USER MOD reduce.3.24.130724 H: found=0, std=0, add=983, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 982 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 96 GLN : amide:sc= -0.933 K(o=-0.99,f=-2.5!) USER MOD Set 1.2: A 100 GLN : amide:sc= -0.0602 X(o=-0.99,f=-0.99) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= -0.0297 X(o=-0.03,f=-0.0093) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= -6.93! USER MOD Single : A 9 CYS SG : rot 180:sc= -1.29 USER MOD Single : A 13 GLN : amide:sc= -0.0697 X(o=-0.07,f=0) USER MOD Single : A 14 ASN : amide:sc= -10.8! C(o=-11!,f=-12!) USER MOD Single : A 17 LYS NZ :NH3+ 143:sc= 1.23 (180deg=0.94) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HD1:sc= -0.51 X(o=-0.51,f=-0.11) USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0.0613 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -9.76! C(o=-9.8!,f=-14!) USER MOD Single : A 44 GLN : amide:sc= -0.0621 X(o=-0.062,f=0) USER MOD Single : A 46 LYS NZ :NH3+ -149:sc= 0 (180deg=-0.885) USER MOD Single : A 54 GLN : amide:sc= -0.197 X(o=-0.2,f=0) USER MOD Single : A 56 THR OG1 : rot 3:sc= 0.912 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0.00608 USER MOD Single : A 61 GLN : amide:sc= -0.0414 X(o=-0.041,f=-0.034) USER MOD Single : A 68 SER OG : rot 180:sc=-0.00641 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= -0.149 X(o=-0.15,f=-0.0027) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 86 SER OG : rot 180:sc=-0.00602 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0.0304 USER MOD Single : A 90 ASN : amide:sc= -0.114 X(o=-0.11,f=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.11 USER MOD Single : A 93 THR OG1 : rot 180:sc= -2.81! USER MOD Single : A 98 LYS NZ :NH3+ 170:sc= 0.0724 (180deg=0.0559) USER MOD Single : A 102 THR OG1 : rot -85:sc= 1.06 USER MOD Single : A 107 THR OG1 : rot 180:sc= -0.0114 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= -0.147 K(o=-0.15,f=-1.7!) USER MOD Single : A 111 SER OG : rot 180:sc= 0.255 USER MOD Single : A 113 THR OG1 : rot 91:sc= 0.0816 USER MOD Single : A 114 LYS NZ :NH3+ -151:sc= -0.348 (180deg=-1.23) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 22.269 12.061 21.624 1.00 0.00 N ATOM 2 CA GLY A 1 22.631 11.008 22.614 1.00 0.00 C ATOM 3 C GLY A 1 22.440 9.607 22.067 1.00 0.00 C ATOM 4 O GLY A 1 23.069 9.228 21.080 1.00 0.00 O ATOM 0 H1 GLY A 1 22.417 13.000 22.046 1.00 0.00 H new ATOM 0 H2 GLY A 1 22.867 11.963 20.779 1.00 0.00 H new ATOM 0 H3 GLY A 1 21.270 11.956 21.355 1.00 0.00 H new ATOM 0 HA2 GLY A 1 23.670 11.139 22.915 1.00 0.00 H new ATOM 0 HA3 GLY A 1 22.022 11.131 23.510 1.00 0.00 H new ATOM 10 N SER A 2 21.568 8.837 22.710 1.00 0.00 N ATOM 11 CA SER A 2 21.296 7.471 22.282 1.00 0.00 C ATOM 12 C SER A 2 20.210 7.441 21.211 1.00 0.00 C ATOM 13 O SER A 2 19.115 7.969 21.408 1.00 0.00 O ATOM 14 CB SER A 2 20.873 6.614 23.477 1.00 0.00 C ATOM 15 OG SER A 2 21.883 6.592 24.471 1.00 0.00 O ATOM 0 H SER A 2 21.038 9.136 23.529 1.00 0.00 H new ATOM 0 HA SER A 2 22.212 7.062 21.856 1.00 0.00 H new ATOM 0 HB2 SER A 2 19.949 7.007 23.901 1.00 0.00 H new ATOM 0 HB3 SER A 2 20.664 5.597 23.144 1.00 0.00 H new ATOM 0 HG SER A 2 21.588 6.039 25.225 1.00 0.00 H new ATOM 21 N HIS A 3 20.520 6.819 20.079 1.00 0.00 N ATOM 22 CA HIS A 3 19.570 6.719 18.976 1.00 0.00 C ATOM 23 C HIS A 3 18.879 5.359 18.972 1.00 0.00 C ATOM 24 O HIS A 3 17.757 5.224 18.484 1.00 0.00 O ATOM 25 CB HIS A 3 20.280 6.947 17.641 1.00 0.00 C ATOM 26 CG HIS A 3 19.369 7.422 16.552 1.00 0.00 C ATOM 27 ND1 HIS A 3 19.256 6.785 15.334 1.00 0.00 N ATOM 28 CD2 HIS A 3 18.521 8.477 16.503 1.00 0.00 C ATOM 29 CE1 HIS A 3 18.380 7.429 14.583 1.00 0.00 C ATOM 30 NE2 HIS A 3 17.920 8.458 15.268 1.00 0.00 N ATOM 0 H HIS A 3 21.421 6.376 19.901 1.00 0.00 H new ATOM 0 HA HIS A 3 18.812 7.490 19.113 1.00 0.00 H new ATOM 0 HB2 HIS A 3 21.076 7.678 17.782 1.00 0.00 H new ATOM 0 HB3 HIS A 3 20.754 6.017 17.327 1.00 0.00 H new ATOM 0 HD2 HIS A 3 18.349 9.198 17.288 1.00 0.00 H new ATOM 0 HE1 HIS A 3 18.090 7.159 13.578 1.00 0.00 H new ATOM 0 HE2 HIS A 3 17.230 9.131 14.935 1.00 0.00 H new ATOM 39 N MET A 4 19.556 4.353 19.519 1.00 0.00 N ATOM 40 CA MET A 4 19.005 3.003 19.578 1.00 0.00 C ATOM 41 C MET A 4 18.832 2.425 18.176 1.00 0.00 C ATOM 42 O MET A 4 18.026 2.917 17.387 1.00 0.00 O ATOM 43 CB MET A 4 17.663 3.005 20.311 1.00 0.00 C ATOM 44 CG MET A 4 17.681 3.787 21.615 1.00 0.00 C ATOM 45 SD MET A 4 18.271 2.804 23.006 1.00 0.00 S ATOM 46 CE MET A 4 16.819 2.795 24.055 1.00 0.00 C ATOM 0 H MET A 4 20.486 4.447 19.927 1.00 0.00 H new ATOM 0 HA MET A 4 19.707 2.376 20.127 1.00 0.00 H new ATOM 0 HB2 MET A 4 16.901 3.427 19.655 1.00 0.00 H new ATOM 0 HB3 MET A 4 17.371 1.976 20.519 1.00 0.00 H new ATOM 0 HG2 MET A 4 18.317 4.664 21.499 1.00 0.00 H new ATOM 0 HG3 MET A 4 16.676 4.149 21.831 1.00 0.00 H new ATOM 0 HE1 MET A 4 17.027 2.224 24.960 1.00 0.00 H new ATOM 0 HE2 MET A 4 16.558 3.819 24.324 1.00 0.00 H new ATOM 0 HE3 MET A 4 15.987 2.337 23.520 1.00 0.00 H new ATOM 56 N ASP A 5 19.594 1.379 17.875 1.00 0.00 N ATOM 57 CA ASP A 5 19.524 0.734 16.568 1.00 0.00 C ATOM 58 C ASP A 5 18.120 0.204 16.297 1.00 0.00 C ATOM 59 O ASP A 5 17.796 -0.932 16.642 1.00 0.00 O ATOM 60 CB ASP A 5 20.537 -0.410 16.486 1.00 0.00 C ATOM 61 CG ASP A 5 21.176 -0.519 15.116 1.00 0.00 C ATOM 62 OD1 ASP A 5 21.926 0.404 14.736 1.00 0.00 O ATOM 63 OD2 ASP A 5 20.929 -1.528 14.424 1.00 0.00 O ATOM 0 H ASP A 5 20.267 0.960 18.517 1.00 0.00 H new ATOM 0 HA ASP A 5 19.764 1.479 15.810 1.00 0.00 H new ATOM 0 HB2 ASP A 5 21.314 -0.258 17.235 1.00 0.00 H new ATOM 0 HB3 ASP A 5 20.040 -1.350 16.728 1.00 0.00 H new ATOM 68 N LYS A 6 17.289 1.036 15.676 1.00 0.00 N ATOM 69 CA LYS A 6 15.919 0.650 15.360 1.00 0.00 C ATOM 70 C LYS A 6 15.544 1.081 13.944 1.00 0.00 C ATOM 71 O LYS A 6 14.380 1.357 13.656 1.00 0.00 O ATOM 72 CB LYS A 6 14.947 1.266 16.370 1.00 0.00 C ATOM 73 CG LYS A 6 14.470 0.285 17.429 1.00 0.00 C ATOM 74 CD LYS A 6 13.378 -0.626 16.892 1.00 0.00 C ATOM 75 CE LYS A 6 12.809 -1.517 17.984 1.00 0.00 C ATOM 76 NZ LYS A 6 13.613 -2.759 18.160 1.00 0.00 N ATOM 0 H LYS A 6 17.540 1.980 15.382 1.00 0.00 H new ATOM 0 HA LYS A 6 15.851 -0.436 15.418 1.00 0.00 H new ATOM 0 HB2 LYS A 6 15.432 2.110 16.860 1.00 0.00 H new ATOM 0 HB3 LYS A 6 14.083 1.661 15.836 1.00 0.00 H new ATOM 0 HG2 LYS A 6 15.311 -0.317 17.774 1.00 0.00 H new ATOM 0 HG3 LYS A 6 14.095 0.834 18.293 1.00 0.00 H new ATOM 0 HD2 LYS A 6 12.579 -0.023 16.460 1.00 0.00 H new ATOM 0 HD3 LYS A 6 13.780 -1.244 16.089 1.00 0.00 H new ATOM 0 HE2 LYS A 6 12.780 -0.966 18.924 1.00 0.00 H new ATOM 0 HE3 LYS A 6 11.781 -1.782 17.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 13.193 -3.340 18.913 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 13.620 -3.297 17.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 14.588 -2.507 18.420 1.00 0.00 H new ATOM 90 N THR A 7 16.537 1.133 13.063 1.00 0.00 N ATOM 91 CA THR A 7 16.308 1.527 11.677 1.00 0.00 C ATOM 92 C THR A 7 16.337 0.309 10.762 1.00 0.00 C ATOM 93 O THR A 7 17.262 -0.501 10.819 1.00 0.00 O ATOM 94 CB THR A 7 17.375 2.523 11.247 1.00 0.00 C ATOM 95 OG1 THR A 7 17.189 2.914 9.902 1.00 0.00 O ATOM 96 CG2 THR A 7 18.776 1.973 11.380 1.00 0.00 C ATOM 0 H THR A 7 17.507 0.908 13.283 1.00 0.00 H new ATOM 0 HA THR A 7 15.325 1.992 11.602 1.00 0.00 H new ATOM 0 HB THR A 7 17.266 3.377 11.916 1.00 0.00 H new ATOM 0 HG1 THR A 7 17.885 3.555 9.649 1.00 0.00 H new ATOM 0 HG21 THR A 7 19.495 2.727 11.059 1.00 0.00 H new ATOM 0 HG22 THR A 7 18.966 1.710 12.420 1.00 0.00 H new ATOM 0 HG23 THR A 7 18.879 1.085 10.756 1.00 0.00 H new ATOM 104 N PHE A 8 15.318 0.182 9.924 1.00 0.00 N ATOM 105 CA PHE A 8 15.229 -0.947 9.001 1.00 0.00 C ATOM 106 C PHE A 8 14.560 -0.569 7.685 1.00 0.00 C ATOM 107 O PHE A 8 13.650 0.260 7.653 1.00 0.00 O ATOM 108 CB PHE A 8 14.459 -2.101 9.642 1.00 0.00 C ATOM 109 CG PHE A 8 13.604 -1.681 10.798 1.00 0.00 C ATOM 110 CD1 PHE A 8 14.157 -1.523 12.058 1.00 0.00 C ATOM 111 CD2 PHE A 8 12.249 -1.452 10.625 1.00 0.00 C ATOM 112 CE1 PHE A 8 13.373 -1.141 13.129 1.00 0.00 C ATOM 113 CE2 PHE A 8 11.459 -1.073 11.696 1.00 0.00 C ATOM 114 CZ PHE A 8 12.023 -0.917 12.949 1.00 0.00 C ATOM 0 H PHE A 8 14.543 0.842 9.862 1.00 0.00 H new ATOM 0 HA PHE A 8 16.252 -1.255 8.783 1.00 0.00 H new ATOM 0 HB2 PHE A 8 13.829 -2.571 8.887 1.00 0.00 H new ATOM 0 HB3 PHE A 8 15.168 -2.856 9.981 1.00 0.00 H new ATOM 0 HD1 PHE A 8 15.212 -1.700 12.205 1.00 0.00 H new ATOM 0 HD2 PHE A 8 11.806 -1.570 9.647 1.00 0.00 H new ATOM 0 HE1 PHE A 8 13.816 -1.018 14.106 1.00 0.00 H new ATOM 0 HE2 PHE A 8 10.403 -0.899 11.553 1.00 0.00 H new ATOM 0 HZ PHE A 8 11.408 -0.620 13.786 1.00 0.00 H new ATOM 124 N CYS A 9 14.984 -1.221 6.611 1.00 0.00 N ATOM 125 CA CYS A 9 14.399 -0.995 5.297 1.00 0.00 C ATOM 126 C CYS A 9 13.333 -2.061 5.036 1.00 0.00 C ATOM 127 O CYS A 9 13.646 -3.249 4.961 1.00 0.00 O ATOM 128 CB CYS A 9 15.478 -1.050 4.210 1.00 0.00 C ATOM 129 SG CYS A 9 17.042 -0.270 4.673 1.00 0.00 S ATOM 0 H CYS A 9 15.733 -1.913 6.625 1.00 0.00 H new ATOM 0 HA CYS A 9 13.943 -0.005 5.272 1.00 0.00 H new ATOM 0 HB2 CYS A 9 15.667 -2.093 3.955 1.00 0.00 H new ATOM 0 HB3 CYS A 9 15.096 -0.566 3.311 1.00 0.00 H new ATOM 0 HG CYS A 9 17.886 -0.372 3.689 1.00 0.00 H new ATOM 135 N VAL A 10 12.075 -1.643 4.925 1.00 0.00 N ATOM 136 CA VAL A 10 10.979 -2.588 4.703 1.00 0.00 C ATOM 137 C VAL A 10 10.399 -2.454 3.302 1.00 0.00 C ATOM 138 O VAL A 10 10.426 -1.382 2.710 1.00 0.00 O ATOM 139 CB VAL A 10 9.848 -2.388 5.740 1.00 0.00 C ATOM 140 CG1 VAL A 10 8.632 -1.705 5.121 1.00 0.00 C ATOM 141 CG2 VAL A 10 9.454 -3.714 6.362 1.00 0.00 C ATOM 0 H VAL A 10 11.788 -0.666 4.984 1.00 0.00 H new ATOM 0 HA VAL A 10 11.400 -3.587 4.817 1.00 0.00 H new ATOM 0 HB VAL A 10 10.231 -1.734 6.523 1.00 0.00 H new ATOM 0 HG11 VAL A 10 7.859 -1.582 5.879 1.00 0.00 H new ATOM 0 HG12 VAL A 10 8.921 -0.727 4.735 1.00 0.00 H new ATOM 0 HG13 VAL A 10 8.246 -2.317 4.306 1.00 0.00 H new ATOM 0 HG21 VAL A 10 8.658 -3.553 7.088 1.00 0.00 H new ATOM 0 HG22 VAL A 10 9.103 -4.391 5.583 1.00 0.00 H new ATOM 0 HG23 VAL A 10 10.318 -4.152 6.862 1.00 0.00 H new ATOM 151 N VAL A 11 9.866 -3.549 2.784 1.00 0.00 N ATOM 152 CA VAL A 11 9.277 -3.543 1.458 1.00 0.00 C ATOM 153 C VAL A 11 7.963 -4.319 1.425 1.00 0.00 C ATOM 154 O VAL A 11 7.876 -5.442 1.924 1.00 0.00 O ATOM 155 CB VAL A 11 10.255 -4.128 0.429 1.00 0.00 C ATOM 156 CG1 VAL A 11 10.630 -5.554 0.797 1.00 0.00 C ATOM 157 CG2 VAL A 11 9.674 -4.056 -0.978 1.00 0.00 C ATOM 0 H VAL A 11 9.830 -4.450 3.261 1.00 0.00 H new ATOM 0 HA VAL A 11 9.066 -2.505 1.200 1.00 0.00 H new ATOM 0 HB VAL A 11 11.164 -3.527 0.442 1.00 0.00 H new ATOM 0 HG11 VAL A 11 11.324 -5.951 0.056 1.00 0.00 H new ATOM 0 HG12 VAL A 11 11.103 -5.564 1.779 1.00 0.00 H new ATOM 0 HG13 VAL A 11 9.732 -6.172 0.821 1.00 0.00 H new ATOM 0 HG21 VAL A 11 10.386 -4.477 -1.688 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.744 -4.624 -1.017 1.00 0.00 H new ATOM 0 HG23 VAL A 11 9.475 -3.016 -1.237 1.00 0.00 H new ATOM 167 N VAL A 12 6.942 -3.703 0.839 1.00 0.00 N ATOM 168 CA VAL A 12 5.623 -4.318 0.737 1.00 0.00 C ATOM 169 C VAL A 12 5.462 -5.067 -0.581 1.00 0.00 C ATOM 170 O VAL A 12 5.279 -4.457 -1.632 1.00 0.00 O ATOM 171 CB VAL A 12 4.509 -3.260 0.843 1.00 0.00 C ATOM 172 CG1 VAL A 12 4.512 -2.615 2.220 1.00 0.00 C ATOM 173 CG2 VAL A 12 4.665 -2.206 -0.246 1.00 0.00 C ATOM 0 H VAL A 12 7.003 -2.773 0.425 1.00 0.00 H new ATOM 0 HA VAL A 12 5.537 -5.022 1.565 1.00 0.00 H new ATOM 0 HB VAL A 12 3.549 -3.757 0.702 1.00 0.00 H new ATOM 0 HG11 VAL A 12 3.718 -1.870 2.275 1.00 0.00 H new ATOM 0 HG12 VAL A 12 4.346 -3.379 2.980 1.00 0.00 H new ATOM 0 HG13 VAL A 12 5.474 -2.133 2.394 1.00 0.00 H new ATOM 0 HG21 VAL A 12 3.869 -1.467 -0.154 1.00 0.00 H new ATOM 0 HG22 VAL A 12 5.631 -1.713 -0.139 1.00 0.00 H new ATOM 0 HG23 VAL A 12 4.607 -2.683 -1.225 1.00 0.00 H new ATOM 183 N GLN A 13 5.526 -6.391 -0.517 1.00 0.00 N ATOM 184 CA GLN A 13 5.378 -7.214 -1.710 1.00 0.00 C ATOM 185 C GLN A 13 3.907 -7.505 -1.985 1.00 0.00 C ATOM 186 O GLN A 13 3.278 -8.296 -1.282 1.00 0.00 O ATOM 187 CB GLN A 13 6.156 -8.523 -1.554 1.00 0.00 C ATOM 188 CG GLN A 13 7.384 -8.608 -2.446 1.00 0.00 C ATOM 189 CD GLN A 13 8.177 -9.881 -2.226 1.00 0.00 C ATOM 190 OE1 GLN A 13 8.406 -10.652 -3.158 1.00 0.00 O ATOM 191 NE2 GLN A 13 8.601 -10.107 -0.988 1.00 0.00 N ATOM 0 H GLN A 13 5.679 -6.916 0.344 1.00 0.00 H new ATOM 0 HA GLN A 13 5.785 -6.663 -2.558 1.00 0.00 H new ATOM 0 HB2 GLN A 13 6.464 -8.632 -0.514 1.00 0.00 H new ATOM 0 HB3 GLN A 13 5.494 -9.359 -1.780 1.00 0.00 H new ATOM 0 HG2 GLN A 13 7.075 -8.553 -3.490 1.00 0.00 H new ATOM 0 HG3 GLN A 13 8.026 -7.747 -2.258 1.00 0.00 H new ATOM 0 HE21 GLN A 13 8.388 -9.440 -0.246 1.00 0.00 H new ATOM 0 HE22 GLN A 13 9.140 -10.947 -0.779 1.00 0.00 H new ATOM 200 N ASN A 14 3.361 -6.856 -3.010 1.00 0.00 N ATOM 201 CA ASN A 14 1.962 -7.043 -3.373 1.00 0.00 C ATOM 202 C ASN A 14 1.829 -7.835 -4.668 1.00 0.00 C ATOM 203 O ASN A 14 2.191 -7.356 -5.743 1.00 0.00 O ATOM 204 CB ASN A 14 1.262 -5.691 -3.523 1.00 0.00 C ATOM 205 CG ASN A 14 -0.170 -5.726 -3.034 1.00 0.00 C ATOM 206 OD1 ASN A 14 -0.448 -6.164 -1.919 1.00 0.00 O ATOM 207 ND2 ASN A 14 -1.091 -5.266 -3.874 1.00 0.00 N ATOM 0 H ASN A 14 3.866 -6.197 -3.602 1.00 0.00 H new ATOM 0 HA ASN A 14 1.486 -7.608 -2.571 1.00 0.00 H new ATOM 0 HB2 ASN A 14 1.815 -4.935 -2.966 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.278 -5.391 -4.571 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -2.074 -5.267 -3.603 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -0.815 -4.912 -4.790 1.00 0.00 H new ATOM 214 N ARG A 15 1.295 -9.045 -4.557 1.00 0.00 N ATOM 215 CA ARG A 15 1.095 -9.904 -5.718 1.00 0.00 C ATOM 216 C ARG A 15 -0.382 -9.944 -6.094 1.00 0.00 C ATOM 217 O ARG A 15 -0.935 -11.006 -6.382 1.00 0.00 O ATOM 218 CB ARG A 15 1.603 -11.318 -5.427 1.00 0.00 C ATOM 219 CG ARG A 15 0.932 -11.971 -4.229 1.00 0.00 C ATOM 220 CD ARG A 15 1.728 -11.745 -2.954 1.00 0.00 C ATOM 221 NE ARG A 15 0.868 -11.698 -1.773 1.00 0.00 N ATOM 222 CZ ARG A 15 1.317 -11.811 -0.525 1.00 0.00 C ATOM 223 NH1 ARG A 15 2.612 -11.977 -0.290 1.00 0.00 N ATOM 224 NH2 ARG A 15 0.466 -11.757 0.491 1.00 0.00 N ATOM 0 H ARG A 15 0.992 -9.454 -3.673 1.00 0.00 H new ATOM 0 HA ARG A 15 1.661 -9.495 -6.555 1.00 0.00 H new ATOM 0 HB2 ARG A 15 1.443 -11.941 -6.307 1.00 0.00 H new ATOM 0 HB3 ARG A 15 2.679 -11.280 -5.255 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -0.073 -11.567 -4.108 1.00 0.00 H new ATOM 0 HG3 ARG A 15 0.826 -13.041 -4.408 1.00 0.00 H new ATOM 0 HD2 ARG A 15 2.461 -12.544 -2.838 1.00 0.00 H new ATOM 0 HD3 ARG A 15 2.285 -10.811 -3.035 1.00 0.00 H new ATOM 0 HE ARG A 15 -0.134 -11.571 -1.913 1.00 0.00 H new ATOM 0 HH11 ARG A 15 3.270 -12.019 -1.068 1.00 0.00 H new ATOM 0 