USER MOD reduce.3.24.130724 H: found=0, std=0, add=763, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 757 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 20 THR OG1 : rot -57:sc= -0.44 USER MOD Set 1.2: A 52 LYS NZ :NH3+ -111:sc= -1.5! (180deg=-4.2!) USER MOD Single : A 1 CYS N :NH3+ 150:sc= 0.564 (180deg=0.261) USER MOD Single : A 2 SER OG : rot 4:sc= 0.864 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot -120:sc= -0.441 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0.023 USER MOD Single : A 53 THR OG1 : rot -81:sc= 0.124 USER MOD Single : A 62 GLN : amide:sc= -0.199 X(o=-0.2,f=-0.63) USER MOD Single : A 63 ASN : amide:sc= -0.147 K(o=-0.15,f=-0.83) USER MOD Single : B 1 CYS N :NH3+ -178:sc= 0.229 (180deg=0.209) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 3 THR OG1 : rot 34:sc= 0.925 USER MOD Single : B 5 SER OG : rot 27:sc= -3.4! USER MOD Single : B 20 THR OG1 : rot 69:sc= 0.302 USER MOD Single : B 28 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 1 68.350 20.497 -20.262 1.00 0.00 N ATOM 2 CA CYS A 1 68.978 19.668 -19.196 1.00 0.00 C ATOM 3 C CYS A 1 68.975 18.205 -19.626 1.00 0.00 C ATOM 4 O CYS A 1 67.916 17.609 -19.820 1.00 0.00 O ATOM 5 CB CYS A 1 68.189 19.831 -17.895 1.00 0.00 C ATOM 6 SG CYS A 1 68.040 21.590 -17.496 1.00 0.00 S ATOM 0 H1 CYS A 1 67.893 21.327 -19.833 1.00 0.00 H new ATOM 0 H2 CYS A 1 69.080 20.812 -20.932 1.00 0.00 H new ATOM 0 H3 CYS A 1 67.638 19.932 -20.767 1.00 0.00 H new ATOM 0 HA CYS A 1 70.006 19.992 -19.034 1.00 0.00 H new ATOM 0 HB2 CYS A 1 67.200 19.386 -17.999 1.00 0.00 H new ATOM 0 HB3 CYS A 1 68.692 19.304 -17.084 1.00 0.00 H new ATOM 10 N SER A 2 70.165 17.633 -19.774 1.00 0.00 N ATOM 11 CA SER A 2 70.282 16.238 -20.183 1.00 0.00 C ATOM 12 C SER A 2 71.709 15.733 -19.984 1.00 0.00 C ATOM 13 O SER A 2 72.637 16.189 -20.654 1.00 0.00 O ATOM 14 CB SER A 2 69.888 16.092 -21.653 1.00 0.00 C ATOM 15 OG SER A 2 70.907 16.654 -22.470 1.00 0.00 O ATOM 0 H SER A 2 71.054 18.108 -19.619 1.00 0.00 H new ATOM 0 HA SER A 2 69.611 15.642 -19.564 1.00 0.00 H new ATOM 0 HB2 SER A 2 69.746 15.040 -21.901 1.00 0.00 H new ATOM 0 HB3 SER A 2 68.939 16.594 -21.839 1.00 0.00 H new ATOM 0 HG SER A 2 71.651 16.953 -21.906 1.00 0.00 H new ATOM 21 N THR A 3 71.874 14.788 -19.064 1.00 0.00 N ATOM 22 CA THR A 3 73.191 14.224 -18.787 1.00 0.00 C ATOM 23 C THR A 3 73.555 13.182 -19.841 1.00 0.00 C ATOM 24 O THR A 3 72.799 12.960 -20.787 1.00 0.00 O ATOM 25 CB THR A 3 73.201 13.576 -17.402 1.00 0.00 C ATOM 26 OG1 THR A 3 72.419 12.389 -17.432 1.00 0.00 O ATOM 27 CG2 THR A 3 72.616 14.548 -16.376 1.00 0.00 C ATOM 0 H THR A 3 71.118 14.399 -18.501 1.00 0.00 H new ATOM 0 HA THR A 3 73.926 15.029 -18.815 1.00 0.00 H new ATOM 0 HB THR A 3 74.226 13.331 -17.123 1.00 0.00 H new ATOM 0 HG1 THR A 3 72.425 11.971 -16.546 1.00 0.00 H new ATOM 0 HG21 THR A 3 72.624 14.084 -15.390 1.00 0.00 H new ATOM 0 HG22 THR A 3 73.215 15.458 -16.354 1.00 0.00 H new ATOM 0 HG23 THR A 3 71.591 14.795 -16.652 1.00 0.00 H new ATOM 35 N VAL A 4 74.715 12.548 -19.669 1.00 0.00 N ATOM 36 CA VAL A 4 75.181 11.524 -20.609 1.00 0.00 C ATOM 37 C VAL A 4 74.818 11.892 -22.043 1.00 0.00 C ATOM 38 O VAL A 4 74.680 11.027 -22.908 1.00 0.00 O ATOM 39 CB VAL A 4 74.592 10.157 -20.235 1.00 0.00 C ATOM 40 CG1 VAL A 4 75.035 9.794 -18.815 1.00 0.00 C ATOM 41 CG2 VAL A 4 73.058 10.198 -20.282 1.00 0.00 C ATOM 0 H VAL A 4 75.349 12.724 -18.890 1.00 0.00 H new ATOM 0 HA VAL A 4 76.268 11.467 -20.544 1.00 0.00 H new ATOM 0 HB VAL A 4 74.948 9.414 -20.948 1.00 0.00 H new ATOM 0 HG11 VAL A 4 74.621 8.824 -18.541 1.00 0.00 H new ATOM 0 HG12 VAL A 4 76.123 9.748 -18.774 1.00 0.00 H new ATOM 0 HG13 VAL A 4 74.677 10.551 -18.117 1.00 0.00 H new ATOM 0 HG21 VAL A 4 72.659 9.220 -20.014 1.00 0.00 H new ATOM 0 HG22 VAL A 4 72.692 10.944 -19.577 1.00 0.00 H new ATOM 0 HG23 VAL A 4 72.732 10.459 -21.289 1.00 0.00 H new ATOM 51 N SER A 5 74.689 13.190 -22.282 1.00 0.00 N ATOM 52 CA SER A 5 74.366 13.693 -23.610 1.00 0.00 C ATOM 53 C SER A 5 75.617 13.721 -24.498 1.00 0.00 C ATOM 54 O SER A 5 75.528 13.469 -25.699 