 1.00 0.00 C ATOM 975 O SER A 65 5.889 -17.888 12.937 1.00 0.00 O ATOM 976 CB SER A 65 6.118 -18.473 9.668 1.00 0.00 C ATOM 977 OG SER A 65 4.986 -19.249 10.041 1.00 0.00 O ATOM 0 H SER A 65 7.715 -16.772 9.163 1.00 0.00 H new ATOM 0 HA SER A 65 5.339 -16.758 10.773 1.00 0.00 H new ATOM 0 HB2 SER A 65 5.998 -18.100 8.651 1.00 0.00 H new ATOM 0 HB3 SER A 65 7.016 -19.091 9.677 1.00 0.00 H new ATOM 0 HG SER A 65 4.172 -18.714 9.931 1.00 0.00 H new ATOM 983 N ALA A 66 7.935 -18.167 12.186 1.00 0.00 N ATOM 984 CA ALA A 66 8.402 -18.674 13.508 1.00 0.00 C ATOM 985 C ALA A 66 8.424 -17.537 14.534 1.00 0.00 C ATOM 986 O ALA A 66 8.072 -17.718 15.683 1.00 0.00 O ATOM 987 CB ALA A 66 9.818 -19.195 13.255 1.00 0.00 C ATOM 0 H ALA A 66 8.650 -18.126 11.460 1.00 0.00 H new ATOM 0 HA ALA A 66 7.747 -19.449 13.907 1.00 0.00 H new ATOM 0 HB1 ALA A 66 10.233 -19.587 14.184 1.00 0.00 H new ATOM 0 HB2 ALA A 66 9.786 -19.989 12.509 1.00 0.00 H new ATOM 0 HB3 ALA A 66 10.446 -18.381 12.892 1.00 0.00 H new ATOM 993 N LEU A 67 8.839 -16.369 14.130 1.00 0.00 N ATOM 994 CA LEU A 67 8.887 -15.221 15.082 1.00 0.00 C ATOM 995 C LEU A 67 7.488 -14.931 15.635 1.00 0.00 C ATOM 996 O LEU A 67 7.320 -14.637 16.802 1.00 0.00 O ATOM 997 CB LEU A 67 9.392 -14.041 14.253 1.00 0.00 C ATOM 998 CG LEU A 67 10.795 -13.653 14.719 1.00 0.00 C ATOM 999 CD1 LEU A 67 11.384 -12.616 13.760 1.00 0.00 C ATOM 1000 CD2 LEU A 67 10.717 -13.057 16.126 1.00 0.00 C ATOM 0 H LEU A 67 9.148 -16.158 13.181 1.00 0.00 H new ATOM 0 HA LEU A 67 9.530 -15.422 15.939 1.00 0.00 H new ATOM 0 HB2 LEU A 67 9.409 -14.306 13.196 1.00 0.00 H new ATOM 0 HB3 LEU A 67 8.715 -13.193 14.358 1.00 0.00 H new ATOM 0 HG LEU A 67 11.431 -14.538 14.732 1.00 0.00 H new ATOM 0 HD11 LEU A 67 12.384 -12.340 14.093 1.00 0.00 H new ATOM 0 HD12 LEU A 67 11.439 -13.038 12.757 1.00 0.00 H new ATOM 0 HD13 LEU A 67 10.749 -11.730 13.747 1.00 0.00 H new ATOM 0 HD21 LEU A 67 11.717 -12.780 16.460 1.00 0.00 H new ATOM 0 HD22 LEU A 67 10.081 -12.172 16.111 1.00 0.00 H new ATOM 0 HD23 LEU A 67 10.297 -13.794 16.811 1.00 0.00 H new ATOM 1012 N TYR A 68 6.484 -15.010 14.806 1.00 0.00 N ATOM 1013 CA TYR A 68 5.098 -14.737 15.285 1.00 0.00 C ATOM 1014 C TYR A 68 4.370 -16.051 15.577 1.00 0.00 C ATOM 1015 O TYR A 68 3.352 -16.075 16.240 1.00 0.00 O ATOM 1016 CB TYR A 68 4.421 -13.993 14.133 1.00 0.00 C ATOM 1017 CG TYR A 68 4.756 -12.523 14.214 1.00 0.00 C ATOM 1018 CD1 TYR A 68 3.972 -11.669 14.998 1.00 0.00 C ATOM 1019 CD2 TYR A 68 5.852 -12.016 13.505 1.00 0.00 C ATOM 1020 CE1 TYR A 68 4.283 -10.306 15.072 1.00 0.00 C ATOM 1021 CE2 TYR A 68 6.162 -10.653 13.579 1.00 0.00 C ATOM 1022 CZ TYR A 68 5.378 -9.798 14.362 1.00 0.00 C ATOM 1023 OH TYR A 68 5.685 -8.454 14.436 1.00 0.00 O ATOM 0 H TYR A 68 6.562 -15.252 13.818 1.00 0.00 H new ATOM 0 HA TYR A 68 5.087 -14.157 16.208 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.754 -14.400 13.178 1.00 0.00 H new ATOM 0 HB3 TYR A 68 3.341 -14.134 14.181 1.00 0.00 H new ATOM 0 HD1 TYR A 68 3.128 -12.061 15.546 1.00 0.00 H new ATOM 0 HD2 TYR A 68 6.458 -12.676 12.902 1.00 0.00 H new ATOM 0 HE1 TYR A 68 3.678 -9.646 15.677 1.00 0.00 H new ATOM 0 HE2 TYR A 68 7.006 -10.261 13.032 1.00 0.00 H new ATOM 0 HH TYR A 68 6.474 -8.268 13.885 1.00 0.00 H new ATOM 1033 N GLY A 69 4.884 -17.146 15.087 1.00 