HH12 ARG A 15 2.949 -12.063 0.669 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -0.531 -11.629 0.315 1.00 0.00 H new ATOM 0 HH22 ARG A 15 0.808 -11.843 1.448 1.00 0.00 H new ATOM 238 N ILE A 16 -1.015 -8.776 -6.075 1.00 0.00 N ATOM 239 CA ILE A 16 -2.431 -8.665 -6.398 1.00 0.00 C ATOM 240 C ILE A 16 -2.641 -8.034 -7.775 1.00 0.00 C ATOM 241 O ILE A 16 -3.205 -8.660 -8.671 1.00 0.00 O ATOM 242 CB ILE A 16 -3.179 -7.844 -5.322 1.00 0.00 C ATOM 243 CG1 ILE A 16 -3.091 -8.547 -3.966 1.00 0.00 C ATOM 244 CG2 ILE A 16 -4.635 -7.626 -5.711 1.00 0.00 C ATOM 245 CD1 ILE A 16 -1.718 -8.474 -3.334 1.00 0.00 C ATOM 0 H ILE A 16 -0.567 -7.891 -5.838 1.00 0.00 H new ATOM 0 HA ILE A 16 -2.840 -9.675 -6.418 1.00 0.00 H new ATOM 0 HB ILE A 16 -2.701 -6.867 -5.247 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -3.818 -8.102 -3.287 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -3.370 -9.593 -4.090 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -5.136 -7.046 -4.936 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -4.682 -7.085 -6.656 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -5.131 -8.591 -5.820 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -1.730 -8.993 -2.376 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -0.989 -8.946 -3.993 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -1.444 -7.431 -3.178 1.00 0.00 H new ATOM 257 N LYS A 17 -2.187 -6.792 -7.942 1.00 0.00 N ATOM 258 CA LYS A 17 -2.338 -6.096 -9.217 1.00 0.00 C ATOM 259 C LYS A 17 -1.662 -4.725 -9.179 1.00 0.00 C ATOM 260 O LYS A 17 -0.940 -4.405 -8.235 1.00 0.00 O ATOM 261 CB LYS A 17 -3.823 -5.944 -9.558 1.00 0.00 C ATOM 262 CG LYS A 17 -4.645 -5.330 -8.437 1.00 0.00 C ATOM 263 CD LYS A 17 -6.098 -5.148 -8.846 1.00 0.00 C ATOM 264 CE LYS A 17 -6.246 -4.102 -9.939 1.00 0.00 C ATOM 265 NZ LYS A 17 -6.909 -2.866 -9.438 1.00 0.00 N ATOM 0 H LYS A 17 -1.716 -6.252 -7.216 1.00 0.00 H new ATOM 0 HA LYS A 17 -1.852 -6.691 -9.990 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -3.921 -5.325 -10.450 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -4.233 -6.924 -9.803 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -4.592 -5.967 -7.554 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -4.220 -4.365 -8.160 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -6.500 -6.099 -9.195 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -6.687 -4.853 -7.977 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -5.263 -3.851 -10.337 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -6.827 -4.517 -10.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -6.479 -2.034 -9.890 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -7.923 -2.899 -9.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -6.788 -2.801 -8.407 1.00 0.00 H new ATOM 279 N GLU A 18 -1.895 -3.919 -10.216 1.00 0.00 N ATOM 280 CA GLU A 18 -1.303 -2.587 -10.301 1.00 0.00 C ATOM 281 C GLU A 18 -2.129 -1.553 -9.537 1.00 0.00 C ATOM 282 O GLU A 18 -1.709 -0.406 -9.384 1.00 0.00 O ATOM 283 CB GLU A 18 -1.172 -2.158 -11.765 1.00 0.00 C ATOM 284 CG GLU A 18 -0.155 -2.970 -12.551 1.00 0.00 C ATOM 285 CD GLU A 18 1.163 -2.241 -12.727 1.00 0.00 C ATOM 286 OE1 GLU A 18 1.144 -0.996 -12.822 1.00 0.00 O ATOM 287 OE2 GLU A 18 2.213 -2.915 -12.770 1.00 0.00 O ATOM 0 H GLU A 18 -2.489 -4.167 -11.007 1.00 0.00 H new ATOM 0 HA GLU A 18 -0.315 -2.638 -9.844 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -2.145 -2.245 -12.248 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -0.891 -1.106 -11.802 1.00 0.00 H new ATOM 0 HG2 GLU A 18 0.023 -3.916 -12.039 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -0.567 -3.210 -13.531 1.00 0.00 H new ATOM 294 N GLY A 19 -3.305 -1.955 -9.062 1.00 0.00 N ATOM 295 CA GLY A 19 -4.157 -1.038 -8.330 1.00 0.00 C ATOM 296 C GLY A 19 -4.763 -1.663 -7.087 1.00 0.00 C ATOM 297 O GLY A 19 -5.921 -2.080 -7.096 1.00 0.00 O ATOM 0 H GLY A 19 -3.681 -2.897 -9.171 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -3.577 -0.160 -8.044 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -4.957 -0.692 -8.984 1.00 0.00 H new ATOM 301 N TYR A 20 -3.981 -1.721 -6.014 1.00 0.00 N ATOM 302 CA TYR A 20 -4.451 -2.291 -4.756 1.00 0.00 C ATOM 303 C TYR A 20 -4.160 -1.357 -3.590 1.00 0.00 C ATOM 304 O TYR A 20 -4.076 -1.790 -2.441 1.00 0.00 O ATOM 305 CB TYR A 20 -3.807 -3.656 -4.505 1.00 0.00 C ATOM 306 CG TYR A 20 -4.680 -4.593 -3.701 1.00 0.00 C ATOM 307 CD1 TYR A 20 -5.947 -4.947 -4.150 1.00 0.00 C ATOM 308 CD2 TYR A 20 -4.240 -5.122 -2.494 1.00 0.00 C ATOM 309 CE1 TYR A 20 -6.748 -5.803 -3.417 1.00 0.00 C ATOM 310 CE2 TYR A 20 -5.036 -5.978 -1.757 1.00 0.00 C ATOM 311 CZ TYR A 20 -6.288 -6.315 -2.223 1.00 0.00 C ATOM 312 OH TYR A 20 -7.085 -7.167 -1.492 1.00 0.00 O ATOM 0 H TYR A 20 -3.020 -1.381 -5.990 1.00 0.00 H new ATOM 0 HA TYR A 20 -5.530 -2.421 -4.834 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -3.573 -4.121 -5.463 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -2.862 -3.513 -3.981 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -6.311 -4.548 -5.085 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -3.259 -4.860 -2.126 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -7.730 -6.069 -3.779 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -4.679 -6.381 -0.821 1.00 0.00 H new ATOM 0 HH TYR A 20 -6.613 -7.439 -0.677 1.00 0.00 H new ATOM 322 N ARG A 21 -4.021 -0.070 -3.890 1.00 0.00 N ATOM 323 CA ARG A 21 -3.757 0.925 -2.860 1.00 0.00 C ATOM 324 C ARG A 21 -2.455 0.636 -2.126 1.00 0.00 C ATOM 325 O ARG A 21 -1.847 -0.421 -2.299 1.00 0.00 O ATOM 326 CB ARG A 21 -4.906 0.946 -1.853 1.00 0.00 C ATOM 327 CG ARG A 21 -6.261 1.243 -2.467 1.00 0.00 C ATOM 328 CD ARG A 21 -6.199 2.403 -3.449 1.00 0.00 C ATOM 329 NE ARG A 21 -7.511 2.716 -4.010 1.00 0.00 N ATOM 330 CZ ARG A 21 -8.501 3.274 -3.316 1.00 0.00 C ATOM 331 NH1 ARG A 21 -8.329 3.589 -2.037 1.00 0.00 N ATOM 332 NH2 ARG A 21 -9.665 3.522 -3.901 1.00 0.00 N ATOM 0 H ARG A 21 -4.087 0.307 -4.836 1.00 0.00 H new ATOM 0 HA ARG A 21 -3.669 1.895 -3.350 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -4.951 -0.019 -1.349 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -4.693 1.694 -1.090 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -6.630 0.354 -2.979 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -6.974 1.475 -1.676 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -5.801 3.284 -2.945 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -5.509 2.158 -4.256 1.00 0.00 H new ATOM 0 HE ARG A 21 -7.679 2.494 -4.991 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -7.435 3.404 -1.582 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -9.091 4.016 -1.510 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -9.803 3.285 -4.884 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -10.423 3.949 -3.368 1.00 0.00 H new ATOM 346 N ARG A 22 -2.048 1.583 -1.291 1.00 0.00 N ATOM 347 CA ARG A 22 -0.837 1.446 -0.500 1.00 0.00 C ATOM 348 C ARG A 22 -0.638 2.676 0.380 1.00 0.00 C ATOM 349 O ARG A 22 -1.046 2.691 1.540 1.00 0.00 O ATOM 350 CB ARG A 22 0.384 1.220 -1.398 1.00 0.00 C ATOM 351 CG ARG A 22 1.694 1.104 -0.631 1.00 0.00 C ATOM 352 CD ARG A 22 2.864 1.656 -1.432 1.00 0.00 C ATOM 353 NE ARG A 22 3.465 2.824 -0.792 1.00 0.00 N ATOM 354 CZ ARG A 22 4.366 2.755 0.187 1.00 0.00 C ATOM 355 NH1 ARG A 22 4.768 1.576 0.647 1.00 0.00 N ATOM 356 NH2 ARG A 22 4.863 3.867 0.710 1.00 0.00 N ATOM 0 H ARG A 22 -2.546 2.461 -1.145 1.00 0.00 H new ATOM 0 HA ARG A 22 -0.946 0.572 0.142 1.00 0.00 H new ATOM 0 HB2 ARG A 22 0.232 0.311 -1.980 1.00 0.00 H new ATOM 0 HB3 ARG A 22 0.460 2.044 -2.107 1.00 0.00 H new ATOM 0 HG2 ARG A 22 1.612 1.643 0.313 1.00 0.00 H new ATOM 0 HG3 ARG A 22 1.881 0.059 -0.386 1.00 0.00 H new ATOM 0 HD2 ARG A 22 3.620 0.880 -1.551 1.00 0.00 H new ATOM 0 HD3 ARG A 22 2.523 1.926 -2.432 1.00 0.00 H new ATOM 0 HE ARG A 22 3.177 3.748 -1.114 1.00 0.00 H new ATOM 0 HH11 ARG A 22 4.387 0.717 0.251 1.00 0.00 H new ATOM 0 HH12 ARG A 22 5.458 1.529 1.397 1.00 0.00 H new ATOM 0 HH21 ARG A 22 4.556 4.776 0.363 1.00 0.00 H new ATOM 0 HH22 ARG A 22 5.553 3.814 1.460 1.00 0.00 H new ATOM 370 N ALA A 23 -0.032 3.714 -0.184 1.00 0.00 N ATOM 371 CA ALA A 23 0.191 4.952 0.547 1.00 0.00 C ATOM 372 C ALA A 23 -0.841 5.997 0.135 1.00 0.00 C ATOM 373 O ALA A 23 -0.672 7.189 0.392 1.00 0.00 O ATOM 374 CB ALA A 23 1.600 5.469 0.302 1.00 0.00 C ATOM 0 H ALA A 23 0.313 3.722 -1.144 1.00 0.00 H new ATOM 0 HA ALA A 23 0.081 4.753 1.613 1.00 0.00 H new ATOM 0 HB1 ALA A 23 1.749 6.396 0.856 1.00 0.00 H new ATOM 0 HB2 ALA A 23 2.324 4.726 0.636 1.00 0.00 H new ATOM 0 HB3 ALA A 23 1.739 5.657 -0.763 1.00 0.00 H new ATOM 380 N GLY A 24 -1.909 5.538 -0.515 1.00 0.00 N ATOM 381 CA GLY A 24 -2.950 6.437 -0.966 1.00 0.00 C ATOM 382 C GLY A 24 -2.668 6.976 -2.352 1.00 0.00 C ATOM 383 O GLY A 24 -2.936 8.142 -2.638 1.00 0.00 O ATOM 0 H GLY A 24 -2.069 4.555 -0.736 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -3.906 5.914 -0.967 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -3.042 7.267 -0.265 1.00 0.00 H new ATOM 387 N PHE A 25 -2.114 6.126 -3.214 1.00 0.00 N ATOM 388 CA PHE A 25 -1.786 6.539 -4.575 1.00 0.00 C ATOM 389 C PHE A 25 -1.736 5.354 -5.537 1.00 0.00 C ATOM 390 O PHE A 25 -0.917 5.328 -6.455 1.00 0.00 O ATOM 391 CB PHE A 25 -0.447 7.282 -4.587 1.00 0.00 C ATOM 392 CG PHE A 25 0.756 6.383 -4.476 1.00 0.00 C ATOM 393 CD1 PHE A 25 0.822 5.397 -3.502 1.00 0.00 C ATOM 394 CD2 PHE A 25 1.822 6.528 -5.350 1.00 0.00 C ATOM 395 CE1 PHE A 25 1.928 4.575 -3.405 1.00 0.00 C ATOM 396 CE2 PHE A 25 2.931 5.708 -5.256 1.00 0.00 C ATOM 397 CZ PHE A 25 2.984 4.730 -4.282 1.00 0.00 C ATOM 0 H PHE A 25 -1.885 5.156 -2.997 1.00 0.00 H new ATOM 0 HA PHE A 25 -2.578 7.205 -4.917 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -0.372 7.859 -5.509 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -0.432 7.995 -3.763 1.00 0.00 H new ATOM 0 HD1 PHE A 25 0.000 5.271 -2.813 1.00 0.00 H new ATOM 0 HD2 PHE A 25 1.786 7.291 -6.114 1.00 0.00 H new ATOM 0 HE1 PHE A 25 1.967 3.811 -2.643 1.00 0.00 H new ATOM 0 HE2 PHE A 25 3.755 5.832 -5.943 1.00 0.00 H new ATOM 0 HZ PHE A 25 3.849 4.088 -4.206 1.00 0.00 H new ATOM 407 N SER A 26 -2.618 4.379 -5.330 1.00 0.00 N ATOM 408 CA SER A 26 -2.676 3.195 -6.189 1.00 0.00 C ATOM 409 C SER A 26 -1.282 2.626 -6.452 1.00 0.00 C ATOM 410 O SER A 26 -0.574 3.082 -7.351 1.00 0.00 O ATOM 411 CB SER A 26 -3.355 3.540 -7.516 1.00 0.00 C ATOM 412 OG SER A 26 -4.179 4.685 -7.386 1.00 0.00 O ATOM 0 H SER A 26 -3.304 4.384 -4.575 1.00 0.00 H new ATOM 0 HA SER A 26 -3.259 2.435 -5.669 1.00 0.00 H new ATOM 0 HB2 SER A 26 -2.598 3.718 -8.280 1.00 0.00 H new ATOM 0 HB3 SER A 26 -3.954 2.694 -7.852 1.00 0.00 H new ATOM 0 HG SER A 26 -4.600 4.885 -8.248 1.00 0.00 H new ATOM 418 N PHE A 27 -0.895 1.628 -5.665 1.00 0.00 N ATOM 419 CA PHE A 27 0.412 1.000 -5.816 1.00 0.00 C ATOM 420 C PHE A 27 0.425 0.039 -7.003 1.00 0.00 C ATOM 421 O PHE A 27 -0.532 -0.702 -7.224 1.00 0.00 O ATOM 422 CB PHE A 27 0.793 0.258 -4.532 1.00 0.00 C ATOM 423 CG PHE A 27 2.086 -0.504 -4.626 1.00 0.00 C ATOM 424 CD1 PHE A 27 3.175 0.027 -5.301 1.00 0.00 C ATOM 425 CD2 PHE A 27 2.210 -1.753 -4.037 1.00 0.00 C ATOM 426 CE1 PHE A 27 4.363 -0.674 -5.386 1.00 0.00 C ATOM 427 CE2 PHE A 27 3.396 -2.458 -4.119 1.00 0.00 C ATOM 428 CZ PHE A 27 4.473 -1.918 -4.795 1.00 0.00 C ATOM 0 H PHE A 27 -1.467 1.237 -4.917 1.00 0.00 H new ATOM 0 HA PHE A 27 1.145 1.784 -6.005 1.00 0.00 H new ATOM 0 HB2 PHE A 27 0.866 0.978 -3.717 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -0.007 -0.435 -4.274 1.00 0.00 H new ATOM 0 HD1 PHE A 27 3.094 0.999 -5.765 1.00 0.00 H new ATOM 0 HD2 PHE A 27 1.371 -2.180 -3.508 1.00 0.00 H new ATOM 0 HE1 PHE A 27 5.204 -0.250 -5.914 1.00 0.00 H new ATOM 0 HE2 PHE A 27 3.481 -3.430 -3.655 1.00 0.00 H new ATOM 0 HZ PHE A 27 5.400 -2.468 -4.861 1.00 0.00 H new ATOM 438 N HIS A 28 1.518 0.057 -7.759 1.00 0.00 N ATOM 439 CA HIS A 28 1.662 -0.811 -8.923 1.00 0.00 C ATOM 440 C HIS A 28 1.826 -2.265 -8.496 1.00 0.00 C ATOM 441 O HIS A 28 1.892 -2.569 -7.304 1.00 0.00 O ATOM 442 CB HIS A 28 2.871 -0.383 -9.760 1.00 0.00 C ATOM 443 CG HIS A 28 3.055 1.101 -9.841 1.00 0.00 C ATOM 444 ND1 HIS A 28 2.481 1.879 -10.825 1.00 0.00 N ATOM 445 CD2 HIS A 28 3.754 1.952 -9.052 1.00 0.00 C ATOM 446 CE1 HIS A 28 2.821 3.143 -10.639 1.00 0.00 C ATOM 447 NE2 HIS A 28 3.591 3.213 -9.570 1.00 0.00 N ATOM 0 H HIS A 28 2.319 0.665 -7.586 1.00 0.00 H new ATOM 0 HA HIS A 28 0.758 -0.721 -9.525 1.00 0.00 H new ATOM 0 HB2 HIS A 28 3.771 -0.829 -9.336 1.00 0.00 H new ATOM 0 HB3 HIS A 28 2.763 -0.782 -10.769 1.00 0.00 H new ATOM 0 HD2 HIS A 28 4.332 1.688 -8.179 1.00 0.00 H new ATOM 0 HE1 HIS A 28 2.520 3.976 -11.257 1.00 0.00 H new ATOM 0 HE2 HIS A 28 4.000 4.067 -9.190 1.00 0.00 H new ATOM 456 N LEU A 29 1.894 -3.159 -9.476 1.00 0.00 N ATOM 457 CA LEU A 29 2.057 -4.579 -9.198 1.00 0.00 C ATOM 458 C LEU A 29 3.522 -4.913 -8.951 1.00 0.00 C ATOM 459 O LEU A 29 4.319 -5.006 -9.884 1.00 0.00 O ATOM 460 CB LEU A 29 1.517 -5.424 -10.352 1.00 0.00 C ATOM 461 CG LEU A 29 1.491 -6.934 -10.096 1.00 0.00 C ATOM 462 CD1 LEU A 29 2.889 -7.522 -10.202 1.00 0.00 C ATOM 463 CD2 LEU A 29 0.885 -7.237 -8.733 1.00 0.00 C ATOM 0 H LEU A 29 1.839 -2.925 -10.467 1.00 0.00 H new ATOM 0 HA LEU A 29 1.487 -4.812 -8.299 1.00 0.00 H new ATOM 0 HB2 LEU A 29 0.504 -5.093 -10.581 1.00 0.00 H new ATOM 0 HB3 LEU A 29 2.123 -5.232 -11.237 1.00 0.00 H new ATOM 0 HG LEU A 29 0.867 -7.398 -10.860 1.00 0.00 H new ATOM 0 HD11 LEU A 29 2.847 -8.595 -10.017 1.00 0.00 H new ATOM 0 HD12 LEU A 29 3.285 -7.341 -11.201 1.00 0.00 H new ATOM 0 HD13 LEU A 29 3.539 -7.051 -9.464 1.00 0.00 H new ATOM 0 HD21 LEU A 29 0.876 -8.315 -8.570 1.00 0.00 H new ATOM 0 HD22 LEU A 29 1.480 -6.758 -7.956 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -0.135 -6.856 -8.696 1.00 0.00 H new ATOM 475 N GLY A 30 3.865 -5.091 -7.684 1.00 0.00 N ATOM 476 CA GLY A 30 5.230 -5.412 -7.319 1.00 0.00 C ATOM 477 C GLY A 30 5.508 -5.155 -5.853 1.00 0.00 C ATOM 478 O GLY A 30 4.651 -5.396 -5.001 1.00 0.00 O ATOM 0 H GLY A 30 3.219 -5.018 -6.898 1.00 0.00 H new ATOM 0 HA2 GLY A 30 5.428 -6.460 -7.546 1.00 0.00 H new ATOM 0 HA3 GLY A 30 5.915 -4.820 -7.926 1.00 0.00 H new ATOM 482 N ASP A 31 6.705 -4.667 -5.556 1.00 0.00 N ATOM 483 CA ASP A 31 7.089 -4.377 -4.182 1.00 0.00 C ATOM 484 C ASP A 31 7.853 -3.062 -4.090 1.00 0.00 C ATOM 485 O ASP A 31 8.700 -2.761 -4.932 1.00 0.00 O ATOM 486 CB ASP A 31 7.943 -5.512 -3.618 1.00 0.00 C ATOM 487 CG ASP A 31 9.223 -5.720 -4.403 1.00 0.00 C ATOM 488 OD1 ASP A 31 9.281 -5.280 -5.571 1.00 0.00 O ATOM 489 OD2 ASP A 31 10.167 -6.324 -3.851 1.00 0.00 O ATOM 0 H ASP A 31 7.426 -4.464 -6.248 1.00 0.00 H new ATOM 0 HA ASP A 31 6.176 -4.287 -3.593 1.00 0.00 H new ATOM 0 HB2 ASP A 31 8.189 -5.295 -2.579 1.00 0.00 H new ATOM 0 HB3 ASP A 31 