1.00 0.00 O ATOM 55 CB SER A 5 73.761 15.102 -23.508 1.00 0.00 C ATOM 56 OG SER A 5 74.168 15.876 -24.630 1.00 0.00 O ATOM 0 H SER A 5 74.803 13.914 -21.573 1.00 0.00 H new ATOM 0 HA SER A 5 73.635 13.023 -24.064 1.00 0.00 H new ATOM 0 HB2 SER A 5 72.673 15.040 -23.471 1.00 0.00 H new ATOM 0 HB3 SER A 5 74.085 15.582 -22.585 1.00 0.00 H new ATOM 0 HG SER A 5 73.781 16.774 -24.566 1.00 0.00 H new ATOM 62 N PRO A 6 76.777 14.017 -23.945 1.00 0.00 N ATOM 63 CA PRO A 6 78.046 14.063 -24.734 1.00 0.00 C ATOM 64 C PRO A 6 78.246 12.821 -25.589 1.00 0.00 C ATOM 65 O PRO A 6 78.655 12.921 -26.745 1.00 0.00 O ATOM 66 CB PRO A 6 79.128 14.187 -23.657 1.00 0.00 C ATOM 67 CG PRO A 6 78.449 14.885 -22.531 1.00 0.00 C ATOM 68 CD PRO A 6 77.025 14.339 -22.523 1.00 0.00 C ATOM 0 HA PRO A 6 78.058 14.884 -25.451 1.00 0.00 H new ATOM 0 HB2 PRO A 6 79.500 13.209 -23.352 1.00 0.00 H new ATOM 0 HB3 PRO A 6 79.985 14.755 -24.018 1.00 0.00 H new ATOM 0 HG2 PRO A 6 78.952 14.687 -21.584 1.00 0.00 H new ATOM 0 HG3 PRO A 6 78.456 15.965 -22.676 1.00 0.00 H new ATOM 0 HD2 PRO A 6 76.936 13.457 -21.889 1.00 0.00 H new ATOM 0 HD3 PRO A 6 76.314 15.075 -22.147 1.00 0.00 H new ATOM 76 N GLY A 7 77.964 11.655 -25.021 1.00 0.00 N ATOM 77 CA GLY A 7 78.147 10.413 -25.771 1.00 0.00 C ATOM 78 C GLY A 7 79.635 10.138 -25.923 1.00 0.00 C ATOM 79 O GLY A 7 80.109 9.030 -25.669 1.00 0.00 O ATOM 0 H GLY A 7 77.617 11.540 -24.069 1.00 0.00 H new ATOM 0 HA2 GLY A 7 77.663 9.586 -25.252 1.00 0.00 H new ATOM 0 HA3 GLY A 7 77.677 10.493 -26.751 1.00 0.00 H new ATOM 83 N VAL A 8 80.378 11.171 -26.307 1.00 0.00 N ATOM 84 CA VAL A 8 81.814 11.040 -26.451 1.00 0.00 C ATOM 85 C VAL A 8 82.391 10.617 -25.115 1.00 0.00 C ATOM 86 O VAL A 8 83.277 9.761 -25.047 1.00 0.00 O ATOM 87 CB VAL A 8 82.430 12.368 -26.895 1.00 0.00 C ATOM 88 CG1 VAL A 8 83.957 12.265 -26.866 1.00 0.00 C ATOM 89 CG2 VAL A 8 81.969 12.683 -28.318 1.00 0.00 C ATOM 0 H VAL A 8 80.009 12.098 -26.521 1.00 0.00 H new ATOM 0 HA VAL A 8 82.042 10.293 -27.211 1.00 0.00 H new ATOM 0 HB VAL A 8 82.111 13.161 -26.219 1.00 0.00 H new ATOM 0 HG11 VAL A 8 84.392 13.213 -27.183 1.00 0.00 H new ATOM 0 HG12 VAL A 8 84.287 12.035 -25.853 1.00 0.00 H new ATOM 0 HG13 VAL A 8 84.281 11.473 -27.542 1.00 0.00 H new ATOM 0 HG21 VAL A 8 82.405 13.629 -28.641 1.00 0.00 H new ATOM 0 HG22 VAL A 8 82.291 11.887 -28.989 1.00 0.00 H new ATOM 0 HG23 VAL A 8 80.882 12.758 -28.340 1.00 0.00 H new ATOM 99 N LEU A 9 81.859 11.198 -24.039 1.00 0.00 N ATOM 100 CA LEU A 9 82.332 10.821 -22.717 1.00 0.00 C ATOM 101 C LEU A 9 82.179 9.301 -22.573 1.00 0.00 C ATOM 102 O LEU A 9 83.052 8.614 -22.035 1.00 0.00 O ATOM 103 CB LEU A 9 81.546 11.557 -21.619 1.00 0.00 C ATOM 104 CG LEU A 9 82.187 12.932 -21.306 1.00 0.00 C ATOM 105 CD1 LEU A 9 83.477 12.758 -20.478 1.00 0.00 C ATOM 106 CD2 LEU A 9 82.516 13.681 -22.613 1.00 0.00 C ATOM 0 H LEU A 9 81.126 11.907 -24.057 1.00 0.00 H new ATOM 0 HA LEU A 9 83.379 11.103 -22.603 1.00 0.00 H new ATOM 0 HB2 LEU A 9 80.513 11.697 -21.938 1.00 0.00 H new ATOM 0 HB3 LEU A 9 81.521 10.949 -20.715 1.00 0.00 H new ATOM 0 HG LEU A 9 81.469 13.513 -20.727 1.00 0.00 H new ATOM 0 HD11 LEU A 9 83.910 13.736 -20.270 1.00 0.00 H new ATOM 0 HD12 LEU A 9 83.242 12.258 -19.539 1.00 0.00 H new ATOM 0 HD13 LEU A 9 84.192 12.157 -21.040 1.00 0.00 H new ATOM 0 HD21 LEU A 9 82.966 14.645 -22.376 1.00 0.00 H new ATOM 0 HD22 LEU A 9 83.215 13.090 -23.205 1.00 0.00 H new ATOM 0 HD23 LEU A 9 81.600 13.838 -23.183 1.00 0.00 H new ATOM 118 N ALA A 10 81.079 8.771 -23.108 1.00 0.00 N ATOM 119 CA ALA A 10 80.863 7.332 -23.072 1.00 0.00 C ATOM 120 C ALA A 10 82.023 6.666 -23.803 1.00 0.00 C ATOM 121 O ALA A 10 82.542 5.630 -23.378 1.00 0.00 O ATOM 122 CB ALA A 10 79.529 6.969 -23.743 1.00 0.00 C ATOM 0 H ALA A 10 80.339 9.307 -23.562 1.00 0.00 H new ATOM 0 HA ALA A 10 80.818 6.986 -22.039 1.00 0.00 H new ATOM 0 HB1 ALA A 10 79.385 5.889 -23.706 1.00 0.00 H new ATOM 0 HB2 ALA A 10 78.711 7.462 -23.217 1.00 0.00 H new ATOM 0 HB3 ALA A 10 79.543 7.298 -24.782 1.00 0.00 H new ATOM 128 N GLY A 11 82.444 7.304 -24.895 1.00 