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 Set 1.1: A 48 TYR OH : rot 130:sc= -1.08 USER MOD Set 1.2: A 53 SER OG : rot 99:sc= 0.544! USER MOD Set 2.1: A 21 LYS NZ :NH3+ 159:sc=-0.00178 (180deg=0) USER MOD Set 2.2: A 23 TYR OH : rot 180:sc= -0.0318 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 156:sc= 1.04 (180deg=0.532) USER MOD Single : A 4 THR OG1 : rot 180:sc= -0.557 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= -0.225 K(o=-0.22,f=-2.4!) USER MOD Single : A 13 SER OG : rot 97:sc= 1.17 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -0.0247 X(o=-0.025,f=-0.5) USER MOD Single : A 39 GLN : amide:sc= -1.23 K(o=-1.2,f=-1.9) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 CYS SG : rot 80:sc= 0.243 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 MET CE :methyl 148:sc= -4.99! (180deg=-7.43!) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 165:sc= 0 USER MOD Single : A 64 SER OG : rot -160:sc= -1.19! USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot -17:sc= -2.19! USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 THR OG1 : rot 180:sc= 0 USER MOD Single : B 22 GLN : amide:sc= -0.438 K(o=-0.44,f=-3.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.565 -14.314 4.672 1.00 0.00 N ATOM 2 CA MET A 1 -3.937 -14.318 3.227 1.00 0.00 C ATOM 3 C MET A 1 -3.813 -12.907 2.645 1.00 0.00 C ATOM 4 O MET A 1 -2.959 -12.639 1.822 1.00 0.00 O ATOM 5 CB MET A 1 -5.391 -14.786 3.195 1.00 0.00 C ATOM 6 CG MET A 1 -5.435 -16.316 3.211 1.00 0.00 C ATOM 7 SD MET A 1 -5.410 -16.900 4.924 1.00 0.00 S ATOM 8 CE MET A 1 -6.205 -18.498 4.633 1.00 0.00 C ATOM 0 H1 MET A 1 -4.017 -15.120 5.149 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.532 -14.392 4.765 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.886 -13.427 5.111 1.00 0.00 H new ATOM 0 HA MET A 1 -3.288 -14.963 2.635 1.00 0.00 H new ATOM 0 HB2 MET A 1 -5.932 -14.387 4.053 1.00 0.00 H new ATOM 0 HB3 MET A 1 -5.887 -14.407 2.302 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.334 -16.670 2.707 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.583 -16.721 2.665 1.00 0.00 H new ATOM 0 HE1 MET A 1 -6.293 -19.038 5.576 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.198 -18.339 4.212 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.604 -19.082 3.936 1.00 0.00 H new ATOM 18 N ALA A 2 -4.655 -12.004 3.065 1.00 0.00 N ATOM 19 CA ALA A 2 -4.581 -10.612 2.534 1.00 0.00 C ATOM 20 C ALA A 2 -5.530 -9.694 3.310 1.00 0.00 C ATOM 21 O ALA A 2 -6.565 -9.294 2.815 1.00 0.00 O ATOM 22 CB ALA A 2 -5.019 -10.722 1.073 1.00 0.00 C ATOM 0 H ALA A 2 -5.391 -12.168 3.752 1.00 0.00 H new ATOM 0 HA ALA A 2 -3.582 -10.188 2.631 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -4.992 -9.736 0.610 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -4.344 -11.392 0.540 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -6.034 -11.117 1.026 1.00 0.00 H new ATOM 28 N ASP A 3 -5.184 -9.354 4.522 1.00 0.00 N ATOM 29 CA ASP A 3 -6.066 -8.458 5.324 1.00 0.00 C ATOM 30 C ASP A 3 -5.277 -7.825 6.472 1.00 0.00 C ATOM 31 O ASP A 3 -5.523 -8.094 7.630 1.00 0.00 O ATOM 32 CB ASP A 3 -7.167 -9.367 5.870 1.00 0.00 C ATOM 33 CG ASP A 3 -8.306 -8.509 6.424 1.00 0.00 C ATOM 34 OD1 ASP A 3 -8.812 -7.681 5.683 1.00 0.00 O ATOM 35 OD2 ASP A 3 -8.653 -8.692 7.579 1.00 0.00 O ATOM 0 H ASP A 3 -4.330 -9.657 4.991 1.00 0.00 H new ATOM 0 HA ASP A 3 -6.471 -7.640 4.728 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -7.540 -10.020 5.081 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -6.767 -10.010 6.654 1.00 0.00 H new ATOM 40 N THR A 4 -4.329 -6.984 6.160 1.00 0.00 N ATOM 41 CA THR A 4 -3.525 -6.335 7.235 1.00 0.00 C ATOM 42 C THR A 4 -2.837 -7.399 8.093 1.00 0.00 C ATOM 43 O THR A 4 -3.476 -8.131 8.822 1.00 0.00 O ATOM 44 CB THR A 4 -4.540 -5.549 8.067 1.00 0.00 C ATOM 45 OG1 THR A 4 -5.675 -5.251 7.267 1.00 0.00 O ATOM 46 CG2 THR A 4 -3.904 -4.248 8.558 1.00 0.00 C ATOM 0 H THR A 4 -4.076 -6.718 5.208 1.00 0.00 H new ATOM 0 HA THR A 4 -2.740 -5.692 6.835 1.00 0.00 H new ATOM 0 HB THR A 4 -4.846 -6.146 8.926 1.00 0.00 H new ATOM 0 HG1 THR A 4 -6.327 -4.749 7.799 1.00 0.00 H new ATOM 0 HG21 THR A 4 -4.629 -3.690 9.150 1.00 0.00 H new ATOM 0 HG22 THR A 4 -3.033 -4.478 9.172 1.00 0.00 H new ATOM 0 HG23 THR A 4 -3.596 -3.648 7.702 1.00 0.00 H new ATOM 54 N ASP A 5 -1.538 -7.492 8.009 1.00 0.00 N ATOM 55 CA ASP A 5 -0.811 -8.511 8.820 1.00 0.00 C ATOM 56 C ASP A 5 0.582 -7.996 9.194 1.00 0.00 C ATOM 57 O ASP A 5 1.092 -7.067 8.601 1.00 0.00 O ATOM 58 CB ASP A 5 -0.705 -9.736 7.912 1.00 0.00 C ATOM 59 CG ASP A 5 -0.429 -10.979 8.762 1.00 0.00 C ATOM 60 OD1 ASP A 5 -0.556 -10.884 9.972 1.00 0.00 O ATOM 61 OD2 ASP A 5 -0.097 -12.003 8.188 1.00 0.00 O ATOM 0 H ASP A 5 -0.949 -6.908 7.415 1.00 0.00 H new ATOM 0 HA ASP A 5 -1.325 -8.739 9.754 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -1.629 -9.865 7.349 1.00 0.00 H new ATOM 0 HB3 ASP A 5 0.095 -9.595 7.185 1.00 0.00 H new ATOM 66 N THR A 6 1.199 -8.594 10.177 1.00 0.00 N ATOM 67 CA THR A 6 2.558 -8.139 10.591 1.00 0.00 C ATOM 68 C THR A 6 3.631 -9.038 9.971 1.00 0.00 C ATOM 69 O THR A 6 4.652 -8.571 9.504 1.00 0.00 O ATOM 70 CB THR A 6 2.568 -8.264 12.115 1.00 0.00 C ATOM 71 OG1 THR A 6 1.303 -7.871 12.629 1.00 0.00 O ATOM 72 CG2 THR A 6 3.659 -7.362 12.696 1.00 0.00 C ATOM 0 H THR A 6 0.822 -9.377 10.711 1.00 0.00 H new ATOM 0 HA THR A 6 2.771 -7.122 10.263 1.00 0.00 H new ATOM 0 HB THR A 6 2.769 -9.299 12.394 1.00 0.00 H new ATOM 0 HG1 THR A 6 1.307 -7.952 13.606 1.00 0.00 H new ATOM 0 HG21 THR A 6 3.665 -7.452 13.782 1.00 0.00 H new ATOM 0 HG22 THR A 6 4.629 -7.664 12.301 1.00 0.00 H new ATOM 0 HG23 THR A 6 3.461 -6.327 12.419 1.00 0.00 H new ATOM 80 N ALA A 7 3.408 -10.324 9.960 1.00 0.00 N ATOM 81 CA ALA A 7 4.414 -11.252 9.368 1.00 0.00 C ATOM 82 C ALA A 7 4.534 -10.998 7.864 1.00 0.00 C ATOM 83 O ALA A 7 5.618 -10.882 7.327 1.00 0.00 O ATOM 84 CB ALA A 7 3.865 -12.654 9.635 1.00 0.00 C ATOM 0 H ALA A 7 2.572 -10.773 10.335 1.00 0.00 H new ATOM 0 HA ALA A 7 5.408 -11.118 9.796 1.00 0.00 H new ATOM 0 HB1 ALA A 7 4.551 -13.397 9.228 1.00 0.00 H new ATOM 0 HB2 ALA A 7 3.761 -12.806 10.709 1.00 0.00 H new ATOM 0 HB3 ALA A 7 2.891 -12.760 9.158 1.00 0.00 H new ATOM 90 N GLU A 8 3.426 -10.906 7.184 1.00 0.00 N ATOM 91 CA GLU A 8 3.469 -10.651 5.716 1.00 0.00 C ATOM 92 C GLU A 8 4.260 -9.373 5.430 1.00 0.00 C ATOM 93 O GLU A 8 4.961 -9.274 4.442 1.00 0.00 O ATOM 94 CB GLU A 8 2.008 -10.488 5.296 1.00 0.00 C ATOM 95 CG GLU A 8 1.944 -10.001 3.846 1.00 0.00 C ATOM 96 CD GLU A 8 0.485 -9.787 3.442 1.00 0.00 C ATOM 97 OE1 GLU A 8 -0.224 -9.131 4.187 1.00 0.00 O ATOM 98 OE2 GLU A 8 0.102 -10.282 2.396 1.00 0.00 O ATOM 0 H GLU A 8 2.491 -10.996 7.581 1.00 0.00 H new ATOM 0 HA GLU A 8 3.958 -11.457 5.169 1.00 0.00 H new ATOM 0 HB2 GLU A 8 1.482 -11.438 5.395 1.00 0.00 H new ATOM 0 HB3 GLU A 8 1.507 -9.776 5.952 1.00 0.00 H new ATOM 0 HG2 GLU A 8 2.502 -9.071 3.739 1.00 0.00 H new ATOM 0 HG3 GLU A 8 2.412 -10.731 3.185 1.00 0.00 H new ATOM 105 N GLN A 9 4.155 -8.392 6.286 1.00 0.00 N ATOM 106 CA GLN A 9 4.904 -7.123 6.054 1.00 0.00 C ATOM 107 C GLN A 9 6.408 -7.406 6.021 1.00 0.00 C ATOM 108 O GLN A 9 7.134 -6.847 5.224 1.00 0.00 O ATOM 109 CB GLN A 9 4.549 -6.228 7.242 1.00 0.00 C ATOM 110 CG GLN A 9 4.737 -4.760 6.850 1.00 0.00 C ATOM 111 CD GLN A 9 3.508 -4.275 6.080 1.00 0.00 C ATOM 112 OE1 GLN A 9 2.456 -4.879 6.150 1.00 0.00 O ATOM 113 NE2 GLN A 9 3.596 -3.203 5.341 1.00 0.00 N ATOM 0 H GLN A 9 3.586 -8.414 7.132 1.00 0.00 H new ATOM 0 HA GLN A 9 4.645 -6.654 5.105 1.00 0.00 H new ATOM 0 HB2 GLN A 9 3.518 -6.404 7.548 1.00 0.00 H new ATOM 0 HB3 GLN A 9 5.181 -6.471 8.096 1.00 0.00 H new ATOM 0 HG2 GLN A 9 4.884 -4.151 7.742 1.00 0.00 H new ATOM 0 HG3 GLN A 9 5.631 -4.648 6.236 1.00 0.00 H new ATOM 0 HE21 GLN A 9 4.479 -2.695 5.282 1.00 0.00 H new ATOM 0 HE22 GLN A 9 2.782 -2.873 4.823 1.00 0.00 H new ATOM 122 N VAL A 10 6.880 -8.281 6.866 1.00 0.00 N ATOM 123 CA VAL A 10 8.334 -8.601 6.859 1.00 0.00 C ATOM 124 C VAL A 10 8.715 -9.180 5.495 1.00 0.00 C ATOM 125 O VAL A 10 9.746 -8.860 4.937 1.00 0.00 O ATOM 126 CB VAL A 10 8.527 -9.642 7.963 1.00 0.00 C ATOM 127 CG1 VAL A 10 10.011 -10.001 8.073 1.00 0.00 C ATOM 128 CG2 VAL A 10 8.045 -9.064 9.296 1.00 0.00 C ATOM 0 H VAL A 10 6.325 -8.785 7.557 1.00 0.00 H new ATOM 0 HA VAL A 10 8.959 -7.724 7.030 1.00 0.00 H new ATOM 0 HB VAL A 10 7.953 -10.537 7.723 1.00 0.00 H new ATOM 0 HG11 VAL A 10 10.149 -10.743 8.860 1.00 0.00 H new ATOM 0 HG12 VAL A 10 10.358 -10.410 7.124 1.00 0.00 H new ATOM 0 HG13 VAL A 10 10.585 -9.106 8.314 1.00 0.00 H new ATOM 0 HG21 VAL A 10 8.182 -9.804 10.084 1.00 0.00 H new ATOM 0 HG22 VAL A 10 8.621 -8.170 9.534 1.00 0.00 H new ATOM 0 HG23 VAL A 10 6.989 -8.806 9.220 1.00 0.00 H new ATOM 138 N ILE A 11 7.880 -10.025 4.949 1.00 0.00 N ATOM 139 CA ILE A 11 8.184 -10.617 3.616 1.00 0.00 C ATOM 140 C ILE A 11 8.427 -9.500 2.602 1.00 0.00 C ATOM 141 O ILE A 11 9.412 -9.494 1.892 1.00 0.00 O ATOM 142 CB ILE A 11 6.937 -11.423 3.236 1.00 0.00 C ATOM 143 CG1 ILE A 11 6.565 -12.380 4.376 1.00 0.00 C ATOM 144 CG2 ILE A 11 7.221 -12.232 1.970 1.00 0.00 C ATOM 145 CD1 ILE A 11 7.825 -13.054 4.921 1.00 0.00 C ATOM 0 H ILE A 11 7.002 -10.330 5.369 1.00 0.00 H new ATOM 0 HA ILE A 11 9.076 -11.243 3.633 1.00 0.00 H new ATOM 0 HB ILE A 11 6.109 -10.737 3.058 1.00 0.00 H new ATOM 0 HG12 ILE A 11 6.061 -11.832 5.173 1.00 0.00 H new ATOM 0 HG13 ILE A 11 5.865 -13.134 4.016 1.00 0.00 H new ATOM 0 HG21 ILE A 11 6.335 -12.806 1.698 1.00 0.00 H new ATOM 0 HG22 ILE A 11 7.478 -11.555 1.156 1.00 0.00 H new ATOM 0 HG23 ILE A 11 8.052 -12.913 2.152 1.00 0.00 H new ATOM 0 HD11 ILE A 11 7.554 -13.732 5.730 1.00 0.00 H new ATOM 0 HD12 ILE A 11 8.311 -13.616 4.124 1.00 0.00 H new ATOM 0 HD13 ILE A 11 8.510 -12.294 5.298 1.00 0.00 H new ATOM 157 N ALA A 12 7.538 -8.544 2.540 1.00 0.00 N ATOM 158 CA ALA A 12 7.725 -7.419 1.583 1.00 0.00 C ATOM 159 C ALA A 12 9.033 -6.697 1.901 1.00 0.00 C ATOM 160 O ALA A 12 9.807 -6.373 1.021 1.00 0.00 O ATOM 161 CB ALA A 12 6.529 -6.496 1.815 1.00 0.00 C ATOM 0 H ALA A 12 6.693 -8.495 3.110 1.00 0.00 H new ATOM 0 HA ALA A 12 7.779 -7.751 0.546 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.595 -5.639 1.144 