7.364 -6.435 -3.623 1.00 0.00 H new ATOM 494 N ASN A 32 7.553 -2.287 -3.056 1.00 0.00 N ATOM 495 CA ASN A 32 8.212 -1.006 -2.838 1.00 0.00 C ATOM 496 C ASN A 32 9.052 -1.060 -1.569 1.00 0.00 C ATOM 497 O ASN A 32 8.545 -1.397 -0.502 1.00 0.00 O ATOM 498 CB ASN A 32 7.177 0.116 -2.734 1.00 0.00 C ATOM 499 CG ASN A 32 7.680 1.422 -3.317 1.00 0.00 C ATOM 500 OD1 ASN A 32 8.507 2.107 -2.714 1.00 0.00 O ATOM 501 ND2 ASN A 32 7.183 1.775 -4.496 1.00 0.00 N ATOM 0 H ASN A 32 6.854 -2.525 -2.352 1.00 0.00 H new ATOM 0 HA ASN A 32 8.864 -0.801 -3.687 1.00 0.00 H new ATOM 0 HB2 ASN A 32 6.267 -0.184 -3.253 1.00 0.00 H new ATOM 0 HB3 ASN A 32 6.912 0.267 -1.687 1.00 0.00 H new ATOM 0 HD21 ASN A 32 7.485 2.644 -4.937 1.00 0.00 H new ATOM 0 HD22 ASN A 32 6.499 1.177 -4.961 1.00 0.00 H new ATOM 508 N SER A 33 10.336 -0.738 -1.689 1.00 0.00 N ATOM 509 CA SER A 33 11.230 -0.770 -0.539 1.00 0.00 C ATOM 510 C SER A 33 11.207 0.541 0.226 1.00 0.00 C ATOM 511 O SER A 33 11.073 1.619 -0.352 1.00 0.00 O ATOM 512 CB SER A 33 12.665 -1.078 -0.959 1.00 0.00 C ATOM 513 OG SER A 33 12.937 -0.583 -2.259 1.00 0.00 O ATOM 0 H SER A 33 10.777 -0.454 -2.564 1.00 0.00 H new ATOM 0 HA SER A 33 10.868 -1.565 0.113 1.00 0.00 H new ATOM 0 HB2 SER A 33 13.359 -0.633 -0.245 1.00 0.00 H new ATOM 0 HB3 SER A 33 12.830 -2.155 -0.935 1.00 0.00 H new ATOM 0 HG SER A 33 13.863 -0.793 -2.502 1.00 0.00 H new ATOM 519 N LEU A 34 11.349 0.424 1.533 1.00 0.00 N ATOM 520 CA LEU A 34 11.360 1.574 2.419 1.00 0.00 C ATOM 521 C LEU A 34 12.751 1.748 3.024 1.00 0.00 C ATOM 522 O LEU A 34 13.396 0.772 3.398 1.00 0.00 O ATOM 523 CB LEU A 34 10.295 1.394 3.520 1.00 0.00 C ATOM 524 CG LEU A 34 10.316 2.403 4.656 1.00 0.00 C ATOM 525 CD1 LEU A 34 11.227 1.886 5.751 1.00 0.00 C ATOM 526 CD2 LEU A 34 10.744 3.790 4.192 1.00 0.00 C ATOM 0 H LEU A 34 11.460 -0.470 2.011 1.00 0.00 H new ATOM 0 HA LEU A 34 11.119 2.474 1.853 1.00 0.00 H new ATOM 0 HB2 LEU A 34 9.311 1.428 3.052 1.00 0.00 H new ATOM 0 HB3 LEU A 34 10.411 0.398 3.947 1.00 0.00 H new ATOM 0 HG LEU A 34 9.302 2.514 5.041 1.00 0.00 H new ATOM 0 HD11 LEU A 34 11.251 2.602 6.573 1.00 0.00 H new ATOM 0 HD12 LEU A 34 10.853 0.929 6.114 1.00 0.00 H new ATOM 0 HD13 LEU A 34 12.234 1.755 5.355 1.00 0.00 H new ATOM 0 HD21 LEU A 34 10.743 4.474 5.041 1.00 0.00 H new ATOM 0 HD22 LEU A 34 11.747 3.739 3.769 1.00 0.00 H new ATOM 0 HD23 LEU A 34 10.049 4.151 3.434 1.00 0.00 H new ATOM 538 N ALA A 35 13.208 2.991 3.115 1.00 0.00 N ATOM 539 CA ALA A 35 14.514 3.293 3.672 1.00 0.00 C ATOM 540 C ALA A 35 14.516 3.050 5.168 1.00 0.00 C ATOM 541 O ALA A 35 13.472 3.049 5.808 1.00 0.00 O ATOM 542 CB ALA A 35 14.907 4.724 3.367 1.00 0.00 C ATOM 0 H ALA A 35 12.685 3.811 2.806 1.00 0.00 H new ATOM 0 HA ALA A 35 15.247 2.632 3.211 1.00 0.00 H new ATOM 0 HB1 ALA A 35 15.889 4.930 3.793 1.00 0.00 H new ATOM 0 HB2 ALA A 35 14.942 4.869 2.287 1.00 0.00 H new ATOM 0 HB3 ALA A 35 14.173 5.403 3.801 1.00 0.00 H new ATOM 548 N ALA A 36 15.687 2.819 5.721 1.00 0.00 N ATOM 549 CA ALA A 36 15.800 2.532 7.142 1.00 0.00 C ATOM 550 C ALA A 36 15.511 3.768 7.984 1.00 0.00 C ATOM 551 O ALA A 36 16.298 4.713 8.027 1.00 0.00 O ATOM 552 CB ALA A 36 17.185 1.984 7.450 1.00 0.00 C ATOM 0 H ALA A 36 16.573 2.823 5.215 1.00 0.00 H new ATOM 0 HA ALA A 36 15.054 1.780 7.399 1.00 0.00 H new ATOM 0 HB1 ALA A 36 17.263 1.771 8.516 1.00 0.00 H new ATOM 0 HB2 ALA A 36 17.348 1.067 6.884 1.00 0.00 H new ATOM 0 HB3 ALA A 36 17.938 2.721 7.171 1.00 0.00 H new ATOM 558 N VAL A 37 14.351 3.740 8.645 1.00 0.00 N ATOM 559 CA VAL A 37 13.907 4.844 9.488 1.00 0.00 C ATOM 560 C VAL A 37 13.515 4.352 10.882 1.00 0.00 C ATOM 561 O VAL A 37 13.645 3.171 11.194 1.00 0.00 O ATOM 562 CB VAL A 37 12.707 5.602 8.848 1.00 0.00 C ATOM 563 CG1 VAL A 37 12.679 5.399 7.340 1.00 0.00 C ATOM 564 CG2 VAL A 37 11.374 5.169 9.451 1.00 0.00 C ATOM 0 H VAL A 37 13.700 2.956 8.609 1.00 0.00 H new ATOM 0 HA VAL A 37 14.747 5.532 9.578 1.00 0.00 H new ATOM 0 HB VAL A 37 12.849 6.661 9.064 1.00 0.00 H new ATOM 0 HG11 VAL A 37 11.832 5.938 6.916 1.00 0.00 H new ATOM 0 HG12 VAL A 37 13.604 5.777 6.905 1.00 0.00 H new ATOM 0 HG13 VAL A 37 12.581 4.336 7.118 1.00 0.00 H new ATOM 0 HG21 VAL A 37 10.563 5.722 8.977 1.00 0.00 H new ATOM 0 HG22 VAL A 37 11.230 4.101 9.286 1.00 0.00 H new ATOM 0 HG23 VAL A 37 11.375 5.374 10.522 1.00 0.00 H new ATOM 574 N SER A 38 13.026 5.272 11.709 1.00 0.00 N ATOM 575 CA SER A 38 12.607 4.943 13.068 1.00 0.00 C ATOM 576 C SER A 38 11.696 3.716 13.091 1.00 0.00 C ATOM 577 O SER A 38 12.080 2.659 13.592 1.00 0.00 O ATOM 578 CB SER A 38 11.889 6.137 13.702 1.00 0.00 C ATOM 579 OG SER A 38 12.457 6.465 14.959 1.00 0.00 O ATOM 0 H SER A 38 12.910 6.254 11.460 1.00 0.00 H new ATOM 0 HA SER A 38 13.502 4.710 13.645 1.00 0.00 H new ATOM 0 HB2 SER A 38 11.950 6.998 13.036 1.00 0.00 H new ATOM 0 HB3 SER A 38 10.831 5.905 13.827 1.00 0.00 H new ATOM 0 HG SER A 38 11.982 7.232 15.343 1.00 0.00 H new ATOM 585 N GLU A 39 10.488 3.862 12.550 1.00 0.00 N ATOM 586 CA GLU A 39 9.529 2.756 12.518 1.00 0.00 C ATOM 587 C GLU A 39 8.225 3.140 11.809 1.00 0.00 C ATOM 588 O GLU A 39 7.451 2.265 11.419 1.00 0.00 O ATOM 589 CB GLU A 39 9.218 2.287 13.941 1.00 0.00 C ATOM 590 CG GLU A 39 8.268 1.101 13.998 1.00 0.00 C ATOM 591 CD GLU A 39 6.909 1.468 14.563 1.00 0.00 C ATOM 592 OE1 GLU A 39 6.278 2.406 14.031 1.00 0.00 O ATOM 593 OE2 GLU A 39 6.476 0.819 15.537 1.00 0.00 O ATOM 0 H GLU A 39 10.150 4.728 12.130 1.00 0.00 H new ATOM 0 HA GLU A 39 9.990 1.947 11.952 1.00 0.00 H new ATOM 0 HB2 GLU A 39 10.150 2.019 14.438 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.785 3.116 14.501 1.00 0.00 H new ATOM 0 HG2 GLU A 39 8.142 0.693 12.995 1.00 0.00 H new ATOM 0 HG3 GLU A 39 8.711 0.315 14.609 1.00 0.00 H new ATOM 600 N SER A 40 7.977 4.442 11.651 1.00 0.00 N ATOM 601 CA SER A 40 6.759 4.924 10.998 1.00 0.00 C ATOM 602 C SER A 40 6.422 4.102 9.753 1.00 0.00 C ATOM 603 O SER A 40 5.254 3.834 9.472 1.00 0.00 O ATOM 604 CB SER A 40 6.913 6.398 10.619 1.00 0.00 C ATOM 605 OG SER A 40 5.907 6.798 9.704 1.00 0.00 O ATOM 0 H SER A 40 8.604 5.182 11.967 1.00 0.00 H new ATOM 0 HA SER A 40 5.939 4.813 11.707 1.00 0.00 H new ATOM 0 HB2 SER A 40 6.859 7.015 11.516 1.00 0.00 H new ATOM 0 HB3 SER A 40 7.896 6.562 10.178 1.00 0.00 H new ATOM 0 HG SER A 40 6.027 7.744 9.479 1.00 0.00 H new ATOM 611 N GLN A 41 7.453 3.704 9.015 1.00 0.00 N ATOM 612 CA GLN A 41 7.272 2.911 7.802 1.00 0.00 C ATOM 613 C GLN A 41 6.441 1.663 8.071 1.00 0.00 C ATOM 614 O GLN A 41 5.479 1.376 7.358 1.00 0.00 O ATOM 615 CB GLN A 41 8.623 2.498 7.236 1.00 0.00 C ATOM 616 CG GLN A 41 9.560 1.879 8.258 1.00 0.00 C ATOM 617 CD GLN A 41 9.442 0.372 8.314 1.00 0.00 C ATOM 618 OE1 GLN A 41 8.888 -0.254 7.413 1.00 0.00 O ATOM 619 NE2 GLN A 41 9.956 -0.216 9.383 1.00 0.00 N ATOM 0 H GLN A 41 8.426 3.918 9.236 1.00 0.00 H new ATOM 0 HA GLN A 41 6.743 3.533 7.080 1.00 0.00 H new ATOM 0 HB2 GLN A 41 8.463 1.785 6.427 1.00 0.00 H new ATOM 0 HB3 GLN A 41 9.105 3.373 6.800 1.00 0.00 H new ATOM 0 HG2 GLN A 41 10.587 2.151 8.016 1.00 0.00 H new ATOM 0 HG3 GLN A 41 9.344 2.294 9.242 1.00 0.00 H new ATOM 0 HE21 GLN A 41 10.407 0.345 10.106 1.00 0.00 H new ATOM 0 HE22 GLN A 41 9.901 -1.230 9.483 1.00 0.00 H new ATOM 628 N LEU A 42 6.832 0.919 9.096 1.00 0.00 N ATOM 629 CA LEU A 42 6.139 -0.311 9.456 1.00 0.00 C ATOM 630 C LEU A 42 4.671 -0.044 9.760 1.00 0.00 C ATOM 631 O LEU A 42 3.789 -0.760 9.288 1.00 0.00 O ATOM 632 CB LEU A 42 6.813 -0.964 10.663 1.00 0.00 C ATOM 633 CG LEU A 42 6.243 -2.325 11.066 1.00 0.00 C ATOM 634 CD1 LEU A 42 6.984 -3.447 10.356 1.00 0.00 C ATOM 635 CD2 LEU A 42 6.316 -2.507 12.575 1.00 0.00 C ATOM 0 H LEU A 42 7.627 1.146 9.694 1.00 0.00 H new ATOM 0 HA LEU A 42 6.194 -0.990 8.605 1.00 0.00 H new ATOM 0 HB2 LEU A 42 7.875 -1.082 10.447 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.734 -0.288 11.514 1.00 0.00 H new ATOM 0 HG LEU A 42 5.196 -2.362 10.765 1.00 0.00 H new ATOM 0 HD11 LEU A 42 6.564 -4.407 10.656 1.00 0.00 H new ATOM 0 HD12 LEU A 42 6.880 -3.326 9.278 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.040 -3.413 10.625 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.906 -3.481 12.844 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.355 -2.448 12.899 1.00 0.00 H new ATOM 0 HD23 LEU A 42 5.739 -1.723 13.064 1.00 0.00 H new ATOM 647 N ALA A 43 4.418 0.989 10.553 1.00 0.00 N ATOM 648 CA ALA A 43 3.056 1.348 10.921 1.00 0.00 C ATOM 649 C ALA A 43 2.306 1.956 9.742 1.00 0.00 C ATOM 650 O ALA A 43 1.096 1.774 9.607 1.00 0.00 O ATOM 651 CB ALA A 43 3.070 2.307 12.096 1.00 0.00 C ATOM 0 H ALA A 43 5.137 1.592 10.953 1.00 0.00 H new ATOM 0 HA ALA A 43 2.531 0.438 11.213 1.00 0.00 H new ATOM 0 HB1 ALA A 43 2.046 2.570 12.364 1.00 0.00 H new ATOM 0 HB2 ALA A 43 3.557 1.832 12.948 1.00 0.00 H new ATOM 0 HB3 ALA A 43 3.616 3.210 11.822 1.00 0.00 H new ATOM 657 N GLN A 44 3.027 2.675 8.888 1.00 0.00 N ATOM 658 CA GLN A 44 2.415 3.299 7.722 1.00 0.00 C ATOM 659 C GLN A 44 1.870 2.234 6.778 1.00 0.00 C ATOM 660 O GLN A 44 0.755 2.351 6.267 1.00 0.00 O ATOM 661 CB GLN A 44 3.431 4.178 6.990 1.00 0.00 C ATOM 662 CG GLN A 44 2.796 5.299 6.183 1.00 0.00 C ATOM 663 CD GLN A 44 2.913 6.648 6.864 1.00 0.00 C ATOM 664 OE1 GLN A 44 1.909 7.281 7.192 1.00 0.00 O ATOM 665 NE2 GLN A 44 4.144 7.096 7.081 1.00 0.00 N ATOM 0 H GLN A 44 4.029 2.839 8.981 1.00 0.00 H new ATOM 0 HA GLN A 44 1.590 3.926 8.060 1.00 0.00 H new ATOM 0 HB2 GLN A 44 4.117 4.610 7.719 1.00 0.00 H new ATOM 0 HB3 GLN A 44 4.026 3.553 6.323 1.00 0.00 H new ATOM 0 HG2 GLN A 44 3.270 5.349 5.203 1.00 0.00 H new ATOM 0 HG3 GLN A 44 1.743 5.070 6.017 1.00 0.00 H new ATOM 0 HE21 GLN A 44 4.948 6.538 6.793 1.00 0.00 H new ATOM 0 HE22 GLN A 44 4.286 7.998 7.536 1.00 0.00 H new ATOM 674 N LEU A 45 2.666 1.196 6.556 1.00 0.00 N ATOM 675 CA LEU A 45 2.275 0.099 5.680 1.00 0.00 C ATOM 676 C LEU A 45 1.319 -0.852 6.393 1.00 0.00 C ATOM 677 O LEU A 45 0.425 -1.430 5.775 1.00 0.00 O ATOM 678 CB LEU A 45 3.516 -0.654 5.204 1.00 0.00 C ATOM 679 CG LEU A 45 4.655 0.241 4.718 1.00 0.00 C ATOM 680 CD1 LEU A 45 5.895 -0.579 4.396 1.00 0.00 C ATOM 681 CD2 LEU A 45 4.215 1.057 3.515 1.00 0.00 C ATOM 0 H LEU A 45 3.591 1.091 6.973 1.00 0.00 H new ATOM 0 HA LEU A 45 1.757 0.514 4.816 1.00 0.00 H new ATOM 0 HB2 LEU A 45 3.883 -1.276 6.020 1.00 0.00 H new ATOM 0 HB3 LEU A 45 3.229 -1.326 4.395 1.00 0.00 H new ATOM 0 HG LEU A 45 4.913 0.930 5.522 1.00 0.00 H new ATOM 0 HD11 LEU A 45 6.690 0.083 4.052 1.00 0.00 H new ATOM 0 HD12 LEU A 45 6.224 -1.107 5.291 1.00 0.00 H new ATOM 0 HD13 LEU A 45 5.661 -1.301 3.614 1.00 0.00 H new ATOM 0 HD21 LEU A 45 5.039 1.688 3.183 1.00 0.00 H new ATOM 0 HD22 LEU A 45 3.923 0.386 2.707 1.00 0.00 H new ATOM 0 HD23 LEU A 45 3.366 1.683 3.791 1.00 0.00 H new ATOM 692 N LYS A 46 1.516 -1.006 7.698 1.00 0.00 N ATOM 693 CA LYS A 46 0.672 -1.885 8.501 1.00 0.00 C ATOM 694 C LYS A 46 -0.726 -1.296 8.677 1.00 0.00 C ATOM 695 O LYS A 46 -1.684 -2.021 8.948 1.00 0.00 O ATOM 696 CB LYS A 46 1.306 -2.124 9.873 1.00 0.00 C ATOM 697 CG LYS A 46 2.300 -3.275 9.894 1.00 0.00 C ATOM 698 CD LYS A 46 2.464 -3.843 11.295 1.00 0.00 C ATOM 699 CE LYS A 46 3.276 -5.127 11.285 1.00 0.00 C ATOM 700 NZ LYS A 46 3.865 -5.421 12.619 1.00 0.00 N ATOM 0 H LYS A 46 2.252 -0.534 8.223 1.00 0.00 H new ATOM 0 HA LYS A 46 0.584 -2.835 7.974 1.00 0.00 H new ATOM 0 HB2 LYS A 46 1.811 -1.213 10.194 1.00 0.00 H new ATOM 0 HB3 LYS A 46 0.517 -2.323 10.598 1.00 0.00 H new ATOM 0 HG2 LYS A 46 1.963 -4.061 9.219 1.00 0.00 H new ATOM 0 HG3 LYS A 46 3.266 -2.930 9.525 1.00 0.00 H new ATOM 0 HD2 LYS A 46 2.954 -3.107 11.932 1.00 0.00 H new ATOM 0 HD3 LYS A 46 1.482 -4.036 11.728 1.00 0.00 H new ATOM 0 HE2 LYS A 46 2.639 -5.957 10.978 1.00 0.00 H new ATOM 0 HE3 LYS A 46 4.073 -5.047 10.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 4.766 -5.926 12.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 4.034 -4.530 13.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 3.208 -6.013 13.166 1.00 0.00 H new ATOM 714 N ALA A 47 -0.837 0.022 8.525 1.00 0.00 N ATOM 715 CA ALA A 47 -2.118 0.708 8.671 1.00 0.00 C ATOM 716 C ALA A 47 -3.227 -0.005 7.903 1.00 0.00 C ATOM 717 O ALA A 47 -4.203 -0.469 8.491 1.00 0.00 O ATOM 718 CB ALA A 47 -1.997 2.151 8.204 1.00 0.00 C ATOM 0 H ALA A 47 -0.054 0.636 8.301 1.00 0.00 H new ATOM 0 HA ALA A 47 -2.385 0.695 9.728 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.958 2.652 8.318 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -1.246 2.666 8.804 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.700 2.170 7.156 1.00 0.00 H new ATOM 724 N ASP A 48 -3.071 -0.087 6.586 1.00 0.00 N ATOM 725 CA ASP A 48 -4.060 -0.742 5.739 1.00 0.00 C ATOM 726 C ASP A 48 -3.677 -2.198 5.479 1.00 0.00 C ATOM 727 O ASP A 48 -2.580 -2.482 4.998 1.00 0.00 O ATOM 728 CB ASP A 48 -4.199 0.004 4.411 1.00 0.00 C ATOM 729 CG ASP A 48 -5.620 -0.022 3.879 1.00 0.00 C ATOM 730 OD1 ASP A 48 -5.966 -0.983 3.161 1.00 0.00 O ATOM 731 OD2 ASP A 48 -6.384 0.918 4.182 1.00 0.00 O ATOM 0 H ASP A 48 -2.269 0.292 6.082 1.00 0.00 H new ATOM 0 HA ASP A 48 -5.017 -0.724 6.261 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -3.882 1.039 4.544 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -3.530 -0.442 3.675 1.00 0.00 H new ATOM 736 N PRO A 49 -4.578 -3.148 5.795 1.00 0.00 N ATOM 737 CA PRO A 49 -4.323 -4.574 5.592 1.00 0.00 C ATOM 738 C PRO A 49 -4.531 -5.002 4.141 1.00 0.00 C ATOM 739 O PRO A 49 -5.326 -5.897 3.856 1.00 0.00 O ATOM 740 CB PRO A 49 -5.356 -5.236 6.500 1.00 0.00 C ATOM 741 CG PRO A 49 -6.505 -4.288 6.505 1.00 0.00 C ATOM 742 CD PRO A 49 -5.915 -2.908 6.376 1.00 0.00 C ATOM 0 HA PRO A 49 -3.292 -4.846 5.818 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -5.650 -6.215 6.121 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -4.962 -5.389 7.505 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -7.186 -4.498 5.680 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -7.081 -4.380 7.426 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -6.522 -2.272 5.732 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -5.847 -2.410 7.343 1.00 0.00 H new ATOM 750 N ARG A 50 -3.811 -4.355 3.230 1.00 0.00 N ATOM 751 CA ARG A 50 -3.919 -4.669 1.809 1.00 0.00 C ATOM 752 C ARG A 50 -2.636 -5.314 1.294 1.00 0.00 C ATOM 753 O ARG A 50 -2.676 -6.246 0.491 1.00 0.00 O ATOM 754 CB ARG A 50 -4.230 -3.402 1.007 1.00 0.00 C ATOM 755 CG ARG A 50 -5.637 -3.379 0.432 1.00 0.00 C ATOM 756 CD ARG A 50 -6.146 -1.957 0.263 1.00 0.00 C ATOM 757 NE ARG A 50 -7.004 -1.817 -0.912 1.00 0.00 N ATOM 758 CZ ARG A 50 -8.261 -2.250 -0.967 1.00 0.00 C ATOM 759 NH1 ARG A 50 -8.811 -2.849 0.083 1.00 0.00 N ATOM 760 NH2 ARG A 50 -8.972 -2.083 -2.074 1.00 0.00 N ATOM 0 H ARG A 50 -3.148 -3.612 3.449 1.00 0.00 H new ATOM 0 HA ARG A 50 -4.735 -5.380 1.680 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -4.094 -2.532 1.650 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -3.511 -3.312 0.192 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -5.645 -3.887 -0.533 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -6.309 -3.931 1.089 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -6.701 -1.663 1.154 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -5.299 -1.277 0.176 1.00 0.00 H new ATOM 0 HE ARG A 50 -6.617 -1.361 -1.738 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -8.269 -2.979 0.937 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -9.775 -3.179 0.035 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -8.555 -1.623 -2.883 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -9.936 -2.415 -2.116 1.00 0.00 H new ATOM 774 N LEU A 51 -1.496 -4.816 1.766 1.00 0.00 N ATOM 775 CA LEU A 51 -0.200 -5.349 1.354 1.00 0.00 C ATOM 776 C LEU A 51 0.481 -6.057 2.522 1.00 0.00 C ATOM 777 O LEU A 51 -0.120 -6.241 3.580 1.00 0.00 O ATOM 778 CB LEU A 51 0.704 -4.233 0.813 1.00 0.00 C ATOM 779 CG LEU A 51 -0.015 -3.063 0.129 1.00 0.00 C ATOM 780 CD1 LEU A 51 -1.029 -3.566 -0.890 1.00 0.00 C ATOM 781 CD2 LEU A 51 -0.686 -2.168 1.160 1.00 0.00 C ATOM 0 H LEU A 51 -1.443 -4.046 2.433 1.00 0.00 H new ATOM 0 HA LEU A 51 -0.370 -6.071 0.555 1.00 0.00 H new ATOM 0 HB2 LEU A 51 1.296 -3.838 1.639 1.00 0.00 H new ATOM 0 HB3 LEU A 51 1.403 -4.671 0.101 1.00 0.00 H new ATOM 0 HG LEU A 51 0.731 -2.473 -0.403 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -1.524 -2.717 -1.360 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -0.518 -4.155 -1.652 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -1.771 -4.187 -0.389 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -1.190 -1.345 0.654 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -1.416 -2.748 1.725 1.00 0.00 H new ATOM 0 HD23 LEU A 51 0.066 -1.769 1.841 1.00 0.00 H new ATOM 793 N VAL A 52 1.731 -6.466 2.323 1.00 0.00 N ATOM 794 CA VAL A 52 2.475 -7.165 3.365 1.00 0.00 C ATOM 795 C VAL A 52 3.737 -6.405 3.771 1.00 0.00 C ATOM 796 O VAL A 52 4.725 -6.386 3.038 1.00 0.00 O ATOM 797 CB VAL A 52 2.859 -8.589 2.909 1.00 0.00 C ATOM 798 CG1 VAL A 52 1.623 -9.346 2.465 1.00 0.00 C ATOM 799 CG2 VAL A 52 3.887 -8.548 1.786 1.00 0.00 C ATOM 0 H VAL A 52 2.247 -6.326 1.454 1.00 0.00 H new ATOM 0 HA VAL A 52 1.817 -7.228 4.232 1.00 0.00 H new ATOM 0 HB VAL A 52 3.308 -9.108 3.756 1.00 0.00 H new ATOM 0 HG11 VAL A 52 1.906 -10.349 2.146 1.00 0.00 H new ATOM 0 HG12 VAL A 52 0.920 -9.414 3.295 1.00 0.00 H new ATOM 0 HG13 VAL A 52 1.153 -8.820 1.634 1.00 0.00 H new ATOM 0 HG21 VAL A 52 4.138 -9.565 1.485 1.00 0.00 H new ATOM 0 HG22 VAL A 52 3.473 -8.009 0.933 1.00 0.00 H new ATOM 0 HG23 VAL A 52 4.786 -8.040 2.134 1.00 0.00 H new ATOM 809 N VAL A 53 3.705 -5.790 4.948 1.00 0.00 N ATOM 810 CA VAL A 53 4.859 -5.046 5.440 1.00 0.00 C ATOM 811 C VAL A 53 5.648 -5.876 6.446 1.00 0.00 C ATOM 812 O VAL A 53 5.220 -6.075 7.583 1.00 0.00 O ATOM 813 CB VAL A 53 4.445 -3.701 6.069 1.00 0.00 C ATOM 814 CG1 VAL A 53 3.297 -3.884 7.051 1.00 0.00 C ATOM 815 CG2 VAL A 53 5.626 -3.015 6.743 1.00 0.00 C ATOM 0 H VAL A 53 2.900 -5.791 5.575 1.00 0.00 H new ATOM 0 HA VAL A 53 5.496 -4.832 4.582 1.00 0.00 H new ATOM 0 HB VAL A 53 4.101 -3.056 5.261 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.027 -2.919 7.479 1.00 0.00 H new ATOM 0 HG12 VAL A 53 2.436 -4.304 6.530 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.605 -4.561 7.848 1.00 0.00 H new ATOM 0 HG21 VAL A 53 5.299 -2.070 7.176 1.00 0.00 H new ATOM 0 HG22 VAL A 53 6.019 -3.658 7.530 1.00 0.00 H new ATOM 0 HG23 VAL A 53 6.406 -2.826 6.006 1.00 0.00 H new ATOM 825 N GLN A 54 6.800 -6.363 6.005 1.00 0.00 N ATOM 826 CA GLN A 54 7.664 -7.185 6.848 1.00 0.00 C ATOM 827 C GLN A 54 9.087 -6.634 6.879 1.00 0.00 C ATOM 828 O GLN A 54 9.690 -6.398 5.834 1.00 0.00 O ATOM 829 CB GLN A 54 7.674 -8.631 6.346 1.00 0.00 C ATOM 830 CG GLN A 54 7.511 -9.661 7.452 1.00 0.00 C ATOM 831 CD GLN A 54 7.349 -11.069 6.916 1.00 0.00 C ATOM 832 OE1 GLN A 54 8.073 -11.983 7.312 1.00 0.00 O ATOM 833 NE2 GLN A 54 6.395 -11.252 6.011 1.00 0.00 N ATOM 0 H GLN A 54 7.161 -6.203 5.064 1.00 0.00 H new ATOM 0 HA GLN A 54 7.266 -7.161 7.862 1.00 0.00 H new ATOM 0 HB2 GLN A 54 6.871 -8.760 5.620 1.00 0.00 H new ATOM 0 HB3 GLN A 54 8.611 -8.818 5.822 1.00 0.00 H new ATOM 0 HG2 GLN A 54 8.380 -9.624 8.109 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.642 -9.404 8.058 1.00 0.00 H new ATOM 0 HE21 GLN A 54 5.818 -10.466 5.712 1.00 0.00 H new ATOM 0 HE22 GLN A 54 6.239 -12.179 5.615 1.00 0.00 H new ATOM 842 N ILE A 55 9.614 -6.435 8.084 1.00 0.00 N ATOM 843 CA ILE A 55 10.966 -5.908 8.253 1.00 0.00 C ATOM 844 C ILE A 55 12.005 -7.028 8.264 1.00 0.00 C ATOM 845 O ILE A 55 11.868 -8.014 8.988 1.00 0.00 O ATOM 846 CB ILE A 55 11.096 -5.068 9.551 1.00 0.00 C ATOM 847 CG1 ILE A 55 11.270 -5.964 10.783 1.00 0.00 C ATOM 848 CG2 ILE A 55 9.887 -4.161 9.732 1.00 0.00 C ATOM 849 CD1 ILE A 55 10.101 -6.891 11.035 1.00 0.00 C ATOM 0 H ILE A 55 9.126 -6.631 8.958 1.00 0.00 H new ATOM 0 HA ILE A 55 11.156 -5.259 7.398 1.00 0.00 H new ATOM 0 HB ILE A 55 11.988 -4.450 9.451 1.00 0.00 H new ATOM 0 HG12 ILE A 55 12.175 -6.560 10.662 1.00 0.00 H new ATOM 0 HG13 ILE A 55 11.418 -5.334 11.660 1.00 0.00 H new ATOM 0 HG21 ILE A 55 10.001 -3.582 10.648 1.00 0.00 H new ATOM 0 HG22 ILE A 55 9.810 -3.483 8.882 1.00 0.00 H new ATOM 0 HG23 ILE A 55 8.983 -4.767 9.796 1.00 0.00 H new ATOM 0 HD11 ILE A 55 10.298 -7.492 11.923 1.00 0.00 H new ATOM 0 HD12 ILE A 55 9.197 -6.302 11.189 1.00 0.00 H new ATOM 0 HD13 ILE A 55 9.965 -7.547 10.175 1.00 0.00 H new ATOM 861 N THR A 56 13.048 -6.860 7.458 1.00 0.00 N ATOM 862 CA THR A 56 14.119 -7.843 7.371 1.00 0.00 C ATOM 863 C THR A 56 15.462 -7.203 7.707 1.00 0.00 C ATOM 864 O THR A 56 16.031 -6.469 6.900 1.00 0.00 O ATOM 865 CB THR A 56 14.167 -8.454 5.969 1.00 0.00 C ATOM 866 OG1 THR A 56 14.727 -7.539 5.044 1.00 0.00 O ATOM 867 CG2 THR A 56 12.807 -8.861 5.446 1.00 0.00 C ATOM 0 H THR A 56 13.173 -6.048 6.854 1.00 0.00 H new ATOM 0 HA THR A 56 13.918 -8.633 8.094 1.00 0.00 H new ATOM 0 HB THR A 56 14.783 -9.348 6.064 1.00 0.00 H new ATOM 0 HG1 THR A 56 15.010 -6.728 5.516 1.00 0.00 H new ATOM 0 HG21 THR A 56 12.913 -9.286 4.448 1.00 0.00 H new ATOM 0 HG22 THR A 56 12.368 -9.604 6.112 1.00 0.00 H new ATOM 0 HG23 THR A 56 12.158 -7.986 5.400 1.00 0.00 H new ATOM 875 N GLU A 57 15.963 -7.486 8.904 1.00 0.00 N ATOM 876 CA GLU A 57 17.241 -6.934 9.347 1.00 0.00 C ATOM 877 C GLU A 57 18.339 -7.994 9.306 1.00 0.00 C ATOM 878 O GLU A 57 19.332 -7.842 8.595 1.00 0.00 O ATOM 879 CB GLU A 57 17.128 -6.352 10.765 1.00 0.00 C ATOM 880 CG GLU A 57 16.018 -6.967 11.607 1.00 0.00 C ATOM 881 CD GLU A 57 14.661 -6.357 11.318 1.00 0.00 C ATOM 882 OE1 GLU A 57 14.481 -5.807 10.211 1.00 0.00 O ATOM 883 OE2 GLU A 57 13.778 -6.427 12.199 1.00 0.00 O ATOM 0 H GLU A 57 15.506 -8.093 9.585 1.00 0.00 H new ATOM 0 HA GLU A 57 17.507 -6.130 8.660 1.00 0.00 H new ATOM 0 HB2 GLU A 57 18.079 -6.492 11.280 1.00 0.00 H new ATOM 0 HB3 GLU A 57 16.960 -5.277 10.692 1.00 0.00 H new ATOM 0 HG2 GLU A 57 15.977 -8.040 11.420 1.00 0.00 H new ATOM 0 HG3 GLU A 57 16.253 -6.836 12.663 1.00 0.00 H new ATOM 890 N THR A 58 18.154 -9.066 10.069 1.00 0.00 N ATOM 891 CA THR A 58 19.130 -10.148 10.117 1.00 0.00 C ATOM 892 C THR A 58 18.458 -11.498 9.889 1.00 0.00 C ATOM 893 O THR A 58 18.944 -12.321 9.112 1.00 0.00 O ATOM 894 CB THR A 58 19.858 -10.149 11.461 1.00 0.00 C ATOM 895 OG1 THR A 58 20.590 -11.349 11.635 1.00 0.00 O ATOM 896 CG2 THR A 58 18.927 -10.004 12.646 1.00 0.00 C ATOM 0 H THR A 58 17.337 -9.209 10.663 1.00 0.00 H new ATOM 0 HA THR A 58 19.855 -9.984 9.320 1.00 0.00 H new ATOM 0 HB THR A 58 20.520 -9.284 11.431 1.00 0.00 H new ATOM 0 HG1 THR A 58 21.050 -11.329 12.500 1.00 0.00 H new ATOM 0 HG21 THR A 58 19.508 -10.012 13.568 1.00 0.00 H new ATOM 0 HG22 THR A 58 18.383 -9.063 12.568 1.00 0.00 H new ATOM 0 HG23 THR A 58 18.219 -10.833 12.656 1.00 0.00 H new ATOM 904 N GLY A 59 17.339 -11.720 10.569 1.00 0.00 N ATOM 905 CA GLY A 59 16.620 -12.972 10.426 1.00 0.00 C ATOM 906 C GLY A 59 15.477 -13.100 11.415 1.00 0.00 C ATOM 907 O GLY A 59 15.368 -12.312 12.354 1.00 0.00 O ATOM 0 H GLY A 59 16.917 -11.055 11.217 1.00 0.00 H new ATOM 0 HA2 GLY A 59 16.229 -13.049 9.411 1.00 0.00 H new ATOM 0 HA3 GLY A 59 17.312 -13.803 10.565 1.00 0.00 H new ATOM 911 N SER A 60 14.623 -14.095 11.203 1.00 0.00 N ATOM 912 CA SER A 60 13.483 -14.325 12.082 1.00 0.00 C ATOM 913 C SER A 60 13.736 -15.512 13.005 1.00 0.00 C ATOM 914 O SER A 60 14.344 -16.504 12.604 1.00 0.00 O ATOM 915 CB SER A 60 12.217 -14.567 11.257 1.00 0.00 C ATOM 916 OG SER A 60 12.480 -15.420 10.156 1.00 0.00 O ATOM 0 H SER A 60 14.699 -14.756 10.429 1.00 0.00 H new ATOM 0 HA SER A 60 13.345 -13.435 12.696 1.00 0.00 H new ATOM 0 HB2 SER A 60 11.447 -15.010 11.888 1.00 0.00 H new ATOM 0 HB3 SER A 60 11.826 -13.615 10.898 1.00 0.00 H new ATOM 0 HG SER A 60 11.655 -15.560 9.646 1.00 0.00 H new ATOM 922 N GLN A 61 13.267 -15.402 14.243 1.00 0.00 N ATOM 923 CA GLN A 61 13.442 -16.467 15.224 1.00 0.00 C ATOM 924 C GLN A 61 12.143 -16.730 15.980 1.00 0.00 C ATOM 925 O GLN A 61 11.148 -16.032 15.786 1.00 0.00 O ATOM 926 CB GLN A 61 14.556 -16.103 16.208 1.00 0.00 C ATOM 927 CG GLN A 61 15.524 -17.243 16.479 1.00 0.00 C ATOM 928 CD GLN A 61 16.438 -17.524 15.302 1.00 0.00 C ATOM 929 OE1 GLN A 61 16.405 -18.608 14.721 1.00 0.00 O ATOM 930 NE2 GLN A 61 17.261 -16.545 14.945 1.00 0.00 N ATOM 0 H GLN A 61 12.763 -14.586 14.591 1.00 0.00 H new ATOM 0 HA GLN A 61 13.720 -17.376 14.691 1.00 0.00 H new ATOM 0 HB2 GLN A 61 15.112 -15.251 15.816 1.00 0.00 H new ATOM 0 HB3 GLN A 61 14.108 -15.786 17.150 1.00 0.00 H new ATOM 0 HG2 GLN A 61 16.128 -17.002 17.354 1.00 0.00 H new ATOM 0 HG3 GLN A 61 14.960 -18.144 16.720 1.00 0.00 H new ATOM 0 HE21 GLN A 61 17.255 -15.662 15.455 1.00 0.00 H new ATOM 0 HE22 GLN A 61 17.900 -16.676 14.160 1.00 0.00 H new ATOM 939 N GLU A 62 12.159 -17.743 16.840 1.00 0.00 N ATOM 940 CA GLU A 62 10.982 -18.099 17.624 1.00 0.00 C ATOM 941 C GLU A 62 9.816 -18.476 16.714 1.00 0.00 C ATOM 942 O GLU A 62 8.653 -18.286 17.068 1.00 0.00 O ATOM 943 CB GLU A 62 10.583 -16.938 18.538 1.00 0.00 C ATOM 944 CG GLU A 62 10.850 -17.203 20.010 1.00 0.00 C ATOM 945 CD GLU A 62 12.327 -17.363 20.316 1.00 0.00 C ATOM 946 OE1 GLU A 62 13.089 -16.402 20.080 1.00 0.00 O ATOM 947 OE2 GLU A 62 12.721 -18.449 20.790 1.00 0.00 O ATOM 0 H GLU A 62 12.974 -18.332 17.012 1.00 0.00 H new ATOM 0 HA GLU A 62 11.231 -18.964 18.238 1.00 0.00 H new ATOM 0 HB2 GLU A 62 11.127 -16.044 18.234 1.00 0.00 H new ATOM 0 HB3 GLU A 62 9.522 -16.727 18.402 1.00 0.00 H new ATOM 0 HG2 GLU A 62 10.447 -16.381 20.602 1.00 0.00 H new ATOM 0 HG3 GLU A 62 10.320 -18.105 20.315 1.00 0.00 H new ATOM 954 N GLY A 63 10.137 -19.013 15.541 1.00 0.00 N ATOM 955 CA GLY A 63 9.105 -19.409 14.601 1.00 0.00 C ATOM 956 C GLY A 63 8.719 -20.870 14.741 1.00 0.00 C ATOM 957 O GLY A 63 7.617 -21.266 14.361 1.00 0.00 O ATOM 0 H GLY A 63 11.092 -19.181 15.225 1.00 0.00 H new ATOM 0 HA2 GLY A 63 8.222 -18.788 14.753 1.00 0.00 H new ATOM 0 HA3 GLY A 63 9.454 -19.225 13.585 1.00 0.00 H new ATOM 961 N GLY A 64 9.627 -21.672 15.289 1.00 0.00 N ATOM 962 CA GLY A 64 9.355 -23.086 15.467 1.00 0.00 C ATOM 963 C GLY A 64 10.519 -23.827 16.097 1.00 0.00 C ATOM 964 O GLY A 64 10.321 -24.750 16.886 1.00 0.00 O ATOM 0 H GLY A 64 10.545 -21.368 15.613 1.00 0.00 H new ATOM 0 HA2 GLY A 64 8.471 -23.207 16.093 1.00 0.00 H new ATOM 0 HA3 GLY A 64 9.125 -23.533 14.500 1.00 0.00 H new ATOM 968 N GLU A 65 11.736 -23.422 15.746 1.00 0.00 N ATOM 969 CA GLU A 65 12.935 -24.054 16.282 1.00 0.00 C ATOM 970 C GLU A 65 13.402 -23.348 17.552 1.00 0.00 C ATOM 971 O GLU A 65 14.574 -22.989 17.681 1.00 0.00 O ATOM 972 CB GLU A 65 14.052 -24.044 15.235 1.00 0.00 C ATOM 973 CG GLU A 65 14.274 -22.682 14.598 1.00 0.00 C ATOM 974 CD GLU A 65 15.548 -22.624 13.778 1.00 0.00 C ATOM 975 OE1 GLU A 65 15.905 -23.649 13.160 1.00 0.00 O ATOM 976 OE2 GLU A 65 16.191 -21.554 13.754 1.00 0.00 O ATOM 0 H GLU A 65 11.917 -22.659 15.093 1.00 0.00 H new ATOM 0 HA GLU A 65 12.691 -25.086 16.533 1.00 0.00 H new ATOM 0 HB2 GLU A 65 14.980 -24.373 15.702 1.00 0.00 H new ATOM 0 HB3 GLU A 65 13.814 -24.767 14.455 1.00 0.00 H new ATOM 0 HG2 GLU A 65 13.424 -22.440 13.960 1.00 0.00 H new ATOM 0 HG3 GLU A 65 14.313 -21.922 15.378 1.00 0.00 H new ATOM 983 N GLY A 66 12.479 -23.152 18.488 1.00 0.00 N ATOM 984 CA GLY A 66 12.816 -22.490 19.734 1.00 0.00 C ATOM 985 C GLY A 66 11.755 -22.684 20.800 1.00 0.00 C ATOM 986 O GLY A 66 10.880 -21.836 20.976 1.00 0.00 O ATOM 0 H GLY A 66 11.504 -23.440 18.406 1.00 0.00 H new ATOM 0 HA2 GLY A 66 13.768 -22.874 20.100 1.00 0.00 H new ATOM 0 HA3 GLY A 66 12.951 -21.424 19.550 1.00 0.00 H new ATOM 990 N LEU A 67 11.832 -23.803 21.512 1.00 0.00 N ATOM 991 CA LEU A 67 10.872 -24.106 22.567 1.00 0.00 C ATOM 992 C LEU A 67 11.344 -25.286 23.411 1.00 0.00 C ATOM 993 O LEU A 67 12.431 -25.821 23.195 1.00 0.00 O ATOM 994 CB LEU A 67 9.500 -24.413 21.963 1.00 0.00 C ATOM 995 CG LEU A 67 9.484 -25.543 20.933 1.00 0.00 C ATOM 996 CD1 LEU A 67 8.209 -26.364 21.058 1.00 0.00 C ATOM 997 CD2 LEU A 67 9.622 -24.980 19.526 1.00 0.00 C ATOM 0 H LEU A 67 12.550 -24.515 21.378 1.00 0.00 H new ATOM 0 HA LEU A 67 10.791 -23.231 23.212 1.00 0.00 H new ATOM 0 HB2 LEU A 67 8.814 -24.668 22.770 1.00 0.00 H new ATOM 0 HB3 LEU A 67 9.116 -23.508 21.493 1.00 0.00 H new ATOM 0 HG LEU A 67 10.333 -26.199 21.127 1.00 0.00 H new ATOM 0 HD11 LEU A 67 8.217 -27.163 20.317 1.00 0.00 H new ATOM 0 HD12 LEU A 67 8.151 -26.796 22.057 1.00 0.00 H new ATOM 0 HD13 LEU A 67 7.345 -25.722 20.890 1.00 0.00 H new ATOM 0 HD21 LEU A 67 9.609 -25.797 18.804 1.00 0.00 H new ATOM 0 HD22 LEU A 67 8.793 -24.302 19.322 1.00 0.00 H new ATOM 0 HD23 LEU A 67 10.563 -24.437 19.442 1.00 0.00 H new ATOM 1009 N SER A 68 10.519 -25.687 24.373 1.00 0.00 N ATOM 1010 CA SER A 68 10.851 -26.803 25.249 1.00 0.00 C ATOM 1011 C SER A 68 9.597 -27.578 25.642 1.00 0.00 C ATOM 1012 O SER A 68 9.563 -28.807 25.560 1.00 0.00 O ATOM 1013 CB SER A 68 11.565 -26.299 26.504 1.00 0.00 C ATOM 1014 OG SER A 68 12.694 -25.510 26.167 1.00 0.00 O ATOM 0 H SER A 68 9.615 -25.255 24.565 1.00 0.00 H new ATOM 0 HA SER A 68 11.516 -27.473 24.705 1.00 0.00 H new ATOM 0 HB2 SER A 68 10.874 -25.711 27.108 1.00 0.00 H new ATOM 0 HB3 SER A 68 11.879 -27.147 27.113 1.00 0.00 H new ATOM 0 HG SER A 68 13.132 -25.199 26.987 1.00 0.00 H new ATOM 1020 N LYS A 69 8.568 -26.854 26.067 1.00 0.00 N ATOM 1021 CA LYS A 69 7.312 -27.474 26.473 1.00 0.00 C ATOM 1022 C LYS A 69 6.266 -27.356 25.369 1.00 0.00 C ATOM 1023 O LYS A 69 6.032 -26.272 24.835 1.00 0.00 O ATOM 1024 CB LYS A 69 6.790 -26.826 27.757 1.00 0.00 C ATOM 1025 CG LYS A 69 5.562 -27.517 28.331 1.00 0.00 C ATOM 1026 CD LYS A 69 5.866 -28.187 29.662 1.00 0.00 C ATOM 1027 CE LYS A 69 6.188 -27.164 30.741 1.00 0.00 C ATOM 1028 NZ LYS A 69 5.412 -27.410 31.988 1.00 0.00 N ATOM 0 H LYS A 69 8.579 -25.837 26.139 1.00 0.00 H new ATOM 0 HA LYS A 69 7.501 -28.531 26.659 1.00 0.00 H new ATOM 0 HB2 LYS A 69 7.583 -26.831 28.505 1.00 0.00 H new ATOM 0 HB3 LYS A 69 6.549 -25.782 27.555 1.00 0.00 H new ATOM 0 HG2 LYS A 69 4.763 -26.788 28.464 1.00 0.00 H new ATOM 0 HG3 LYS A 69 5.199 -28.262 27.623 1.00 0.00 H new ATOM 0 HD2 LYS A 69 5.011 -28.787 29.972 1.00 0.00 H new ATOM 0 HD3 LYS A 69 6.708 -28.869 29.543 1.00 0.00 H new ATOM 0 HE2 LYS A 69 7.254 -27.196 30.965 1.00 0.00 H new ATOM 0 HE3 LYS A 69 5.970 -26.163 30.