0.00 N ATOM 129 CA GLY A 11 83.567 6.800 -25.668 1.00 0.00 C ATOM 130 C GLY A 11 84.804 6.751 -24.784 1.00 0.00 C ATOM 131 O GLY A 11 85.693 5.927 -24.984 1.00 0.00 O ATOM 0 H GLY A 11 82.026 8.161 -25.257 1.00 0.00 H new ATOM 0 HA2 GLY A 11 83.341 5.805 -26.053 1.00 0.00 H new ATOM 0 HA3 GLY A 11 83.747 7.442 -26.530 1.00 0.00 H new ATOM 135 N ILE A 12 84.840 7.639 -23.792 1.00 0.00 N ATOM 136 CA ILE A 12 85.964 7.685 -22.857 1.00 0.00 C ATOM 137 C ILE A 12 85.946 6.415 -22.006 1.00 0.00 C ATOM 138 O ILE A 12 86.983 5.793 -21.784 1.00 0.00 O ATOM 139 CB ILE A 12 85.891 8.984 -21.977 1.00 0.00 C ATOM 140 CG1 ILE A 12 87.226 9.752 -22.031 1.00 0.00 C ATOM 141 CG2 ILE A 12 85.571 8.669 -20.499 1.00 0.00 C ATOM 142 CD1 ILE A 12 87.034 11.156 -21.447 1.00 0.00 C ATOM 0 H ILE A 12 84.111 8.331 -23.615 1.00 0.00 H new ATOM 0 HA ILE A 12 86.907 7.725 -23.402 1.00 0.00 H new ATOM 0 HB ILE A 12 85.086 9.592 -22.390 1.00 0.00 H new ATOM 0 HG12 ILE A 12 87.990 9.214 -21.469 1.00 0.00 H new ATOM 0 HG13 ILE A 12 87.577 9.820 -23.061 1.00 0.00 H new ATOM 0 HG21 ILE A 12 85.531 9.598 -19.930 1.00 0.00 H new ATOM 0 HG22 ILE A 12 84.608 8.162 -20.435 1.00 0.00 H new ATOM 0 HG23 ILE A 12 86.348 8.025 -20.088 1.00 0.00 H new ATOM 0 HD11 ILE A 12 87.979 11.698 -21.486 1.00 0.00 H new ATOM 0 HD12 ILE A 12 86.284 11.692 -22.028 1.00 0.00 H new ATOM 0 HD13 ILE A 12 86.703 11.077 -20.411 1.00 0.00 H new ATOM 154 N VAL A 13 84.758 6.034 -21.545 1.00 0.00 N ATOM 155 CA VAL A 13 84.629 4.825 -20.735 1.00 0.00 C ATOM 156 C VAL A 13 85.205 3.643 -21.504 1.00 0.00 C ATOM 157 O VAL A 13 86.090 2.924 -21.016 1.00 0.00 O ATOM 158 CB VAL A 13 83.154 4.555 -20.420 1.00 0.00 C ATOM 159 CG1 VAL A 13 83.021 3.258 -19.617 1.00 0.00 C ATOM 160 CG2 VAL A 13 82.581 5.715 -19.602 1.00 0.00 C ATOM 0 H VAL A 13 83.885 6.534 -21.714 1.00 0.00 H new ATOM 0 HA VAL A 13 85.172 4.962 -19.800 1.00 0.00 H new ATOM 0 HB VAL A 13 82.604 4.460 -21.356 1.00 0.00 H new ATOM 0 HG11 VAL A 13 81.970 3.073 -19.397 1.00 0.00 H new ATOM 0 HG12 VAL A 13 83.422 2.428 -20.198 1.00 0.00 H new ATOM 0 HG13 VAL A 13 83.577 3.349 -18.684 1.00 0.00 H new ATOM 0 HG21 VAL A 13 81.532 5.520 -19.380 1.00 0.00 H new ATOM 0 HG22 VAL A 13 83.137 5.813 -18.670 1.00 0.00 H new ATOM 0 HG23 VAL A 13 82.665 6.639 -20.173 1.00 0.00 H new ATOM 170 N VAL A 14 84.709 3.460 -22.721 1.00 0.00 N ATOM 171 CA VAL A 14 85.188 2.376 -23.564 1.00 0.00 C ATOM 172 C VAL A 14 86.692 2.507 -23.763 1.00 0.00 C ATOM 173 O VAL A 14 87.412 1.510 -23.806 1.00 0.00 O ATOM 174 CB VAL A 14 84.483 2.412 -24.921 1.00 0.00 C ATOM 175 CG1 VAL A 14 85.066 1.327 -25.828 1.00 0.00 C ATOM 176 CG2 VAL A 14 82.987 2.160 -24.723 1.00 0.00 C ATOM 0 H VAL A 14 83.984 4.041 -23.141 1.00 0.00 H new ATOM 0 HA VAL A 14 84.969 1.426 -23.077 1.00 0.00 H new ATOM 0 HB VAL A 14 84.631 3.389 -25.382 1.00 0.00 H new ATOM 0 HG11 VAL A 14 84.564 1.353 -26.795 1.00 0.00 H new ATOM 0 HG12 VAL A 14 86.132 1.504 -25.968 1.00 0.00 H new ATOM 0 HG13 VAL A 14 84.918 0.350 -25.368 1.00 0.00 H new ATOM 0 HG21 VAL A 14 82.483 2.185 -25.689 1.00 0.00 H new ATOM 0 HG22 VAL A 14 82.840 1.183 -24.263 1.00 0.00 H new ATOM 0 HG23 VAL A 14 82.570 2.932 -24.076 1.00 0.00 H new ATOM 186 N GLY A 15 87.156 3.751 -23.879 1.00 0.00 N ATOM 187 CA GLY A 15 88.573 4.026 -24.071 1.00 0.00 C ATOM 188 C GLY A 15 89.398 3.490 -22.907 1.00 0.00 C ATOM 189 O GLY A 15 90.489 2.959 -23.099 1.00 0.00 O ATOM 0 H GLY A 15 86.567 4.583 -23.843 1.00 0.00 H new ATOM 0 HA2 GLY A 15 88.912 3.571 -25.001 1.00 0.00 H new ATOM 0 HA3 GLY A 15 88.728 5.101 -24.167 1.00 0.00 H new ATOM 193 N ASP A 16 88.871 3.636 -21.697 1.00 0.00 N ATOM 194 CA ASP A 16 89.571 3.163 -20.511 1.00 0.00 C ATOM 195 C ASP A 16 89.696 1.644 -20.538 1.00 0.00 C ATOM 196 O ASP A 16 90.770 1.092 -20.284 1.00 0.00 O ATOM 197 CB ASP A 16 88.817 3.592 -19.250 1.00 0.00 C ATOM 198 CG ASP A 16 89.580 3.144 -18.006 1.00 0.00 C ATOM 199 OD1 ASP A 16 90.499 2.357 -18.149 1.00 0.00 O ATOM 200 OD2 ASP A 16 89.233 3.599 -16.928 1.00 0.00 O ATOM 0 H ASP A 16 87.969 4.075 -21.513 1.00 0.00 H new ATOM 0 HA ASP A 16 