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.606 -7.041 1.618 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.532 -6.149 2.848 1.00 0.00 H new ATOM 167 N SER A 13 9.294 -6.459 3.157 1.00 0.00 N ATOM 168 CA SER A 13 10.559 -5.775 3.538 1.00 0.00 C ATOM 169 C SER A 13 11.743 -6.685 3.214 1.00 0.00 C ATOM 170 O SER A 13 12.765 -6.246 2.726 1.00 0.00 O ATOM 171 CB SER A 13 10.451 -5.546 5.045 1.00 0.00 C ATOM 172 OG SER A 13 9.132 -5.121 5.361 1.00 0.00 O ATOM 0 H SER A 13 8.684 -6.709 3.936 1.00 0.00 H new ATOM 0 HA SER A 13 10.710 -4.838 3.002 1.00 0.00 H new ATOM 0 HB2 SER A 13 10.688 -6.464 5.582 1.00 0.00 H new ATOM 0 HB3 SER A 13 11.174 -4.795 5.363 1.00 0.00 H new ATOM 0 HG SER A 13 8.600 -5.892 5.650 1.00 0.00 H new ATOM 178 N PHE A 14 11.606 -7.959 3.473 1.00 0.00 N ATOM 179 CA PHE A 14 12.717 -8.904 3.167 1.00 0.00 C ATOM 180 C PHE A 14 12.888 -9.021 1.651 1.00 0.00 C ATOM 181 O PHE A 14 13.990 -9.050 1.141 1.00 0.00 O ATOM 182 CB PHE A 14 12.283 -10.240 3.771 1.00 0.00 C ATOM 183 CG PHE A 14 12.919 -10.406 5.130 1.00 0.00 C ATOM 184 CD1 PHE A 14 14.291 -10.175 5.293 1.00 0.00 C ATOM 185 CD2 PHE A 14 12.139 -10.787 6.228 1.00 0.00 C ATOM 186 CE1 PHE A 14 14.882 -10.327 6.553 1.00 0.00 C ATOM 187 CE2 PHE A 14 12.730 -10.938 7.489 1.00 0.00 C ATOM 188 CZ PHE A 14 14.102 -10.708 7.650 1.00 0.00 C ATOM 0 H PHE A 14 10.774 -8.384 3.882 1.00 0.00 H new ATOM 0 HA PHE A 14 13.673 -8.575 3.574 1.00 0.00 H new ATOM 0 HB2 PHE A 14 11.197 -10.276 3.859 1.00 0.00 H new ATOM 0 HB3 PHE A 14 12.578 -11.060 3.117 1.00 0.00 H new ATOM 0 HD1 PHE A 14 14.893 -9.880 4.446 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.081 -10.965 6.103 1.00 0.00 H new ATOM 0 HE1 PHE A 14 15.940 -10.150 6.678 1.00 0.00 H new ATOM 0 HE2 PHE A 14 12.128 -11.232 8.336 1.00 0.00 H new ATOM 0 HZ PHE A 14 14.558 -10.825 8.622 1.00 0.00 H new ATOM 198 N ARG A 15 11.802 -9.078 0.927 1.00 0.00 N ATOM 199 CA ARG A 15 11.901 -9.182 -0.555 1.00 0.00 C ATOM 200 C ARG A 15 12.793 -8.059 -1.089 1.00 0.00 C ATOM 201 O ARG A 15 13.717 -8.291 -1.845 1.00 0.00 O ATOM 202 CB ARG A 15 10.467 -9.013 -1.058 1.00 0.00 C ATOM 203 CG ARG A 15 10.045 -10.260 -1.838 1.00 0.00 C ATOM 204 CD ARG A 15 8.564 -10.550 -1.579 1.00 0.00 C ATOM 205 NE ARG A 15 7.885 -10.290 -2.879 1.00 0.00 N ATOM 206 CZ ARG A 15 7.585 -9.070 -3.237 1.00 0.00 C ATOM 207 NH1 ARG A 15 7.879 -8.064 -2.459 1.00 0.00 N ATOM 208 NH2 ARG A 15 6.990 -8.855 -4.380 1.00 0.00 N ATOM 0 H ARG A 15 10.852 -9.057 1.299 1.00 0.00 H new ATOM 0 HA ARG A 15 12.336 -10.126 -0.883 1.00 0.00 H new ATOM 0 HB2 ARG A 15 9.793 -8.853 -0.217 1.00 0.00 H new ATOM 0 HB3 ARG A 15 10.396 -8.132 -1.696 1.00 0.00 H new ATOM 0 HG2 ARG A 15 10.216 -10.110 -2.904 1.00 0.00 H new ATOM 0 HG3 ARG A 15 10.652 -11.113 -1.535 1.00 0.00 H new ATOM 0 HD2 ARG A 15 8.415 -11.580 -1.255 1.00 0.00 H new ATOM 0 HD3 ARG A 15 8.168 -9.908 -0.792 1.00 0.00 H new ATOM 0 HE ARG A 15 7.653 -11.070 -3.494 1.00 0.00 H new ATOM 0 HH11 ARG A 15 8.345 -8.229 -1.567 1.00 0.00 H new ATOM 0 HH12 ARG A 15 7.643 -7.113 -2.743 1.00 0.00 H new ATOM 0 HH21 ARG A 15 6.761 -9.639 -4.991 1.00 0.00 H new ATOM 0 HH22 ARG A 15 6.755 -7.903 -4.661 1.00 0.00 H new ATOM 222 N ILE A 16 12.531 -6.843 -0.691 1.00 0.00 N ATOM 223 CA ILE A 16 13.370 -5.706 -1.164 1.00 0.00 C ATOM 224 C ILE A 16 14.824 -5.924 -0.736 1.00 0.00 C ATOM 225 O ILE A 16 15.747 -5.675 -1.485 1.00 0.00 O ATOM 226 CB ILE A 16 12.788 -4.470 -0.477 1.00 0.00 C ATOM 227 CG1 ILE A 16 11.423 -4.144 -1.089 1.00 0.00 C ATOM 228 CG2 ILE A 16 13.731 -3.284 -0.675 1.00 0.00 C ATOM 229 CD1 ILE A 16 10.664 -3.186 -0.170 1.00 0.00 C ATOM 0 H ILE A 16 11.772 -6.589 -0.059 1.00 0.00 H new ATOM 0 HA ILE A 16 13.364 -5.605 -2.249 1.00 0.00 H new ATOM 0 HB ILE A 16 12.672 -4.667 0.589 1.00 0.00 H new ATOM 0 HG12 ILE A 16 11.553 -3.694 -2.073 1.00 0.00 H new ATOM 0 HG13 ILE A 16 10.849 -5.060 -1.231 1.00 0.00 H new ATOM 0 HG21 ILE A 16 13.316 -2.403 -0.185 1.00 0.00 H new ATOM 0 HG22 ILE A 16 14.704 -3.516 -0.241 1.00 0.00 H new ATOM 0 HG23 ILE A 16 13.847 -3.086 -1.740 1.00 0.00 H new ATOM 0 HD11 ILE A 16 9.693 -2.955 -0.607 1.00 0.00 H new ATOM 0 HD12 ILE A 16 10.521 -3.653 0.804 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.236 -2.266 -0.051 1.00 0.00 H new ATOM 241 N LEU A 17 15.030 -6.395 0.464 1.00 0.00 N ATOM 242 CA LEU A 17 16.420 -6.638 0.943 1.00 0.00 C ATOM 243 C LEU A 17 17.072 -7.744 0.110 1.00 0.00 C ATOM 244 O LEU A 17 18.253 -7.706 -0.177 1.00 0.00 O ATOM 245 CB LEU A 17 16.265 -7.082 2.398 1.00 0.00 C ATOM 246 CG LEU A 17 16.863 -6.022 3.324 1.00 0.00 C ATOM 247 CD1 LEU A 17 15.877 -4.863 3.476 1.00 0.00 C ATOM 248 CD2 LEU A 17 17.136 -6.640 4.697 1.00 0.00 C ATOM 0 H LEU A 17 14.295 -6.622 1.134 1.00 0.00 H new ATOM 0 HA LEU A 17 17.052 -5.755 0.854 1.00 0.00 H new ATOM 0 HB2 LEU A 17 15.211 -7.232 2.633 1.00 0.00 H new ATOM 0 HB3 LEU A 17 16.765 -8.038 2.552 1.00 0.00 H new ATOM 0 HG LEU A 17 17.796 -5.653 2.898 1.00 0.00 H new ATOM 0 HD11 LEU A 17 16.303 -4.107 4.136 1.00 0.00 H new ATOM 0 HD12 LEU A 17 15.680 -4.422 2.499 1.00 0.00 H new ATOM 0 HD13 LEU A 17 14.944 -5.232 3.902 1.00 0.00 H new ATOM 0 HD21 LEU A 17 17.562 -5.885 5.358 1.00 0.00 H new ATOM 0 HD22 LEU A 17 16.203 -7.009 5.122 1.00 0.00 H new ATOM 0 HD23 LEU A 17 17.838 -7.467 4.591 1.00 0.00 H new ATOM 260 N ALA A 18 16.310 -8.729 -0.280 1.00 0.00 N ATOM 261 CA ALA A 18 16.881 -9.841 -1.093 1.00 0.00 C ATOM 262 C ALA A 18 16.777 -9.512 -2.584 1.00 0.00 C ATOM 263 O ALA A 18 17.046 -10.340 -3.432 1.00 0.00 O ATOM 264 CB ALA A 18 16.022 -11.057 -0.751 1.00 0.00 C ATOM 0 H ALA A 18 15.315 -8.812 -0.071 1.00 0.00 H new ATOM 0 HA ALA A 18 17.936 -10.012 -0.879 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.378 -11.922 -1.310 1.00 0.00 H new ATOM 0 HB2 ALA A 18 16.090 -11.262 0.317 1.00 0.00 H new ATOM 0 HB3 ALA A 18 14.984 -10.855 -1.016 1.00 0.00 H new ATOM 270 N SER A 19 16.389 -8.310 -2.912 1.00 0.00 N ATOM 271 CA SER A 19 16.268 -7.928 -4.350 1.00 0.00 C ATOM 272 C SER A 19 15.121 -8.700 -5.009 1.00 0.00 C ATOM 273 O SER A 19 15.305 -9.373 -6.005 1.00 0.00 O ATOM 274 CB SER A 19 17.606 -8.312 -4.979 1.00 0.00 C ATOM 275 OG SER A 19 17.944 -7.362 -5.982 1.00 0.00 O ATOM 0 H SER A 19 16.150 -7.575 -2.247 1.00 0.00 H new ATOM 0 HA SER A 19 16.050 -6.868 -4.477 1.00 0.00 H new ATOM 0 HB2 SER A 19 18.384 -8.344 -4.216 1.00 0.00 H new ATOM 0 HB3 SER A 19 17.544 -9.310 -5.413 1.00 0.00 H new ATOM 0 HG SER A 19 18.803 -7.605 -6.386 1.00 0.00 H new ATOM 281 N ASP A 20 13.939 -8.604 -4.465 1.00 0.00 N ATOM 282 CA ASP A 20 12.780 -9.327 -5.063 1.00 0.00 C ATOM 283 C ASP A 20 13.116 -10.810 -5.253 1.00 0.00 C ATOM 284 O ASP A 20 13.035 -11.340 -6.343 1.00 0.00 O ATOM 285 CB ASP A 20 12.550 -8.652 -6.415 1.00 0.00 C ATOM 286 CG ASP A 20 12.184 -7.183 -6.195 1.00 0.00 C ATOM 287 OD1 ASP A 20 12.443 -6.683 -5.112 1.00 0.00 O ATOM 288 OD2 ASP A 20 11.652 -6.581 -7.113 1.00 0.00 O ATOM 0 H ASP A 20 13.725 -8.056 -3.632 1.00 0.00 H new ATOM 0 HA ASP A 20 11.895 -9.284 -4.428 1.00 0.00 H new ATOM 0 HB2 ASP A 20 13.448 -8.726 -7.028 1.00 0.00 H new ATOM 0 HB3 ASP A 20 11.752 -9.160 -6.956 1.00 0.00 H new ATOM 293 N LYS A 21 13.489 -11.484 -4.200 1.00 0.00 N ATOM 294 CA LYS A 21 13.825 -12.931 -4.316 1.00 0.00 C ATOM 295 C LYS A 21 13.250 -13.697 -3.125 1.00 0.00 C ATOM 296 O LYS A 21 13.278 -13.220 -2.009 1.00 0.00 O ATOM 297 CB LYS A 21 15.354 -12.985 -4.307 1.00 0.00 C ATOM 298 CG LYS A 21 15.894 -12.389 -5.609 1.00 0.00 C ATOM 299 CD LYS A 21 17.271 -12.983 -5.913 1.00 0.00 C ATOM 300 CE LYS A 21 17.791 -12.413 -7.235 1.00 0.00 C ATOM 301 NZ LYS A 21 18.950 -13.278 -7.596 1.00 0.00 N ATOM 0 H LYS A 21 13.576 -11.094 -3.262 1.00 0.00 H new ATOM 0 HA LYS A 21 13.410 -13.384 -5.216 1.00 0.00 H new ATOM 0 HB2 LYS A 21 15.743 -12.431 -3.452 1.00 0.00 H new ATOM 0 HB3 LYS A 21 15.691 -14.016 -4.199 1.00 0.00 H new ATOM 0 HG2 LYS A 21 15.207 -12.599 -6.429 1.00 0.00 H new ATOM 0 HG3 LYS A 21 15.966 -11.305 -5.522 1.00 0.00 H new ATOM 0 HD2 LYS A 21 17.966 -12.750 -5.106 1.00 0.00 H new ATOM 0 HD3 LYS A 21 17.205 -14.069 -5.974 1.00 0.00 H new ATOM 0 HE2 LYS A 21 17.022 -12.441 -8.007 1.00 0.00 H new ATOM 0 HE3 LYS A 21 18.094 -11.372 -7.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 19.137 -13.200 -8.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 19.790 -12.972 -7.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 18.732 -14.267 -7.359 1.00 0.00 H new ATOM 315 N PRO A 22 12.746 -14.867 -3.407 1.00 0.00 N ATOM 316 CA PRO A 22 12.167 -15.681 -2.307 1.00 0.00 C ATOM 317 C PRO A 22 13.240 -15.989 -1.259 1.00 0.00 C ATOM 318 O PRO A 22 12.947 -16.453 -0.175 1.00 0.00 O ATOM 319 CB PRO A 22 11.686 -16.965 -2.984 1.00 0.00 C ATOM 320 CG PRO A 22 12.344 -16.985 -4.325 1.00 0.00 C ATOM 321 CD PRO A 22 12.637 -15.558 -4.695 1.00 0.00 C ATOM 0 HA PRO A 22 11.358 -15.167 -1.787 1.00 0.00 H new ATOM 0 HB2 PRO A 22 11.961 -17.843 -2.399 1.00 0.00 H new ATOM 0 HB3 PRO A 22 10.600 -16.974 -3.080 1.00 0.00 H new ATOM 0 HG2 PRO A 22 13.262 -17.571 -4.295 1.00 0.00 H new ATOM 0 HG3 PRO A 22 11.694 -17.449 -5.066 1.00 0.00 H new ATOM 0 HD2 PRO A 22 13.560 -15.477 -5.270 1.00 0.00 H new ATOM 0 HD3 PRO A 22 11.842 -15.134 -5.308 1.00 0.00 H new ATOM 329 N TYR A 23 14.480 -15.730 -1.572 1.00 0.00 N ATOM 330 CA TYR A 23 15.568 -16.005 -0.590 1.00 0.00 C ATOM 331 C TYR A 23 16.544 -14.826 -0.544 1.00 0.00 C ATOM 332 O TYR A 23 16.473 -13.918 -1.347 1.00 0.00 O ATOM 333 CB TYR A 23 16.268 -17.261 -1.110 1.00 0.00 C ATOM 334 CG TYR A 23 16.769 -17.014 -2.513 1.00 0.00 C ATOM 335 CD1 TYR A 23 18.021 -16.422 -2.714 1.00 0.00 C ATOM 336 CD2 TYR A 23 15.981 -17.377 -3.611 1.00 0.00 C ATOM 337 CE1 TYR A 23 18.486 -16.192 -4.015 1.00 0.00 C ATOM 338 CE2 TYR A 23 16.446 -17.149 -4.911 1.00 0.00 C ATOM 339 CZ TYR A 23 17.698 -16.556 -5.114 1.00 0.00 C ATOM 340 OH TYR A 23 18.156 -16.330 -6.395 1.00 0.00 O ATOM 0 H TYR A 23 14.787 -15.341 -2.463 1.00 0.00 H new ATOM 0 HA TYR A 23 15.186 -16.144 0.421 1.00 0.00 H new ATOM 0 HB2 TYR A 23 17.100 -17.524 -0.456 1.00 0.00 H new ATOM 0 HB3 TYR A 23 15.578 -18.105 -1.102 1.00 0.00 H new ATOM 0 HD1 TYR A 23 18.629 -16.143 -1.866 1.00 0.00 H new ATOM 0 HD2 TYR A 23 15.014 -17.833 -3.455 1.00 0.00 H new ATOM 0 