0.00 N ATOM 1034 CA GLY A 69 4.221 -18.457 15.336 1.00 0.00 C ATOM 1035 C GLY A 69 3.239 -18.753 14.202 1.00 0.00 C ATOM 1036 O GLY A 69 2.983 -17.920 13.357 1.00 0.00 O ATOM 0 H GLY A 69 5.734 -17.189 14.525 1.00 0.00 H new ATOM 0 HA2 GLY A 69 4.968 -19.248 15.401 1.00 0.00 H new ATOM 0 HA3 GLY A 69 3.695 -18.436 16.291 1.00 0.00 H new ATOM 1040 N GLU A 70 2.685 -19.935 14.176 1.00 0.00 N ATOM 1041 CA GLU A 70 1.720 -20.280 13.094 1.00 0.00 C ATOM 1042 C GLU A 70 0.811 -21.428 13.541 1.00 0.00 C ATOM 1043 O GLU A 70 -0.386 -21.269 13.673 1.00 0.00 O ATOM 1044 CB GLU A 70 2.588 -20.713 11.912 1.00 0.00 C ATOM 1045 CG GLU A 70 1.708 -20.920 10.679 1.00 0.00 C ATOM 1046 CD GLU A 70 1.480 -19.577 9.983 1.00 0.00 C ATOM 1047 OE1 GLU A 70 2.320 -18.704 10.131 1.00 0.00 O ATOM 1048 OE2 GLU A 70 0.469 -19.444 9.313 1.00 0.00 O ATOM 0 H GLU A 70 2.859 -20.675 14.856 1.00 0.00 H new ATOM 0 HA GLU A 70 1.071 -19.443 12.838 1.00 0.00 H new ATOM 0 HB2 GLU A 70 3.346 -19.957 11.708 1.00 0.00 H new ATOM 0 HB3 GLU A 70 3.116 -21.636 12.154 1.00 0.00 H new ATOM 0 HG2 GLU A 70 2.184 -21.621 9.993 1.00 0.00 H new ATOM 0 HG3 GLU A 70 0.753 -21.357 10.970 1.00 0.00 H new ATOM 1055 N SER A 71 1.371 -22.583 13.775 1.00 0.00 N ATOM 1056 CA SER A 71 0.537 -23.739 14.213 1.00 0.00 C ATOM 1057 C SER A 71 -0.432 -24.145 13.100 1.00 0.00 C ATOM 1058 O SER A 71 -0.853 -23.330 12.303 1.00 0.00 O ATOM 1059 CB SER A 71 -0.229 -23.233 15.433 1.00 0.00 C ATOM 1060 OG SER A 71 0.141 -23.999 16.571 1.00 0.00 O ATOM 0 H SER A 71 2.368 -22.777 13.682 1.00 0.00 H new ATOM 0 HA SER A 71 1.138 -24.618 14.445 1.00 0.00 H new ATOM 0 HB2 SER A 71 -0.010 -22.179 15.603 1.00 0.00 H new ATOM 0 HB3 SER A 71 -1.302 -23.311 15.261 1.00 0.00 H new ATOM 0 HG SER A 71 -0.348 -23.675 17.356 1.00 0.00 H new ATOM 1066 N ASP A 72 -0.786 -25.399 13.038 1.00 0.00 N ATOM 1067 CA ASP A 72 -1.727 -25.857 11.974 1.00 0.00 C ATOM 1068 C ASP A 72 -3.175 -25.622 12.412 1.00 0.00 C ATOM 1069 O ASP A 72 -3.603 -26.083 13.452 1.00 0.00 O ATOM 1070 CB ASP A 72 -1.450 -27.353 11.818 1.00 0.00 C ATOM 1071 CG ASP A 72 -1.642 -28.052 13.164 1.00 0.00 C ATOM 1072 OD1 ASP A 72 -0.746 -27.965 13.987 1.00 0.00 O ATOM 1073 OD2 ASP A 72 -2.682 -28.663 13.350 1.00 0.00 O ATOM 0 H ASP A 72 -0.465 -26.127 13.677 1.00 0.00 H new ATOM 0 HA ASP A 72 -1.587 -25.317 11.038 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -2.122 -27.782 11.075 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -0.433 -27.509 11.457 1.00 0.00 H new ATOM 1078 N LEU A 73 -3.934 -24.909 11.626 1.00 0.00 N ATOM 1079 CA LEU A 73 -5.354 -24.645 11.997 1.00 0.00 C ATOM 1080 C LEU A 73 -6.287 -25.568 11.209 1.00 0.00 C ATOM 1081 O LEU A 73 -6.403 -26.742 11.499 1.00 0.00 O ATOM 1082 CB LEU A 73 -5.599 -23.184 11.619 1.00 0.00 C ATOM 1083 CG LEU A 73 -4.764 -22.276 12.523 1.00 0.00 C ATOM 1084 CD1 LEU A 73 -3.771 -21.483 11.672 1.00 0.00 C ATOM 1085 CD2 LEU A 73 -5.688 -21.306 13.264 1.00 0.00 C ATOM 0 H LEU A 73 -3.633 -24.498 10.743 1.00 0.00 H new ATOM 0 HA LEU A 73 -5.545 -24.829 13.054 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -5.334 -23.018 10.575 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -6.657 -22.943 11.722 1.00 0.00 H new ATOM 0 HG LEU A 73 -4.219 -22.884 13.245 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -3.176 -20.836 12.316 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -3.113 -22.173 11.143 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -4.315 -20.875 10.950 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -5.094 -20.658 13.909 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -6.232 -20.698 12.541 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -6.397 -21.870 13.870 1.00 0.00 H new TER 1097 LEU A 73 ATOM 1098 N GLY B 7 12.708 6.103 -0.238 1.00 0.00 N ATOM 1099 CA GLY B 7 13.900 5.243 -0.486 1.00 0.00 C ATOM 1100 C GLY B 7 13.449 3.805 -0.749 1.00 0.00 C ATOM 1101 O GLY B 7 14.176 3.008 -1.308 1.00 0.00 O ATOM 0 HA2 GLY B 7 14.462 5.621 -1.340 1.00 0.00 H new ATOM 0 HA3 GLY B 7 14.569 5.274 0.374 1.00 0.00 H new ATOM 1105 N LYS B 8 12.253 3.467 -0.350 1.00 0.00 N ATOM 1106 CA LYS B 8 11.753 2.081 -0.576 1.00 0.00 C ATOM 1107 C LYS B 8 12.576 1.081 0.243 1.00 0.00 C ATOM 1108 O LYS B 8 12.071 0.436 1.140 1.00 0.00 O ATOM 1109 CB LYS B 8 11.934 1.829 -2.073 1.00 0.00 C ATOM 1110 CG LYS B 8 10.643 1.248 -2.656 1.00 0.00 C ATOM 1111 CD LYS B 8 9.576 2.343 -2.729 1.00 0.00 C ATOM 1112 CE LYS B 8 8.706 2.129 -3.970 1.00 0.00 C ATOM 1113 NZ LYS B 8 7.829 0.973 -3.632 1.00 0.00 N ATOM 0 H LYS B 8 11.600 4.092 0.123 1.00 0.00 H new ATOM 0 HA LYS B 8 10.714 1.963 -0.269 1.00 0.00 H new ATOM 0 HB2 LYS B 8 12.188 2.760 -2.581 1.00 0.00 H new ATOM 0 HB3 LYS B 8 12.762 1.140 -2.238 1.00 0.00 H new ATOM 0 HG2 LYS B 8 10.831 0.842 -3.650 1.00 0.00 H new ATOM 0 HG3 LYS B 8 10.291 0.423 -2.036 1.00 0.00 H new ATOM 0 HD2 LYS B 8 8.958 2.323 -1.831 1.00 0.00 H new ATOM 0 HD3 LYS B 8 10.049 3.324 -2.769 1.00 0.00 H new ATOM 0 HE2 LYS B 8 8.117 3.018 -4.197 1.00 0.00 H new ATOM 0 HE3 LYS B 8 9.316 1.918 -4.848 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 7.113 0.851 -4.377 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 8.405 0.110 -3.560 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 7.356 1.150 -2.723 1.00 0.00 H new ATOM 1127 N LYS B 9 13.839 0.948 -0.058 1.00 0.00 N ATOM 1128 CA LYS B 9 14.689 -0.009 0.709 1.00 0.00 C ATOM 1129 C LYS B 9 14.756 0.412 2.179 1.00 0.00 C ATOM 1130 O LYS B 9 14.670 -0.405 3.073 1.00 0.00 O ATOM 1131 CB LYS B 9 16.072 0.075 0.061 1.00 0.00 C ATOM 1132 CG LYS B 9 16.633 -1.335 -0.133 1.00 0.00 C ATOM 1133 CD LYS B 9 18.142 -1.256 -0.378 1.00 0.00 C ATOM 1134 CE LYS B 9 18.881 -1.344 0.959 1.00 0.00 C ATOM 1135 NZ LYS B 9 20.297 -1.008 0.639 1.00 0.00 N ATOM 0 H LYS B 9 14.319 1.459 -0.799 1.00 0.00 H new ATOM 0 HA LYS B 9 14.294 -1.024 0.685 1.00 0.00 H new ATOM 0 HB2 LYS B 9 16.005 0.586 -0.899 1.00 0.00 H new ATOM 0 HB3 LYS B 9 16.744 0.662 0.688 1.00 0.00 H new ATOM 0 HG2 LYS B 9 16.428 -1.943 0.748 1.00 0.00 H new ATOM 0 HG3 LYS B 9 16.142 -1.820 -0.977 1.00 0.00 H new ATOM 0 HD2 LYS B 9 18.458 -2.067 -1.034 1.00 0.00 H new ATOM 0 HD3 LYS B 9 18.391 -0.322 -0.883 1.00 0.00 H new ATOM 0 HE2 LYS B 9 18.465 -0.647 1.687 1.00 0.00 H new ATOM 0 HE3 LYS B 9 18.800 -2.342 1.390 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 20.868 -1.047 1.507 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 20.669 -1.692 -0.051 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 20.344 -0.050 0.237 1.00 0.00 H new ATOM 1149 N ALA B 10 14.905 1.683 2.435 1.00 0.00 N ATOM 1150 CA ALA B 10 14.971 