90.569 3.601 -20.502 1.00 0.00 H new ATOM 0 HB2 ASP A 16 88.694 4.675 -19.241 1.00 0.00 H new ATOM 0 HB3 ASP A 16 87.817 3.158 -19.249 1.00 0.00 H new ATOM 205 N LEU A 17 88.588 0.973 -20.842 1.00 0.00 N ATOM 206 CA LEU A 17 88.591 -0.487 -20.888 1.00 0.00 C ATOM 207 C LEU A 17 89.664 -1.001 -21.851 1.00 0.00 C ATOM 208 O LEU A 17 90.472 -1.864 -21.490 1.00 0.00 O ATOM 209 CB LEU A 17 87.213 -0.999 -21.325 1.00 0.00 C ATOM 210 CG LEU A 17 87.134 -2.528 -21.163 1.00 0.00 C ATOM 211 CD1 LEU A 17 87.102 -2.919 -19.671 1.00 0.00 C ATOM 212 CD2 LEU A 17 85.863 -3.034 -21.855 1.00 0.00 C ATOM 0 H LEU A 17 87.691 1.408 -21.057 1.00 0.00 H new ATOM 0 HA LEU A 17 88.817 -0.860 -19.889 1.00 0.00 H new ATOM 0 HB2 LEU A 17 86.435 -0.523 -20.729 1.00 0.00 H new ATOM 0 HB3 LEU A 17 87.029 -0.727 -22.364 1.00 0.00 H new ATOM 0 HG LEU A 17 88.016 -2.980 -21.616 1.00 0.00 H new ATOM 0 HD11 LEU A 17 87.046 -4.004 -19.580 1.00 0.00 H new ATOM 0 HD12 LEU A 17 88.007 -2.560 -19.181 1.00 0.00 H new ATOM 0 HD13 LEU A 17 86.230 -2.470 -19.196 1.00 0.00 H new ATOM 0 HD21 LEU A 17 85.796 -4.117 -21.747 1.00 0.00 H new ATOM 0 HD22 LEU A 17 84.990 -2.569 -21.397 1.00 0.00 H new ATOM 0 HD23 LEU A 17 85.898 -2.777 -22.914 1.00 0.00 H new ATOM 224 N VAL A 18 89.674 -0.475 -23.075 1.00 0.00 N ATOM 225 CA VAL A 18 90.660 -0.912 -24.059 1.00 0.00 C ATOM 226 C VAL A 18 92.064 -0.477 -23.656 1.00 0.00 C ATOM 227 O VAL A 18 93.041 -1.105 -24.050 1.00 0.00 O ATOM 228 CB VAL A 18 90.326 -0.368 -25.449 1.00 0.00 C ATOM 229 CG1 VAL A 18 88.985 -0.940 -25.915 1.00 0.00 C ATOM 230 CG2 VAL A 18 90.232 1.150 -25.389 1.00 0.00 C ATOM 0 H VAL A 18 89.025 0.240 -23.404 1.00 0.00 H new ATOM 0 HA VAL A 18 90.628 -2.001 -24.093 1.00 0.00 H new ATOM 0 HB VAL A 18 91.109 -0.659 -26.149 1.00 0.00 H new ATOM 0 HG11 VAL A 18 88.748 -0.552 -26.906 1.00 0.00 H new ATOM 0 HG12 VAL A 18 89.048 -2.027 -25.957 1.00 0.00 H new ATOM 0 HG13 VAL A 18 88.202 -0.649 -25.215 1.00 0.00 H new ATOM 0 HG21 VAL A 18 89.994 1.539 -26.379 1.00 0.00 H new ATOM 0 HG22 VAL A 18 89.449 1.439 -24.688 1.00 0.00 H new ATOM 0 HG23 VAL A 18 91.186 1.561 -25.057 1.00 0.00 H new ATOM 240 N LEU A 19 92.172 0.596 -22.873 1.00 0.00 N ATOM 241 CA LEU A 19 93.490 1.059 -22.447 1.00 0.00 C ATOM 242 C LEU A 19 94.161 -0.026 -21.601 1.00 0.00 C ATOM 243 O LEU A 19 95.259 -0.493 -21.922 1.00 0.00 O ATOM 244 CB LEU A 19 93.361 2.367 -21.634 1.00 0.00 C ATOM 245 CG LEU A 19 94.617 3.250 -21.793 1.00 0.00 C ATOM 246 CD1 LEU A 19 95.874 2.432 -21.479 1.00 0.00 C ATOM 247 CD2 LEU A 19 94.709 3.817 -23.228 1.00 0.00 C ATOM 0 H LEU A 19 91.386 1.147 -22.529 1.00 0.00 H new ATOM 0 HA LEU A 19 94.102 1.260 -23.326 1.00 0.00 H new ATOM 0 HB2 LEU A 19 92.481 2.919 -21.965 1.00 0.00 H new ATOM 0 HB3 LEU A 19 93.211 2.130 -20.581 1.00 0.00 H new ATOM 0 HG LEU A 19 94.542 4.083 -21.094 1.00 0.00 H new ATOM 0 HD11 LEU A 19 96.756 3.062 -21.593 1.00 0.00 H new ATOM 0 HD12 LEU A 19 95.822 2.063 -20.455 1.00 0.00 H new ATOM 0 HD13 LEU A 19 95.940 1.588 -22.165 1.00 0.00 H new ATOM 0 HD21 LEU A 19 95.601 4.436 -23.318 1.00 0.00 H new ATOM 0 HD22 LEU A 19 94.765 2.995 -23.941 1.00 0.00 H new ATOM 0 HD23 LEU A 19 93.826 4.420 -23.438 1.00 0.00 H new ATOM 259 N THR A 20 93.487 -0.434 -20.524 1.00 0.00 N ATOM 260 CA THR A 20 94.024 -1.467 -19.650 1.00 0.00 C ATOM 261 C THR A 20 94.279 -2.761 -20.418 1.00 0.00 C ATOM 262 O THR A 20 95.311 -3.401 -20.238 1.00 0.00 O ATOM 263 CB THR A 20 93.037 -1.751 -18.519 1.00 0.00 C ATOM 264 OG1 THR A 20 92.558 -0.521 -18.004 1.00 0.00 O ATOM 265 CG2 THR A 20 93.732 -2.547 -17.404 1.00 0.00 C ATOM 0 H THR A 20 92.578 -0.067 -20.242 1.00 0.00 H new ATOM 0 HA THR A 20 94.969 -1.106 -19.245 1.00 0.00 H new ATOM 0 HB THR A 20 92.203 -2.339 -18.902 1.00 0.00 H new ATOM 0 HG1 THR A 20 93.315 0.025 -17.703 1.00 0.00 H new ATOM 0 HG21 THR A 20 93.022 -2.745 -16.601 1.00 0.00 H new ATOM 0 HG22 THR A 20 94.099 -3.492 -17.806 1.00 0.00 H new ATOM 0 HG23 THR A 20 94.570 -1.970 -17.013 1.00 0.00 H new ATOM 273 N VAL A 21 93.323 -3.152 -21.254 1.00 0.00 N ATOM 274 CA VAL A 21 93.454 -4.391 -22.018 