HE1 TYR A 23 19.452 -15.734 -4.171 1.00 0.00 H new ATOM 0 HE2 TYR A 23 15.839 -17.431 -5.758 1.00 0.00 H new ATOM 0 HH TYR A 23 17.488 -16.642 -7.041 1.00 0.00 H new ATOM 350 N ILE A 24 17.454 -14.833 0.390 1.00 0.00 N ATOM 351 CA ILE A 24 18.430 -13.711 0.485 1.00 0.00 C ATOM 352 C ILE A 24 19.782 -14.226 0.986 1.00 0.00 C ATOM 353 O ILE A 24 19.867 -15.266 1.610 1.00 0.00 O ATOM 354 CB ILE A 24 17.816 -12.739 1.492 1.00 0.00 C ATOM 355 CG1 ILE A 24 18.672 -11.473 1.570 1.00 0.00 C ATOM 356 CG2 ILE A 24 17.759 -13.400 2.870 1.00 0.00 C ATOM 357 CD1 ILE A 24 18.090 -10.527 2.621 1.00 0.00 C ATOM 0 H ILE A 24 17.564 -15.566 1.091 1.00 0.00 H new ATOM 0 HA ILE A 24 18.612 -13.237 -0.480 1.00 0.00 H new ATOM 0 HB ILE A 24 16.808 -12.476 1.172 1.00 0.00 H new ATOM 0 HG12 ILE A 24 19.699 -11.731 1.827 1.00 0.00 H new ATOM 0 HG13 ILE A 24 18.701 -10.980 0.598 1.00 0.00 H new ATOM 0 HG21 ILE A 24 17.321 -12.707 3.588 1.00 0.00 H new ATOM 0 HG22 ILE A 24 17.148 -14.301 2.816 1.00 0.00 H new ATOM 0 HG23 ILE A 24 18.767 -13.664 3.189 1.00 0.00 H new ATOM 0 HD11 ILE A 24 18.700 -9.625 2.676 1.00 0.00 H new ATOM 0 HD12 ILE A 24 17.070 -10.259 2.344 1.00 0.00 H new ATOM 0 HD13 ILE A 24 18.084 -11.021 3.592 1.00 0.00 H new ATOM 369 N LEU A 25 20.839 -13.509 0.719 1.00 0.00 N ATOM 370 CA LEU A 25 22.182 -13.961 1.180 1.00 0.00 C ATOM 371 C LEU A 25 22.492 -13.375 2.558 1.00 0.00 C ATOM 372 O LEU A 25 22.112 -12.264 2.872 1.00 0.00 O ATOM 373 CB LEU A 25 23.162 -13.428 0.137 1.00 0.00 C ATOM 374 CG LEU A 25 23.015 -14.229 -1.157 1.00 0.00 C ATOM 375 CD1 LEU A 25 22.148 -13.448 -2.145 1.00 0.00 C ATOM 376 CD2 LEU A 25 24.397 -14.468 -1.769 1.00 0.00 C ATOM 0 H LEU A 25 20.831 -12.630 0.202 1.00 0.00 H new ATOM 0 HA LEU A 25 22.242 -15.045 1.275 1.00 0.00 H new ATOM 0 HB2 LEU A 25 22.969 -12.372 -0.053 1.00 0.00 H new ATOM 0 HB3 LEU A 25 24.183 -13.504 0.510 1.00 0.00 H new ATOM 0 HG LEU A 25 22.544 -15.187 -0.939 1.00 0.00 H new ATOM 0 HD11 LEU A 25 22.043 -14.019 -3.068 1.00 0.00 H new ATOM 0 HD12 LEU A 25 21.163 -13.278 -1.710 1.00 0.00 H new ATOM 0 HD13 LEU A 25 22.619 -12.489 -2.363 1.00 0.00 H new ATOM 0 HD21 LEU A 25 24.293 -15.039 -2.692 1.00 0.00 H new ATOM 0 HD22 LEU A 25 24.869 -13.510 -1.987 1.00 0.00 H new ATOM 0 HD23 LEU A 25 25.015 -15.025 -1.065 1.00 0.00 H new ATOM 388 N ALA A 26 23.179 -14.115 3.384 1.00 0.00 N ATOM 389 CA ALA A 26 23.512 -13.600 4.742 1.00 0.00 C ATOM 390 C ALA A 26 24.335 -12.316 4.636 1.00 0.00 C ATOM 391 O ALA A 26 24.146 -11.383 5.390 1.00 0.00 O ATOM 392 CB ALA A 26 24.333 -14.713 5.396 1.00 0.00 C ATOM 0 H ALA A 26 23.524 -15.053 3.178 1.00 0.00 H new ATOM 0 HA ALA A 26 22.621 -13.356 5.321 1.00 0.00 H new ATOM 0 HB1 ALA A 26 24.619 -14.410 6.403 1.00 0.00 H new ATOM 0 HB2 ALA A 26 23.736 -15.624 5.446 1.00 0.00 H new ATOM 0 HB3 ALA A 26 25.230 -14.899 4.805 1.00 0.00 H new ATOM 398 N GLU A 27 25.243 -12.257 3.705 1.00 0.00 N ATOM 399 CA GLU A 27 26.070 -11.029 3.552 1.00 0.00 C ATOM 400 C GLU A 27 25.192 -9.863 3.095 1.00 0.00 C ATOM 401 O GLU A 27 25.388 -8.733 3.492 1.00 0.00 O ATOM 402 CB GLU A 27 27.095 -11.379 2.476 1.00 0.00 C ATOM 403 CG GLU A 27 28.505 -11.123 3.008 1.00 0.00 C ATOM 404 CD GLU A 27 29.047 -9.822 2.413 1.00 0.00 C ATOM 405 OE1 GLU A 27 29.385 -9.827 1.240 1.00 0.00 O ATOM 406 OE2 GLU A 27 29.113 -8.844 3.138 1.00 0.00 O ATOM 0 H GLU A 27 25.449 -13.005 3.043 1.00 0.00 H new ATOM 0 HA GLU A 27 26.545 -10.727 4.485 1.00 0.00 H new ATOM 0 HB2 GLU A 27 26.989 -12.424 2.185 1.00 0.00 H new ATOM 0 HB3 GLU A 27 26.918 -10.780 1.583 1.00 0.00 H new ATOM 0 HG2 GLU A 27 28.488 -11.058 4.096 1.00 0.00 H new ATOM 0 HG3 GLU A 27 29.160 -11.955 2.748 1.00 0.00 H new ATOM 413 N GLU A 28 24.218 -10.133 2.268 1.00 0.00 N ATOM 414 CA GLU A 28 23.327 -9.035 1.797 1.00 0.00 C ATOM 415 C GLU A 28 22.456 -8.551 2.955 1.00 0.00 C ATOM 416 O GLU A 28 22.391 -7.374 3.247 1.00 0.00 O ATOM 417 CB GLU A 28 22.466 -9.661 0.699 1.00 0.00 C ATOM 418 CG GLU A 28 21.912 -8.559 -0.207 1.00 0.00 C ATOM 419 CD GLU A 28 21.688 -9.119 -1.613 1.00 0.00 C ATOM 420 OE1 GLU A 28 21.089 -10.176 -1.720 1.00 0.00 O ATOM 421 OE2 GLU A 28 22.118 -8.480 -2.559 1.00 0.00 O ATOM 0 H GLU A 28 24.002 -11.060 1.901 1.00 0.00 H new ATOM 0 HA GLU A 28 23.883 -8.174 1.427 1.00 0.00 H new ATOM 0 HB2 GLU A 28 23.059 -10.364 0.114 1.00 0.00 H new ATOM 0 HB3 GLU A 28 21.647 -10.227 1.143 1.00 0.00 H new ATOM 0 HG2 GLU A 28 20.974 -8.178 0.198 1.00 0.00 H new ATOM 0 HG3 GLU A 28 22.607 -7.720 -0.245 1.00 0.00 H new ATOM 428 N LEU A 29 21.797 -9.454 3.628 1.00 0.00 N ATOM 429 CA LEU A 29 20.946 -9.047 4.778 1.00 0.00 C ATOM 430 C LEU A 29 21.831 -8.532 5.914 1.00 0.00 C ATOM 431 O LEU A 29 21.461 -7.638 6.649 1.00 0.00 O ATOM 432 CB LEU A 29 20.182 -10.311 5.191 1.00 0.00 C ATOM 433 CG LEU A 29 21.070 -11.220 6.045 1.00 0.00 C ATOM 434 CD1 LEU A 29 21.072 -10.723 7.491 1.00 0.00 C ATOM 435 CD2 LEU A 29 20.521 -12.648 6.001 1.00 0.00 C ATOM 0 H LEU A 29 21.812 -10.455 3.430 1.00 0.00 H new ATOM 0 HA LEU A 29 20.256 -8.242 4.525 1.00 0.00 H new ATOM 0 HB2 LEU A 29 19.288 -10.036 5.751 1.00 0.00 H new ATOM 0 HB3 LEU A 29 19.849 -10.848 4.303 1.00 0.00 H new ATOM 0 HG LEU A 29 22.088 -11.205 5.655 1.00 0.00 H new ATOM 0 HD11 LEU A 29 21.705 -11.371 8.098 1.00 0.00 H new ATOM 0 HD12 LEU A 29 21.458 -9.704 7.525 1.00 0.00 H new ATOM 0 HD13 LEU A 29 20.055 -10.739 7.883 1.00 0.00 H new ATOM 0 HD21 LEU A 29 21.151 -13.299 6.608 1.00 0.00 H new ATOM 0 HD22 LEU A 29 19.504 -12.659 6.393 1.00 0.00 H new ATOM 0 HD23 LEU A 29 20.517 -13.005 4.971 1.00 0.00 H new ATOM 447 N ARG A 30 23.004 -9.090 6.059 1.00 0.00 N ATOM 448 CA ARG A 30 23.917 -8.631 7.144 1.00 0.00 C ATOM 449 C ARG A 30 24.302 -7.165 6.924 1.00 0.00 C ATOM 450 O ARG A 30 24.473 -6.411 7.861 1.00 0.00 O ATOM 451 CB ARG A 30 25.147 -9.535 7.040 1.00 0.00 C ATOM 452 CG ARG A 30 26.163 -9.143 8.114 1.00 0.00 C ATOM 453 CD ARG A 30 27.554 -9.034 7.484 1.00 0.00 C ATOM 454 NE ARG A 30 27.959 -7.617 7.694 1.00 0.00 N ATOM 455 CZ ARG A 30 28.214 -7.177 8.897 1.00 0.00 C ATOM 456 NH1 ARG A 30 28.114 -7.978 9.924 1.00 0.00 N ATOM 457 NH2 ARG A 30 28.569 -5.934 9.072 1.00 0.00 N ATOM 0 H ARG A 30 23.368 -9.842 5.474 1.00 0.00 H new ATOM 0 HA ARG A 30 23.453 -8.692 8.128 1.00 0.00 H new ATOM 0 HB2 ARG A 30 24.856 -10.578 7.164 1.00 0.00 H new ATOM 0 HB3 ARG A 30 25.595 -9.444 6.051 1.00 0.00 H new ATOM 0 HG2 ARG A 30 25.881 -8.192 8.567 1.00 0.00 H new ATOM 0 HG3 ARG A 30 26.170 -9.886 8.912 1.00 0.00 H new ATOM 0 HD2 ARG A 30 28.257 -9.720 7.957 1.00 0.00 H new ATOM 0 HD3 ARG A 30 27.528 -9.285 6.424 1.00 0.00 H new ATOM 0 HE ARG A 30 28.038 -6.987 6.895 1.00 0.00 H new ATOM 0 HH11 ARG A 30 27.836 -8.950 9.788 1.00 0.00 H new ATOM 0 HH12 ARG A 30 28.314 -7.632 10.862 1.00 0.00 H new ATOM 0 HH21 ARG A 30 28.647 -5.308 8.270 1.00 0.00 H new ATOM 0 HH22 ARG A 30 28.769 -5.588 10.010 1.00 0.00 H new ATOM 471 N ARG A 31 24.436 -6.755 5.691 1.00 0.00 N ATOM 472 CA ARG A 31 24.808 -5.338 5.412 1.00 0.00 C ATOM 473 C ARG A 31 23.561 -4.450 5.437 1.00 0.00 C ATOM 474 O ARG A 31 23.620 -3.290 5.793 1.00 0.00 O ATOM 475 CB ARG A 31 25.424 -5.358 4.013 1.00 0.00 C ATOM 476 CG ARG A 31 26.485 -4.259 3.906 1.00 0.00 C ATOM 477 CD ARG A 31 27.790 -4.751 4.536 1.00 0.00 C ATOM 478 NE ARG A 31 28.683 -5.050 3.381 1.00 0.00 N ATOM 479 CZ ARG A 31 29.634 -5.940 3.494 1.00 0.00 C ATOM 480 NH1 ARG A 31 29.841 -6.548 4.632 1.00 0.00 N ATOM 481 NH2 ARG A 31 30.390 -6.216 2.465 1.00 0.00 N ATOM 0 H ARG A 31 24.304 -7.340 4.866 1.00 0.00 H new ATOM 0 HA ARG A 31 25.498 -4.938 6.155 1.00 0.00 H new ATOM 0 HB2 ARG A 31 25.873 -6.332 3.816 1.00 0.00 H new ATOM 0 HB3 ARG A 31 24.650 -5.205 3.261 1.00 0.00 H new ATOM 0 HG2 ARG A 31 26.649 -3.997 2.861 1.00 0.00 H new ATOM 0 HG3 ARG A 31 26.142 -3.356 4.411 1.00 0.00 H new ATOM 0 HD2 ARG A 31 28.226 -3.992 5.186 1.00 0.00 H new ATOM 0 HD3 ARG A 31 27.624 -5.638 5.147 1.00 0.00 H new ATOM 0 HE ARG A 31 28.552 -4.558 2.497 1.00 0.00 H new ATOM 0 HH11 ARG A 31 29.259 -6.329 5.440 1.00 0.00 H new ATOM 0 HH12 ARG A 31 30.585 -7.241 4.712 1.00 0.00 H new ATOM 0 HH21 ARG A 31 30.237 -5.738 1.577 1.00 0.00 H new ATOM 0 HH22 ARG A 31 31.133 -6.910 2.549 1.00 0.00 H new ATOM 495 N GLU A 32 22.433 -4.986 5.060 1.00 0.00 N ATOM 496 CA GLU A 32 21.183 -4.172 5.061 1.00 0.00 C ATOM 497 C GLU A 32 20.658 -4.007 6.490 1.00 0.00 C ATOM 498 O GLU A 32 19.936 -3.078 6.792 1.00 0.00 O ATOM 499 CB GLU A 32 20.192 -4.970 4.216 1.00 0.00 C ATOM 500 CG GLU A 32 20.279 -4.517 2.757 1.00 0.00 C ATOM 501 CD GLU A 32 19.661 -3.125 2.615 1.00 0.00 C ATOM 502 OE1 GLU A 32 18.521 -2.961 3.015 1.00 0.00 O ATOM 503 OE2 GLU A 32 20.339 -2.246 2.109 1.00 0.00 O ATOM 0 H GLU A 32 22.322 -5.952 4.751 1.00 0.00 H new ATOM 0 HA GLU A 32 21.343 -3.169 4.665 1.00 0.00 H new ATOM 0 HB2 GLU A 32 20.411 -6.035 4.290 1.00 0.00 H new ATOM 0 HB3 GLU A 32 19.179 -4.826 4.592 1.00 0.00 H new ATOM 0 HG2 GLU A 32 21.319 -4.499 2.433 1.00 0.00 H new ATOM 0 HG3 GLU A 32 19.757 -5.225 2.114 1.00 0.00 H new ATOM 510 N LEU A 33 21.012 -4.902 7.371 1.00 0.00 N ATOM 511 CA LEU A 33 20.534 -4.798 8.774 1.00 0.00 C ATOM 512 C LEU A 33 21.710 -4.503 9.709 1.00 0.00 C ATOM 513 O LEU A 33 22.831 -4.881 9.433 1.00 0.00 O ATOM 514 CB LEU A 33 19.939 -6.169 9.077 1.00 0.00 C ATOM 515 CG LEU A 33 18.457 -6.181 8.698 1.00 0.00 C ATOM 516 CD1 LEU A 33 18.077 -7.561 8.160 1.00 0.00 C ATOM 517 CD2 LEU A 33 17.608 -5.866 9.933 1.00 0.00 C ATOM 0 H LEU A 33 21.614 -5.702 7.177 1.00 0.00 H new ATOM 0 HA LEU A 33 19.810 -3.995 8.914 1.00 0.00 H new ATOM 0 HB2 LEU A 33 20.473 -6.939 8.521 1.00 0.00 H new ATOM 0 HB3 LEU A 33 20.056 -6.401 10.136 1.00 0.00 H new ATOM 0 HG LEU A 33 18.276 -5.428 7.931 1.00 0.00 H new ATOM 0 HD11 LEU A 33 17.021 -7.568 7.890 1.00 0.00 H new ATOM 0 HD12 LEU A 33 18.678 -7.786 7.279 1.00 0.00 H new ATOM 0 HD13 LEU A 33 18.261 -8.314 8.927 1.00 0.00 H new ATOM 0 HD21 LEU A 33 16.553 -5.875 9.661 1.00 0.00 H new ATOM 0 HD22 LEU A 33 17.791 -6.617 10.702 1.00 0.00 H new ATOM 0 HD23 LEU A 33 17.875 -4.881 10.317 1.00 0.00 H new ATOM 529 N PRO A 34 21.410 -3.836 10.788 1.00 0.00 N ATOM 530 CA PRO A 34 22.492 -3.507 11.753 1.00 0.00 C ATOM 531 C PRO A 34 23.225 -4.782 12.182 1.00 0.00 C ATOM 532 O PRO A 34 22.816 -5.877 