2.154 3.849 1.00 0.00 C ATOM 1151 C ALA B 10 13.687 1.769 4.587 1.00 0.00 C ATOM 1152 O ALA B 10 13.707 1.433 5.755 1.00 0.00 O ATOM 1153 CB ALA B 10 15.104 3.674 3.757 1.00 0.00 C ATOM 0 H ALA B 10 14.984 2.415 1.729 1.00 0.00 H new ATOM 0 HA ALA B 10 15.801 1.709 4.397 1.00 0.00 H new ATOM 0 HB1 ALA B 10 15.159 4.096 4.761 1.00 0.00 H new ATOM 0 HB2 ALA B 10 16.010 3.927 3.207 1.00 0.00 H new ATOM 0 HB3 ALA B 10 14.238 4.084 3.238 1.00 0.00 H new ATOM 1159 N GLU B 11 12.569 1.811 3.913 1.00 0.00 N ATOM 1160 CA GLU B 11 11.287 1.441 4.578 1.00 0.00 C ATOM 1161 C GLU B 11 11.285 -0.051 4.913 1.00 0.00 C ATOM 1162 O GLU B 11 10.871 -0.455 5.981 1.00 0.00 O ATOM 1163 CB GLU B 11 10.199 1.766 3.555 1.00 0.00 C ATOM 1164 CG GLU B 11 9.099 2.589 4.229 1.00 0.00 C ATOM 1165 CD GLU B 11 8.144 1.654 4.973 1.00 0.00 C ATOM 1166 OE1 GLU B 11 8.280 0.451 4.815 1.00 0.00 O ATOM 1167 OE2 GLU B 11 7.293 2.156 5.687 1.00 0.00 O ATOM 0 H GLU B 11 12.488 2.085 2.934 1.00 0.00 H new ATOM 0 HA GLU B 11 11.134 1.979 5.514 1.00 0.00 H new ATOM 0 HB2 GLU B 11 10.624 2.322 2.719 1.00 0.00 H new ATOM 0 HB3 GLU B 11 9.782 0.846 3.146 1.00 0.00 H new ATOM 0 HG2 GLU B 11 9.539 3.304 4.924 1.00 0.00 H new ATOM 0 HG3 GLU B 11 8.552 3.165 3.483 1.00 0.00 H new ATOM 1174 N ALA B 12 11.754 -0.872 4.013 1.00 0.00 N ATOM 1175 CA ALA B 12 11.786 -2.335 4.292 1.00 0.00 C ATOM 1176 C ALA B 12 12.705 -2.606 5.484 1.00 0.00 C ATOM 1177 O ALA B 12 12.405 -3.407 6.345 1.00 0.00 O ATOM 1178 CB ALA B 12 12.348 -2.973 3.021 1.00 0.00 C ATOM 0 H ALA B 12 12.115 -0.594 3.100 1.00 0.00 H new ATOM 0 HA ALA B 12 10.804 -2.737 4.540 1.00 0.00 H new ATOM 0 HB1 ALA B 12 12.402 -4.054 3.150 1.00 0.00 H new ATOM 0 HB2 ALA B 12 11.697 -2.740 2.178 1.00 0.00 H new ATOM 0 HB3 ALA B 12 13.346 -2.580 2.828 1.00 0.00 H new ATOM 1184 N VAL B 13 13.820 -1.930 5.544 1.00 0.00 N ATOM 1185 CA VAL B 13 14.755 -2.132 6.685 1.00 0.00 C ATOM 1186 C VAL B 13 14.072 -1.707 7.986 1.00 0.00 C ATOM 1187 O VAL B 13 14.203 -2.347 9.010 1.00 0.00 O ATOM 1188 CB VAL B 13 15.950 -1.227 6.385 1.00 0.00 C ATOM 1189 CG1 VAL B 13 16.903 -1.222 7.581 1.00 0.00 C ATOM 1190 CG2 VAL B 13 16.687 -1.749 5.148 1.00 0.00 C ATOM 0 H VAL B 13 14.123 -1.246 4.851 1.00 0.00 H new ATOM 0 HA VAL B 13 15.058 -3.173 6.801 1.00 0.00 H new ATOM 0 HB VAL B 13 15.598 -0.212 6.199 1.00 0.00 H new ATOM 0 HG11 VAL B 13 17.754 -0.576 7.365 1.00 0.00 H new ATOM 0 HG12 VAL B 13 16.380 -0.850 8.462 1.00 0.00 H new ATOM 0 HG13 VAL B 13 17.255 -2.236 7.770 1.00 0.00 H new ATOM 0 HG21 VAL B 13 17.539 -1.104 4.933 1.00 0.00 H new ATOM 0 HG22 VAL B 13 17.038 -2.764 5.335 1.00 0.00 H new ATOM 0 HG23 VAL B 13 16.009 -1.751 4.294 1.00 0.00 H new ATOM 1200 N ALA B 14 13.339 -0.627 7.948 1.00 0.00 N ATOM 1201 CA ALA B 14 12.639 -0.151 9.175 1.00 0.00 C ATOM 1202 C ALA B 14 11.637 -1.206 9.651 1.00 0.00 C ATOM 1203 O ALA B 14 11.433 -1.395 10.834 1.00 0.00 O ATOM 1204 CB ALA B 14 11.911 1.123 8.743 1.00 0.00 C ATOM 0 H ALA B 14 13.195 -0.053 7.118 1.00 0.00 H new ATOM 0 HA ALA B 14 13.326 0.032 10.001 1.00 0.00 H new ATOM 0 HB1 ALA B 14 11.369 1.538 9.593 1.00 0.00 H new ATOM 0 HB2 ALA B 14 12.637 1.853 8.384 1.00 0.00 H new ATOM 0 HB3 ALA B 14 11.208 0.887 7.944 1.00 0.00 H new ATOM 1210 N THR B 15 11.007 -1.893 8.738 1.00 0.00 N ATOM 1211 CA THR B 15 10.016 -2.932 