1.00 0.00 C ATOM 275 C VAL A 21 94.615 -4.328 -23.015 1.00 0.00 C ATOM 276 O VAL A 21 95.243 -5.345 -23.308 1.00 0.00 O ATOM 277 CB VAL A 21 92.154 -4.672 -22.775 1.00 0.00 C ATOM 278 CG1 VAL A 21 92.316 -5.937 -23.622 1.00 0.00 C ATOM 279 CG2 VAL A 21 91.015 -4.873 -21.772 1.00 0.00 C ATOM 0 H VAL A 21 92.458 -2.637 -21.420 1.00 0.00 H new ATOM 0 HA VAL A 21 93.660 -5.193 -21.309 1.00 0.00 H new ATOM 0 HB VAL A 21 91.924 -3.828 -23.425 1.00 0.00 H new ATOM 0 HG11 VAL A 21 91.389 -6.136 -24.160 1.00 0.00 H new ATOM 0 HG12 VAL A 21 93.127 -5.795 -24.336 1.00 0.00 H new ATOM 0 HG13 VAL A 21 92.547 -6.782 -22.973 1.00 0.00 H new ATOM 0 HG21 VAL A 21 90.088 -5.073 -22.309 1.00 0.00 H new ATOM 0 HG22 VAL A 21 91.247 -5.717 -21.122 1.00 0.00 H new ATOM 0 HG23 VAL A 21 90.898 -3.972 -21.169 1.00 0.00 H new ATOM 289 N LEU A 22 94.878 -3.144 -23.552 1.00 0.00 N ATOM 290 CA LEU A 22 95.944 -2.983 -24.539 1.00 0.00 C ATOM 291 C LEU A 22 97.330 -3.134 -23.912 1.00 0.00 C ATOM 292 O LEU A 22 98.138 -3.943 -24.374 1.00 0.00 O ATOM 293 CB LEU A 22 95.823 -1.606 -25.204 1.00 0.00 C ATOM 294 CG LEU A 22 96.846 -1.465 -26.345 1.00 0.00 C ATOM 295 CD1 LEU A 22 96.544 -2.480 -27.465 1.00 0.00 C ATOM 296 CD2 LEU A 22 96.768 -0.040 -26.907 1.00 0.00 C ATOM 0 H LEU A 22 94.374 -2.286 -23.325 1.00 0.00 H new ATOM 0 HA LEU A 22 95.831 -3.770 -25.284 1.00 0.00 H new ATOM 0 HB2 LEU A 22 94.814 -1.472 -25.594 1.00 0.00 H new ATOM 0 HB3 LEU A 22 95.985 -0.823 -24.464 1.00 0.00 H new ATOM 0 HG LEU A 22 97.846 -1.661 -25.959 1.00 0.00 H new ATOM 0 HD11 LEU A 22 97.276 -2.368 -28.265 1.00 0.00 H new ATOM 0 HD12 LEU A 22 96.598 -3.492 -27.063 1.00 0.00 H new ATOM 0 HD13 LEU A 22 95.544 -2.299 -27.860 1.00 0.00 H new ATOM 0 HD21 LEU A 22 97.489 0.072 -27.717 1.00 0.00 H new ATOM 0 HD22 LEU A 22 95.764 0.147 -27.287 1.00 0.00 H new ATOM 0 HD23 LEU A 22 96.996 0.676 -26.117 1.00 0.00 H new ATOM 308 N ILE A 23 97.614 -2.357 -22.871 1.00 0.00 N ATOM 309 CA ILE A 23 98.923 -2.436 -22.228 1.00 0.00 C ATOM 310 C ILE A 23 99.064 -3.757 -21.472 1.00 0.00 C ATOM 311 O ILE A 23 100.113 -4.409 -21.522 1.00 0.00 O ATOM 312 CB ILE A 23 99.109 -1.247 -21.280 1.00 0.00 C ATOM 313 CG1 ILE A 23 98.620 0.035 -21.968 1.00 0.00 C ATOM 314 CG2 ILE A 23 100.592 -1.094 -20.917 1.00 0.00 C ATOM 315 CD1 ILE A 23 99.256 0.168 -23.356 1.00 0.00 C ATOM 0 H ILE A 23 96.972 -1.679 -22.461 1.00 0.00 H new ATOM 0 HA ILE A 23 99.699 -2.397 -22.993 1.00 0.00 H new ATOM 0 HB ILE A 23 98.533 -1.421 -20.371 1.00 0.00 H new ATOM 0 HG12 ILE A 23 97.534 0.016 -22.058 1.00 0.00 H new ATOM 0 HG13 ILE A 23 98.874 0.903 -21.359 1.00 0.00 H new ATOM 0 HG21 ILE A 23 100.716 -0.247 -20.243 1.00 0.00 H new ATOM 0 HG22 ILE A 23 100.942 -2.002 -20.426 1.00 0.00 H new ATOM 0 HG23 ILE A 23 101.173 -0.924 -21.824 1.00 0.00 H new ATOM 0 HD11 ILE A 23 98.901 1.081 -23.833 1.00 0.00 H new ATOM 0 HD12 ILE A 23 100.341 0.209 -23.257 1.00 0.00 H new ATOM 0 HD13 ILE A 23 98.980 -0.691 -23.967 1.00 0.00 H new ATOM 327 N ALA A 24 97.995 -4.156 -20.788 1.00 0.00 N ATOM 328 CA ALA A 24 97.999 -5.409 -20.042 1.00 0.00 C ATOM 329 C ALA A 24 98.264 -6.577 -20.985 1.00 0.00 C ATOM 330 O ALA A 24 99.002 -7.506 -20.654 1.00 0.00 O ATOM 331 CB ALA A 24 96.652 -5.609 -19.344 1.00 0.00 C ATOM 0 H ALA A 24 97.121 -3.633 -20.735 1.00 0.00 H new ATOM 0 HA ALA A 24 98.788 -5.367 -19.292 1.00 0.00 H new ATOM 0 HB1 ALA A 24 96.665 -6.547 -18.790 1.00 0.00 H new ATOM 0 HB2 ALA A 24 96.473 -4.783 -18.655 1.00 0.00 H new ATOM 0 HB3 ALA A 24 95.857 -5.639 -20.089 1.00 0.00 H new ATOM 337 N LEU A 25 97.662 -6.520 -22.167 1.00 0.00 N ATOM 338 CA LEU A 25 97.849 -7.571 -23.157 1.00 0.00 C ATOM 339 C LEU A 25 99.287 -7.551 -23.659 1.00 0.00 C ATOM 340 O LEU A 25 99.886 -8.597 -23.907 1.00 0.00 O ATOM 341 CB LEU A 25 96.878 -7.364 -24.328 1.00 0.00 C ATOM 342 CG LEU A 25 97.167 -8.368 -25.455 1.00 0.00 C ATOM 343 CD1 LEU A 25 97.142 -9.802 -24.905 1.00 0.00 C ATOM 344 CD2 LEU A 25 96.094 -8.218 -26.539 1.00 0.00 C ATOM 0 H LEU A 25 97.045 -5.763 -22.461 1.00 0.00 H new ATOM 0 HA LEU A 25 97.645 -8.539 -22.698 1.00 0.00 H