11.850 1.00 0.00 O ATOM 533 CB PRO A 34 21.763 -2.877 12.937 1.00 0.00 C ATOM 534 CG PRO A 34 20.461 -2.399 12.386 1.00 0.00 C ATOM 535 CD PRO A 34 20.118 -3.291 11.224 1.00 0.00 C ATOM 0 HA PRO A 34 23.246 -2.842 11.331 1.00 0.00 H new ATOM 0 HB2 PRO A 34 21.610 -3.602 13.736 1.00 0.00 H new ATOM 0 HB3 PRO A 34 22.338 -2.053 13.360 1.00 0.00 H new ATOM 0 HG2 PRO A 34 19.682 -2.441 13.147 1.00 0.00 H new ATOM 0 HG3 PRO A 34 20.537 -1.360 12.065 1.00 0.00 H new ATOM 0 HD2 PRO A 34 19.432 -4.084 11.521 1.00 0.00 H new ATOM 0 HD3 PRO A 34 19.632 -2.732 10.424 1.00 0.00 H new ATOM 543 N PRO A 35 24.294 -4.592 12.906 1.00 0.00 N ATOM 544 CA PRO A 35 25.075 -5.772 13.367 1.00 0.00 C ATOM 545 C PRO A 35 24.193 -6.696 14.213 1.00 0.00 C ATOM 546 O PRO A 35 24.193 -7.899 14.042 1.00 0.00 O ATOM 547 CB PRO A 35 26.197 -5.174 14.214 1.00 0.00 C ATOM 548 CG PRO A 35 25.704 -3.825 14.620 1.00 0.00 C ATOM 549 CD PRO A 35 24.764 -3.357 13.545 1.00 0.00 C ATOM 0 HA PRO A 35 25.454 -6.374 12.541 1.00 0.00 H new ATOM 0 HB2 PRO A 35 26.407 -5.795 15.085 1.00 0.00 H new ATOM 0 HB3 PRO A 35 27.124 -5.100 13.645 1.00 0.00 H new ATOM 0 HG2 PRO A 35 25.195 -3.874 15.582 1.00 0.00 H new ATOM 0 HG3 PRO A 35 26.535 -3.129 14.735 1.00 0.00 H new ATOM 0 HD2 PRO A 35 23.935 -2.786 13.963 1.00 0.00 H new ATOM 0 HD3 PRO A 35 25.270 -2.708 12.830 1.00 0.00 H new ATOM 557 N ASP A 36 23.446 -6.141 15.127 1.00 0.00 N ATOM 558 CA ASP A 36 22.567 -6.985 15.988 1.00 0.00 C ATOM 559 C ASP A 36 21.459 -7.639 15.157 1.00 0.00 C ATOM 560 O ASP A 36 21.149 -8.801 15.326 1.00 0.00 O ATOM 561 CB ASP A 36 21.970 -6.017 17.009 1.00 0.00 C ATOM 562 CG ASP A 36 23.077 -5.506 17.932 1.00 0.00 C ATOM 563 OD1 ASP A 36 24.191 -5.351 17.459 1.00 0.00 O ATOM 564 OD2 ASP A 36 22.793 -5.279 19.096 1.00 0.00 O ATOM 0 H ASP A 36 23.405 -5.139 15.316 1.00 0.00 H new ATOM 0 HA ASP A 36 23.119 -7.796 16.463 1.00 0.00 H new ATOM 0 HB2 ASP A 36 21.493 -5.181 16.498 1.00 0.00 H new ATOM 0 HB3 ASP A 36 21.197 -6.517 17.592 1.00 0.00 H new ATOM 569 N GLN A 37 20.854 -6.901 14.265 1.00 0.00 N ATOM 570 CA GLN A 37 19.762 -7.484 13.434 1.00 0.00 C ATOM 571 C GLN A 37 20.331 -8.506 12.447 1.00 0.00 C ATOM 572 O GLN A 37 19.770 -9.565 12.243 1.00 0.00 O ATOM 573 CB GLN A 37 19.163 -6.294 12.687 1.00 0.00 C ATOM 574 CG GLN A 37 17.825 -5.910 13.323 1.00 0.00 C ATOM 575 CD GLN A 37 18.050 -5.485 14.774 1.00 0.00 C ATOM 576 OE1 GLN A 37 18.959 -4.732 15.065 1.00 0.00 O ATOM 577 NE2 GLN A 37 17.255 -5.938 15.705 1.00 0.00 N ATOM 0 H GLN A 37 21.068 -5.922 14.076 1.00 0.00 H new ATOM 0 HA GLN A 37 19.019 -8.008 14.035 1.00 0.00 H new ATOM 0 HB2 GLN A 37 19.849 -5.448 12.720 1.00 0.00 H new ATOM 0 HB3 GLN A 37 19.019 -6.546 11.636 1.00 0.00 H new ATOM 0 HG2 GLN A 37 17.365 -5.096 12.762 1.00 0.00 H new ATOM 0 HG3 GLN A 37 17.136 -6.754 13.283 1.00 0.00 H new ATOM 0 HE21 GLN A 37 16.492 -6.570 15.461 1.00 0.00 H new ATOM 0 HE22 GLN A 37 17.397 -5.660 16.676 1.00 0.00 H new ATOM 586 N ALA A 38 21.437 -8.196 11.831 1.00 0.00 N ATOM 587 CA ALA A 38 22.038 -9.147 10.853 1.00 0.00 C ATOM 588 C ALA A 38 22.311 -10.498 11.522 1.00 0.00 C ATOM 589 O ALA A 38 21.964 -11.540 11.002 1.00 0.00 O ATOM 590 CB ALA A 38 23.348 -8.490 10.420 1.00 0.00 C ATOM 0 H ALA A 38 21.952 -7.325 11.962 1.00 0.00 H new ATOM 0 HA ALA A 38 21.378 -9.341 10.008 1.00 0.00 H new ATOM 0 HB1 ALA A 38 23.854 -9.130 9.697 1.00 0.00 H new ATOM 0 HB2 ALA A 38 23.137 -7.523 9.964 1.00 0.00 H new ATOM 0 HB3 ALA A 38 23.989 -8.348 11.290 1.00 0.00 H new ATOM 596 N GLN A 39 22.934 -10.488 12.667 1.00 0.00 N ATOM 597 CA GLN A 39 23.234 -11.772 13.367 1.00 0.00 C ATOM 598 C GLN A 39 21.944 -12.452 13.830 1.00 0.00 C ATOM 599 O GLN A 39 21.782 -13.650 13.699 1.00 0.00 O ATOM 600 CB GLN A 39 24.091 -11.373 14.570 1.00 0.00 C ATOM 601 CG GLN A 39 24.868 -12.592 15.067 1.00 0.00 C ATOM 602 CD GLN A 39 23.937 -13.493 15.880 1.00 0.00 C ATOM 603 OE1 GLN A 39 23.171 -13.017 16.693 1.00 0.00 O ATOM 604 NE2 GLN A 39 23.972 -14.784 15.694 1.00 0.00 N ATOM 0 H GLN A 39 23.249 -9.647 13.150 1.00 0.00 H new ATOM 0 HA GLN A 39 23.743 -12.483 12.716 1.00 0.00 H new ATOM 0 HB2 GLN A 39 24.781 -10.577 14.291 1.00 0.00 H new ATOM 0 HB3 GLN A 39 23.459 -10.981 15.367 1.00 0.00 H new ATOM 0 HG2 GLN A 39 25.279 -13.144 14.222 1.00 0.00 H new ATOM 0 HG3 GLN A 39 25.711 -12.274 15.680 1.00 0.00 H new ATOM 0 HE21 GLN A 39 24.616 -15.184 15.011 1.00 0.00 H new ATOM 0 HE22 GLN A 39 23.356 -15.394 16.232 1.00 0.00 H new ATOM 613 N TYR A 40 21.027 -11.704 14.379 1.00 0.00 N ATOM 614 CA TYR A 40 19.755 -12.316 14.858 1.00 0.00 C ATOM 615 C TYR A 40 18.956 -12.883 13.681 1.00 0.00 C ATOM 616 O TYR A 40 18.398 -13.960 13.760 1.00 0.00 O ATOM 617 CB TYR A 40 18.991 -11.173 15.526 1.00 0.00 C ATOM 618 CG TYR A 40 18.302 -11.691 16.765 1.00 0.00 C ATOM 619 CD1 TYR A 40 17.085 -12.375 16.655 1.00 0.00 C ATOM 620 CD2 TYR A 40 18.880 -11.490 18.024 1.00 0.00 C ATOM 621 CE1 TYR A 40 16.448 -12.859 17.804 1.00 0.00 C ATOM 622 CE2 TYR A 40 18.242 -11.974 19.172 1.00 0.00 C ATOM 623 CZ TYR A 40 17.026 -12.658 19.063 1.00 0.00 C ATOM 624 OH TYR A 40 16.398 -13.136 20.194 1.00 0.00 O ATOM 0 H TYR A 40 21.103 -10.696 14.517 1.00 0.00 H new ATOM 0 HA TYR A 40 19.932 -13.144 15.544 1.00 0.00 H new ATOM 0 HB2 TYR A 40 19.676 -10.366 15.787 1.00 0.00 H new ATOM 0 HB3 TYR A 40 18.258 -10.758 14.835 1.00 0.00 H new ATOM 0 HD1 TYR A 40 16.638 -12.529 15.684 1.00 0.00 H new ATOM 0 HD2 TYR A 40 19.818 -10.962 18.110 1.00 0.00 H new ATOM 0 HE1 TYR A 40 15.510 -13.388 17.719 1.00 0.00 H new ATOM 0 HE2 TYR A 40 18.689 -11.819 20.143 1.00 0.00 H new ATOM 0 HH TYR A 40 16.933 -12.913 20.984 1.00 0.00 H new ATOM 634 N CYS A 41 18.890 -12.168 12.592 1.00 0.00 N ATOM 635 CA CYS A 41 18.119 -12.670 11.418 1.00 0.00 C ATOM 636 C CYS A 41 18.765 -13.937 10.847 1.00 0.00 C ATOM 637 O CYS A 41 18.110 -14.941 10.649 1.00 0.00 O ATOM 638 CB CYS A 41 18.176 -11.536 10.394 1.00 0.00 C ATOM 639 SG CYS A 41 17.344 -10.076 11.064 1.00 0.00 S ATOM 0 H CYS A 41 19.335 -11.259 12.464 1.00 0.00 H new ATOM 0 HA CYS A 41 17.096 -12.934 11.686 1.00 0.00 H new ATOM 0 HB2 CYS A 41 19.213 -11.299 10.155 1.00 0.00 H new ATOM 0 HB3 CYS A 41 17.698 -11.846 9.465 1.00 0.00 H new ATOM 0 HG CYS A 41 18.143 -9.459 11.883 1.00 0.00 H new ATOM 645 N ILE A 42 20.041 -13.899 10.578 1.00 0.00 N ATOM 646 CA ILE A 42 20.723 -15.101 10.011 1.00 0.00 C ATOM 647 C ILE A 42 20.473 -16.332 10.889 1.00 0.00 C ATOM 648 O ILE A 42 20.558 -17.457 10.437 1.00 0.00 O ATOM 649 CB ILE A 42 22.208 -14.744 10.006 1.00 0.00 C ATOM 650 CG1 ILE A 42 22.487 -13.743 8.883 1.00 0.00 C ATOM 651 CG2 ILE A 42 23.037 -16.010 9.777 1.00 0.00 C ATOM 652 CD1 ILE A 42 23.832 -13.059 9.129 1.00 0.00 C ATOM 0 H ILE A 42 20.642 -13.089 10.726 1.00 0.00 H new ATOM 0 HA ILE A 42 20.353 -15.348 9.016 1.00 0.00 H new ATOM 0 HB ILE A 42 22.478 -14.301 10.965 1.00 0.00 H new ATOM 0 HG12 ILE A 42 22.498 -14.255 7.921 1.00 0.00 H new ATOM 0 HG13 ILE A 42 21.692 -12.999 8.839 1.00 0.00 H new ATOM 0 HG21 ILE A 42 24.097 -15.755 9.773 1.00 0.00 H new ATOM 0 HG22 ILE A 42 22.838 -16.724 10.576 1.00 0.00 H new ATOM 0 HG23 ILE A 42 22.767 -16.453 8.818 1.00 0.00 H new ATOM 0 HD11 ILE A 42 24.030 -12.346 8.328 1.00 0.00 H new ATOM 0 HD12 ILE A 42 23.804 -12.534 10.084 1.00 0.00 H new ATOM 0 HD13 ILE A 42 24.623 -13.809 9.151 1.00 0.00 H new ATOM 664 N LYS A 43 20.171 -16.130 12.141 1.00 0.00 N ATOM 665 CA LYS A 43 19.924 -17.289 13.048 1.00 0.00 C ATOM 666 C LYS A 43 18.469 -17.751 12.949 1.00 0.00 C ATOM 667 O LYS A 43 18.132 -18.855 13.329 1.00 0.00 O ATOM 668 CB LYS A 43 20.222 -16.762 14.453 1.00 0.00 C ATOM 669 CG LYS A 43 20.909 -17.854 15.274 1.00 0.00 C ATOM 670 CD LYS A 43 20.016 -18.241 16.456 1.00 0.00 C ATOM 671 CE LYS A 43 19.948 -19.765 16.567 1.00 0.00 C ATOM 672 NZ LYS A 43 18.690 -20.040 17.318 1.00 0.00 N ATOM 0 H LYS A 43 20.084 -15.212 12.577 1.00 0.00 H new ATOM 0 HA LYS A 43 20.544 -18.148 12.790 1.00 0.00 H new ATOM 0 HB2 LYS A 43 20.861 -15.881 14.394 1.00 0.00 H new ATOM 0 HB3 LYS A 43 19.297 -16.453 14.941 1.00 0.00 H new ATOM 0 HG2 LYS A 43 21.102 -18.726 14.650 1.00 0.00 H new ATOM 0 HG3 LYS A 43 21.875 -17.500 15.635 1.00 0.00 H new ATOM 0 HD2 LYS A 43 20.411 -17.816 17.379 1.00 0.00 H new ATOM 0 HD3 LYS A 43 19.015 -17.831 16.319 1.00 0.00 H new ATOM 0 HE2 LYS A 43 19.930 -20.232 15.582 1.00 0.00 H new ATOM 0 HE3 LYS A 43 20.817 -20.162 17.093 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 18.573 -21.067 17.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 18.738 -19.588 18.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 17.880 -19.657 16.790 1.00 0.00 H new ATOM 686 N ARG A 44 17.602 -16.913 12.453 1.00 0.00 N ATOM 687 CA ARG A 44 16.168 -17.305 12.343 1.00 0.00 C ATOM 688 C ARG A 44 15.890 -17.981 10.998 1.00 0.00 C ATOM 689 O ARG A 44 15.632 -19.166 10.931 1.00 0.00 O ATOM 690 CB ARG A 44 15.392 -15.994 12.452 1.00 0.00 C ATOM 691 CG ARG A 44 15.344 -15.545 13.915 1.00 0.00 C ATOM 692 CD ARG A 44 14.055 -16.056 14.563 1.00 0.00 C ATOM 693 NE ARG A 44 14.037 -15.441 15.919 1.00 0.00 N ATOM 694 CZ ARG A 44 13.206 -15.880 16.827 1.00 0.00 C ATOM 695 NH1 ARG A 44 12.388 -16.861 16.550 1.00 0.00 N ATOM 696 NH2 ARG A 44 13.192 -15.338 18.014 1.00 0.00 N ATOM 0 H ARG A 44 17.823 -15.975 12.119 1.00 0.00 H new ATOM 0 HA ARG A 44 15.882 -18.020 13.114 1.00 0.00 H new ATOM 0 HB2 ARG A 44 15.867 -15.227 11.841 1.00 0.00 H new ATOM 0 HB3 ARG A 44 14.380 -16.126 12.068 1.00 0.00 H new ATOM 0 HG2 ARG A 44 16.211 -15.928 14.453 1.00 0.00 H new ATOM 0 HG3 ARG A 44 15.387 -14.457 13.974 1.00 0.00 H new ATOM 0 HD2 ARG A 44 13.179 -15.763 13.985 1.00 0.00 H new ATOM 0 HD3 ARG A 44 14.048 -17.144 14.623 1.00 0.00 H new ATOM 0 HE ARG A 44 14.674 -14.676 16.140 1.00 0.00 H new ATOM 0 HH11 ARG A 44 12.397 -17.286 15.623 1.00 0.00 H new ATOM 0 HH12 ARG A 44 11.741 -17.201 17.261 1.00 0.00 H new ATOM 0 HH21 ARG A 44 13.829 -14.572 18.233 1.00 0.00 H new ATOM 0 HH22 ARG A 44 12.544 -15.680 18.723 1.00 0.00 H new ATOM 710 N MET A 45 15.929 -17.237 9.926 1.00 0.00 N ATOM 711 CA MET A 45 15.653 -17.843 8.595 1.00 0.00 C ATOM 712 C MET A 45 16.432 -19.149 8.425 1.00 0.00 C ATOM 713 O MET A 45 17.641 -19.143 8.295 1.00 0.00 O ATOM 714 CB MET A 45 16.110 -16.798 7.576 