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 5.660 -26.692 32.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 4.394 -27.355 31.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 5.639 -28.355 32.357 1.00 0.00 H new ATOM 1042 N GLU A 70 5.639 -28.479 25.032 1.00 0.00 N ATOM 1043 CA GLU A 70 4.618 -28.502 23.992 1.00 0.00 C ATOM 1044 C GLU A 70 3.650 -29.664 24.205 1.00 0.00 C ATOM 1045 O GLU A 70 3.987 -30.652 24.857 1.00 0.00 O ATOM 1046 CB GLU A 70 5.270 -28.607 22.610 1.00 0.00 C ATOM 1047 CG GLU A 70 5.117 -27.350 21.769 1.00 0.00 C ATOM 1048 CD GLU A 70 5.155 -27.638 20.281 1.00 0.00 C ATOM 1049 OE1 GLU A 70 4.769 -28.757 19.882 1.00 0.00 O ATOM 1050 OE2 GLU A 70 5.571 -26.743 19.514 1.00 0.00 O ATOM 0 H GLU A 70 5.821 -29.385 25.465 1.00 0.00 H new ATOM 0 HA GLU A 70 4.054 -27.571 24.048 1.00 0.00 H new ATOM 0 HB2 GLU A 70 6.331 -28.825 22.733 1.00 0.00 H new ATOM 0 HB3 GLU A 70 4.832 -29.449 22.074 1.00 0.00 H new ATOM 0 HG2 GLU A 70 4.174 -26.863 22.017 1.00 0.00 H new ATOM 0 HG3 GLU A 70 5.913 -26.649 22.021 1.00 0.00 H new ATOM 1057 N PRO A 71 2.429 -29.560 23.653 1.00 0.00 N ATOM 1058 CA PRO A 71 1.411 -30.607 23.785 1.00 0.00 C ATOM 1059 C PRO A 71 1.759 -31.857 22.984 1.00 0.00 C ATOM 1060 O PRO A 71 2.881 -32.004 22.500 1.00 0.00 O ATOM 1061 CB PRO A 71 0.148 -29.948 23.228 1.00 0.00 C ATOM 1062 CG PRO A 71 0.649 -28.914 22.281 1.00 0.00 C ATOM 1063 CD PRO A 71 1.945 -28.415 22.858 1.00 0.00 C ATOM 0 HA PRO A 71 1.309 -30.949 24.815 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -0.488 -30.674 22.722 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -0.449 -29.501 24.023 1.00 0.00 H new ATOM 0 HG2 PRO A 71 0.801 -29.336 21.288 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -0.069 -28.101 22.175 1.00 0.00 H new ATOM 0 HD2 PRO A 71 2.653 -28.140 22.076 1.00 0.00 H new ATOM 0 HD3 PRO A 71 1.795 -27.531 23.477 1.00 0.00 H new ATOM 1071 N ALA A 72 0.789 -32.755 22.847 1.00 0.00 N ATOM 1072 CA ALA A 72 0.993 -33.992 22.104 1.00 0.00 C ATOM 1073 C ALA A 72 0.501 -33.856 20.667 1.00 0.00 C ATOM 1074 O ALA A 72 -0.600 -34.295 20.333 1.00 0.00 O ATOM 1075 CB ALA A 72 0.287 -35.147 22.798 1.00 0.00 C ATOM 0 H ALA A 72 -0.146 -32.649 23.241 1.00 0.00 H new ATOM 0 HA ALA A 72 2.063 -34.198 22.077 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.448 -36.065 22.232 1.00 0.00 H new ATOM 0 HB2 ALA A 72 0.688 -35.266 23.805 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -0.781 -34.939 22.855 1.00 0.00 H new ATOM 1081 N GLY A 73 1.324 -33.247 19.820 1.00 0.00 N ATOM 1082 CA GLY A 73 0.956 -33.065 18.429 1.00 0.00 C ATOM 1083 C GLY A 73 1.672 -34.032 17.507 1.00 0.00 C ATOM 1084 O GLY A 73 2.874 -33.903 17.274 1.00 0.00 O ATOM 0 H GLY A 73 2.240 -32.876 20.073 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -0.121 -33.196 18.321 1.00 0.00 H new ATOM 0 HA3 GLY A 73 1.185 -32.043 18.127 1.00 0.00 H new ATOM 1088 N SER A 74 0.932 -35.003 16.981 1.00 0.00 N ATOM 1089 CA SER A 74 1.504 -35.996 16.079 1.00 0.00 C ATOM 1090 C SER A 74 0.575 -36.259 14.899 1.00 0.00 C ATOM 1091 O SER A 74 -0.603 -36.567 15.080 1.00 0.00 O ATOM 1092 CB SER A 74 1.775 -37.301 16.830 1.00 0.00 C ATOM 1093 OG SER A 74 0.894 -37.450 17.930 1.00 0.00 O ATOM 0 H SER A 74 -0.064 -35.123 17.164 1.00 0.00 H new ATOM 0 HA SER A 74 2.446 -35.602 15.696 1.00 0.00 H new ATOM 0 HB2 SER A 74 1.659 -38.146 16.151 1.00 0.00 H new ATOM 0 HB3 SER A 74 2.806 -37.314 17.182 1.00 0.00 H new ATOM 0 HG SER A 74 1.087 -38.293 18.392 1.00 0.00 H new ATOM 1099 N ASP A 75 1.112 -36.135 13.690 1.00 0.00 N ATOM 1100 CA ASP A 75 0.331 -36.359 12.479 1.00 0.00 C ATOM 1101 C ASP A 75 -0.845 -35.392 12.404 1.00 0.00 C ATOM 1102 O ASP A 75 -1.902 -35.723 11.867 1.00 0.00 O ATOM 1103 CB ASP A 75 -0.177 -37.801 12.434 1.00 0.00 C ATOM 1104 CG ASP A 75 0.946 -38.813 12.557 1.00 0.00 C ATOM 1105 OD1 ASP A 75 1.933 -38.700 11.799 1.00 0.00 O ATOM 1106 OD2 ASP A 75 0.839 -39.718 13.411 1.00 0.00 O ATOM 0 H ASP A 75 2.085 -35.880 13.523 1.00 0.00 H new ATOM 0 HA ASP A 75 0.979 -36.182 11.621 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -0.893 -37.957 13.241 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -0.711 -37.966 11.498 1.00 0.00 H new ATOM 1111 N GLU A 76 -0.654 -34.192 12.945 1.00 0.00 N ATOM 1112 CA GLU A 76 -1.701 -33.176 12.940 1.00 0.00 C ATOM 1113 C GLU A 76 -1.171 -31.855 12.393 1.00 0.00 C ATOM 1114 O GLU A 76 -0.746 -30.983 13.150 1.00 0.00 O ATOM 1115 CB GLU A 76 -2.249 -32.971 14.353 1.00 0.00 C ATOM 1116 CG GLU A 76 -3.742 -32.680 14.389 1.00 0.00 C ATOM 1117 CD GLU A 76 -4.077 -31.447 15.206 1.00 0.00 C ATOM 1118 OE1 GLU A 76 -3.516 -30.371 14.913 1.00 0.00 O ATOM 1119 OE2 GLU A 76 -4.900 -31.559 16.139 1.00 0.00 O ATOM 0 H GLU A 76 0.215 -33.900 13.392 1.00 0.00 H new ATOM 0 HA GLU A 76 -2.506 -33.522 12.292 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -2.046 -33.863 14.946 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -1.715 -32.147 14.825 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -4.107 -32.547 13.371 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -4.266 -33.540 14.805 1.00 0.00 H new ATOM 1126 N GLN A 77 -1.200 -31.713 11.071 1.00 0.00 N ATOM 1127 CA GLN A 77 -0.723 -30.497 10.422 1.00 0.00 C ATOM 1128 C GLN A 77 -1.847 -29.471 10.269 1.00 0.00 C ATOM 1129 O GLN A 77 -1.674 -28.449 9.606 1.00 0.00 O ATOM 1130 CB GLN A 77 -0.127 -30.829 9.052 1.00 0.00 C ATOM 1131 CG GLN A 77 1.368 -30.573 8.961 1.00 0.00 C ATOM 1132 CD GLN A 77 2.172 -31.489 9.864 1.00 0.00 C ATOM 1133 OE1 GLN A 77 2.996 -31.031 10.657 1.00 0.00 O ATOM 1134 NE2 GLN A 77 1.937 -32.790 9.748 1.00 0.00 N ATOM 0 H GLN A 77 -1.549 -32.425 10.429 1.00 0.00 H new ATOM 0 HA GLN A 77 0.050 -30.060 11.054 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -0.322 -31.877 8.824 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -0.636 -30.237 8.291 1.00 0.00 H new ATOM 0 HG2 GLN A 77 1.694 -30.708 7.930 1.00 0.00 H new ATOM 0 HG3 GLN A 77 1.572 -29.536 9.227 1.00 0.00 H new ATOM 0 HE21 GLN A 77 1.245 -33.126 9.078 1.00 0.00 H new ATOM 0 HE22 GLN A 77 2.448 -33.454 10.329 1.00 0.00 H new ATOM 1143 N LYS A 78 -2.996 -29.747 10.885 1.00 0.00 N ATOM 1144 CA LYS A 78 -4.140 -28.844 10.814 1.00 0.00 C ATOM 1145 C LYS A 78 -4.622 -28.683 9.373 1.00 0.00 C ATOM 1146 O LYS A 78 -5.586 -29.324 8.957 1.00 0.00 O ATOM 1147 CB LYS A 78 -3.781 -27.481 11.408 1.00 0.00 C ATOM 1148 CG LYS A 78 -3.767 -27.465 12.927 1.00 0.00 C ATOM 1149 CD LYS A 78 -3.978 -26.060 13.474 1.00 0.00 C ATOM 1150 CE LYS A 78 -5.083 -26.024 14.519 1.00 0.00 C ATOM 1151 NZ LYS A 78 -4.648 -25.334 15.764 1.00 0.00 N ATOM 0 H LYS A 78 -3.158 -30.589 11.438 1.00 0.00 H new ATOM 0 HA LYS A 78 -4.951 -29.280 11.398 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -2.800 -27.181 11.041 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -4.495 -26.739 11.052 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -4.548 -28.125 13.306 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -2.816 -27.857 13.287 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -3.049 -25.697 13.914 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -4.228 -25.385 12.656 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -5.955 -25.515 14.108 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -5.391 -27.042 14.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -5.429 -25.331 16.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -3.832 -25.834 16.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -4.378 -24.354 15.542 1.00 0.00 H new ATOM 1165 N GLN A 79 -3.946 -27.823 8.617 1.00 0.00 N ATOM 1166 CA GLN A 79 -4.308 -27.580 7.225 1.00 0.00 C ATOM 1167 C GLN A 79 -3.195 -28.035 6.287 1.00 0.00 C ATOM 1168 O GLN A 79 -2.013 -27.827 6.562 1.00 0.00 O ATOM 1169 CB GLN A 79 -4.605 -26.095 7.004 1.00 0.00 C ATOM 1170 CG GLN A 79 -6.089 -25.771 6.973 1.00 0.00 C ATOM 1171 CD GLN A 79 -6.584 -25.178 8.277 1.00 0.00 C ATOM 1172 OE1 GLN A 79 -6.696 -25.874 9.286 1.00 0.00 O ATOM 1173 NE2 GLN A 79 -6.884 -23.884 8.264 1.00 0.00 N ATOM 0 H GLN A 79 -3.145 -27.283 8.945 1.00 0.00 H new ATOM 0 HA GLN A 79 -5.205 -28.158 7.002 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -4.131 -25.516 7.797 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -4.152 -25.778 6.064 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -6.287 -25.071 6.161 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -6.651 -26.679 6.755 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -6.776 -23.344 7.405 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -7.222 -23.430 9.113 1.00 0.00 H new ATOM 1182 N LEU A 80 -3.580 -28.659 5.179 1.00 0.00 N ATOM 1183 CA LEU A 80 -2.615 -29.144 4.199 1.00 0.00 C ATOM 1184 C LEU A 80 -2.898 -28.556 2.820 1.00 0.00 C ATOM 1185 O LEU A 80 -1.996 -28.050 2.153 1.00 0.00 O ATOM 1186 CB LEU A 80 -2.651 -30.674 4.132 1.00 0.00 C ATOM 1187 CG LEU A 80 -1.285 -31.346 3.987 1.00 0.00 C ATOM 1188 CD1 LEU A 80 -0.646 -31.557 5.350 1.00 0.00 C ATOM 1189 CD2 LEU A 80 -1.420 -32.669 3.248 1.00 0.00 C ATOM 0 H LEU A 80 -4.554 -28.841 4.937 1.00 0.00 H new ATOM 0 HA LEU A 80 -1.622 -28.824 4.513 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -3.131 -31.051 5.035 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -3.277 -30.971 3.291 1.00 0.00 H new ATOM 0 HG LEU A 80 -0.638 -30.690 3.404 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.325 -32.036 5.226 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -0.515 -30.594 5.844 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -1.289 -32.192 5.959 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -0.439 -33.135 3.153 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -2.083 -33.331 3.805 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -1.835 -32.491 2.256 1.00 0.00 H new ATOM 1201 N ARG A 81 -4.157 -28.624 2.402 1.00 0.00 N ATOM 1202 CA ARG A 81 -4.559 -28.097 1.103 1.00 0.00 C ATOM 1203 C ARG A 81 -6.058 -27.814 1.072 1.00 0.00 C ATOM 1204 O ARG A 81 -6.846 -28.521 1.698 1.00 0.00 O ATOM 1205 CB ARG A 81 -4.191 -29.083 -0.007 1.00 0.00 C ATOM 1206 CG ARG A 81 -4.207 -28.468 -1.396 1.00 0.00 C ATOM 1207 CD ARG A 81 -3.354 -29.266 -2.369 1.00 0.00 C ATOM 1208 NE ARG A 81 -4.087 -30.391 -2.944 1.00 0.00 N ATOM 1209 CZ ARG A 81 -3.676 -31.078 -4.007 1.00 0.00 C ATOM 1210 NH1 ARG A 81 -2.538 -30.761 -4.612 1.00 0.00 N ATOM 1211 NH2 ARG A 81 -4.404 -32.087 -4.466 1.00 0.00 N ATOM 0 H ARG A 81 -4.916 -29.038 2.943 1.00 0.00 H new ATOM 0 HA ARG A 81 -4.027 -27.160 0.938 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -3.198 -29.486 0.191 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -4.887 -29.922 0.018 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -5.232 -28.422 -1.763 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -3.840 -27.443 -1.345 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -3.008 -28.612 -3.169 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -2.467 -29.636 -1.854 1.00 0.00 H new ATOM 0 HE ARG A 81 -4.966 -30.666 -2.505 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -1.973 -29.987 -4.263 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -2.228 -31.291 -5.426 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -5.279 -32.336 -4.004 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -4.089 -32.614 -5.281 1.00 0.00 H new ATOM 1225 N ALA A 82 -6.443 -26.776 0.338 1.00 0.00 N ATOM 1226 CA ALA A 82 -7.847 -26.399 0.224 1.00 0.00 C ATOM 1227 C ALA A 82 -8.439 -26.880 -1.096 1.00 0.00 C ATOM 1228 O ALA A 82 -7.903 -26.599 -2.168 1.00 0.00 O ATOM 1229 CB ALA A 82 -8.000 -24.892 0.355 1.00 0.00 C ATOM 0 H ALA A 82 -5.803 -26.181 -0.187 1.00 0.00 H new ATOM 0 HA ALA A 82 -8.394 -26.881 1.034 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -9.053 -24.624 0.268 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.623 -24.571 1.326 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -7.434 -24.399 -0.435 1.00 0.00 H new ATOM 1235 N ASP A 83 -9.550 -27.605 -1.011 1.00 0.00 N ATOM 1236 CA ASP A 83 -10.217 -28.122 -2.200 1.00 0.00 C ATOM 1237 C ASP A 83 -11.606 -28.663 -1.856 1.00 0.00 C ATOM 1238 O ASP A 83 -12.615 -28.124 -2.312 1.00 0.00 O ATOM 1239 CB ASP A 83 -9.369 -29.216 -2.856 1.00 0.00 C ATOM 1240 CG ASP A 83 -8.988 -28.874 -4.283 1.00 0.00 C ATOM 1241 OD1 ASP A 83 -9.902 -28.682 -5.112 1.00 0.00 O ATOM 1242 OD2 ASP A 83 -7.775 -28.799 -4.571 1.00 0.00 O ATOM 0 H ASP A 83 -10.007 -27.847 -0.132 1.00 0.00 H new ATOM 0 HA ASP A 83 -10.336 -27.300 -2.906 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -8.464 -29.372 -2.269 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -9.922 -30.156 -2.846 1.00 0.00 H new ATOM 1247 N PRO A 84 -11.679 -29.737 -1.047 1.00 0.00 N ATOM 1248 CA PRO A 84 -12.949 -30.344 -0.648 1.00 0.00 C ATOM 1249 C PRO A 84 -14.011 -29.303 -0.285 1.00 0.00 C ATOM 1250 O PRO A 84 -15.087 -29.275 -0.881 1.00 0.00 O ATOM 1251 CB PRO A 84 -12.587 -31.204 0.576 1.00 0.00 C ATOM 1252 CG PRO A 84 -11.117 -31.020 0.806 1.00 0.00 C ATOM 1253 CD PRO A 84 -10.541 -30.449 -0.459 1.00 0.00 C ATOM 0 HA PRO A 84 -13.388 -30.919 -1.463 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -13.158 -30.894 1.451 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -12.823 -32.253 0.397 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -10.939 -30.350 1.647 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -10.643 -31.971 1.050 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -9.706 -29.778 -0.256 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -10.168 -31.230 -1.121 1.00 0.00 H new ATOM 1261 N PRO A 85 -13.725 -28.426 0.697 1.00 0.00 N ATOM 1262 CA PRO A 85 -14.669 -27.386 1.121 1.00 0.00 C ATOM 1263 C PRO A 85 -14.851 -26.303 0.063 1.00 0.00 C ATOM 1264 O PRO A 85 -13.903 -25.936 -0.632 1.00 0.00 O ATOM 1265 CB PRO A 85 -14.017 -26.802 2.376 1.00 0.00 C ATOM 1266 CG PRO A 85 -12.563 -27.068 2.202 1.00 0.00 C ATOM 1267 CD PRO A 85 -12.467 -28.377 1.468 1.00 0.00 C ATOM 0 HA PRO A 85 -15.667 -27.788 1.292 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -14.217 -25.734 2.466 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -14.401 -27.276 3.279 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -12.085 -26.268 1.637 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -12.058 -27.123 3.166 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -11.594 -28.410 0.816 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -12.383 -29.219 2.155 1.00 0.00 H new ATOM 1275 N SER A 86 -16.073 -25.793 -0.052 1.00 0.00 N ATOM 1276 CA SER A 86 -16.376 -24.751 -1.026 1.00 0.00 C ATOM 1277 C SER A 86 -17.781 -24.195 -0.810 1.00 0.00 C ATOM 1278 O SER A 86 -17.950 -23.040 -0.420 1.00 0.00 O ATOM 1279 CB SER A 86 -16.245 -25.297 -2.449 1.00 0.00 C ATOM 1280 OG SER A 86 -16.474 -26.694 -2.484 1.00 0.00 O ATOM 0 H SER A 86 -16.868 -26.084 0.516 1.00 0.00 H new ATOM 0 HA SER A 86 -15.659 -23.942 -0.888 1.00 0.00 H new ATOM 0 HB2 SER A 86 -16.957 -24.793 -3.102 1.00 0.00 H new ATOM 0 HB3 SER A 86 -15.249 -25.079 -2.835 1.00 0.00 H new ATOM 0 HG SER A 86 -16.386 -27.017 -3.405 1.00 0.00 H new ATOM 1286 N THR A 87 -18.786 -25.026 -1.067 1.00 0.00 N ATOM 1287 CA THR A 87 -20.177 -24.619 -0.901 1.00 0.00 C ATOM 1288 C THR A 87 -20.535 -24.496 0.578 1.00 0.00 C ATOM 1289 O THR A 87 -19.690 -24.697 1.449 1.00 0.00 O ATOM 1290 CB THR A 87 -21.107 -25.623 -1.581 1.00 0.00 C ATOM 1291 OG1 THR A 87 -20.691 -26.951 -1.319 1.00 0.00 O ATOM 1292 CG2 THR A 87 -21.178 -25.451 -3.083 1.00 0.00 C ATOM 0 H THR A 87 -18.663 -25.985 -1.391 1.00 0.00 H new ATOM 0 HA THR A 87 -20.303 -23.643 -1.369 1.00 0.00 H new ATOM 0 HB THR A 87 -22.095 -25.430 -1.163 1.00 0.00 H new ATOM 0 HG1 THR A 87 -21.300 -27.578 -1.762 1.00 0.00 H new ATOM 0 HG21 THR A 87 -21.855 -26.195 -3.503 1.00 0.00 H new ATOM 0 HG22 THR A 87 -21.546 -24.452 -3.318 1.00 0.00 H new ATOM 0 HG23 THR A 87 -20.184 -25.582 -3.512 1.00 0.00 H new ATOM 1300 N ASP A 88 -21.796 -24.168 0.850 1.00 0.00 N ATOM 1301 CA ASP A 88 -22.274 -24.017 2.222 1.00 0.00 C ATOM 1302 C ASP A 88 -21.629 -22.810 2.897 1.00 0.00 C ATOM 1303 O ASP A 88 -22.291 -21.806 3.160 1.00 0.00 O ATOM 1304 CB ASP A 88 -21.990 -25.287 3.031 1.00 0.00 C ATOM 1305 CG ASP A 88 -23.233 -26.127 3.242 1.00 0.00 C ATOM 1306 OD1 ASP A 88 -24.242 -25.580 3.734 1.00 0.00 O ATOM 1307 OD2 ASP A 88 -23.198 -27.332 2.916 1.00 0.00 O ATOM 0 H ASP A 88 -22.506 -24.001 0.137 1.00 0.00 H new ATOM 0 HA ASP A 88 -23.351 -23.854 2.186 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -21.236 -25.882 2.516 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -21.572 -25.012 3.999 1.00 0.00 H new ATOM 1312 N LEU A 89 -20.334 -22.916 3.179 1.00 0.00 N ATOM 1313 CA LEU A 89 -19.601 -21.833 3.825 1.00 0.00 C ATOM 1314 C LEU A 89 -19.548 -20.589 2.938 1.00 0.00 C ATOM 1315 O LEU A 89 -19.234 -19.496 3.411 1.00 0.00 O ATOM 1316 CB LEU A 89 -18.181 -22.287 4.177 1.00 0.00 C ATOM 1317 CG LEU A 89 -17.946 -22.593 5.659 1.00 0.00 C ATOM 1318 CD1 LEU A 89 -18.202 -21.359 6.511 1.00 0.00 C ATOM 1319 CD2 LEU A 89 -18.830 -23.746 6.109 1.00 0.00 C ATOM 0 H LEU A 89 -19.771 -23.741 2.970 1.00 0.00 H new ATOM 0 HA LEU A 89 -20.131 -21.573 4.741 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -17.947 -23.179 3.596 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -17.481 -21.512 3.866 1.00 0.00 H new ATOM 0 HG LEU A 89 -16.904 -22.885 5.788 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -18.029 -21.599 7.560 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -17.527 -20.560 6.206 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -19.234 -21.033 6.379 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -18.651 -23.951 7.164 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -19.877 -23.480 5.963 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -18.596 -24.634 5.522 1.00 0.00 H new ATOM 1331 N ASN A 90 -19.852 -20.758 1.652 1.00 0.00 N ATOM 1332 CA ASN A 90 -19.831 -19.643 0.707 1.00 0.00 C ATOM 1333 C ASN A 90 -20.589 -18.437 1.258 1.00 0.00 C ATOM 1334 O ASN A 90 -20.081 -17.316 1.245 1.00 0.00 O ATOM 1335 CB ASN A 90 -20.437 -20.071 -0.630 1.00 0.00 C ATOM 1336 CG ASN A 90 -20.282 -19.009 -1.702 1.00 0.00 C ATOM 1337 OD1 ASN A 90 -21.259 -18.594 -2.327 1.00 0.00 O ATOM 1338 ND2 ASN A 90 -19.051 -18.565 -1.921 1.00 0.00 N ATOM 0 H ASN A 90 -20.115 -21.654 1.242 1.00 0.00 H new ATOM 0 HA ASN A 90 -18.791 -19.353 0.555 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -19.960 -20.992 -0.964 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -21.495 -20.292 -0.492 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -18.885 -17.852 -2.631 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -18.271 -18.937 -1.380 1.00 0.00 H new ATOM 1345 N THR A 91 -21.807 -18.671 1.739 1.00 0.00 N ATOM 1346 CA THR A 91 -22.631 -17.597 2.290 1.00 0.00 C ATOM 1347 C THR A 91 -21.987 -16.947 3.522 1.00 0.00 C ATOM 1348 O THR A 91 -22.455 -15.911 3.993 1.00 0.00 O ATOM 1349 CB THR A 91 -24.021 -18.130 2.652 1.00 0.00 C ATOM 1350 OG1 THR A 91 -24.144 -19.498 2.305 1.00 0.00 O ATOM 1351 CG2 THR A 91 -25.144 -17.383 1.968 1.00 0.00 C ATOM 0 H THR A 91 -22.245 -19.592 1.759 1.00 0.00 H new ATOM 0 HA THR A 91 -22.720 -16.830 1.520 1.00 0.00 H new ATOM 0 HB THR A 91 -24.111 -17.987 3.729 1.00 0.00 H new ATOM 0 HG1 THR A 91 -25.038 -19.818 2.547 1.00 0.00 H new ATOM 0 HG21 THR A 91 -26.101 -17.811 2.268 1.00 0.00 H new ATOM 0 HG22 THR A 91 -25.110 -16.332 2.256 1.00 0.00 H new ATOM 0 HG23 THR A 91 -25.032 -17.467 0.887 1.00 0.00 H new ATOM 1359 N PHE A 92 -20.915 -17.549 4.045 1.00 0.00 N ATOM 1360 CA PHE A 92 -20.231 -17.009 5.214 1.00 0.00 C ATOM 1361 C PHE A 92 -18.919 -16.343 4.810 1.00 0.00 C ATOM 1362 O PHE A 92 -18.092 -16.947 4.125 1.00 0.00 O ATOM 1363 CB PHE A 92 -19.962 -18.126 6.226 1.00 0.00 C ATOM 1364 CG PHE A 92 -21.192 -18.898 6.615 1.00 0.00 C ATOM 1365 CD1 PHE A 92 -21.856 -19.683 5.686 1.00 0.00 C ATOM 1366 CD2 PHE A 92 -21.684 -18.839 7.909 1.00 0.00 C ATOM 1367 CE1 PHE A 92 -22.988 -20.395 6.040 1.00 0.00 C ATOM 1368 CE2 PHE A 92 -22.813 -19.548 8.270 1.00 0.00 C ATOM 1369 CZ PHE A 92 -23.467 -20.326 7.334 1.00 0.00 C ATOM 0 H PHE A 92 -20.506 -18.408 3.676 1.00 0.00 H new ATOM 0 HA PHE A 92 -20.873 -16.257 5.673 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -19.229 -18.815 5.807 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -19.517 -17.693 7.122 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -21.485 -19.740 4.673 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -21.178 -18.231 8.645 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -23.496 -21.003 5.306 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -23.184 -19.494 9.283 1.00 0.00 H new ATOM 0 HZ PHE A 92 -24.351 -20.879 7.614 1.00 0.00 H new ATOM 1379 N THR A 93 -18.734 -15.095 5.231 1.00 0.00 N ATOM 1380 CA THR A 93 -17.520 -14.351 4.903 1.00 0.00 C ATOM 1381 C THR A 93 -16.724 -14.014 6.165 1.00 0.00 C ATOM 1382 O THR A 93 -15.832 -14.764 6.562 1.00 0.00 O ATOM 1383 CB THR A 93 -17.866 -13.076 4.118 1.00 0.00 C ATOM 1384 OG1 THR A 93 -16.898 -12.066 4.340 1.00 0.00 O ATOM 1385 CG2 THR A 93 -19.221 -12.494 4.467 1.00 0.00 C ATOM 0 H THR A 93 -19.406 -14.578 5.798 1.00 0.00 H new ATOM 0 HA THR A 93 -16.894 -14.983 4.273 1.00 0.00 H new ATOM 0 HB THR A 93 -17.883 -13.387 3.073 1.00 0.00 H new ATOM 0 HG1 THR A 93 -17.138 -11.265 3.829 1.00 0.00 H new ATOM 0 HG21 THR A 93 -19.395 -11.596 3.874 1.00 0.00 H new ATOM 0 HG22 THR A 93 -19.998 -13.227 4.252 1.00 0.00 H new ATOM 0 HG23 THR A 93 -19.245 -12.239 5.526 1.00 0.00 H new ATOM 1393 N VAL A 94 -17.047 -12.886 6.793 1.00 0.00 N ATOM 1394 CA VAL A 94 -16.359 -12.461 8.010 1.00 0.00 C ATOM 1395 C VAL A 94 -17.273 -11.612 8.888 1.00 0.00 C ATOM 1396 O VAL A 94 -17.241 -11.707 10.105 1.00 0.00 O ATOM 1397 CB VAL A 94 -15.065 -11.670 7.704 1.00 0.00 C ATOM 1398 CG1 VAL A 94 -13.847 -12.575 7.821 1.00 0.00 C ATOM 1399 CG2 VAL A 94 -15.125 -11.028 6.324 1.00 0.00 C ATOM 0 H VAL A 94 -17.780 -12.250 6.480 1.00 0.00 H new ATOM 0 HA VAL A 94 -16.085 -13.371 8.543 1.00 0.00 H new ATOM 0 HB VAL A 94 -14.977 -10.871 8.441 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -12.946 -12.002 7.602 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -13.786 -12.975 8.833 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -13.935 -13.397 7.111 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -14.202 -10.479 6.138 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -15.246 -11.803 5.567 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -15.971 -10.342 6.278 1.00 0.00 H new ATOM 1409 N GLU A 95 -18.091 -10.785 8.263 1.00 0.00 N ATOM 1410 CA GLU A 95 -19.028 -9.940 8.990 1.00 0.00 C ATOM 1411 C GLU A 95 -20.308 -10.706 9.328 1.00 0.00 C ATOM 1412 O GLU A 95 -21.078 -10.297 10.197 1.00 0.00 O ATOM 1413 CB GLU A 95 -19.363 -8.688 8.176 1.00 0.00 C ATOM 1414 CG GLU A 95 -20.102 -8.986 6.880 1.00 0.00 C ATOM 1415 CD GLU A 95 -19.536 -8.222 5.698 1.00 0.00 C ATOM 1416 OE1 GLU A 95 -19.333 -6.997 5.826 1.00 0.00 O ATOM 1417 OE2 GLU A 95 -19.299 -8.849 4.645 1.00 0.00 O ATOM 0 H GLU A 95 -18.127 -10.678 7.249 1.00 0.00 H new ATOM 0 HA GLU A 95 -18.553 -9.637 9.923 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -19.971 -8.020 8.786 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -18.440 -8.157 7.945 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -20.052 -10.055 6.675 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -21.156 -8.734 7.000 1.00 0.00 H new ATOM 1424 N GLN A 96 -20.548 -11.799 8.602 1.00 0.00 N ATOM 1425 CA GLN A 96 -21.752 -12.600 8.785 1.00 0.00 C ATOM 1426 C GLN A 96 -21.665 -13.497 10.005 1.00 0.00 C ATOM 1427 O GLN A 96 -22.630 -13.617 10.760 1.00 0.00 O ATOM 1428 CB GLN A 96 -22.010 -13.447 7.535 1.00 0.00 C ATOM 1429 CG GLN A 96 -23.475 -13.511 7.136 1.00 0.00 C ATOM 1430 CD GLN A 96 -24.133 -14.814 7.547 1.00 0.00 C ATOM 1431 OE1 GLN A 96 -23.471 -15.843 7.683 1.00 0.00 O ATOM 1432 NE2 GLN A 96 -25.445 -14.775 7.748 1.00 0.00 N ATOM 0 H GLN A 96 -19.919 -12.148 7.879 1.00 0.00 H new ATOM 0 HA GLN A 96 -22.581 -11.910 8.944 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -21.433 -13.040 6.705 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -21.645 -14.459 7.710 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -24.009 -12.678 7.593 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -23.560 -13.390 6.056 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -25.954 -13.900 7.624 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -25.944 -15.620 8.027 1.00 0.00 H new ATOM 1441 N LEU A 97 -20.521 -14.133 10.200 1.00 0.00 N ATOM 1442 CA LEU A 97 -20.367 -15.014 11.347 1.00 0.00 C ATOM 1443 C LEU A 97 -20.450 -14.206 12.635 1.00 0.00 C ATOM 1444 O LEU A 97 -21.287 -14.483 13.487 1.00 0.00 O ATOM 1445 CB LEU A 97 -19.078 -15.856 11.299 1.00 0.00 C ATOM 1446 CG LEU A 97 -17.997 -15.454 10.301 1.00 0.00 C ATOM 1447 CD1 LEU A 97 -18.488 -15.572 8.865 1.00 0.00 C ATOM 1448 CD2 LEU A 97 -17.509 -14.061 10.598 1.00 0.00 C ATOM 0 H LEU A 97 -19.703 -14.060 9.595 1.00 0.00 H new ATOM 0 HA LEU A 97 -21.188 -15.730 11.315 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -18.634 -15.844 12.295 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -19.361 -16.887 11.088 1.00 0.00 H new ATOM 0 HG LEU A 97 -17.161 -16.145 10.409 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -17.691 -15.277 8.183 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -18.776 -16.604 8.663 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -19.349 -14.920 8.720 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -16.738 -13.785 9.879 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -18.341 -13.361 10.525 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -17.095 -14.028 11.606 1.00 0.00 H new ATOM 1460 N LYS A 98 -19.603 -13.192 12.770 1.00 0.00 N ATOM 1461 CA LYS A 98 -19.633 -12.347 13.966 1.00 0.00 C ATOM 1462 C LYS A 98 -21.049 -11.849 14.249 1.00 0.00 C ATOM 1463 O LYS A 98 -21.424 -11.662 15.406 1.00 0.00 O ATOM 1464 CB LYS A 98 -18.675 -11.153 13.849 1.00 0.00 C ATOM 1465 CG LYS A 98 -18.510 -10.585 12.446 1.00 0.00 C ATOM 1466 CD LYS A 98 -17.074 -10.137 12.202 1.00 0.00 C ATOM 1467 CE LYS A 98 -16.083 -11.273 12.428 1.00 0.00 C ATOM 1468 NZ LYS A 98 -14.863 -11.119 11.587 1.00 0.00 N ATOM 0 H LYS A 98 -18.897 -12.935 12.081 1.00 0.00 H new ATOM 0 HA LYS A 98 -19.300 -12.967 14.799 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -19.030 -10.358 14.505 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -17.695 -11.457 14.217 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -18.789 -11.339 11.710 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -19.186 -9.741 12.310 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -16.977 -9.767 11.181 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -16.834 -9.307 12.866 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -15.798 -11.303 13.480 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -16.563 -12.225 12.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -14.145 -11.809 11.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -15.106 -11.285 10.