new ATOM 0 HB2 LEU A 25 95.851 -7.484 -23.982 1.00 0.00 H new ATOM 0 HB3 LEU A 25 96.970 -6.346 -24.708 1.00 0.00 H new ATOM 0 HG LEU A 25 98.153 -8.169 -25.874 1.00 0.00 H new ATOM 0 HD11 LEU A 25 97.348 -10.505 -25.712 1.00 0.00 H new ATOM 0 HD12 LEU A 25 97.901 -9.908 -24.129 1.00 0.00 H new ATOM 0 HD13 LEU A 25 96.160 -10.013 -24.482 1.00 0.00 H new ATOM 0 HD21 LEU A 25 96.289 -8.926 -27.344 1.00 0.00 H new ATOM 0 HD22 LEU A 25 95.112 -8.418 -26.110 1.00 0.00 H new ATOM 0 HD23 LEU A 25 96.116 -7.203 -26.935 1.00 0.00 H new ATOM 356 N ALA A 26 99.836 -6.349 -23.805 1.00 0.00 N ATOM 357 CA ALA A 26 101.208 -6.201 -24.278 1.00 0.00 C ATOM 358 C ALA A 26 102.173 -6.978 -23.388 1.00 0.00 C ATOM 359 O ALA A 26 102.985 -7.760 -23.881 1.00 0.00 O ATOM 360 CB ALA A 26 101.599 -4.722 -24.293 1.00 0.00 C ATOM 0 H ALA A 26 99.357 -5.471 -23.605 1.00 0.00 H new ATOM 0 HA ALA A 26 101.267 -6.602 -25.290 1.00 0.00 H new ATOM 0 HB1 ALA A 26 102.625 -4.620 -24.647 1.00 0.00 H new ATOM 0 HB2 ALA A 26 100.930 -4.175 -24.957 1.00 0.00 H new ATOM 0 HB3 ALA A 26 101.521 -4.315 -23.285 1.00 0.00 H new ATOM 366 N VAL A 27 102.085 -6.763 -22.076 1.00 0.00 N ATOM 367 CA VAL A 27 102.972 -7.467 -21.152 1.00 0.00 C ATOM 368 C VAL A 27 102.658 -8.958 -21.140 1.00 0.00 C ATOM 369 O VAL A 27 103.559 -9.790 -21.026 1.00 0.00 O ATOM 370 CB VAL A 27 102.839 -6.903 -19.735 1.00 0.00 C ATOM 371 CG1 VAL A 27 103.412 -5.488 -19.694 1.00 0.00 C ATOM 372 CG2 VAL A 27 101.367 -6.861 -19.330 1.00 0.00 C ATOM 0 H VAL A 27 101.424 -6.122 -21.637 1.00 0.00 H new ATOM 0 HA VAL A 27 103.996 -7.321 -21.495 1.00 0.00 H new ATOM 0 HB VAL A 27 103.387 -7.543 -19.043 1.00 0.00 H new ATOM 0 HG11 VAL A 27 103.317 -5.086 -18.685 1.00 0.00 H new ATOM 0 HG12 VAL A 27 104.464 -5.513 -19.977 1.00 0.00 H new ATOM 0 HG13 VAL A 27 102.864 -4.853 -20.390 1.00 0.00 H new ATOM 0 HG21 VAL A 27 101.279 -6.459 -18.321 1.00 0.00 H new ATOM 0 HG22 VAL A 27 100.817 -6.225 -20.024 1.00 0.00 H new ATOM 0 HG23 VAL A 27 100.954 -7.869 -19.356 1.00 0.00 H new ATOM 382 N TYR A 28 101.377 -9.294 -21.261 1.00 0.00 N ATOM 383 CA TYR A 28 100.967 -10.693 -21.264 1.00 0.00 C ATOM 384 C TYR A 28 101.655 -11.447 -22.397 1.00 0.00 C ATOM 385 O TYR A 28 102.149 -12.558 -22.206 1.00 0.00 O ATOM 386 CB TYR A 28 99.449 -10.795 -21.427 1.00 0.00 C ATOM 387 CG TYR A 28 99.044 -12.249 -21.462 1.00 0.00 C ATOM 388 CD1 TYR A 28 98.890 -12.961 -20.265 1.00 0.00 C ATOM 389 CD2 TYR A 28 98.824 -12.887 -22.689 1.00 0.00 C ATOM 390 CE1 TYR A 28 98.515 -14.310 -20.297 1.00 0.00 C ATOM 391 CE2 TYR A 28 98.450 -14.236 -22.719 1.00 0.00 C ATOM 392 CZ TYR A 28 98.295 -14.948 -21.523 1.00 0.00 C ATOM 393 OH TYR A 28 97.927 -16.276 -21.553 1.00 0.00 O ATOM 0 H TYR A 28 100.613 -8.625 -21.357 1.00 0.00 H new ATOM 0 HA TYR A 28 101.258 -11.140 -20.314 1.00 0.00 H new ATOM 0 HB2 TYR A 28 98.949 -10.287 -20.603 1.00 0.00 H new ATOM 0 HB3 TYR A 28 99.137 -10.297 -22.345 1.00 0.00 H new ATOM 0 HD1 TYR A 28 99.060 -12.470 -19.318 1.00 0.00 H new ATOM 0 HD2 TYR A 28 98.943 -12.339 -23.612 1.00 0.00 H new ATOM 0 HE1 TYR A 28 98.395 -14.859 -19.374 1.00 0.00 H new ATOM 0 HE2 TYR A 28 98.281 -14.728 -23.665 1.00 0.00 H new ATOM 0 HH TYR A 28 97.813 -16.563 -22.483 1.00 0.00 H new ATOM 403 N PHE A 29 101.685 -10.834 -23.577 1.00 0.00 N ATOM 404 CA PHE A 29 102.316 -11.457 -24.734 1.00 0.00 C ATOM 405 C PHE A 29 103.822 -11.586 -24.523 1.00 0.00 C ATOM 406 O PHE A 29 104.413 -12.625 -24.817 1.00 0.00 O ATOM 407 CB PHE A 29 102.044 -10.625 -25.989 1.00 0.00 C ATOM 408 CG PHE A 29 102.697 -11.284 -27.182 1.00 0.00 C ATOM 409 CD1 PHE A 29 101.998 -12.249 -27.917 1.00 0.00 C ATOM 410 CD2 PHE A 29 103.999 -10.929 -27.551 1.00 0.00 C ATOM 411 CE1 PHE A 29 102.603 -12.859 -29.022 1.00 0.00 C ATOM 412 CE2 PHE A 29 104.603 -11.540 -28.657 1.00 0.00 C ATOM 413 CZ PHE A 29 103.906 -12.505 -29.392 1.00 0.00 C ATOM 0 H PHE A 29 101.283 -9.914 -23.756 1.00 0.00 H new ATOM 0 HA PHE A 29 101.893 -12.454 -24.860 1.00 0.00 H new ATOM 0 HB2 PHE A 29 100.970 -10.535 -26.153 1.00 0.00 H new ATOM 0 HB3 PHE A 29 102.433 -9.615 -25.860 1.00 