1.00 0.00 C ATOM 715 CG MET A 45 17.527 -16.325 7.901 1.00 0.00 C ATOM 716 SD MET A 45 17.995 -14.998 6.760 1.00 0.00 S ATOM 717 CE MET A 45 16.480 -14.015 6.908 1.00 0.00 C ATOM 0 H MET A 45 16.139 -16.239 9.915 1.00 0.00 H new ATOM 0 HA MET A 45 14.600 -18.094 8.471 1.00 0.00 H new ATOM 0 HB2 MET A 45 16.082 -17.222 6.572 1.00 0.00 H new ATOM 0 HB3 MET A 45 15.426 -15.950 7.583 1.00 0.00 H new ATOM 0 HG2 MET A 45 17.576 -15.969 8.930 1.00 0.00 H new ATOM 0 HG3 MET A 45 18.228 -17.156 7.817 1.00 0.00 H new ATOM 0 HE1 MET A 45 16.719 -12.958 6.788 1.00 0.00 H new ATOM 0 HE2 MET A 45 15.773 -14.317 6.135 1.00 0.00 H new ATOM 0 HE3 MET A 45 16.035 -14.177 7.890 1.00 0.00 H new ATOM 727 N PRO A 46 15.700 -20.232 8.428 1.00 0.00 N ATOM 728 CA PRO A 46 16.356 -21.555 8.267 1.00 0.00 C ATOM 729 C PRO A 46 17.028 -21.648 6.894 1.00 0.00 C ATOM 730 O PRO A 46 17.343 -20.649 6.279 1.00 0.00 O ATOM 731 CB PRO A 46 15.215 -22.571 8.380 1.00 0.00 C ATOM 732 CG PRO A 46 13.953 -21.778 8.278 1.00 0.00 C ATOM 733 CD PRO A 46 14.272 -20.378 8.721 1.00 0.00 C ATOM 0 HA PRO A 46 17.134 -21.728 9.010 1.00 0.00 H new ATOM 0 HB2 PRO A 46 15.274 -23.316 7.586 1.00 0.00 H new ATOM 0 HB3 PRO A 46 15.263 -23.110 9.326 1.00 0.00 H new ATOM 0 HG2 PRO A 46 13.578 -21.782 7.255 1.00 0.00 H new ATOM 0 HG3 PRO A 46 13.174 -22.212 8.905 1.00 0.00 H new ATOM 0 HD2 PRO A 46 13.676 -19.642 8.181 1.00 0.00 H new ATOM 0 HD3 PRO A 46 14.066 -20.238 9.782 1.00 0.00 H new ATOM 741 N ALA A 47 17.253 -22.840 6.410 1.00 0.00 N ATOM 742 CA ALA A 47 17.909 -22.991 5.079 1.00 0.00 C ATOM 743 C ALA A 47 16.916 -22.674 3.956 1.00 0.00 C ATOM 744 O ALA A 47 15.823 -23.202 3.913 1.00 0.00 O ATOM 745 CB ALA A 47 18.341 -24.455 5.014 1.00 0.00 C ATOM 0 H ALA A 47 17.012 -23.714 6.877 1.00 0.00 H new ATOM 0 HA ALA A 47 18.752 -22.311 4.957 1.00 0.00 H new ATOM 0 HB1 ALA A 47 18.834 -24.647 4.061 1.00 0.00 H new ATOM 0 HB2 ALA A 47 19.033 -24.667 5.829 1.00 0.00 H new ATOM 0 HB3 ALA A 47 17.465 -25.097 5.105 1.00 0.00 H new ATOM 751 N TYR A 48 17.296 -21.814 3.048 1.00 0.00 N ATOM 752 CA TYR A 48 16.387 -21.454 1.919 1.00 0.00 C ATOM 753 C TYR A 48 15.636 -22.691 1.420 1.00 0.00 C ATOM 754 O TYR A 48 14.464 -22.631 1.103 1.00 0.00 O ATOM 755 CB TYR A 48 17.314 -20.919 0.826 1.00 0.00 C ATOM 756 CG TYR A 48 18.178 -22.045 0.309 1.00 0.00 C ATOM 757 CD1 TYR A 48 19.278 -22.483 1.058 1.00 0.00 C ATOM 758 CD2 TYR A 48 17.878 -22.656 -0.914 1.00 0.00 C ATOM 759 CE1 TYR A 48 20.077 -23.530 0.582 1.00 0.00 C ATOM 760 CE2 TYR A 48 18.676 -23.703 -1.388 1.00 0.00 C ATOM 761 CZ TYR A 48 19.775 -24.141 -0.640 1.00 0.00 C ATOM 762 OH TYR A 48 20.562 -25.173 -1.108 1.00 0.00 O ATOM 0 H TYR A 48 18.201 -21.343 3.039 1.00 0.00 H new ATOM 0 HA TYR A 48 15.633 -20.725 2.215 1.00 0.00 H new ATOM 0 HB2 TYR A 48 16.727 -20.492 0.012 1.00 0.00 H new ATOM 0 HB3 TYR A 48 17.939 -20.119 1.223 1.00 0.00 H new ATOM 0 HD1 TYR A 48 19.510 -22.013 2.002 1.00 0.00 H new ATOM 0 HD2 TYR A 48 17.030 -22.319 -1.492 1.00 0.00 H new ATOM 0 HE1 TYR A 48 20.926 -23.866 1.158 1.00 0.00 H new ATOM 0 HE2 TYR A 48 18.444 -24.174 -2.332 1.00 0.00 H new ATOM 0 HH TYR A 48 19.993 -25.928 -1.365 1.00 0.00 H new ATOM 772 N SER A 49 16.300 -23.813 1.347 1.00 0.00 N ATOM 773 CA SER A 49 15.622 -25.051 0.867 1.00 0.00 C ATOM 774 C SER A 49 15.112 -24.854 -0.563 1.00 0.00 C ATOM 775 O SER A 49 14.019 -24.369 -0.782 1.00 0.00 O ATOM 776 CB SER A 49 14.455 -25.261 1.829 1.00 0.00 C ATOM 777 OG SER A 49 14.471 -26.602 2.301 1.00 0.00 O ATOM 0 H SER A 49 17.282 -23.926 1.599 1.00 0.00 H new ATOM 0 HA SER A 49 16.293 -25.909 0.848 1.00 0.00 H new ATOM 0 HB2 SER A 49 14.530 -24.568 2.667 1.00 0.00 H new ATOM 0 HB3 SER A 49 13.511 -25.052 1.325 1.00 0.00 H new ATOM 0 HG SER A 49 13.724 -26.740 2.920 1.00 0.00 H new ATOM 783 N GLY A 50 15.895 -25.226 -1.538 1.00 0.00 N ATOM 784 CA GLY A 50 15.455 -25.058 -2.952 1.00 0.00 C ATOM 785 C GLY A 50 16.358 -25.885 -3.870 1.00 0.00 C ATOM 786 O GLY A 50 17.281 -26.531 -3.417 1.00 0.00 O ATOM 0 H GLY A 50 16.820 -25.639 -1.417 1.00 0.00 H new ATOM 0 HA2 GLY A 50 14.418 -25.376 -3.062 1.00 0.00 H new ATOM 0 HA3 GLY A 50 15.497 -24.006 -3.234 1.00 0.00 H new ATOM 790 N PRO A 51 16.056 -25.831 -5.138 1.00 0.00 N ATOM 791 CA PRO A 51 16.877 -26.601 -6.110 1.00 0.00 C ATOM 792 C PRO A 51 18.074 -25.764 -6.571 1.00 0.00 C ATOM 793 O PRO A 51 19.212 -26.077 -6.282 1.00 0.00 O ATOM 794 CB PRO A 51 15.932 -26.880 -7.279 1.00 0.00 C ATOM 795 CG PRO A 51 14.793 -25.930 -7.109 1.00 0.00 C ATOM 796 CD PRO A 51 14.697 -25.611 -5.644 1.00 0.00 C ATOM 0 HA PRO A 51 17.281 -27.518 -5.681 1.00 0.00 H new ATOM 0 HB2 PRO A 51 16.433 -26.724 -8.234 1.00 0.00 H new ATOM 0 HB3 PRO A 51 15.586 -27.914 -7.265 1.00 0.00 H new ATOM 0 HG2 PRO A 51 14.958 -25.023 -7.690 1.00 0.00 H new ATOM 0 HG3 PRO A 51 13.865 -26.374 -7.468 1.00 0.00 H new ATOM 0 HD2 PRO A 51 14.373 -24.583 -5.481 1.00 0.00 H new ATOM 0 HD3 PRO A 51 13.976 -26.256 -5.142 1.00 0.00 H new ATOM 804 N GLY A 52 17.825 -24.701 -7.285 1.00 0.00 N ATOM 805 CA GLY A 52 18.948 -23.845 -7.761 1.00 0.00 C ATOM 806 C GLY A 52 19.377 -22.896 -6.641 1.00 0.00 C ATOM 807 O GLY A 52 19.283 -21.691 -6.766 1.00 0.00 O ATOM 0 H GLY A 52 16.894 -24.388 -7.559 1.00 0.00 H new ATOM 0 HA2 GLY A 52 19.789 -24.467 -8.067 1.00 0.00 H new ATOM 0 HA3 GLY A 52 18.638 -23.275 -8.637 1.00 0.00 H new ATOM 811 N SER A 53 19.835 -23.432 -5.542 1.00 0.00 N ATOM 812 CA SER A 53 20.260 -22.579 -4.410 1.00 0.00 C ATOM 813 C SER A 53 21.300 -21.549 -4.859 1.00 0.00 C ATOM 814 O SER A 53 21.430 -21.242 -6.027 1.00 0.00 O ATOM 815 CB SER A 53 20.872 -23.544 -3.398 1.00 0.00 C ATOM 816 OG SER A 53 21.278 -22.818 -2.245 1.00 0.00 O ATOM 0 H SER A 53 19.931 -24.435 -5.385 1.00 0.00 H new ATOM 0 HA SER A 53 19.425 -22.015 -3.994 1.00 0.00 H new ATOM 0 HB2 SER A 53 20.147 -24.310 -3.123 1.00 0.00 H new ATOM 0 HB3 SER A 53 21.727 -24.058 -3.838 1.00 0.00 H new ATOM 0 HG SER A 53 20.597 -22.908 -1.546 1.00 0.00 H new ATOM 822 N VAL A 54 22.044 -21.018 -3.930 1.00 0.00 N ATOM 823 CA VAL A 54 23.084 -20.009 -4.282 1.00 0.00 C ATOM 824 C VAL A 54 24.175 -19.994 -3.210 1.00 0.00 C ATOM 825 O VAL A 54 24.021 -20.588 -2.163 1.00 0.00 O ATOM 826 CB VAL A 54 22.347 -18.669 -4.313 1.00 0.00 C ATOM 827 CG1 VAL A 54 21.408 -18.627 -5.519 1.00 0.00 C ATOM 828 CG2 VAL A 54 21.532 -18.509 -3.028 1.00 0.00 C ATOM 0 H VAL A 54 21.977 -21.240 -2.937 1.00 0.00 H new ATOM 0 HA VAL A 54 23.568 -20.226 -5.234 1.00 0.00 H new ATOM 0 HB VAL A 54 23.072 -17.858 -4.391 1.00 0.00 H new ATOM 0 HG11 VAL A 54 20.884 -17.671 -5.539 1.00 0.00 H new ATOM 0 HG12 VAL A 54 21.987 -18.743 -6.435 1.00 0.00 H new ATOM 0 HG13 VAL A 54 20.683 -19.437 -5.444 1.00 0.00 H new ATOM 0 HG21 VAL A 54 21.006 -17.555 -3.047 1.00 0.00 H new ATOM 0 HG22 VAL A 54 20.809 -19.321 -2.952 1.00 0.00 H new ATOM 0 HG23 VAL A 54 22.200 -18.537 -2.167 1.00 0.00 H new ATOM 838 N PRO A 55 25.245 -19.310 -3.509 1.00 0.00 N ATOM 839 CA PRO A 55 26.351 -19.242 -2.521 1.00 0.00 C ATOM 840 C PRO A 55 25.816 -18.793 -1.157 1.00 0.00 C ATOM 841 O PRO A 55 25.801 -17.619 -0.842 1.00 0.00 O ATOM 842 CB PRO A 55 27.322 -18.205 -3.095 1.00 0.00 C ATOM 843 CG PRO A 55 26.650 -17.630 -4.304 1.00 0.00 C ATOM 844 CD PRO A 55 25.604 -18.613 -4.743 1.00 0.00 C ATOM 0 HA PRO A 55 26.832 -20.207 -2.364 1.00 0.00 H new ATOM 0 HB2 PRO A 55 27.539 -17.427 -2.363 1.00 0.00 H new ATOM 0 HB3 PRO A 55 28.273 -18.667 -3.361 1.00 0.00 H new ATOM 0 HG2 PRO A 55 26.198 -16.666 -4.070 1.00 0.00 H new ATOM 0 HG3 PRO A 55 27.374 -17.458 -5.101 1.00 0.00 H new ATOM 0 HD2 PRO A 55 24.743 -18.111 -5.185 1.00 0.00 H new ATOM 0 HD3 PRO A 55 25.991 -19.302 -5.494 1.00 0.00 H new ATOM 852 N GLY A 56 25.377 -19.717 -0.347 1.00 0.00 N ATOM 853 CA GLY A 56 24.843 -19.344 0.995 1.00 0.00 C ATOM 854 C GLY A 56 23.466 -18.693 0.837 1.00 0.00 C ATOM 855 O GLY A 56 23.355 -17.503 0.619 1.00 0.00 O ATOM 0 H GLY A 56 25.365 -20.715 -0.556 1.00 0.00 H new ATOM 0 HA2 GLY A 56 24.768 -20.229 1.626 1.00 0.00 H new ATOM 0 HA3 GLY A 56 25.527 -18.656 1.491 1.00 0.00 H new ATOM 859 N ALA A 57 22.417 -19.463 0.946 1.00 0.00 N ATOM 860 CA ALA A 57 21.050 -18.880 0.800 1.00 0.00 C ATOM 861 C ALA A 57 20.224 -19.120 2.068 1.00 0.00 C ATOM 862 O ALA A 57 20.286 -20.171 2.674 1.00 0.00 O ATOM 863 CB ALA A 57 20.430 -19.619 -0.386 1.00 0.00 C ATOM 0 H ALA A 57 22.446 -20.466 1.129 1.00 0.00 H new ATOM 0 HA ALA A 57 21.081 -17.802 0.644 1.00 0.00 H new ATOM 0 HB1 ALA A 57 19.420 -19.247 -0.559 1.00 0.00 H new ATOM 0 HB2 ALA A 57 21.036 -19.451 -1.276 1.00 0.00 H new ATOM 0 HB3 ALA A 57 20.391 -20.687 -0.169 1.00 0.00 H new ATOM 869 N LEU A 58 19.446 -18.150 2.467 1.00 0.00 N ATOM 870 CA LEU A 58 18.604 -18.314 3.689 1.00 0.00 C ATOM 871 C LEU A 58 17.158 -17.921 3.379 1.00 0.00 C ATOM 872 O LEU A 58 16.889 -17.228 2.417 1.00 0.00 O ATOM 873 CB LEU A 58 19.208 -17.362 4.721 1.00 0.00 C ATOM 874 CG LEU A 58 20.596 -17.859 5.125 1.00 0.00 C ATOM 875 CD1 LEU A 58 21.574 -16.683 5.148 1.00 0.00 C ATOM 876 CD2 LEU A 58 20.523 -18.487 6.521 1.00 0.00 C ATOM 0 H LEU A 58 19.357 -17.248 1.999 1.00 0.00 H new ATOM 0 HA LEU A 58 18.589 -19.343 4.049 1.00 0.00 H new ATOM 0 HB2 LEU A 58 19.277 -16.356 4.307 1.00 0.00 H new ATOM 0 HB3 LEU A 58 18.563 -17.302 5.597 1.00 0.00 H new ATOM 0 HG LEU A 58 20.940 -18.603 4.406 1.00 0.00 H new ATOM 0 HD11 LEU A 58 22.563 -17.038 5.436 1.00 0.00 H new ATOM 0 HD12 LEU A 58 21.625 -16.232 4.157 1.00 0.00 H new ATOM 0 HD13 LEU A 58 21.232 -15.939 5.868 1.00 0.00 H new ATOM 0 HD21 LEU A 58 21.511 -18.843 6.812 1.00 0.00 H new ATOM 0 HD22 LEU A 58 20.180 -17.741 7.238 1.00 0.00 H new ATOM 0 HD23 LEU A 58 19.826 -19.325 6.507 1.00 0.00 H new ATOM 888 N ASP A 59 16.222 -18.357 4.178 1.00 0.00 N ATOM 889 CA ASP A 59 14.799 -18.001 3.909 1.00 0.00 C ATOM 890 C ASP A 59 14.275 -17.030 4.970 1.00 0.00 C ATOM 891 O ASP A 59 14.079 -17.391 6.113 1.00 0.00 O ATOM 892 CB ASP A 59 14.037 -19.325 3.985 1.00 0.00 C ATOM 893 CG ASP A 59 12.837 -19.280 3.038 1.00 0.00 C ATOM 894 OD1 ASP A 59 13.022 -19.556 1.864 1.00 0.00 O ATOM 895 OD2 ASP A 59 11.752 -18.969 3.503 1.00 0.00 O ATOM 0 H ASP A 59 16.379 -18.940 5.000 1.00 0.00 H new ATOM 0 HA ASP A 59 14.680 -17.509 2.943 1.00 0.00 H new ATOM 0 HB2 ASP A 59 14.695 -20.151 3.716 1.00 0.00 H new ATOM 0 HB3 ASP A 59 13.701 -19.505 5.006 1.00 0.00 H new ATOM 900 N TYR A 60 14.027 -15.805 4.596 1.00 0.00 N ATOM 901 CA TYR A 60 13.499 -14.820 5.581 1.00 0.00 C ATOM 902 C TYR A 60 12.017 -15.100 5.832 1.00 0.00 C ATOM 903 O TYR A 60 11.475 -14.762 6.864 1.00 0.00 O ATOM 904 CB TYR A 60 13.684 -13.454 4.921 1.00 0.00 C ATOM 905 CG TYR A 60 12.855 -13.389 3.661 1.00 0.00 C ATOM 906 CD1 TYR A 60 11.492 -13.078 3.734 1.00 0.00 C ATOM 907 CD2 TYR A 60 13.449 -13.639 2.418 1.00 0.00 C ATOM 908 CE1 TYR A 60 10.722 -13.019 2.566 1.00 0.00 C ATOM 909 CE2 TYR A 60 12.680 -13.580 1.249 1.00 0.00 C ATOM 910 CZ TYR A 60 11.318 -13.269 1.324 1.00 0.00 C ATOM 911 OH TYR A 60 10.560 -13.210 0.171 1.00 0.00 O ATOM 0 H TYR A 60 14.167 -15.444 3.652 1.00 0.00 H new ATOM 0 HA TYR A 60 14.010 -14.871 6.542 1.00 0.00 H new ATOM 0 HB2 TYR A 60 13.384 -12.662 5.608 1.00 0.00 H new ATOM 0 HB3 TYR A 60 14.736 -13.291 4.686 1.00 0.00 H new ATOM 0 HD1 TYR A 60 11.034 -12.883 4.692 1.00 0.00 H new ATOM 0 HD2 TYR A 60 14.501 -13.877 2.361 1.00 0.00 H new ATOM 0 HE1 TYR A 60 9.670 -12.781 2.623 1.00 0.00 H new ATOM 0 HE2 TYR A 60 13.138 -13.774 0.290 1.00 0.00 H new ATOM 0 HH TYR A 60 11.153 -13.170 -0.608 1.00 0.00 H new ATOM 921 N ALA A 61 11.362 -15.725 4.891 1.00 0.00 N ATOM 922 CA ALA A 61 9.918 -16.038 5.069 1.00 0.00 C ATOM 923 C ALA A 61 9.740 -16.981 6.260 1.00 0.00 C ATOM 924 O ALA A 61 8.868 -16.797 7.085 1.00 0.00 O ATOM 925 CB ALA A 61 9.497 -16.727 3.772 1.00 0.00 C ATOM 0 H ALA A 61 11.766 -16.032 4.006 1.00 0.00 H new ATOM 0 HA ALA A 61 9.318 -15.149 5.266 1.00 0.00 H new ATOM 0 HB1 ALA A 61 8.441 -16.990 3.826 1.00 0.00 H new ATOM 0 HB2 ALA A 61 9.661 -16.052 2.932 1.00 0.00 H new ATOM 0 HB3 ALA A 61 10.089 -17.631 3.632 1.00 0.00 H new ATOM 931 N ALA A 62 10.566 -17.988 6.360 1.00 0.00 N ATOM 932 CA ALA A 62 10.443 -18.934 7.504 1.00 0.00 C ATOM 933 C ALA A 62 10.660 -18.190 8.820 1.00 0.00 C ATOM 934 O ALA A 62 10.080 -18.513 9.837 1.00 0.00 O ATOM 935 CB ALA A 62 11.539 -19.976 7.280 1.00 0.00 C ATOM 0 H ALA A 62 11.317 -18.195 5.702 1.00 0.00 H new ATOM 0 HA ALA A 62 9.457 -19.395 7.559 1.00 0.00 H new ATOM 0 HB1 ALA A 62 11.513 -20.711 8.085 1.00 0.00 H new ATOM 0 HB2 ALA A 62 11.375 -20.477 6.326 1.00 0.00 H new ATOM 0 HB3 ALA A 62 12.512 -19.484 7.269 1.00 0.00 H new ATOM 941 N PHE A 63 11.495 -17.194 8.801 1.00 0.00 N ATOM 942 CA PHE A 63 11.763 -16.412 10.042 1.00 0.00 C ATOM 943 C PHE A 63 10.546 -15.552 10.400 1.00 0.00 C ATOM 944 O PHE A 63 10.192 -15.412 11.554 1.00 0.00 O ATOM 945 CB PHE A 63 12.966 -15.532 9.698 1.00 0.00 C ATOM 946 CG PHE A 63 13.090 -14.413 10.707 1.00 0.00 C ATOM 947 CD1 PHE A 63 12.648 -14.602 12.021 1.00 0.00 C ATOM 948 CD2 PHE A 63 13.651 -13.189 10.327 1.00 0.00 C ATOM 949 CE1 PHE A 63 12.766 -13.566 12.956 1.00 0.00 C ATOM 950 CE2 PHE A 63 13.770 -12.153 11.261 1.00 0.00 C ATOM 951 CZ PHE A 63 13.328 -12.342 12.575 1.00 0.00 C ATOM 0 H PHE A 63 12.008 -16.884 7.976 1.00 0.00 H new ATOM 0 HA PHE A 63 11.959 -17.052 10.903 1.00 0.00 H new ATOM 0 HB2 PHE A 63 13.876 -16.131 9.693 1.00 0.00 H new ATOM 0 HB3 PHE A 63 12.851 -15.119 8.696 1.00 0.00 H new ATOM 0 HD1 PHE A 63 12.216 -15.547 12.314 1.00 0.00 H new ATOM 0 HD2 PHE A 63 13.992 -13.043 9.313 1.00 0.00 H new ATOM 0 HE1 PHE A 63 12.424 -13.711 13.970 1.00 0.00 H new ATOM 0 HE2 PHE A 63 14.203 -11.208 10.967 1.00 0.00 H new ATOM 0 HZ PHE A 63 13.421 -11.543 13.296 1.00 0.00 H new ATOM 961 N SER A 64 9.908 -14.972 9.421 1.00 0.00 N ATOM 962 CA SER A 64 8.719 -14.116 9.707 1.00 0.00 C ATOM 963 C SER A 64 7.615 -14.935 10.382 1.00 0.00 C ATOM 964 O SER A 64 7.072 -14.545 11.397 1.00 0.00 O ATOM 965 CB SER A 64 8.252 -13.620 8.340 1.00 0.00 C ATOM 966 OG SER A 64 7.488 -12.434 8.508 1.00 0.00 O ATOM 0 H SER A 64 10.157 -15.053 8.435 1.00 0.00 H new ATOM 0 HA SER A 64 8.960 -13.296 10.383 1.00 0.00 H new ATOM 0 HB2 SER A 64 9.111 -13.425 7.698 1.00 0.00 H new ATOM 0 HB3 SER A 64 7.653 -14.386 7.847 1.00 0.00 H new ATOM 0 HG SER A 64 6.934 -12.287 7.713 1.00 0.00 H new ATOM 972 N SER A 65 7.274 -16.062 9.824 1.00 0.00 N ATOM 973 CA SER A 65 6.202 -16.900 10.433 1.00 0.00 C ATOM 974 C SER A 65 6.673 -17.484 11.768 1.00 0.00 C ATOM 975 O SER A 65 5.903 -17.638 12.694 1.00 0.00 O ATOM 976 CB SER A 65 5.946 -18.012 9.418 1.00 0.00 C ATOM 977 OG SER A 65 4.805 -17.681 8.636 1.00 0.00 O ATOM 0 H SER A 65 7.690 -16.440 8.973 1.00 0.00 H new ATOM 0 HA SER A 65 5.300 -16.325 10.644 1.00 0.00 H new ATOM 0 HB2 SER A 65 6.817 -18.141 8.775 1.00 0.00 H new ATOM 0 HB3 SER A 65 5.786 -18.960 9.932 1.00 0.00 H new ATOM 0 HG SER A 65 4.639 -18.392 7.982 1.00 0.00 H new ATOM 983 N ALA A 66 7.930 -17.819 11.871 1.00 0.00 N ATOM 984 CA ALA A 66 8.446 -18.403 13.144 1.00 0.00 C ATOM 985 C ALA A 66 8.456 -17.352 14.260 1.00 0.00 C ATOM 986 O ALA A 66 8.034 -17.613 15.370 1.00 0.00 O ATOM 987 CB ALA A 66 9.871 -18.856 12.823 1.00 0.00 C ATOM 0 H ALA A 66 8.623 -17.714 11.130 1.00 0.00 H new ATOM 0 HA ALA A 66 7.822 -19.225 13.496 1.00 0.00 H new ATOM 0 HB1 ALA A 66 10.321 -19.298 13.712 1.00 0.00 H new ATOM 0 HB2 ALA A 66 9.846 -19.595 12.023 1.00 0.00 H new ATOM 0 HB3 ALA A 66 10.463 -17.998 12.506 1.00 0.00 H new ATOM 993 N LEU A 67 8.943 -16.173 13.984 1.00 0.00 N ATOM 994 CA LEU A 67 8.984 -15.124 15.040 1.00 0.00 C ATOM 995 C LEU A 67 7.574 -14.620 15.359 1.00 0.00 C ATOM 996 O LEU A 67 7.273 -14.263 16.480 1.00 0.00 O ATOM 997 CB LEU A 67 9.843 -14.005 14.451 1.00 0.00 C ATOM 998 CG LEU A 67 9.040 -13.203 13.425 1.00 0.00 C ATOM 999 CD1 LEU A 67 8.255 -12.101 14.140 1.00 0.00 C ATOM 1000 CD2 LEU A 67 10.000 -12.568 12.416 1.00 0.00 C ATOM 0 H LEU A 67 9.313 -15.892 13.076 1.00 0.00 H new ATOM 0 HA LEU A 67 9.393 -15.501 15.977 1.00 0.00 H new ATOM 0 HB2 LEU A 67 10.190 -13.346 15.247 1.00 0.00 H new ATOM 0 HB3 LEU A 67 10.730 -14.428 13.979 1.00 0.00 H new ATOM 0 HG LEU A 67 8.347 -13.865 12.906 1.00 0.00 H new ATOM 0 HD11 LEU A 67 7.683 -11.529 13.409 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.574 -12.550 14.863 1.00 0.00 H new ATOM 0 HD13 LEU A 67 8.948 -11.438 14.657 1.00 0.00 H new ATOM 0 HD21 LEU A 67 9.431 -11.996 11.683 1.00 0.00 H new ATOM 0 HD22 LEU A 67 10.690 -11.905 12.938 1.00 0.00 H new ATOM 0 HD23 LEU A 67 10.563 -13.350 11.907 1.00 0.00 H new ATOM 1012 N TYR A 68 6.711 -14.587 14.385 1.00 0.00 N ATOM 1013 CA TYR A 68 5.322 -14.106 14.636 1.00 0.00 C ATOM 1014 C TYR A 68 4.369 -15.293 14.808 1.00 0.00 C ATOM 1015 O TYR A 68 3.167 -15.130 14.883 1.00 0.00 O ATOM 1016 CB TYR A 68 4.951 -13.290 13.397 1.00 0.00 C ATOM 1017 CG TYR A 68 5.116 -11.820 13.699 1.00 0.00 C ATOM 1018 CD1 TYR A 68 4.669 -11.304 14.921 1.00 0.00 C ATOM 1019 CD2 TYR A 68 5.716 -10.974 12.759 1.00 0.00 C ATOM 1020 CE1 TYR A 68 4.821 -9.941 15.202 1.00 0.00 C ATOM 1021 CE2 TYR A 68 5.869 -9.610 13.042 1.00 0.00 C ATOM 1022 CZ TYR A 68 5.421 -9.094 14.264 1.00 0.00 C ATOM 1023 OH TYR A 68 5.571 -7.751 14.544 1.00 0.00 O ATOM 0 H TYR A 68 6.905 -14.872 13.425 1.00 0.00 H new ATOM 0 HA TYR A 68 5.252 -13.513 15.548 1.00 0.00 H new ATOM 0 HB2 TYR A 68 5.585 -13.574 12.557 1.00 0.00 H new ATOM 0 HB3 TYR A 68 3.922 -13.500 13.104 1.00 0.00 H new ATOM 0 HD1 TYR A 68 4.207 -11.957 15.647 1.00 0.00 H new ATOM 0 HD2 TYR A 68 6.061 -11.372 11.816 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.475 -9.543 16.144 1.00 0.00 H new ATOM 0 HE2 TYR A 68 6.332 -8.957 12.317 1.00 0.00 H new ATOM 0 HH TYR A 68 4.982 -7.504 15.287 1.00 0.00 H new ATOM 1033 N GLY A 69 4.895 -16.486 14.871 1.00 0.00 N ATOM 1034 CA GLY A 69 4.016 -17.680 15.038 1.00 0.00 C ATOM 1035 C GLY A 69 4.331 -18.365 16.368 1.00 0.00 C ATOM 1036 O GLY A 69 5.477 -18.585 16.708 1.00 0.00 O ATOM 0 H GLY A 69 5.894 -16.686 14.814 1.00 0.00 H new ATOM 0 HA2 GLY A 69 2.968 -17.380 15.011 1.00 0.00 H new ATOM 0 HA3 GLY A 69 4.170 -18.376 14.213 1.00 0.00 H new ATOM 1040 N GLU A 70 3.323 -18.705 17.124 1.00 0.00 N ATOM 1041 CA GLU A 70 3.567 -19.377 18.434 1.00 0.00 C ATOM 1042 C GLU A 70 3.194 -20.860 18.345 1.00 0.00 C ATOM 1043 O GLU A 70 2.688 -21.323 17.342 1.00 0.00 O ATOM 1044 CB GLU A 70 2.656 -18.653 19.428 1.00 0.00 C ATOM 1045 CG GLU A 70 3.261 -17.292 19.778 1.00 0.00 C ATOM 1046 CD GLU A 70 2.265 -16.493 20.622 1.00 0.00 C ATOM 1047 OE1 GLU A 70 1.282 -17.076 21.050 1.00 0.00 O ATOM 1048 OE2 GLU A 70 2.501 -15.313 20.824 1.00 0.00 O ATOM 0 H GLU A 70 2.342 -18.547 16.893 1.00 0.00 H new ATOM 0 HA GLU A 70 4.614 -19.330 18.733 1.00 0.00 H new ATOM 0 HB2 GLU A 70 1.663 -18.522 18.998 1.00 0.00 H new ATOM 0 HB3 GLU A 70 2.536 -19.252 20.331 1.00 0.00 H new ATOM 0 HG2 GLU A 70 4.193 -17.427 20.327 1.00 0.00 H new ATOM 0 HG3 GLU A 70 3.503 -16.745 18.867 1.00 0.00 H new ATOM 1055 N SER A 71 3.439 -21.607 19.387 1.00 0.00 N ATOM 1056 CA SER A 71 3.098 -23.059 19.361 1.00 0.00 C ATOM 1057 C SER A 71 1.620 -23.260 19.704 1.00 0.00 C ATOM 1058 O SER A 71 0.972 -24.156 19.198 1.00 0.00 O ATOM 1059 CB SER A 71 3.987 -23.693 20.430 1.00 0.00 C ATOM 1060 OG SER A 71 4.494 -24.931 19.946 1.00 0.00 O ATOM 0 H SER A 71 3.860 -21.275 20.255 1.00 0.00 H new ATOM 0 HA SER A 71 3.260 -23.504 18.379 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.809 -23.023 20.680 1.00 0.00 H new ATOM 0 HB3 SER A 71 3.417 -23.853 21.345 1.00 0.00 H new ATOM 0 HG SER A 71 5.066 -25.340 20.629 1.00 0.00 H new ATOM 1066 N ASP A 72 1.081 -22.435 20.559 1.00 0.00 N ATOM 1067 CA ASP A 72 -0.354 -22.580 20.935 1.00 0.00 C ATOM 1068 C ASP A 72 -1.213 -21.601 20.130 1.00 0.00 C ATOM 1069 O ASP A 72 -1.040 -20.401 20.205 1.00 0.00 O ATOM 1070 CB ASP A 72 -0.410 -22.243 22.424 1.00 0.00 C ATOM 1071 CG ASP A 72 -1.633 -22.913 23.053 1.00 0.00 C ATOM 1072 OD1 ASP A 72 -2.717 -22.742 22.519 1.00 0.00 O ATOM 1073 OD2 ASP A 72 -1.466 -23.585 24.057 1.00 0.00 O ATOM 0 H ASP A 72 1.573 -21.666 21.014 1.00 0.00 H new ATOM 0 HA ASP A 72 -0.735 -23.580 20.730 1.00 0.00 H new ATOM 0 HB2 ASP A 72 0.499 -22.583 22.919 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -0.463 -21.163 22.562 1.00 0.00 H new ATOM 1078 N LEU A 73 -2.140 -22.103 19.360 1.00 0.00 N ATOM 1079 CA LEU A 73 -3.009 -21.200 18.553 1.00 0.00 C ATOM 1080 C LEU A 73 -4.180 -21.987 17.961 1.00 0.00 C ATOM 1081 O LEU A 73 -4.202 -23.202 17.989 1.00 0.00 O ATOM 