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -14.485 -10.156 11.696 1.00 0.00 H new ATOM 1482 N ALA A 99 -21.837 -11.642 13.196 1.00 0.00 N ATOM 1483 CA ALA A 99 -23.211 -11.175 13.363 1.00 0.00 C ATOM 1484 C ALA A 99 -24.165 -12.329 13.618 1.00 0.00 C ATOM 1485 O ALA A 99 -25.223 -12.158 14.224 1.00 0.00 O ATOM 1486 CB ALA A 99 -23.653 -10.370 12.150 1.00 0.00 C ATOM 0 H ALA A 99 -21.552 -11.788 12.228 1.00 0.00 H new ATOM 0 HA ALA A 99 -23.237 -10.527 14.239 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -24.679 -10.031 12.293 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -22.999 -9.507 12.028 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -23.598 -10.995 11.259 1.00 0.00 H new ATOM 1492 N GLN A 100 -23.780 -13.501 13.154 1.00 0.00 N ATOM 1493 CA GLN A 100 -24.590 -14.699 13.326 1.00 0.00 C ATOM 1494 C GLN A 100 -24.285 -15.375 14.659 1.00 0.00 C ATOM 1495 O GLN A 100 -25.193 -15.803 15.371 1.00 0.00 O ATOM 1496 CB GLN A 100 -24.351 -15.677 12.173 1.00 0.00 C ATOM 1497 CG GLN A 100 -25.199 -15.387 10.946 1.00 0.00 C ATOM 1498 CD GLN A 100 -25.946 -16.611 10.451 1.00 0.00 C ATOM 1499 OE1 GLN A 100 -27.155 -16.736 10.647 1.00 0.00 O ATOM 1500 NE2 GLN A 100 -25.226 -17.522 9.806 1.00 0.00 N ATOM 0 H GLN A 100 -22.906 -13.654 12.651 1.00 0.00 H new ATOM 0 HA GLN A 100 -25.638 -14.401 13.323 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -23.298 -15.645 11.893 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -24.559 -16.690 12.517 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -25.915 -14.600 11.181 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -24.560 -15.009 10.148 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -24.226 -17.377 9.666 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -25.673 -18.367 9.450 1.00 0.00 H new ATOM 1509 N LEU A 101 -22.999 -15.469 14.989 1.00 0.00 N ATOM 1510 CA LEU A 101 -22.568 -16.094 16.233 1.00 0.00 C ATOM 1511 C LEU A 101 -23.259 -15.443 17.423 1.00 0.00 C ATOM 1512 O LEU A 101 -23.776 -16.125 18.307 1.00 0.00 O ATOM 1513 CB LEU A 101 -21.048 -15.977 16.397 1.00 0.00 C ATOM 1514 CG LEU A 101 -20.227 -17.125 15.800 1.00 0.00 C ATOM 1515 CD1 LEU A 101 -18.778 -17.039 16.256 1.00 0.00 C ATOM 1516 CD2 LEU A 101 -20.826 -18.476 16.171 1.00 0.00 C ATOM 0 H LEU A 101 -22.237 -15.119 14.409 1.00 0.00 H new ATOM 0 HA LEU A 101 -22.841 -17.148 16.193 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -20.722 -15.044 15.938 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -20.820 -15.906 17.460 1.00 0.00 H new ATOM 0 HG LEU A 101 -20.254 -17.031 14.714 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -18.211 -17.862 15.822 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -18.350 -16.091 15.930 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -18.734 -17.102 17.343 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -20.224 -19.273 15.735 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -20.838 -18.583 17.256 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -21.845 -18.540 15.788 1.00 0.00 H new ATOM 1528 N THR A 102 -23.268 -14.117 17.431 1.00 0.00 N ATOM 1529 CA THR A 102 -23.904 -13.374 18.505 1.00 0.00 C ATOM 1530 C THR A 102 -25.403 -13.605 18.474 1.00 0.00 C ATOM 1531 O THR A 102 -26.046 -13.736 19.516 1.00 0.00 O ATOM 1532 CB THR A 102 -23.606 -11.882 18.376 1.00 0.00 C ATOM 1533 OG1 THR A 102 -23.236 -11.554 17.049 1.00 0.00 O ATOM 1534 CG2 THR A 102 -22.498 -11.424 19.290 1.00 0.00 C ATOM 0 H THR A 102 -22.843 -13.537 16.707 1.00 0.00 H new ATOM 0 HA THR A 102 -23.504 -13.727 19.456 1.00 0.00 H new ATOM 0 HB THR A 102 -24.528 -11.374 18.659 1.00 0.00 H new ATOM 0 HG1 THR A 102 -22.276 -11.712 16.928 1.00 0.00 H new ATOM 0 HG21 THR A 102 -22.332 -10.355 19.153 1.00 0.00 H new ATOM 0 HG22 THR A 102 -22.777 -11.618 20.326 1.00 0.00 H new ATOM 0 HG23 THR A 102 -21.583 -11.967 19.053 1.00 0.00 H new ATOM 1542 N GLU A 103 -25.953 -13.656 17.268 1.00 0.00 N ATOM 1543 CA GLU A 103 -27.379 -13.872 17.104 1.00 0.00 C ATOM 1544 C GLU A 103 -27.788 -15.259 17.587 1.00 0.00 C ATOM 1545 O GLU A 103 -28.969 -15.526 17.812 1.00 0.00 O ATOM 1546 CB GLU A 103 -27.790 -13.674 15.642 1.00 0.00 C ATOM 1547 CG GLU A 103 -28.562 -12.387 15.396 1.00 0.00 C ATOM 1548 CD GLU A 103 -29.972 -12.637 14.898 1.00 0.00 C ATOM 1549 OE1 GLU A 103 -30.756 -13.276 15.632 1.00 0.00 O ATOM 1550 OE2 GLU A 103 -30.293 -12.194 13.776 1.00 0.00 O ATOM 0 H GLU A 103 -25.435 -13.551 16.396 1.00 0.00 H new ATOM 0 HA GLU A 103 -27.899 -13.135 17.716 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -26.896 -13.677 15.018 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -28.401 -14.520 15.327 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -28.604 -11.811 16.320 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -28.026 -11.780 14.667 1.00 0.00 H new ATOM 1557 N ARG A 104 -26.807 -16.134 17.755 1.00 0.00 N ATOM 1558 CA ARG A 104 -27.068 -17.493 18.223 1.00 0.00 C ATOM 1559 C ARG A 104 -26.587 -17.680 19.662 1.00 0.00 C ATOM 1560 O ARG A 104 -26.961 -18.645 20.328 1.00 0.00 O ATOM 1561 CB ARG A 104 -26.395 -18.517 17.306 1.00 0.00 C ATOM 1562 CG ARG A 104 -24.885 -18.376 17.237 1.00 0.00 C ATOM 1563 CD ARG A 104 -24.256 -19.503 16.435 1.00 0.00 C ATOM 1564 NE ARG A 104 -23.773 -20.583 17.293 1.00 0.00 N ATOM 1565 CZ ARG A 104 -23.357 -21.762 16.837 1.00 0.00 C ATOM 1566 NH1 ARG A 104 -23.363 -22.017 15.534 1.00 0.00 N ATOM 1567 NH2 ARG A 104 -22.935 -22.689 17.686 1.00 0.00 N ATOM 0 H ARG A 104 -25.824 -15.930 17.575 1.00 0.00 H new ATOM 0 HA ARG A 104 -28.146 -17.653 18.198 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -26.642 -19.520 17.654 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -26.806 -18.418 16.302 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -24.628 -17.418 16.784 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -24.473 -18.372 18.246 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -24.988 -19.899 15.731 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -23.427 -19.110 15.846 1.00 0.00 H new ATOM 0 HE ARG A 104 -23.754 -20.424 18.300 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -23.688 -21.308 14.877 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -23.043 -22.922 15.190 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -22.929 -22.498 18.688 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -22.616 -23.593 17.337 1.00 0.00 H new ATOM 1581 N GLY A 105 -25.760 -16.751 20.138 1.00 0.00 N ATOM 1582 CA GLY A 105 -25.252 -16.834 21.495 1.00 0.00 C ATOM 1583 C GLY A 105 -24.149 -17.862 21.648 1.00 0.00 C ATOM 1584 O GLY A 105 -24.402 -19.000 22.044 1.00 0.00 O ATOM 0 H GLY A 105 -25.434 -15.943 19.607 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -24.876 -15.857 21.798 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -26.071 -17.083 22.170 1.00 0.00 H new ATOM 1588 N ILE A 106 -22.921 -17.462 21.333 1.00 0.00 N ATOM 1589 CA ILE A 106 -21.775 -18.360 21.440 1.00 0.00 C ATOM 1590 C ILE A 106 -20.666 -17.754 22.300 1.00 0.00 C ATOM 1591 O ILE A 106 -20.021 -18.455 23.078 1.00 0.00 O ATOM 1592 CB ILE A 106 -21.204 -18.710 20.052 1.00 0.00 C ATOM 1593 CG1 ILE A 106 -20.120 -19.783 20.177 1.00 0.00 C ATOM 1594 CG2 ILE A 106 -20.650 -17.466 19.373 1.00 0.00 C ATOM 1595 CD1 ILE A 106 -19.870 -20.542 18.892 1.00 0.00 C ATOM 0 H ILE A 106 -22.694 -16.524 21.002 1.00 0.00 H new ATOM 0 HA ILE A 106 -22.136 -19.271 21.918 1.00 0.00 H new ATOM 0 HB ILE A 106 -22.011 -19.105 19.435 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -19.191 -19.313 20.499 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -20.407 -20.489 20.956 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -20.251 -17.733 18.394 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -21.447 -16.732 19.252 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -19.855 -17.041 19.985 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -19.090 -21.286 19.055 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -20.787 -21.041 18.580 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -19.552 -19.847 18.115 1.00 0.00 H new ATOM 1607 N THR A 107 -20.444 -16.450 22.148 1.00 0.00 N ATOM 1608 CA THR A 107 -19.407 -15.754 22.905 1.00 0.00 C ATOM 1609 C THR A 107 -18.020 -16.151 22.408 1.00 0.00 C ATOM 1610 O THR A 107 -17.408 -17.086 22.925 1.00 0.00 O ATOM 1611 CB THR A 107 -19.533 -16.057 24.401 1.00 0.00 C ATOM 1612 OG1 THR A 107 -20.891 -16.035 24.803 1.00 0.00 O ATOM 1613 CG2 THR A 107 -18.779 -15.079 25.275 1.00 0.00 C ATOM 0 H THR A 107 -20.969 -15.854 21.507 1.00 0.00 H new ATOM 0 HA THR A 107 -19.541 -14.683 22.753 1.00 0.00 H new ATOM 0 HB THR A 107 -19.097 -17.047 24.534 1.00 0.00 H new ATOM 0 HG1 THR A 107 -20.952 -16.232 25.761 1.00 0.00 H new ATOM 0 HG21 THR A 107 -18.910 -15.351 26.322 1.00 0.00 H new ATOM 0 HG22 THR A 107 -17.719 -15.108 25.023 1.00 0.00 H new ATOM 0 HG23 THR A 107 -19.164 -14.073 25.111 1.00 0.00 H new ATOM 1621 N PHE A 108 -17.533 -15.436 21.399 1.00 0.00 N ATOM 1622 CA PHE A 108 -16.221 -15.715 20.826 1.00 0.00 C ATOM 1623 C PHE A 108 -15.270 -14.540 21.039 1.00 0.00 C ATOM 1624 O PHE A 108 -15.570 -13.409 20.658 1.00 0.00 O ATOM 1625 CB PHE A 108 -16.349 -16.021 19.331 1.00 0.00 C ATOM 1626 CG PHE A 108 -16.739 -14.831 18.499 1.00 0.00 C ATOM 1627 CD1 PHE A 108 -18.031 -14.328 18.546 1.00 0.00 C ATOM 1628 CD2 PHE A 108 -15.814 -14.215 17.672 1.00 0.00 C ATOM 1629 CE1 PHE A 108 -18.391 -13.234 17.781 1.00 0.00 C ATOM 1630 CE2 PHE A 108 -16.169 -13.120 16.906 1.00 0.00 C ATOM 1631 CZ PHE A 108 -17.459 -12.630 16.961 1.00 0.00 C ATOM 0 H PHE A 108 -18.027 -14.659 20.961 1.00 0.00 H new ATOM 0 HA PHE A 108 -15.809 -16.587 21.334 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -15.399 -16.411 18.967 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -17.091 -16.808 19.193 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -18.763 -14.796 19.187 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -14.804 -14.594 17.625 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -19.400 -12.852 17.825 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -15.438 -12.648 16.265 1.00 0.00 H new ATOM 0 HZ PHE A 108 -17.738 -11.775 16.363 1.00 0.00 H new ATOM 1641 N LYS A 109 -14.121 -14.818 21.648 1.00 0.00 N ATOM 1642 CA LYS A 109 -13.126 -13.784 21.909 1.00 0.00 C ATOM 1643 C LYS A 109 -11.875 -14.377 22.548 1.00 0.00 C ATOM 1644 O LYS A 109 -11.263 -13.764 23.423 1.00 0.00 O ATOM 1645 CB LYS A 109 -13.710 -12.699 22.817 1.00 0.00 C ATOM 1646 CG LYS A 109 -12.925 -11.397 22.790 1.00 0.00 C ATOM 1647 CD LYS A 109 -13.333 -10.475 23.929 1.00 0.00 C ATOM 1648 CE LYS A 109 -12.120 -9.872 24.622 1.00 0.00 C ATOM 1649 NZ LYS A 109 -12.298 -9.809 26.099 1.00 0.00 N ATOM 0 H LYS A 109 -13.857 -15.749 21.969 1.00 0.00 H new ATOM 0 HA LYS A 109 -12.847 -13.338 20.954 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -14.739 -12.500 22.516 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -13.744 -13.072 23.840 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -11.859 -11.613 22.859 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -13.087 -10.893 21.837 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -13.967 -9.677 23.543 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -13.928 -11.032 24.653 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -11.236 -10.465 24.388 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -11.942 -8.869 24.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -11.450 -9.392 26.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -13.126 -9.222 26.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -12.442 -10.769 26.473 1.00 0.00 H new ATOM 1663 N GLN A 110 -11.498 -15.574 22.108 1.00 0.00 N ATOM 1664 CA GLN A 110 -10.317 -16.244 22.644 1.00 0.00 C ATOM 1665 C GLN A 110 -9.966 -17.487 21.830 1.00 0.00 C ATOM 1666 O GLN A 110 -9.420 -18.452 22.365 1.00 0.00 O ATOM 1667 CB GLN A 110 -10.545 -16.628 24.106 1.00 0.00 C ATOM 1668 CG GLN A 110 -11.691 -17.607 24.305 1.00 0.00 C ATOM 1669 CD GLN A 110 -11.540 -18.433 25.567 1.00 0.00 C ATOM 1670 OE1 GLN A 110 -10.427 -18.668 26.039 1.00 0.00 O ATOM 1671 NE2 GLN A 110 -12.661 -18.879 26.121 1.00 0.00 N ATOM 0 H GLN A 110 -11.991 -16.098 21.385 1.00 0.00 H new ATOM 0 HA GLN A 110 -9.481 -15.548 22.580 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -9.630 -17.066 24.505 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -10.744 -15.725 24.683 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -12.631 -17.057 24.346 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -11.749 -18.273 23.444 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -13.562 -18.660 25.696 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -12.621 -19.440 26.972 1.00 0.00 H new ATOM 1680 N SER A 111 -10.277 -17.458 20.536 1.00 0.00 N ATOM 1681 CA SER A 111 -9.987 -18.584 19.652 1.00 0.00 C ATOM 1682 C SER A 111 -10.471 -18.302 18.235 1.00 0.00 C ATOM 1683 O SER A 111 -9.676 -17.990 17.349 1.00 0.00 O ATOM 1684 CB SER A 111 -10.640 -19.865 20.180 1.00 0.00 C ATOM 1685 OG SER A 111 -12.050 -19.731 20.243 1.00 0.00 O ATOM 0 H SER A 111 -10.729 -16.668 20.077 1.00 0.00 H new ATOM 0 HA SER A 111 -8.906 -18.721 19.629 1.00 0.00 H new ATOM 0 HB2 SER A 111 -10.380 -20.703 19.533 1.00 0.00 H new ATOM 0 HB3 SER A 111 -10.249 -20.094 21.171 1.00 0.00 H new ATOM 0 HG SER A 111 -12.443 -20.563 20.581 1.00 0.00 H new ATOM 1691 N ALA A 112 -11.780 -18.411 18.025 1.00 0.00 N ATOM 1692 CA ALA A 112 -12.365 -18.164 16.714 1.00 0.00 C ATOM 1693 C ALA A 112 -12.167 -16.711 16.300 1.00 0.00 C ATOM 1694 O ALA A 112 -13.068 -15.885 16.444 1.00 0.00 O ATOM 1695 CB ALA A 112 -13.845 -18.516 16.721 1.00 0.00 C ATOM 0 H ALA A 112 -12.454 -18.669 18.746 1.00 0.00 H new ATOM 0 HA ALA A 112 -11.858 -18.799 15.987 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -14.269 -18.326 15.735 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -13.967 -19.570 16.972 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -14.361 -17.905 17.461 1.00 0.00 H new ATOM 1701 N THR A 113 -10.978 -16.406 15.791 1.00 0.00 N ATOM 1702 CA THR A 113 -10.658 -15.050 15.364 1.00 0.00 C ATOM 1703 C THR A 113 -11.459 -14.653 14.129 1.00 0.00 C ATOM 1704 O THR A 113 -12.380 -13.841 14.217 1.00 0.00 O ATOM 1705 CB THR A 113 -9.162 -14.919 15.084 1.00 0.00 C ATOM 1706 OG1 THR A 113 -8.429 -15.906 15.788 1.00 0.00 O ATOM 1707 CG2 THR A 113 -8.608 -13.569 15.474 1.00 0.00 C ATOM 0 H THR A 113 -10.222 -17.079 15.665 1.00 0.00 H new ATOM 0 HA THR A 113 -10.929 -14.374 16.175 1.00 0.00 H new ATOM 0 HB THR A 113 -9.053 -15.047 14.007 1.00 0.00 H new ATOM 0 HG1 THR A 113 -8.332 -16.703 15.227 1.00 0.00 H new ATOM 0 HG21 THR A 113 -7.541 -13.535 15.252 1.00 0.00 H new ATOM 0 HG22 THR A 113 -9.121 -12.789 14.911 1.00 0.00 H new ATOM 0 HG23 THR A 113 -8.762 -13.407 16.541 1.00 0.00 H new ATOM 1715 N LYS A 114 -11.108 -15.223 12.980 1.00 0.00 N ATOM 1716 CA LYS A 114 -11.810 -14.910 11.741 1.00 0.00 C ATOM 1717 C LYS A 114 -11.884 -16.119 10.822 1.00 0.00 C ATOM 1718 O LYS A 114 -12.972 -16.551 10.440 1.00 0.00 O ATOM 1719 CB LYS A 114 -11.139 -13.737 11.017 1.00 0.00 C ATOM 1720 CG LYS A 114 -9.661 -13.573 11.339 1.00 0.00 C ATOM 1721 CD LYS A 114 -8.979 -12.626 10.365 1.00 0.00 C ATOM 1722 CE LYS A 114 -8.928 -13.213 8.963 1.00 0.00 C ATOM 1723 NZ LYS A 114 -8.491 -14.637 8.973 1.00 0.00 N ATOM 0 H LYS A 114 -10.349 -15.897 12.882 1.00 0.00 H new ATOM 0 HA LYS A 114 -12.828 -14.624 12.006 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -11.253 -13.875 9.942 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -11.661 -12.816 11.278 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -9.549 -13.194 12.355 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -9.170 -14.546 11.306 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -9.514 -11.676 10.344 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -7.967 -12.414 10.709 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -9.913 -13.139 8.502 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -8.244 -12.628 8.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -8.006 -14.858 8.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -7.840 -14.795 9.