9.137 1.00 0.00 C ATOM 1212 C THR B 15 10.728 -4.130 9.772 1.00 0.00 C ATOM 1213 O THR B 15 10.332 -4.621 10.811 1.00 0.00 O ATOM 1214 CB THR B 15 9.332 -3.348 7.834 1.00 0.00 C ATOM 1215 OG1 THR B 15 9.145 -2.203 7.013 1.00 0.00 O ATOM 1216 CG2 THR B 15 7.977 -3.980 8.148 1.00 0.00 C ATOM 0 H THR B 15 11.136 -1.780 7.733 1.00 0.00 H new ATOM 0 HA THR B 15 9.304 -2.559 9.873 1.00 0.00 H new ATOM 0 HB THR B 15 9.955 -4.073 7.310 1.00 0.00 H new ATOM 0 HG1 THR B 15 9.964 -2.028 6.504 1.00 0.00 H new ATOM 0 HG21 THR B 15 7.490 -4.276 7.219 1.00 0.00 H new ATOM 0 HG22 THR B 15 8.122 -4.858 8.778 1.00 0.00 H new ATOM 0 HG23 THR B 15 7.351 -3.257 8.672 1.00 0.00 H new ATOM 1224 N VAL B 16 11.773 -4.607 9.153 1.00 0.00 N ATOM 1225 CA VAL B 16 12.506 -5.775 9.717 1.00 0.00 C ATOM 1226 C VAL B 16 13.091 -5.425 11.089 1.00 0.00 C ATOM 1227 O VAL B 16 13.026 -6.204 12.018 1.00 0.00 O ATOM 1228 CB VAL B 16 13.624 -6.061 8.715 1.00 0.00 C ATOM 1229 CG1 VAL B 16 14.335 -7.359 9.102 1.00 0.00 C ATOM 1230 CG2 VAL B 16 13.027 -6.205 7.314 1.00 0.00 C ATOM 0 H VAL B 16 12.151 -4.238 8.280 1.00 0.00 H new ATOM 0 HA VAL B 16 11.856 -6.638 9.862 1.00 0.00 H new ATOM 0 HB VAL B 16 14.339 -5.239 8.723 1.00 0.00 H new ATOM 0 HG11 VAL B 16 15.133 -7.564 8.388 1.00 0.00 H new ATOM 0 HG12 VAL B 16 14.759 -7.257 10.101 1.00 0.00 H new ATOM 0 HG13 VAL B 16 13.620 -8.182 9.093 1.00 0.00 H new ATOM 0 HG21 VAL B 16 13.823 -6.409 6.598 1.00 0.00 H new ATOM 0 HG22 VAL B 16 12.312 -7.028 7.306 1.00 0.00 H new ATOM 0 HG23 VAL B 16 12.519 -5.281 7.038 1.00 0.00 H new ATOM 1240 N VAL B 17 13.662 -4.260 11.221 1.00 0.00 N ATOM 1241 CA VAL B 17 14.250 -3.863 12.533 1.00 0.00 C ATOM 1242 C VAL B 17 13.162 -3.806 13.608 1.00 0.00 C ATOM 1243 O VAL B 17 13.293 -4.384 14.668 1.00 0.00 O ATOM 1244 CB VAL B 17 14.846 -2.475 12.295 1.00 0.00 C ATOM 1245 CG1 VAL B 17 15.434 -1.940 13.601 1.00 0.00 C ATOM 1246 CG2 VAL B 17 15.952 -2.570 11.241 1.00 0.00 C ATOM 0 H VAL B 17 13.747 -3.566 10.479 1.00 0.00 H new ATOM 0 HA VAL B 17 14.999 -4.574 12.882 1.00 0.00 H new ATOM 0 HB VAL B 17 14.065 -1.800 11.945 1.00 0.00 H new ATOM 0 HG11 VAL B 17 15.859 -0.951 13.431 1.00 0.00 H new ATOM 0 HG12 VAL B 17 14.648 -1.873 14.353 1.00 0.00 H new ATOM 0 HG13 VAL B 17 16.215 -2.615 13.952 1.00 0.00 H new ATOM 0 HG21 VAL B 17 16.378 -1.581 11.070 1.00 0.00 H new ATOM 0 HG22 VAL B 17 16.732 -3.245 11.592 1.00 0.00 H new ATOM 0 HG23 VAL B 17 15.535 -2.951 10.309 1.00 0.00 H new ATOM 1256 N ALA B 18 12.087 -3.114 13.343 1.00 0.00 N ATOM 1257 CA ALA B 18 10.991 -3.022 14.350 1.00 0.00 C ATOM 1258 C ALA B 18 10.451 -4.419 14.677 1.00 0.00 C ATOM 1259 O ALA B 18 10.159 -4.731 15.814 1.00 0.00 O ATOM 1260 CB ALA B 18 9.910 -2.173 13.681 1.00 0.00 C ATOM 0 H ALA B 18 11.920 -2.608 12.473 1.00 0.00 H new ATOM 0 HA ALA B 18 11.330 -2.586 15.290 1.00 0.00 H new ATOM 0 HB1 ALA B 18 9.065 -2.058 14.360 1.00 0.00 H new ATOM 0 HB2 ALA B 18 10.317 -1.191 13.438 1.00 0.00 H new ATOM 0 HB3 ALA B 18 9.576 -2.664 12.767 1.00 0.00 H new ATOM 1266 N ALA B 19 10.316 -5.261 13.689 1.00 0.00 N ATOM 1267 CA ALA B 19 9.796 -6.636 13.945 1.00 0.00 C ATOM 1268 C ALA B 19 10.764 -7.408 14.845 1.00 0.00 C ATOM 1269 O ALA B 19 10.360 -8.118 15.744 1.00 0.00 O ATOM 1270 CB ALA B 19 9.708 -7.290 12.566 1.00 0.00 C ATOM 0 H ALA B 19 10.543 -5.057 12.716 1.00 0.00 H new ATOM 0 HA ALA B 19 8.831 -6.625 14.452 1.00 0.00 H new ATOM 0 HB1 ALA B 19 9.332 -8.308 12.669 1.00 0.00 H new ATOM 0 HB2 ALA B 19 9.031 -6.716 11.934 1.00 0.00 H new ATOM 0 HB3 ALA B 19 10.698 -7.313 12.110 1.00 0.00 H new ATOM 1276 N VAL B 20 12.042 -7.273 14.612 1.00 0.00 N ATOM 1277 CA VAL B 20 13.034 -8.000 15.456 1.00 0.00 C ATOM 1278 C VAL B 20 13.007 -7.460 16.888 1.00 0.00 C ATOM 1279 O VAL B 20 13.076 -8.206 17.845 1.00 0.00 O ATOM 1280 CB VAL B 20 14.389 -7.721 14.807 1.00 0.00 C ATOM 1281 CG1 VAL B 20 15.506 -8.253 15.707 1.00 0.00 C ATOM 1282 CG2 VAL B 20 14.458 -8.420 13.447 1.00 0.00 C ATOM 0 H VAL B 20 12.441 -6.692 13.875 1.00 0.00 H new ATOM 0 HA VAL B 20 12.821 -9.067 15.513 1.00 0.00 H new ATOM 0 HB VAL B 20 14.510 -6.646 14.671 1.00 0.00 H new ATOM 0 HG11 VAL B 20 16.472 -8.054 15.244 1.00 0.00 H new ATOM 0 HG12 VAL B 20 15.459 -7.757 16.677 1.00 0.00 H new ATOM 0 HG13 VAL B 20 15.383 -9.328 15.843 1.00 0.00 H new ATOM 0 HG21 VAL B 20 15.425 -8.221 12.984 1.00 0.00 H new ATOM 0 HG22 VAL B 20 14.336 -9.494 13.584 1.00 0.00 H new ATOM 0 HG23 VAL B 20 13.663 -8.043 12.803 1.00 0.00 H new ATOM 1292 N ASP B 21 12.908 -6.168 17.042 1.00 0.00 N ATOM 1293 CA ASP B 21 12.878 -5.583 18.413 1.00 0.00 C ATOM 1294 C ASP B 21 11.622 -6.040 19.158 1.00 0.00 C ATOM 1295 O ASP B 21 11.659 -6.330 20.338 1.00 0.00 O ATOM 1296 CB ASP B 21 12.855 -4.069 18.197 1.00 0.00 C ATOM 1297 CG ASP B 21 13.252 -3.363 19.495 1.00 0.00 C ATOM 1298 OD1 ASP B 21 14.412 -3.449 19.862 1.00 0.00 O ATOM 1299 OD2 ASP B 21 12.388 -2.751 20.101 1.00 0.00 O ATOM 0 H ASP B 21 12.847 -5.493 16.280 1.00 0.00 H new ATOM 0 HA ASP B 21 13.732 -5.896 19.014 1.00 0.00 H new ATOM 0 HB2 ASP B 21 13.542 -3.795 17.396 1.00 0.00 H new ATOM 0 HB3 ASP B 21 11.860 -3.750 17.887 1.00 0.00 H new ATOM 1304 N GLN B 22 10.507 -6.107 18.482 1.00 0.00 N ATOM 1305 CA GLN B 22 9.251 -6.545 19.157 1.00 0.00 C ATOM 1306 C GLN B 22 9.427 -7.946 19.750 1.00 0.00 C ATOM 1307 O GLN B 22 9.085 -8.195 20.889 1.00 0.00 O ATOM 1308 CB GLN B 22 8.192 -6.561 18.052 1.00 0.00 C ATOM 1309 CG GLN B 22 6.827 -6.213 18.651 1.00 0.00 C ATOM 1310 CD GLN B 22 5.863 -5.811 17.534 1.00 0.00 C ATOM 1311 OE1 GLN B 22 6.282 -5.388 16.475 1.00 0.00 O ATOM 1312 NE2 GLN B 22 4.577 -5.926 17.729 1.00 0.00 N ATOM 0 H GLN B 22 10.411 -5.878 17.493 1.00 0.00 H new ATOM 0 HA GLN B 22 8.974 -5.885 19.979 1.00 0.00 H new ATOM 0 HB2 GLN B 22 8.453 -5.845 17.273 1.00 0.00 H new ATOM 0 HB3 GLN B 22 8.155 -7.544 17.582 1.00 0.00 H new ATOM 0 HG2 GLN B 22 6.430 -7.068 19.197 1.00 0.00 H new ATOM 0 HG3 GLN B 22 6.930 -5.398 19.367 1.00 0.00 H new ATOM 0 HE21 GLN B 22 4.226 -6.281 18.618 1.00 0.00 H new ATOM 0 HE22 GLN B 22 3.924 -5.661 16.992 1.00 0.00 H new ATOM 1321 N ALA B 23 9.958 -8.861 18.986 1.00 0.00 N ATOM 1322 CA ALA B 23 10.155 -10.246 19.505 1.00 0.00 C ATOM 1323 C ALA B 23 11.019 -10.223 20.769 1.00 0.00 C ATOM 1324 O ALA B 23 10.763 -10.934 21.721 1.00 0.00 O ATOM 1325 CB ALA B 23 10.876 -10.988 18.379 1.00 0.00 C ATOM 0 H ALA B 23 10.264 -8.710 18.025 1.00 0.00 H new ATOM 0 HA ALA B 23 9.213 -10.723 19.775 1.00 0.00 H new ATOM 0 HB1 ALA B 23 11.059 -12.019 18.682 1.00 0.00 H new ATOM 0 HB2 ALA B 23 10.257 -10.978 17.482 1.00 0.00 H new ATOM 0 HB3 ALA B 23 11.826 -10.497 18.170 1.00 