1082 CB LEU A 73 -2.103 -20.670 17.442 1.00 0.00 C ATOM 1083 CG LEU A 73 -2.608 -19.301 16.982 1.00 0.00 C ATOM 1084 CD1 LEU A 73 -1.676 -18.209 17.511 1.00 0.00 C ATOM 1085 CD2 LEU A 73 -2.630 -19.255 15.453 1.00 0.00 C ATOM 0 H LEU A 73 -2.333 -23.099 19.255 1.00 0.00 H new ATOM 0 HA LEU A 73 -3.437 -20.394 19.149 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -1.077 -20.589 17.802 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -2.092 -21.366 16.603 1.00 0.00 H new ATOM 0 HG LEU A 73 -3.615 -19.137 17.366 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -2.036 -17.234 17.183 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -1.658 -18.242 18.600 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -0.669 -18.372 17.127 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -2.990 -18.280 15.123 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -1.623 -19.419 15.070 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -3.293 -20.033 15.075 1.00 0.00 H new TER 1097 LEU A 73 ATOM 1098 N GLY B 7 14.061 3.203 -4.711 1.00 0.00 N ATOM 1099 CA GLY B 7 12.704 2.662 -4.419 1.00 0.00 C ATOM 1100 C GLY B 7 12.363 2.903 -2.947 1.00 0.00 C ATOM 1101 O GLY B 7 11.848 3.940 -2.580 1.00 0.00 O ATOM 0 HA2 GLY B 7 11.964 3.144 -5.058 1.00 0.00 H new ATOM 0 HA3 GLY B 7 12.671 1.595 -4.641 1.00 0.00 H new ATOM 1105 N LYS B 8 12.648 1.952 -2.100 1.00 0.00 N ATOM 1106 CA LYS B 8 12.342 2.128 -0.652 1.00 0.00 C ATOM 1107 C LYS B 8 13.092 1.082 0.176 1.00 0.00 C ATOM 1108 O LYS B 8 12.565 0.531 1.122 1.00 0.00 O ATOM 1109 CB LYS B 8 10.831 1.921 -0.537 1.00 0.00 C ATOM 1110 CG LYS B 8 10.445 0.595 -1.195 1.00 0.00 C ATOM 1111 CD LYS B 8 9.258 -0.018 -0.450 1.00 0.00 C ATOM 1112 CE LYS B 8 8.192 -0.450 -1.460 1.00 0.00 C ATOM 1113 NZ LYS B 8 6.968 -0.688 -0.645 1.00 0.00 N ATOM 0 H LYS B 8 13.079 1.061 -2.348 1.00 0.00 H new ATOM 0 HA LYS B 8 12.648 3.106 -0.281 1.00 0.00 H new ATOM 0 HB2 LYS B 8 10.532 1.919 0.511 1.00 0.00 H new ATOM 0 HB3 LYS B 8 10.303 2.745 -1.017 1.00 0.00 H new ATOM 0 HG2 LYS B 8 10.186 0.758 -2.241 1.00 0.00 H new ATOM 0 HG3 LYS B 8 11.292 -0.091 -1.179 1.00 0.00 H new ATOM 0 HD2 LYS B 8 9.587 -0.875 0.138 1.00 0.00 H new ATOM 0 HD3 LYS B 8 8.840 0.706 0.249 1.00 0.00 H new ATOM 0 HE2 LYS B 8 8.023 0.322 -2.211 1.00 0.00 H new ATOM 0 HE3 LYS B 8 8.494 -1.352 -1.992 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 6.190 -0.988 -1.267 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 7.157 -1.432 0.057 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 6.701 0.190 -0.155 1.00 0.00 H new ATOM 1127 N LYS B 9 14.318 0.805 -0.171 1.00 0.00 N ATOM 1128 CA LYS B 9 15.099 -0.204 0.600 1.00 0.00 C ATOM 1129 C LYS B 9 15.276 0.262 2.047 1.00 0.00 C ATOM 1130 O LYS B 9 15.036 -0.478 2.981 1.00 0.00 O ATOM 1131 CB LYS B 9 16.450 -0.285 -0.109 1.00 0.00 C ATOM 1132 CG LYS B 9 16.731 -1.736 -0.504 1.00 0.00 C ATOM 1133 CD LYS B 9 18.129 -1.838 -1.116 1.00 0.00 C ATOM 1134 CE LYS B 9 18.408 -3.289 -1.516 1.00 0.00 C ATOM 1135 NZ LYS B 9 17.970 -3.385 -2.937 1.00 0.00 N ATOM 0 H LYS B 9 14.813 1.233 -0.954 1.00 0.00 H new ATOM 0 HA LYS B 9 14.602 -1.173 0.637 1.00 0.00 H new ATOM 0 HB2 LYS B 9 16.447 0.350 -0.995 1.00 0.00 H new ATOM 0 HB3 LYS B 9 17.239 0.085 0.546 1.00 0.00 H new ATOM 0 HG2 LYS B 9 16.657 -2.383 0.370 1.00 0.00 H new ATOM 0 HG3 LYS B 9 15.984 -2.080 -1.219 1.00 0.00 H new ATOM 0 HD2 LYS B 9 18.204 -1.189 -1.988 1.00 0.00 H new ATOM 0 HD3 LYS B 9 18.877 -1.497 -0.400 1.00 0.00 H new ATOM 0 HE2 LYS B 9 19.465 -3.532 -1.411 1.00 0.00 H new ATOM 0 HE3 LYS B 9 17.857 -3.986 -0.885 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 18.129 -4.352 -3.285 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 16.958 -3.155 -3.005 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 18.517 -2.715 -3.515 1.00 0.00 H new ATOM 1149 N ALA B 10 15.693 1.484 2.239 1.00 0.00 N ATOM 1150 CA ALA B 10 15.882 1.996 3.627 1.00 0.00 C ATOM 1151 C ALA B 10 14.586 1.844 4.428 1.00 0.00 C ATOM 1152 O ALA B 10 14.594 1.398 5.558 1.00 0.00 O ATOM 1153 CB ALA B 10 16.241 3.473 3.458 1.00 0.00 C ATOM 0 H ALA B 10 15.911 2.149 1.497 1.00 0.00 H new ATOM 0 HA ALA B 10 16.654 1.449 4.168 1.00 0.00 H new ATOM 0 HB1 ALA B 10 16.397 3.924 4.438 1.00 0.00 H new ATOM 0 HB2 ALA B 10 17.154 3.560 2.869 1.00 0.00 H new ATOM 0 HB3 ALA B 10 15.428 3.989 2.946 1.00 0.00 H new ATOM 1159 N GLU B 11 13.474 2.210 3.851 1.00 0.00 N ATOM 1160 CA GLU B 11 12.177 2.085 4.581 1.00 0.00 C ATOM 1161 C GLU B 11 11.882 0.612 4.880 1.00 0.00 C ATOM 1162 O GLU B 11 11.422 0.265 5.949 1.00 0.00 O ATOM 1163 CB GLU B 11 11.127 2.656 3.628 1.00 0.00 C ATOM 1164 CG GLU B 11 11.298 4.174 3.523 1.00 0.00 C ATOM 1165 CD GLU B 11 10.920 4.634 2.113 1.00 0.00 C ATOM 1166 OE1 GLU B 11 9.735 4.727 1.839 1.00 0.00 O ATOM 1167 OE2 GLU B 11 11.822 4.884 1.331 1.00 0.00 O ATOM 0 H GLU B 11 13.406 2.590 2.907 1.00 0.00 H new ATOM 0 HA GLU B 11 12.189 2.610 5.536 1.00 0.00 H new ATOM 0 HB2 GLU B 11 11.229 2.200 2.643 1.00 0.00 H new ATOM 0 HB3 GLU B 11 10.126 2.417 3.988 1.00 0.00 H new ATOM 0 HG2 GLU B 11 10.670 4.673 4.261 1.00 0.00 H new ATOM 0 HG3 GLU B 11 12.329 4.451 3.743 1.00 0.00 H new ATOM 1174 N ALA B 12 12.144 -0.256 3.940 1.00 0.00 N ATOM 1175 CA ALA B 12 11.878 -1.705 4.170 1.00 0.00 C ATOM 1176 C ALA B 12 12.755 -2.228 5.310 1.00 0.00 C ATOM 1177 O ALA B 12 12.358 -3.093 6.064 1.00 0.00 O ATOM 1178 CB ALA B 12 12.248 -2.390 2.853 1.00 0.00 C ATOM 0 H ALA B 12 12.530 -0.025 3.025 1.00 0.00 H new ATOM 0 HA ALA B 12 10.842 -1.895 4.452 1.00 0.00 H new ATOM 0 HB1 ALA B 12 12.080 -3.463 2.941 1.00 0.00 H new ATOM 0 HB2 ALA B 12 11.630 -1.991 2.049 1.00 0.00 H new ATOM 0 HB3 ALA B 12 13.299 -2.205 2.629 1.00 0.00 H new ATOM 1184 N VAL B 13 13.945 -1.709 5.441 1.00 0.00 N ATOM 1185 CA VAL B 13 14.845 -2.179 6.533 1.00 0.00 C ATOM 1186 C VAL B 13 14.241 -1.835 7.897 1.00 0.00 C ATOM 1187 O VAL B 13 14.270 -2.628 8.818 1.00 0.00 O ATOM 1188 CB VAL B 13 16.156 -1.423 6.321 1.00 0.00 C ATOM 1189 CG1 VAL B 13 17.168 -1.848 7.386 1.00 0.00 C ATOM 1190 CG2 VAL B 13 16.711 -1.743 4.932 1.00 0.00 C ATOM 0 H VAL B 13 14.333 -0.981 4.841 1.00 0.00 H new ATOM 0 HA VAL B 13 14.991 -3.259 6.512 1.00 0.00 H new ATOM 0 HB VAL B 13 15.974 -0.351 6.401 1.00 0.00 H new ATOM 0 HG11 VAL B 13 18.103 -1.309 7.235 1.00 0.00 H new ATOM 0 HG12 VAL B 13 16.773 -1.619 8.376 1.00 0.00 H new ATOM 0 HG13 VAL B 13 17.350 -2.920 7.308 1.00 0.00 H new ATOM 0 HG21 VAL B 13 17.646 -1.204 4.781 1.00 0.00 H new ATOM 0 HG22 VAL B 13 16.893 -2.815 4.851 1.00 0.00 H new ATOM 0 HG23 VAL B 13 15.990 -1.439 4.173 1.00 0.00 H new ATOM 1200 N ALA B 14 13.693 -0.659 8.034 1.00 0.00 N ATOM 1201 CA ALA B 14 13.088 -0.264 9.338 1.00 0.00 C ATOM 1202 C ALA B 14 11.924 -1.197 9.692 1.00 0.00 C ATOM 1203 O ALA B 14 11.702 -1.516 10.844 1.00 0.00 O ATOM 1204 CB ALA B 14 12.584 1.165 9.124 1.00 0.00 C ATOM 0 H ALA B 14 13.638 0.046 7.299 1.00 0.00 H new ATOM 0 HA ALA B 14 13.803 -0.327 10.158 1.00 0.00 H new ATOM 0 HB1 ALA B 14 12.123 1.530 10.042 1.00 0.00 H new ATOM 0 HB2 ALA B 14 13.421 1.810 8.857 1.00 0.00 H new ATOM 0 HB3 ALA B 14 11.848 1.175 8.320 1.00 0.00 H new ATOM 1210 N THR B 15 11.179 -1.634 8.715 1.00 0.00 N ATOM 1211 CA THR B 15 10.030 -2.543 9.004 1.00 0.00 C ATOM 1212 C THR B 15 10.524 -3.851 9.626 1.00 0.00 C ATOM 1213 O THR B 15 9.957 -4.351 10.578 1.00 0.00 O ATOM 1214 CB THR B 15 9.383 -2.810 7.644 1.00 0.00 C ATOM 1215 OG1 THR B 15 9.108 -1.573 7.000 1.00 0.00 O ATOM 1216 CG2 THR B 15 8.080 -3.586 7.841 1.00 0.00 C ATOM 0 H THR B 15 11.314 -1.403 7.731 1.00 0.00 H new ATOM 0 HA THR B 15 9.329 -2.102 9.713 1.00 0.00 H new ATOM 0 HB THR B 15 10.063 -3.397 7.027 1.00 0.00 H new ATOM 0 HG1 THR B 15 8.695 -1.743 6.128 1.00 0.00 H new ATOM 0 HG21 THR B 15 7.619 -3.776 6.871 1.00 0.00 H new ATOM 0 HG22 THR B 15 8.292 -4.535 8.334 1.00 0.00 H new ATOM 0 HG23 THR B 15 7.398 -3.001 8.458 1.00 0.00 H new ATOM 1224 N VAL B 16 11.574 -4.414 9.092 1.00 0.00 N ATOM 1225 CA VAL B 16 12.100 -5.694 9.650 1.00 0.00 C ATOM 1226 C VAL B 16 12.703 -5.468 11.039 1.00 0.00 C ATOM 1227 O VAL B 16 12.504 -6.249 11.948 1.00 0.00 O ATOM 1228 CB VAL B 16 13.180 -6.136 8.663 1.00 0.00 C ATOM 1229 CG1 VAL B 16 13.885 -7.382 9.201 1.00 0.00 C ATOM 1230 CG2 VAL B 16 12.535 -6.459 7.313 1.00 0.00 C ATOM 0 H VAL B 16 12.090 -4.044 8.294 1.00 0.00 H new ATOM 0 HA VAL B 16 11.317 -6.443 9.768 1.00 0.00 H new ATOM 0 HB VAL B 16 13.907 -5.333 8.537 1.00 0.00 H new ATOM 0 HG11 VAL B 16 14.655 -7.697 8.497 1.00 0.00 H new ATOM 0 HG12 VAL B 16 14.344 -7.153 10.163 1.00 0.00 H new ATOM 0 HG13 VAL B 16 13.159 -8.185 9.327 1.00 0.00 H new ATOM 0 HG21 VAL B 16 13.304 -6.774 6.608 1.00 0.00 H new ATOM 0 HG22 VAL B 16 11.808 -7.261 7.440 1.00 0.00 H new ATOM 0 HG23 VAL B 16 12.032 -5.572 6.928 1.00 0.00 H new ATOM 1240 N VAL B 17 13.443 -4.406 11.212 1.00 0.00 N ATOM 1241 CA VAL B 17 14.061 -4.132 12.541 1.00 0.00 C ATOM 1242 C VAL B 17 12.982 -4.027 13.623 1.00 0.00 C ATOM 1243 O VAL B 17 13.114 -4.576 14.698 1.00 0.00 O ATOM 1244 CB VAL B 17 14.780 -2.795 12.374 1.00 0.00 C ATOM 1245 CG1 VAL B 17 15.414 -2.383 13.704 1.00 0.00 C ATOM 1246 CG2 VAL B 17 15.873 -2.936 11.313 1.00 0.00 C ATOM 0 H VAL B 17 13.646 -3.716 10.489 1.00 0.00 H new ATOM 0 HA VAL B 17 14.739 -4.928 12.849 1.00 0.00 H new ATOM 0 HB VAL B 17 14.063 -2.035 12.064 1.00 0.00 H new ATOM 0 HG11 VAL B 17 15.927 -1.429 13.583 1.00 0.00 H new ATOM 0 HG12 VAL B 17 14.637 -2.284 14.462 1.00 0.00 H new ATOM 0 HG13 VAL B 17 16.131 -3.143 14.016 1.00 0.00 H new ATOM 0 HG21 VAL B 17 16.388 -1.983 11.192 1.00 0.00 H new ATOM 0 HG22 VAL B 17 16.588 -3.697 11.626 1.00 0.00 H new ATOM 0 HG23 VAL B 17 15.423 -3.229 10.364 1.00 0.00 H new ATOM 1256 N ALA B 18 11.919 -3.324 13.347 1.00 0.00 N ATOM 1257 CA ALA B 18 10.837 -3.183 14.363 1.00 0.00 C ATOM 1258 C ALA B 18 10.206 -4.546 14.659 1.00 0.00 C ATOM 1259 O ALA B 18 9.872 -4.855 15.786 1.00 0.00 O ATOM 1260 CB ALA B 18 9.813 -2.244 13.727 1.00 0.00 C ATOM 0 H ALA B 18 11.752 -2.842 12.464 1.00 0.00 H new ATOM 0 HA ALA B 18 11.211 -2.795 15.311 1.00 0.00 H new ATOM 0 HB1 ALA B 18 8.983 -2.090 14.416 1.00 0.00 H new ATOM 0 HB2 ALA B 18 10.285 -1.286 13.508 1.00 0.00 H new ATOM 0 HB3 ALA B 18 9.440 -2.685 12.802 1.00 0.00 