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -9.321 -15.254 9.078 1.00 0.00 H new ATOM 1737 N ALA A 115 -10.733 -16.668 10.473 1.00 0.00 N ATOM 1738 CA ALA A 115 -10.691 -17.832 9.603 1.00 0.00 C ATOM 1739 C ALA A 115 -11.276 -19.047 10.306 1.00 0.00 C ATOM 1740 O ALA A 115 -11.815 -19.950 9.667 1.00 0.00 O ATOM 1741 CB ALA A 115 -9.264 -18.109 9.153 1.00 0.00 C ATOM 0 H ALA A 115 -9.820 -16.329 10.776 1.00 0.00 H new ATOM 0 HA ALA A 115 -11.296 -17.624 8.720 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -9.251 -18.984 8.503 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -8.880 -17.246 8.609 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -8.637 -18.296 10.025 1.00 0.00 H new ATOM 1747 N GLU A 116 -11.171 -19.058 11.629 1.00 0.00 N ATOM 1748 CA GLU A 116 -11.697 -20.157 12.427 1.00 0.00 C ATOM 1749 C GLU A 116 -13.169 -19.941 12.744 1.00 0.00 C ATOM 1750 O GLU A 116 -13.955 -20.886 12.777 1.00 0.00 O ATOM 1751 CB GLU A 116 -10.898 -20.309 13.721 1.00 0.00 C ATOM 1752 CG GLU A 116 -9.409 -20.517 13.496 1.00 0.00 C ATOM 1753 CD GLU A 116 -9.079 -21.923 13.036 1.00 0.00 C ATOM 1754 OE1 GLU A 116 -8.979 -22.821 13.897 1.00 0.00 O ATOM 1755 OE2 GLU A 116 -8.922 -22.126 11.813 1.00 0.00 O ATOM 0 H GLU A 116 -10.726 -18.318 12.172 1.00 0.00 H new ATOM 0 HA GLU A 116 -11.601 -21.073 11.844 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.044 -19.420 14.335 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.293 -21.154 14.285 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -9.055 -19.803 12.753 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -8.873 -20.306 14.421 1.00 0.00 H new ATOM 1762 N LEU A 117 -13.530 -18.687 12.984 1.00 0.00 N ATOM 1763 CA LEU A 117 -14.905 -18.329 13.310 1.00 0.00 C ATOM 1764 C LEU A 117 -15.810 -18.510 12.105 1.00 0.00 C ATOM 1765 O LEU A 117 -16.935 -18.994 12.227 1.00 0.00 O ATOM 1766 CB LEU A 117 -14.949 -16.881 13.835 1.00 0.00 C ATOM 1767 CG LEU A 117 -15.920 -15.915 13.145 1.00 0.00 C ATOM 1768 CD1 LEU A 117 -17.061 -15.570 14.082 1.00 0.00 C ATOM 1769 CD2 LEU A 117 -15.186 -14.656 12.712 1.00 0.00 C ATOM 0 H LEU A 117 -12.886 -17.897 12.959 1.00 0.00 H new ATOM 0 HA LEU A 117 -15.273 -18.993 14.092 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -15.201 -16.913 14.895 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -13.945 -16.463 13.758 1.00 0.00 H new ATOM 0 HG LEU A 117 -16.331 -16.397 12.258 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -17.746 -14.884 13.584 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -17.595 -16.480 14.356 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -16.664 -15.098 14.981 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -15.885 -13.977 12.223 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -14.756 -14.167 13.586 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -14.390 -14.920 12.016 1.00 0.00 H new ATOM 1781 N ILE A 118 -15.313 -18.123 10.945 1.00 0.00 N ATOM 1782 CA ILE A 118 -16.081 -18.248 9.724 1.00 0.00 C ATOM 1783 C ILE A 118 -16.218 -19.716 9.323 1.00 0.00 C ATOM 1784 O ILE A 118 -17.215 -20.115 8.723 1.00 0.00 O ATOM 1785 CB ILE A 118 -15.447 -17.435 8.575 1.00 0.00 C ATOM 1786 CG1 ILE A 118 -14.130 -18.066 8.111 1.00 0.00 C ATOM 1787 CG2 ILE A 118 -15.216 -15.994 9.010 1.00 0.00 C ATOM 1788 CD1 ILE A 118 -14.130 -18.443 6.648 1.00 0.00 C ATOM 0 H ILE A 118 -14.383 -17.721 10.824 1.00 0.00 H new ATOM 0 HA ILE A 118 -17.075 -17.842 9.915 1.00 0.00 H new ATOM 0 HB ILE A 118 -16.141 -17.444 7.735 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -13.315 -17.367 8.299 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -13.931 -18.956 8.708 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -14.769 -15.433 8.189 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -16.168 -15.539 9.283 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -14.546 -15.976 9.869 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -13.168 -18.884 6.386 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -14.924 -19.165 6.458 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -14.298 -17.552 6.043 1.00 0.00 H new ATOM 1800 N ALA A 119 -15.210 -20.514 9.671 1.00 0.00 N ATOM 1801 CA ALA A 119 -15.216 -21.938 9.361 1.00 0.00 C ATOM 1802 C ALA A 119 -15.942 -22.738 10.439 1.00 0.00 C ATOM 1803 O ALA A 119 -16.550 -23.770 10.156 1.00 0.00 O ATOM 1804 CB ALA A 119 -13.792 -22.445 9.194 1.00 0.00 C ATOM 0 H ALA A 119 -14.378 -20.196 10.169 1.00 0.00 H new ATOM 0 HA ALA A 119 -15.754 -22.076 8.423 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -13.810 -23.510 8.963 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -13.307 -21.905 8.381 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -13.238 -22.284 10.119 1.00 0.00 H new ATOM 1810 N LEU A 120 -15.864 -22.260 11.680 1.00 0.00 N ATOM 1811 CA LEU A 120 -16.505 -22.938 12.805 1.00 0.00 C ATOM 1812 C LEU A 120 -17.990 -23.162 12.544 1.00 0.00 C ATOM 1813 O LEU A 120 -18.525 -24.232 12.836 1.00 0.00 O ATOM 1814 CB LEU A 120 -16.321 -22.130 14.094 1.00 0.00 C ATOM 1815 CG LEU A 120 -15.575 -22.858 15.214 1.00 0.00 C ATOM 1816 CD1 LEU A 120 -14.255 -23.416 14.705 1.00 0.00 C ATOM 1817 CD2 LEU A 120 -15.341 -21.925 16.393 1.00 0.00 C ATOM 0 H LEU A 120 -15.364 -21.407 11.931 1.00 0.00 H new ATOM 0 HA LEU A 120 -16.026 -23.910 12.920 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -15.782 -21.213 13.856 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -17.303 -21.836 14.464 1.00 0.00 H new ATOM 0 HG LEU A 120 -16.192 -23.691 15.551 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -13.740 -23.930 15.517 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -14.446 -24.119 13.894 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -13.632 -22.600 14.339 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -14.809 -22.460 17.180 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -14.746 -21.071 16.069 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -16.300 -21.575 16.776 1.00 0.00 H new ATOM 1829 N PHE A 121 -18.653 -22.147 11.998 1.00 0.00 N ATOM 1830 CA PHE A 121 -20.084 -22.237 11.705 1.00 0.00 C ATOM 1831 C PHE A 121 -20.435 -23.554 11.014 1.00 0.00 C ATOM 1832 O PHE A 121 -21.555 -24.049 11.138 1.00 0.00 O ATOM 1833 CB PHE A 121 -20.523 -21.062 10.834 1.00 0.00 C ATOM 1834 CG PHE A 121 -21.217 -19.978 11.604 1.00 0.00 C ATOM 1835 CD1 PHE A 121 -22.540 -20.118 11.991 1.00 0.00 C ATOM 1836 CD2 PHE A 121 -20.546 -18.817 11.938 1.00 0.00 C ATOM 1837 CE1 PHE A 121 -23.177 -19.118 12.696 1.00 0.00 C ATOM 1838 CE2 PHE A 121 -21.178 -17.814 12.639 1.00 0.00 C ATOM 1839 CZ PHE A 121 -22.495 -17.964 13.020 1.00 0.00 C ATOM 0 H PHE A 121 -18.226 -21.255 11.749 1.00 0.00 H new ATOM 0 HA PHE A 121 -20.616 -22.201 12.655 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -19.649 -20.642 10.336 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -21.190 -21.427 10.053 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -23.078 -21.020 11.738 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -19.514 -18.695 11.646 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -24.208 -19.239 12.994 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -20.643 -16.910 12.890 1.00 0.00 H new ATOM 0 HZ PHE A 121 -22.991 -17.179 13.571 1.00 0.00 H new ATOM 1849 N ALA A 122 -19.475 -24.116 10.284 1.00 0.00 N ATOM 1850 CA ALA A 122 -19.689 -25.374 9.572 1.00 0.00 C ATOM 1851 C ALA A 122 -20.349 -26.418 10.477 1.00 0.00 C ATOM 1852 O ALA A 122 -19.909 -26.634 11.606 1.00 0.00 O ATOM 1853 CB ALA A 122 -18.370 -25.904 9.031 1.00 0.00 C ATOM 0 H ALA A 122 -18.542 -23.721 10.170 1.00 0.00 H new ATOM 0 HA ALA A 122 -20.362 -25.178 8.737 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -18.544 -26.842 8.503 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -17.939 -25.175 8.344 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -17.680 -26.076 9.858 1.00 0.00 H new ATOM 1859 N PRO A 123 -21.417 -27.078 9.993 1.00 0.00 N ATOM 1860 CA PRO A 123 -22.131 -28.097 10.770 1.00 0.00 C ATOM 1861 C PRO A 123 -21.194 -29.157 11.337 1.00 0.00 C ATOM 1862 O PRO A 123 -21.336 -29.575 12.486 1.00 0.00 O ATOM 1863 CB PRO A 123 -23.087 -28.718 9.749 1.00 0.00 C ATOM 1864 CG PRO A 123 -23.306 -27.648 8.737 1.00 0.00 C ATOM 1865 CD PRO A 123 -22.014 -26.884 8.657 1.00 0.00 C ATOM 0 HA PRO A 123 -22.633 -27.669 11.638 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -22.656 -29.610 9.295 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -24.025 -29.019 10.216 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -23.568 -28.074 7.769 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -24.128 -26.995 9.031 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -21.368 -27.270 7.869 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -22.184 -25.829 8.442 1.00 0.00 H new ATOM 1873 N ALA A 124 -20.234 -29.587 10.524 1.00 0.00 N ATOM 1874 CA ALA A 124 -19.273 -30.599 10.947 1.00 0.00 C ATOM 1875 C ALA A 124 -18.035 -30.586 10.058 1.00 0.00 C ATOM 1876 O ALA A 124 -18.120 -30.299 8.863 1.00 0.00 O ATOM 1877 CB ALA A 124 -19.919 -31.977 10.936 1.00 0.00 C ATOM 0 H ALA A 124 -20.101 -29.251 9.570 1.00 0.00 H new ATOM 0 HA ALA A 124 -18.960 -30.365 11.964 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -19.190 -32.723 11.254 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -20.769 -31.986 11.619 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -20.261 -32.210 9.928 1.00 0.00 H new ATOM 1883 N ASP A 125 -16.887 -30.901 10.647 1.00 0.00 N ATOM 1884 CA ASP A 125 -15.630 -30.927 9.909 1.00 0.00 C ATOM 1885 C ASP A 125 -14.891 -32.241 10.140 1.00 0.00 C ATOM 1886 O ASP A 125 -13.662 -32.273 10.193 1.00 0.00 O ATOM 1887 CB ASP A 125 -14.744 -29.751 10.326 1.00 0.00 C ATOM 1888 CG ASP A 125 -15.303 -28.416 9.870 1.00 0.00 C ATOM 1889 OD1 ASP A 125 -15.704 -28.312 8.692 1.00 0.00 O ATOM 1890 OD2 ASP A 125 -15.339 -27.477 10.692 1.00 0.00 O ATOM 0 H ASP A 125 -16.801 -31.142 11.634 1.00 0.00 H new ATOM 0 HA ASP A 125 -15.860 -30.841 8.847 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -14.638 -29.746 11.411 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -13.746 -29.886 9.909 1.00 0.00 H new ATOM 1895 N GLY A 126 -15.649 -33.325 10.277 1.00 0.00 N ATOM 1896 CA GLY A 126 -15.049 -34.626 10.501 1.00 0.00 C ATOM 1897 C GLY A 126 -15.961 -35.764 10.090 1.00 0.00 C ATOM 1898 O GLY A 126 -15.522 -36.723 9.453 1.00 0.00 O ATOM 0 H GLY A 126 -16.668 -33.324 10.237 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -14.115 -34.693 9.942 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -14.797 -34.730 11.556 1.00 0.00 H new ATOM 1902 N GLU A 127 -17.235 -35.661 10.454 1.00 0.00 N ATOM 1903 CA GLU A 127 -18.212 -36.692 10.119 1.00 0.00 C ATOM 1904 C GLU A 127 -19.507 -36.069 9.609 1.00 0.00 C ATOM 1905 O GLU A 127 -20.097 -35.211 10.267 1.00 0.00 O ATOM 1906 CB GLU A 127 -18.499 -37.568 11.340 1.00 0.00 C ATOM 1907 CG GLU A 127 -19.311 -38.811 11.018 1.00 0.00 C ATOM 1908 CD GLU A 127 -19.953 -39.423 12.249 1.00 0.00 C ATOM 1909 OE1 GLU A 127 -19.316 -39.404 13.323 1.00 0.00 O ATOM 1910 OE2 GLU A 127 -21.094 -39.919 12.139 1.00 0.00 O ATOM 0 H GLU A 127 -17.615 -34.875 10.981 1.00 0.00 H new ATOM 0 HA GLU A 127 -17.792 -37.312 9.327 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -17.554 -37.868 11.792 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -19.034 -36.977 12.083 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -20.087 -38.557 10.296 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -18.665 -39.550 10.544 1.00 0.00 H new ATOM 1917 N LYS A 128 -19.945 -36.505 8.432 1.00 0.00 N ATOM 1918 CA LYS A 128 -21.170 -35.990 7.834 1.00 0.00 C ATOM 1919 C LYS A 128 -21.489 -36.721 6.533 1.00 0.00 C ATOM 1920 O LYS A 128 -20.590 -37.197 5.841 1.00 0.00 O ATOM 1921 CB LYS A 128 -21.043 -34.489 7.571 1.00 0.00 C ATOM 1922 CG LYS A 128 -22.382 -33.772 7.480 1.00 0.00 C ATOM 1923 CD LYS A 128 -22.416 -32.796 6.314 1.00 0.00 C ATOM 1924 CE LYS A 128 -23.835 -32.564 5.822 1.00 0.00 C ATOM 1925 NZ LYS A 128 -24.347 -31.222 6.216 1.00 0.00 N ATOM 0 H LYS A 128 -19.469 -37.214 7.874 1.00 0.00 H new ATOM 0 HA LYS A 128 -21.987 -36.160 8.536 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -20.452 -34.038 8.368 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -20.494 -34.336 6.642 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -23.181 -34.505 7.365 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -22.572 -33.236 8.410 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -21.976 -31.847 6.620 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -21.805 -33.182 5.498 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -23.863 -32.659 4.736 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -24.490 -33.336 6.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -25.317 -31.103 5.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -24.345 -31.140 7.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -23.737 -30.485 5.809 1.00 0.00 H new ATOM 1939 N SER A 129 -22.774 -36.805 6.207 1.00 0.00 N ATOM 1940 CA SER A 129 -23.212 -37.478 4.990 1.00 0.00 C ATOM 1941 C SER A 129 -22.792 -38.944 4.997 1.00 0.00 C ATOM 1942 O SER A 129 -22.190 -39.424 5.958 1.00 0.00 O ATOM 1943 CB SER A 129 -22.635 -36.775 3.759 1.00 0.00 C ATOM 1944 OG SER A 129 -23.559 -35.844 3.222 1.00 0.00 O ATOM 0 H SER A 129 -23.531 -36.415 6.769 1.00 0.00 H new ATOM 0 HA SER A 129 -24.300 -37.432 4.950 1.00 0.00 H new ATOM 0 HB2 SER A 129 -21.712 -36.261 4.029 1.00 0.00 H new ATOM 0 HB3 SER A 129 -22.378 -37.515 3.001 1.00 0.00 H new ATOM 0 HG SER A 129 -23.165 -35.408 2.438 1.00 0.00 H new ATOM 1950 N GLU A 130 -23.111 -39.652 3.918 1.00 0.00 N ATOM 1951 CA GLU A 130 -22.766 -41.063 3.801 1.00 0.00 C ATOM 1952 C GLU A 130 -22.202 -41.373 2.418 1.00 0.00 C ATOM 1953 O GLU A 130 -21.172 -42.035 2.290 1.00 0.00 O ATOM 1954 CB GLU A 130 -23.996 -41.934 4.068 1.00 0.00 C ATOM 1955 CG GLU A 130 -25.220 -41.520 3.269 1.00 0.00 C ATOM 1956 CD GLU A 130 -26.480 -42.233 3.719 1.00 0.00 C ATOM 1957 OE1 GLU A 130 -27.031 -41.854 4.774 1.00 0.00 O ATOM 1958 OE2 GLU A 130 -26.915 -43.170 3.017 1.00 0.00 O ATOM 0 H GLU A 130 -23.608 -39.271 3.113 1.00 0.00 H new ATOM 0 HA GLU A 130 -22.001 -41.287 4.545 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -23.754 -42.971 3.835 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -24.236 -41.894 5.131 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -25.363 -40.444 3.363 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -25.047 -41.728 2.213 1.00 0.00 H new ATOM 1965 N ALA A 131 -22.884 -40.889 1.384 1.00 0.00 N ATOM 1966 CA ALA A 131 -22.451 -41.112 0.011 1.00 0.00 C ATOM 1967 C ALA A 131 -22.471 -39.814 -0.790 1.00 0.00 C ATOM 1968 O ALA A 131 -23.403 -39.009 -0.584 1.00 0.00 O ATOM 1969 CB ALA A 131 -23.330 -42.159 -0.656 1.00 0.00 C ATOM 1970 OXT ALA A 131 -21.556 -39.615 -1.615 1.00 0.00 O ATOM 0 H ALA A 131 -23.739 -40.340 1.472 1.00 0.00 H new ATOM 0 HA ALA A 131 -21.424 -41.477 0.035 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -22.995 -42.316 -1.681 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -23.261 -43.097 -0.105 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -24.365 -41.816 -0.661 1.00 0.00 H new TER 1976 ALA A 131