0.00 H new ATOM 1331 N ARG B 24 12.041 -9.412 20.785 1.00 0.00 N ATOM 1332 CA ARG B 24 12.923 -9.345 21.986 1.00 0.00 C ATOM 1333 C ARG B 24 12.150 -8.776 23.178 1.00 0.00 C ATOM 1334 O ARG B 24 12.284 -9.238 24.294 1.00 0.00 O ATOM 1335 CB ARG B 24 14.060 -8.403 21.588 1.00 0.00 C ATOM 1336 CG ARG B 24 15.364 -9.195 21.482 1.00 0.00 C ATOM 1337 CD ARG B 24 15.868 -9.540 22.886 1.00 0.00 C ATOM 1338 NE ARG B 24 16.498 -8.287 23.389 1.00 0.00 N ATOM 1339 CZ ARG B 24 17.687 -7.937 22.974 1.00 0.00 C ATOM 1340 NH1 ARG B 24 18.326 -8.680 22.110 1.00 0.00 N ATOM 1341 NH2 ARG B 24 18.236 -6.841 23.424 1.00 0.00 N ATOM 0 H ARG B 24 12.304 -8.792 20.019 1.00 0.00 H new ATOM 0 HA ARG B 24 13.290 -10.327 22.284 1.00 0.00 H new ATOM 0 HB2 ARG B 24 13.834 -7.925 20.635 1.00 0.00 H new ATOM 0 HB3 ARG B 24 14.164 -7.608 22.327 1.00 0.00 H new ATOM 0 HG2 ARG B 24 15.202 -10.107 20.908 1.00 0.00 H new ATOM 0 HG3 ARG B 24 16.114 -8.611 20.948 1.00 0.00 H new ATOM 0 HD2 ARG B 24 15.049 -9.857 23.532 1.00 0.00 H new ATOM 0 HD3 ARG B 24 16.587 -10.359 22.857 1.00 0.00 H new ATOM 0 HE ARG B 24 16.000 -7.701 24.059 1.00 0.00 H new ATOM 0 HH11 ARG B 24 17.897 -9.536 21.758 1.00 0.00 H new ATOM 0 HH12 ARG B 24 19.254 -8.404 21.788 1.00 0.00 H new ATOM 0 HH21 ARG B 24 17.737 -6.260 24.098 1.00 0.00 H new ATOM 0 HH22 ARG B 24 19.164 -6.566 23.102 1.00 0.00 H new ATOM 1355 N VAL B 25 11.342 -7.778 22.951 1.00 0.00 N ATOM 1356 CA VAL B 25 10.561 -7.182 24.072 1.00 0.00 C ATOM 1357 C VAL B 25 9.600 -8.218 24.656 1.00 0.00 C ATOM 1358 O VAL B 25 9.158 -8.106 25.782 1.00 0.00 O ATOM 1359 CB VAL B 25 9.790 -6.022 23.443 1.00 0.00 C ATOM 1360 CG1 VAL B 25 8.951 -5.323 24.514 1.00 0.00 C ATOM 1361 CG2 VAL B 25 10.779 -5.023 22.836 1.00 0.00 C ATOM 0 H VAL B 25 11.188 -7.349 22.038 1.00 0.00 H new ATOM 0 HA VAL B 25 11.199 -6.849 24.891 1.00 0.00 H new ATOM 0 HB VAL B 25 9.133 -6.405 22.662 1.00 0.00 H new ATOM 0 HG11 VAL B 25 8.402 -4.496 24.064 1.00 0.00 H new ATOM 0 HG12 VAL B 25 8.247 -6.034 24.946 1.00 0.00 H new ATOM 0 HG13 VAL B 25 9.606 -4.940 25.297 1.00 0.00 H new ATOM 0 HG21 VAL B 25 10.230 -4.195 22.387 1.00 0.00 H new ATOM 0 HG22 VAL B 25 11.436 -4.641 23.617 1.00 0.00 H new ATOM 0 HG23 VAL B 25 11.375 -5.520 22.071 1.00 0.00 H new ATOM 1371 N ARG B 26 9.277 -9.226 23.898 1.00 0.00 N ATOM 1372 CA ARG B 26 8.346 -10.277 24.404 1.00 0.00 C ATOM 1373 C ARG B 26 9.104 -11.586 24.638 1.00 0.00 C ATOM 1374 O ARG B 26 8.526 -12.654 24.651 1.00 0.00 O ATOM 1375 CB ARG B 26 7.304 -10.453 23.298 1.00 0.00 C ATOM 1376 CG ARG B 26 5.899 -10.290 23.884 1.00 0.00 C ATOM 1377 CD ARG B 26 4.875 -10.241 22.749 1.00 0.00 C ATOM 1378 NE ARG B 26 3.566 -9.994 23.416 1.00 0.00 N ATOM 1379 CZ ARG B 26 2.947 -10.965 24.033 1.00 0.00 C ATOM 1380 NH1 ARG B 26 3.477 -12.159 24.078 1.00 0.00 N ATOM 1381 NH2 ARG B 26 1.797 -10.743 24.607 1.00 0.00 N ATOM 0 H ARG B 26 9.617 -9.370 22.947 1.00 0.00 H new ATOM 0 HA ARG B 26 7.889 -9.999 25.354 1.00 0.00 H new ATOM 0 HB2 ARG B 26 7.468 -9.718 22.510 1.00 0.00 H new ATOM 0 HB3 ARG B 26 7.406 -11.437 22.842 1.00 0.00 H new ATOM 0 HG2 ARG B 26 5.675 -11.119 24.555 1.00 0.00 H new ATOM 0 HG3 ARG B 26 5.844 -9.377 24.477 1.00 0.00 H new ATOM 0 HD2 ARG B 26 5.111 -9.448 22.039 1.00 0.00 H new ATOM 0 HD3 ARG B 26 4.862 -11.176 22.190 1.00 0.00 H new ATOM 