H new ATOM 1266 N ALA B 19 10.040 -5.365 13.657 1.00 0.00 N ATOM 1267 CA ALA B 19 9.429 -6.706 13.885 1.00 0.00 C ATOM 1268 C ALA B 19 10.338 -7.563 14.773 1.00 0.00 C ATOM 1269 O ALA B 19 9.889 -8.196 15.708 1.00 0.00 O ATOM 1270 CB ALA B 19 9.306 -7.324 12.494 1.00 0.00 C ATOM 0 H ALA B 19 10.300 -5.164 12.691 1.00 0.00 H new ATOM 0 HA ALA B 19 8.466 -6.639 14.391 1.00 0.00 H new ATOM 0 HB1 ALA B 19 8.863 -8.317 12.575 1.00 0.00 H new ATOM 0 HB2 ALA B 19 8.672 -6.693 11.870 1.00 0.00 H new ATOM 0 HB3 ALA B 19 10.295 -7.404 12.042 1.00 0.00 H new ATOM 1276 N VAL B 20 11.612 -7.589 14.487 1.00 0.00 N ATOM 1277 CA VAL B 20 12.546 -8.408 15.314 1.00 0.00 C ATOM 1278 C VAL B 20 12.620 -7.853 16.739 1.00 0.00 C ATOM 1279 O VAL B 20 12.620 -8.592 17.702 1.00 0.00 O ATOM 1280 CB VAL B 20 13.903 -8.285 14.620 1.00 0.00 C ATOM 1281 CG1 VAL B 20 14.980 -8.944 15.485 1.00 0.00 C ATOM 1282 CG2 VAL B 20 13.844 -8.983 13.259 1.00 0.00 C ATOM 0 H VAL B 20 12.046 -7.079 13.718 1.00 0.00 H new ATOM 0 HA VAL B 20 12.222 -9.446 15.395 1.00 0.00 H new ATOM 0 HB VAL B 20 14.145 -7.232 14.479 1.00 0.00 H new ATOM 0 HG11 VAL B 20 15.948 -8.857 14.991 1.00 0.00 H new ATOM 0 HG12 VAL B 20 15.022 -8.448 16.455 1.00 0.00 H new ATOM 0 HG13 VAL B 20 14.739 -9.998 15.627 1.00 0.00 H new ATOM 0 HG21 VAL B 20 14.811 -8.896 12.763 1.00 0.00 H new ATOM 0 HG22 VAL B 20 13.602 -10.036 13.401 1.00 0.00 H new ATOM 0 HG23 VAL B 20 13.077 -8.514 12.643 1.00 0.00 H new ATOM 1292 N ASP B 21 12.685 -6.557 16.880 1.00 0.00 N ATOM 1293 CA ASP B 21 12.758 -5.959 18.244 1.00 0.00 C ATOM 1294 C ASP B 21 11.540 -6.377 19.070 1.00 0.00 C ATOM 1295 O ASP B 21 11.648 -6.694 20.238 1.00 0.00 O ATOM 1296 CB ASP B 21 12.757 -4.448 18.018 1.00 0.00 C ATOM 1297 CG ASP B 21 13.094 -3.737 19.330 1.00 0.00 C ATOM 1298 OD1 ASP B 21 12.429 -4.010 20.317 1.00 0.00 O ATOM 1299 OD2 ASP B 21 14.011 -2.932 19.327 1.00 0.00 O ATOM 0 H ASP B 21 12.691 -5.887 16.111 1.00 0.00 H new ATOM 0 HA ASP B 21 13.642 -6.288 18.790 1.00 0.00 H new ATOM 0 HB2 ASP B 21 13.485 -4.184 17.251 1.00 0.00 H new ATOM 0 HB3 ASP B 21 11.781 -4.124 17.656 1.00 0.00 H new ATOM 1304 N GLN B 22 10.380 -6.380 18.473 1.00 0.00 N ATOM 1305 CA GLN B 22 9.156 -6.777 19.227 1.00 0.00 C ATOM 1306 C GLN B 22 9.296 -8.215 19.733 1.00 0.00 C ATOM 1307 O GLN B 22 9.039 -8.505 20.885 1.00 0.00 O ATOM 1308 CB GLN B 22 8.015 -6.669 18.215 1.00 0.00 C ATOM 1309 CG GLN B 22 6.813 -5.992 18.875 1.00 0.00 C ATOM 1310 CD GLN B 22 6.205 -6.932 19.916 1.00 0.00 C ATOM 1311 OE1 GLN B 22 6.387 -8.132 19.849 1.00 0.00 O ATOM 1312 NE2 GLN B 22 5.484 -6.436 20.883 1.00 0.00 N ATOM 0 H GLN B 22 10.226 -6.125 17.497 1.00 0.00 H new ATOM 0 HA GLN B 22 8.983 -6.148 20.100 1.00 0.00 H new ATOM 0 HB2 GLN B 22 8.338 -6.095 17.346 1.00 0.00 H new ATOM 0 HB3 GLN B 22 7.737 -7.660 17.857 1.00 0.00 H new ATOM 0 HG2 GLN B 22 7.122 -5.060 19.348 1.00 0.00 H new ATOM 0 HG3 GLN B 22 6.068 -5.736 18.122 1.00 0.00 H new ATOM 0 HE21 GLN B 22 5.331 -5.429 20.940 1.00 0.00 H new ATOM 0 HE22 GLN B 22 5.073 -7.055 21.582 1.00 0.00 H new ATOM 1321 N ALA B 23 9.702 -9.116 18.882 1.00 0.00 N ATOM 1322 CA ALA B 23 9.861 -10.534 19.315 1.00 0.00 C ATOM 1323 C ALA B 23 10.971 -10.645 20.366 1.00 0.00 C ATOM 1324 O ALA B 23 10.897 -11.444 21.278 1.00 0.00 O ATOM 1325 CB ALA B 23 10.248 -11.291 18.045 1.00 0.00 C ATOM 0 H ALA B 23 9.931 -8.932 17.905 1.00 0.00 H new ATOM 0 HA ALA B 23 8.954 -10.933 19.769 1.00 0.00 H new ATOM 0 HB1 ALA B 23 10.384 -12.347 18.278 1.00 0.00 H new ATOM 0 HB2 ALA B 23 9.458 -11.183 17.302 1.00 0.00 H new ATOM 0 HB3 ALA B 23 11.178 -10.884 17.648 1.00 0.00 H new ATOM 1331 N ARG B 24 12.001 -9.851 20.243 1.00 0.00 N ATOM 1332 CA ARG B 24 13.115 -9.915 21.234 1.00 0.00 C ATOM 1333 C ARG B 24 12.616 -9.520 22.626 1.00 0.00 C ATOM 1334 O ARG B 24 12.921 -10.167 23.610 1.00 0.00 O ATOM 1335 CB ARG B 24 14.149 -8.906 20.733 1.00 0.00 C ATOM 1336 CG ARG B 24 15.463 -9.101 21.493 1.00 0.00 C ATOM 1337 CD ARG B 24 16.636 -8.693 20.599 1.00 0.00 C ATOM 1338 NE ARG B 24 16.695 -7.209 20.698 1.00 0.00 N ATOM 1339 CZ ARG B 24 17.057 -6.641 21.818 1.00 0.00 C ATOM 1340 NH1 ARG B 24 17.366 -7.372 22.856 1.00 0.00 N ATOM 1341 NH2 ARG B 24 17.110 -5.340 21.900 1.00 0.00 N ATOM 0 H ARG B 24 12.119 -9.162 19.500 1.00 0.00 H new ATOM 0 HA ARG B 24 13.529 -10.920 21.320 1.00 0.00 H new ATOM 0 HB2 ARG B 24 14.312 -9.037 19.663 1.00 0.00 H new ATOM 0 HB3 ARG B 24 13.781 -7.890 20.877 1.00 0.00 H new ATOM 0 HG2 ARG B 24 15.461 -8.502 22.404 1.00 0.00 H new ATOM 0 HG3 ARG B 24 15.569 -10.143 21.797 1.00 0.00 H new ATOM 0 HD2 ARG B 24 17.567 -9.149 20.936 1.00 0.00 H new ATOM 0 HD3 ARG B 24 16.478 -9.014 19.569 1.00 0.00 H new ATOM 0 HE ARG B 24 16.453 -6.635 19.891 1.00 0.00 H new ATOM 0 HH11 ARG B 24 17.325 -8.389 22.794 1.00 0.00 H new ATOM 0 HH12 ARG B 24 17.648 -6.925 23.729 1.00 0.00 H new ATOM 0 HH21 ARG B 24 16.869 -4.768 21.091 1.00 0.00 H new ATOM 0 HH22 ARG B 24 17.392 -4.895 22.773 1.00 0.00 H new ATOM 1355 N VAL B 25 11.856 -8.464 22.721 1.00 0.00 N ATOM 1356 CA VAL B 25 11.343 -8.031 24.053 1.00 0.00 C ATOM 1357 C VAL B 25 10.438 -9.112 24.651 1.00 0.00 C ATOM 1358 O VAL B 25 10.206 -9.156 25.842 1.00 0.00 O ATOM 1359 CB VAL B 25 10.557 -6.744 23.777 1.00 0.00 C ATOM 1360 CG1 VAL B 25 9.155 -7.081 23.260 1.00 0.00 C ATOM 1361 CG2 VAL B 25 10.441 -5.930 25.070 1.00 0.00 C ATOM 0 H VAL B 25 11.568 -7.882 21.935 1.00 0.00 H new ATOM 0 HA VAL B 25 12.144 -7.866 24.773 1.00 0.00 H new ATOM 0 HB VAL B 25 11.084 -6.162 23.021 1.00 0.00 H new ATOM 0 HG11 VAL B 25 8.607 -6.159 23.068 1.00 0.00 H new ATOM 0 HG12 VAL B 25 9.236 -7.654 22.337 1.00 0.00 H new ATOM 0 HG13 VAL B 25 8.623 -7.670 24.007 1.00 0.00 H new ATOM 0 HG21 VAL B 25 9.882 -5.015 24.875 1.00 0.00 H new ATOM 0 HG22 VAL B 25 9.920 -6.519 25.825 1.00 0.00 H new ATOM 0 HG23 VAL B 25 11.438 -5.677 25.431 1.00 0.00 H new ATOM 1371 N ARG B 26 9.922 -9.976 23.825 1.00 0.00 N ATOM 1372 CA ARG B 26 9.023 -11.055 24.332 1.00 0.00 C ATOM 1373 C ARG B 26 9.815 -12.320 24.626 1.00 0.00 C ATOM 1374 O ARG B 26 9.652 -12.959 25.646 1.00 0.00 O ATOM 1375 CB ARG B 26 8.026 -11.303 23.199 1.00 0.00 C ATOM 1376 CG ARG B 26 6.647 -10.782 23.603 1.00 0.00 C ATOM 1377 CD ARG B 26 5.576 -11.790 23.178 1.00 0.00 C ATOM 1378 NE ARG B 26 5.336 -11.506 21.734 1.00 0.00 N ATOM 1379 CZ ARG B 26 4.793 -12.414 20.965 1.00 0.00 C ATOM 1380 NH1 ARG B 26 4.446 -13.572 21.460 1.00 0.00 N ATOM 1381 NH2 ARG B 26 4.596 -12.160 19.699 1.00 0.00 N ATOM 0 H ARG B 26 10.083 -9.984 22.818 1.00 0.00 H new ATOM 0 HA ARG B 26 8.530 -10.771 25.261 1.00 0.00 H new ATOM 0 HB2 ARG B 26 8.362 -10.804 22.290 1.00 0.00 H new ATOM 0 HB3 ARG B 26 7.972 -12.369 22.976 1.00 0.00 H new ATOM 0 HG2 ARG B 26 6.607 -10.626 24.681 1.00 0.00 H new ATOM 0 HG3 ARG B 26 6.459 -9.816 23.134 1.00 0.00 H new ATOM 0 HD2 ARG B 26 5.916 -12.815 23.328 1.00 0.00 H new ATOM 0 HD3 ARG B 26 4.664 -11.668 23.762 1.00 0.00 H new ATOM 0 HE ARG B 26 5.596 -10.600 21.344 1.00 0.00 H new ATOM 0 HH11 ARG B 26 4.598 -13.770 22.449 1.00 0.00 H new ATOM 0 HH12 ARG B 26 4.023 -14.278 20.858 1.00 0.00 H new ATOM 0 HH21 ARG B 26 4.865 -11.255 19.312 1.00 0.00 H new ATOM 0 HH22 ARG B 26 4.173 -12.866 19.097 1.00 0.00 H new ATOM 1395 N GLU B 27 10.661 -12.676 23.726 1.00 0.00 N ATOM 1396 CA GLU B 27 11.487 -13.905 23.903 1.00 0.00 C ATOM 1397 C GLU B 27 12.801 -13.564 24.613 1.00 0.00 C ATOM 1398 O GLU B 27 13.465 -12.609 24.261 1.00 0.00 O ATOM 1399 CB GLU B 27 11.754 -14.403 22.483 1.00 0.00 C ATOM 1400 CG GLU B 27 12.488 -15.744 22.542 1.00 0.00 C ATOM 1401 CD GLU B 27 12.994 -16.110 21.145 1.00 0.00 C ATOM 1402 OE1 GLU B 27 12.233 -15.963 20.204 1.00 0.00 O ATOM 1403 OE2 GLU B 27 14.134 -16.532 21.042 1.00 0.00 O ATOM 0 H GLU B 27 10.827 -12.168 22.857 1.00 0.00 H new ATOM 0 HA GLU B 27 10.987 -14.658 24.513 1.00 0.00 H new ATOM 0 HB2 GLU B 27 10.814 -14.514 21.943 1.00 0.00 H new ATOM 0 HB3 GLU B 27 12.351 -13.673 21.937 1.00 0.00 H new ATOM 0 HG2 GLU B 27 13.324 -15.683 23.239 1.00 0.00 H new ATOM 0 HG3 GLU B 27 11.820 -16.521 22.913 1.00 0.00 H new ATOM 1410 N PRO B 28 13.131 -14.363 25.592 1.00 0.00 N ATOM 1411 CA PRO B 28 14.392 -14.109 26.339 1.00 0.00 C ATOM 1412 C PRO B 28 15.583 -14.700 25.581 1.00 0.00 C ATOM 1413 O PRO B 28 15.665 -15.894 25.371 1.00 0.00 O ATOM 1414 CB PRO B 28 14.204 -14.825 27.680 1.00 0.00 C ATOM 1415 CG PRO B 28 12.788 -15.313 27.694 1.00 0.00 C ATOM 1416 CD PRO B 28 12.328 -15.382 26.268 1.00 0.00 C ATOM 0 HA PRO B 28 14.592 -13.045 26.466 1.00 0.00 H new ATOM 0 HB2 PRO B 28 14.903 -15.655 27.780 1.00 0.00 H new ATOM 0 HB3 PRO B 28 14.391 -14.148 28.513 1.00 0.00 H new ATOM 0 HG2 PRO B 28 12.724 -16.293 28.167 1.00 0.00 H new ATOM 0 HG3 PRO B 28 12.154 -14.639 28.270 1.00 0.00 H new ATOM 0 HD2 PRO B 28 12.495 -16.371 25.841 1.00 0.00 H new ATOM 0 HD3 PRO B 28 11.262 -15.173 26.181 1.00 0.00 H new ATOM 1424 N ARG B 29 16.508 -13.878 25.170 1.00 0.00 N ATOM 1425 CA ARG B 29 17.691 -14.399 24.427 1.00 0.00 C ATOM 1426 C ARG B 29 18.261 -15.631 25.136 1.00 0.00 C ATOM 1427 O ARG B 29 19.363 -16.063 24.862 1.00 0.00 O ATOM 1428 CB ARG B 29 18.702 -13.251 24.435 1.00 0.00 C ATOM 1429 CG ARG B 29 19.350 -13.144 25.819 1.00 0.00 C ATOM 1430 CD ARG B 29 20.201 -11.873 25.888 1.00 0.00 C ATOM 1431 NE ARG B 29 19.236 -10.778 26.188 1.00 0.00 N ATOM 1432 CZ ARG B 29 19.623 -9.531 26.139 1.00 0.00 C ATOM 1433 NH1 ARG B 29 20.850 -9.235 25.804 1.00 0.00 N ATOM 1434 NH2 ARG B 29 18.778 -8.577 26.422 1.00 0.00 N ATOM 0 H ARG B 29 16.497 -12.869 25.316 1.00 0.00 H new ATOM 0 HA ARG B 29 17.440 -14.709 23.413 1.00 0.00 H new ATOM 0 HB2 ARG B 29 19.466 -13.421 23.677 1.00 0.00 H new ATOM 0 HB3 ARG B 29 18.205 -12.314 24.182 1.00 0.00 H new ATOM 0 HG2 ARG B 29 18.581 -13.122 26.591 1.00 0.00 H new ATOM 0 HG3 ARG B 29 19.970 -14.020 26.011 1.00 0.00 H new ATOM 0 HD2 ARG B 29 20.964 -11.950 26.663 1.00 0.00 H new ATOM 0 HD3 ARG B 29 20.720 -11.694 24.947 1.00 0.00 H new ATOM 0 HE ARG B 29 18.271 -11.002 26.432 1.00 0.00 H new ATOM 0 HH11 ARG B 29 21.511 -9.979 25.579 1.00 0.00 H new ATOM 0 HH12 ARG B 29 21.148 -8.260 25.767 1.00 0.00 H new ATOM 0 HH21 ARG B 29 17.818 -8.806 26.681 1.00 0.00 H new ATOM 0 HH22 ARG B 29 19.078 -7.603 26.385 1.00 0.00 H new TER 1448 ARG B 29