0 HE ARG B 26 3.151 -9.063 23.391 1.00 0.00 H new ATOM 0 HH11 ARG B 26 4.377 -12.335 23.631 1.00 0.00 H new ATOM 0 HH12 ARG B 26 2.991 -12.915 24.561 1.00 0.00 H new ATOM 0 HH21 ARG B 26 1.382 -9.812 24.574 1.00 0.00 H new ATOM 0 HH22 ARG B 26 1.313 -11.500 25.089 1.00 0.00 H new ATOM 1395 N GLU B 27 10.395 -11.512 24.818 1.00 0.00 N ATOM 1396 CA GLU B 27 11.188 -12.756 25.047 1.00 0.00 C ATOM 1397 C GLU B 27 11.170 -13.130 26.532 1.00 0.00 C ATOM 1398 O GLU B 27 11.599 -12.363 27.371 1.00 0.00 O ATOM 1399 CB GLU B 27 12.607 -12.408 24.599 1.00 0.00 C ATOM 1400 CG GLU B 27 13.165 -13.546 23.742 1.00 0.00 C ATOM 1401 CD GLU B 27 14.693 -13.498 23.761 1.00 0.00 C ATOM 1402 OE1 GLU B 27 15.246 -12.603 23.144 1.00 0.00 O ATOM 1403 OE2 GLU B 27 15.286 -14.358 24.393 1.00 0.00 O ATOM 0 H GLU B 27 10.935 -10.647 24.817 1.00 0.00 H new ATOM 0 HA GLU B 27 10.785 -13.609 24.501 1.00 0.00 H new ATOM 0 HB2 GLU B 27 12.602 -11.478 24.030 1.00 0.00 H new ATOM 0 HB3 GLU B 27 13.245 -12.246 25.468 1.00 0.00 H new ATOM 0 HG2 GLU B 27 12.816 -14.506 24.122 1.00 0.00 H new ATOM 0 HG3 GLU B 27 12.801 -13.457 22.719 1.00 0.00 H new ATOM 1410 N PRO B 28 10.672 -14.306 26.805 1.00 0.00 N ATOM 1411 CA PRO B 28 10.615 -14.753 28.221 1.00 0.00 C ATOM 1412 C PRO B 28 11.980 -14.568 28.890 1.00 0.00 C ATOM 1413 O PRO B 28 12.944 -14.183 28.258 1.00 0.00 O ATOM 1414 CB PRO B 28 10.250 -16.235 28.141 1.00 0.00 C ATOM 1415 CG PRO B 28 10.607 -16.654 26.754 1.00 0.00 C ATOM 1416 CD PRO B 28 10.501 -15.434 25.879 1.00 0.00 C ATOM 0 HA PRO B 28 9.897 -14.184 28.812 1.00 0.00 H new ATOM 0 HB2 PRO B 28 10.800 -16.816 28.881 1.00 0.00 H new ATOM 0 HB3 PRO B 28 9.189 -16.390 28.338 1.00 0.00 H new ATOM 0 HG2 PRO B 28 11.617 -17.063 26.724 1.00 0.00 H new ATOM 0 HG3 PRO B 28 9.935 -17.438 26.404 1.00 0.00 H new ATOM 0 HD2 PRO B 28 11.268 -15.432 25.104 1.00 0.00 H new ATOM 0 HD3 PRO B 28 9.537 -15.390 25.373 1.00 0.00 H new ATOM 1424 N ARG B 29 12.068 -14.838 30.163 1.00 0.00 N ATOM 1425 CA ARG B 29 13.371 -14.676 30.872 1.00 0.00 C ATOM 1426 C ARG B 29 13.887 -16.037 31.348 1.00 0.00 C ATOM 1427 O ARG B 29 13.315 -17.067 31.051 1.00 0.00 O ATOM 1428 CB ARG B 29 13.058 -13.773 32.065 1.00 0.00 C ATOM 1429 CG ARG B 29 14.357 -13.408 32.787 1.00 0.00 C ATOM 1430 CD ARG B 29 14.135 -13.477 34.300 1.00 0.00 C ATOM 1431 NE ARG B 29 15.218 -12.638 34.886 1.00 0.00 N ATOM 1432 CZ ARG B 29 15.127 -11.335 34.855 1.00 0.00 C ATOM 1433 NH1 ARG B 29 14.089 -10.762 34.309 1.00 0.00 N ATOM 1434 NH2 ARG B 29 16.078 -10.605 35.370 1.00 0.00 N ATOM 0 H ARG B 29 11.295 -15.164 30.744 1.00 0.00 H new ATOM 0 HA ARG B 29 14.143 -14.252 30.230 1.00 0.00 H new ATOM 0 HB2 ARG B 29 12.552 -12.869 31.727 1.00 0.00 H new ATOM 0 HB3 ARG B 29 12.379 -14.281 32.750 1.00 0.00 H new ATOM 0 HG2 ARG B 29 15.153 -14.092 32.494 1.00 0.00 H new ATOM 0 HG3 ARG B 29 14.676 -12.406 32.501 1.00 0.00 H new ATOM 0 HD2 ARG B 29 13.150 -13.097 34.572 1.00 0.00 H new ATOM 0 HD3 ARG B 29 14.192 -14.504 34.661 1.00 0.00 H new ATOM 0 HE ARG B 29 16.032 -13.082 35.312 1.00 0.00 H new ATOM 0 HH11 ARG B 29 13.346 -11.332 33.905 1.00 0.00 H new ATOM 0 HH12 ARG B 29 14.021 -9.745 34.287 1.00 0.00 H new ATOM 0 HH21 ARG B 29 16.890 -11.052 35.796 1.00 0.00 H new ATOM 0 HH22 ARG B 29 16.009 -9.588 35.347 1.00 0.00 H new TER 1448 ARG B 29