0.00 H new ATOM 0 HD1 PHE A 29 100.993 -12.522 -27.632 1.00 0.00 H new ATOM 0 HD2 PHE A 29 104.538 -10.185 -26.984 1.00 0.00 H new ATOM 0 HE1 PHE A 29 102.064 -13.603 -29.590 1.00 0.00 H new ATOM 0 HE2 PHE A 29 105.608 -11.266 -28.943 1.00 0.00 H new ATOM 0 HZ PHE A 29 104.373 -12.977 -30.244 1.00 0.00 H new ATOM 423 N LEU A 30 104.436 -10.521 -24.015 1.00 0.00 N ATOM 424 CA LEU A 30 105.875 -10.525 -23.773 1.00 0.00 C ATOM 425 C LEU A 30 106.244 -11.591 -22.746 1.00 0.00 C ATOM 426 O LEU A 30 107.211 -12.331 -22.925 1.00 0.00 O ATOM 427 CB LEU A 30 106.320 -9.147 -23.264 1.00 0.00 C ATOM 428 CG LEU A 30 107.861 -9.045 -23.273 1.00 0.00 C ATOM 429 CD1 LEU A 30 108.363 -8.642 -24.666 1.00 0.00 C ATOM 430 CD2 LEU A 30 108.313 -7.987 -22.259 1.00 0.00 C ATOM 0 H LEU A 30 103.965 -9.652 -23.765 1.00 0.00 H new ATOM 0 HA LEU A 30 106.383 -10.750 -24.711 1.00 0.00 H new ATOM 0 HB2 LEU A 30 105.893 -8.365 -23.892 1.00 0.00 H new ATOM 0 HB3 LEU A 30 105.944 -8.986 -22.254 1.00 0.00 H new ATOM 0 HG LEU A 30 108.274 -10.019 -23.009 1.00 0.00 H new ATOM 0 HD11 LEU A 30 109.451 -8.575 -24.655 1.00 0.00 H new ATOM 0 HD12 LEU A 30 108.053 -9.391 -25.395 1.00 0.00 H new ATOM 0 HD13 LEU A 30 107.942 -7.674 -24.938 1.00 0.00 H new ATOM 0 HD21 LEU A 30 109.401 -7.917 -22.267 1.00 0.00 H new ATOM 0 HD22 LEU A 30 107.885 -7.021 -22.526 1.00 0.00 H new ATOM 0 HD23 LEU A 30 107.975 -8.271 -21.262 1.00 0.00 H new ATOM 442 N GLY A 31 105.468 -11.662 -21.669 1.00 0.00 N ATOM 443 CA GLY A 31 105.725 -12.641 -20.618 1.00 0.00 C ATOM 444 C GLY A 31 105.340 -14.045 -21.071 1.00 0.00 C ATOM 445 O GLY A 31 104.293 -14.243 -21.689 1.00 0.00 O ATOM 0 H GLY A 31 104.663 -11.059 -21.501 1.00 0.00 H new ATOM 0 HA2 GLY A 31 106.780 -12.620 -20.347 1.00 0.00 H new ATOM 0 HA3 GLY A 31 105.161 -12.376 -19.724 1.00 0.00 H new ATOM 449 N ARG A 32 106.192 -15.015 -20.759 1.00 0.00 N ATOM 450 CA ARG A 32 105.931 -16.400 -21.137 1.00 0.00 C ATOM 451 C ARG A 32 106.958 -17.329 -20.498 1.00 0.00 C ATOM 452 O ARG A 32 108.050 -17.526 -21.032 1.00 0.00 O ATOM 453 CB ARG A 32 105.983 -16.547 -22.659 1.00 0.00 C ATOM 454 CG ARG A 32 105.458 -17.928 -23.055 1.00 0.00 C ATOM 455 CD ARG A 32 105.647 -18.133 -24.559 1.00 0.00 C ATOM 456 NE ARG A 32 104.820 -17.194 -25.305 1.00 0.00 N ATOM 457 CZ ARG A 32 104.912 -17.098 -26.628 1.00 0.00 C ATOM 458 NH1 ARG A 32 105.751 -17.855 -27.280 1.00 0.00 N ATOM 459 NH2 ARG A 32 104.162 -16.247 -27.275 1.00 0.00 N ATOM 0 H ARG A 32 107.063 -14.870 -20.249 1.00 0.00 H new ATOM 0 HA ARG A 32 104.937 -16.674 -20.782 1.00 0.00 H new ATOM 0 HB2 ARG A 32 105.383 -15.769 -23.131 1.00 0.00 H new ATOM 0 HB3 ARG A 32 107.006 -16.420 -23.013 1.00 0.00 H new ATOM 0 HG2 ARG A 32 105.989 -18.703 -22.502 1.00 0.00 H new ATOM 0 HG3 ARG A 32 104.403 -18.016 -22.795 1.00 0.00 H new ATOM 0 HD2 ARG A 32 106.695 -17.994 -24.823 1.00 0.00 H new ATOM 0 HD3 ARG A 32 105.383 -19.155 -24.830 1.00 0.00 H new ATOM 0 HE ARG A 32 104.159 -16.600 -24.804 1.00 0.00 H new ATOM 0 HH11 ARG A 32 106.336 -18.520 -26.775 1.00 0.00 H new ATOM 0 HH12 ARG A 32 105.822 -17.781 -28.295 1.00 0.00 H new ATOM 0 HH21 ARG A 32 103.505 -15.656 -26.765 1.00 0.00 H new ATOM 0 HH22 ARG A 32 104.233 -16.174 -28.290 1.00 0.00 H new ATOM 473 N LEU A 33 106.601 -17.900 -19.352 1.00 0.00 N ATOM 474 CA LEU A 33 107.500 -18.808 -18.649 1.00 0.00 C ATOM 475 C LEU A 33 108.898 -18.202 -18.549 1.00 0.00 C ATOM 476 O LEU A 33 109.805 -18.588 -19.285 1.00 0.00 O ATOM 477 CB LEU A 33 107.571 -20.149 -19.389 1.00 0.00 C ATOM 478 CG LEU A 33 106.303 -20.963 -19.116 1.00 0.00 C ATOM 479 CD1 LEU A 33 105.064 -20.129 -19.463 1.00 0.00 C ATOM 480 CD2 LEU A 33 106.323 -22.231 -19.976 1.00 0.00 C ATOM 0 H LEU A 33 105.702 -17.752 -18.893 1.00 0.00 H new ATOM 0 HA LEU A 33 107.113 -18.970 -17.643 1.00 0.00 H new ATOM 0 HB2 LEU A 33 107.680 -19.978 -20.460 1.00 0.00 H new ATOM 0 HB3 LEU A 33 108.449 -20.707 -19.064 1.00 0.00 H new ATOM 0 HG LEU A 33 106.267 -21.234 -18.061 1.00 0.00 H new ATOM 0 HD11 LEU A 33 104.165 -20.714 -19.267 1.00 0.00 H new ATOM 0 HD12 LEU A 33 105.050 -19.226 -18.852 1.00 0.00 H new ATOM 0 HD13 LEU A 33 105.094 -19.853 -20.517 1.00 0.00 H new ATOM 0 HD21 LEU A 33 105.422 -22.814 -19.785 1.00 0.00 H new ATOM 0 HD22 LEU A 33 106.360 -21.955 -21.030 1.00 0.00 H new ATOM 0 HD23 LEU A 33 107.201 -22.827 -19.725 1.00 0.00 H new ATOM 492 N GLY A 34 109.063 -17.251 -17.635 1.00 0.00 N ATOM 493 CA GLY A 34 110.355 -16.600 -17.450 1.00 0.00 C ATOM 494 C GLY A 34 110.320 -15.636 -16.270 1.00 0.00 C ATOM 495 O GLY A 34 110.999 -15.846 -15.265 1.00 0.00 O ATOM 0 H GLY A 34 108.325 -16.916 -17.016 1.00 0.00 H new ATOM 0 HA2 GLY A 34 111.125 -17.354 -17.285 1.00 0.00 H new ATOM 0 HA3 GLY A 34 110.627 -16.060 -18.357 1.00 0.00 H new ATOM 499 N THR A 35 109.527 -14.577 -16.399 1.00 0.00 N ATOM 500 CA THR A 35 109.414 -13.584 -15.337 1.00 0.00 C ATOM 501 C THR A 35 108.873 -14.223 -14.061 1.00 0.00 C ATOM 502 O THR A 35 109.160 -13.762 -12.956 1.00 0.00 O ATOM 503 CB THR A 35 108.482 -12.451 -15.776 1.00 0.00 C ATOM 504 OG1 THR A 35 107.976 -11.787 -14.627 1.00 0.00 O ATOM 505 CG2 THR A 35 107.321 -13.025 -16.587 1.00 0.00 C ATOM 0 H THR A 35 108.957 -14.385 -17.223 1.00 0.00 H new ATOM 0 HA THR A 35 110.407 -13.181 -15.137 1.00 0.00 H new ATOM 0 HB THR A 35 109.036 -11.743 -16.393 1.00 0.00 H new ATOM 0 HG1 THR A 35 106.998 -11.850 -14.617 1.00 0.00 H new ATOM 0 HG21 THR A 35 106.660 -12.216 -16.898 1.00 0.00 H new ATOM 0 HG22 THR A 35 107.710 -13.535 -17.468 1.00 0.00 H new ATOM 0 HG23 THR A 35 106.764 -13.734 -15.974 1.00 0.00 H new ATOM 513 N ALA A 36 108.088 -15.282 -14.222 1.00 0.00 N ATOM 514 CA ALA A 36 107.510 -15.973 -13.075 1.00 0.00 C ATOM 515 C ALA A 36 106.595 -15.037 -12.292 1.00 0.00 C ATOM 516 O ALA A 36 106.514 -13.844 -12.585 1.00 0.00 O ATOM 517 CB ALA A 36 108.623 -16.490 -12.161 1.00 0.00 C ATOM 0 H ALA A 36 107.838 -15.679 -15.128 1.00 0.00 H new ATOM 0 HA ALA A 36 106.922 -16.815 -13.439 1.00 0.00 H new ATOM 0 HB1 ALA A 36 108.183 -17.005 -11.307 1.00 0.00 H new ATOM 0 HB2 ALA A 36 109.256 -17.183 -12.715 1.00 0.00 H new ATOM 0 HB3 ALA A 36 109.224 -15.651 -11.809 1.00 0.00 H new ATOM 523 N GLU A 37 105.907 -15.585 -11.297 1.00 0.00 N ATOM 524 CA GLU A 37 104.999 -14.789 -10.479 1.00 0.00 C ATOM 525 C GLU A 37 103.963 -14.092 -11.357 1.00 0.00 C ATOM 526 O GLU A 37 103.851 -12.866 -11.351 1.00 0.00 O ATOM 527 CB GLU A 37 105.788 -13.746 -9.684 1.00 0.00 C ATOM 528 CG GLU A 37 104.905 -13.168 -8.576 1.00 0.00 C ATOM 529 CD GLU A 37 105.713 -12.201 -7.717 1.00 0.00 C ATOM 530 OE1 GLU A 37 106.929 -12.237 -7.803 1.00 0.00 O ATOM 531 OE2 GLU A 37 105.103 -11.439 -6.985 1.00 0.00 O ATOM 0 H GLU A 37 105.959 -16.570 -11.038 1.00 0.00 H new ATOM 0 HA GLU A 37 104.483 -15.454 -9.787 1.00 0.00 H new ATOM 0 HB2 GLU A 37 106.679 -14.201 -9.252 1.00 0.00 H new ATOM 0 HB3 GLU A 37 106.126 -12.949 -10.346 1.00 0.00 H new ATOM 0 HG2 GLU A 37 104.050 -12.652 -9.013 1.00 0.00 H new ATOM 0 HG3 GLU A 37 104.509 -13.974 -7.957 1.00 0.00 H new ATOM 538 N VAL A 38 103.211 -14.885 -12.113 1.00 0.00 N ATOM 539 CA VAL A 38 102.185 -14.343 -12.997 1.00 0.00 C ATOM 540 C VAL A 38 101.023 -13.773 -12.189 1.00 0.00 C ATOM 541 O VAL A 38 100.296 -12.898 -12.658 1.00 0.00 O ATOM 542 CB VAL A 38 101.671 -15.439 -13.931 1.00 0.00 C ATOM 543 CG1 VAL A 38 102.789 -15.865 -14.884 1.00 0.00 C ATOM 544 CG2 VAL A 38 101.222 -16.646 -13.102 1.00 0.00 C ATOM 0 H VAL A 38 103.292 -15.902 -12.132 1.00 0.00 H new ATOM 0 HA VAL A 38 102.628 -13.540 -13.586 1.00 0.00 H new ATOM 0 HB VAL A 38 100.828 -15.058 -14.507 1.00 0.00 H new ATOM 0 HG11 VAL A 38 102.422 -16.646 -15.549 1.00 0.00 H new ATOM 0 HG12 VAL A 38 103.110 -15.007 -15.474 1.00 0.00 H new ATOM 0 HG13 VAL A 38 103.633 -16.246 -14.308 1.00 0.00 H new ATOM 0 HG21 VAL A 38 100.855 -17.428 -13.767 1.00 0.00 H new ATOM 0 HG22 VAL A 38 102.066 -17.026 -12.526 1.00 0.00 H new ATOM 0 HG23 VAL A 38 100.425 -16.344 -12.422 1.00 0.00 H new ATOM 554 N LEU A 39 100.850 -14.284 -10.975 1.00 0.00 N ATOM 555 CA LEU A 39 99.768 -13.831 -10.107 1.00 0.00 C ATOM 556 C LEU A 39 99.686 -12.305 -10.091 1.00 0.00 C ATOM 557 O LEU A 39 98.610 -11.738 -9.903 1.00 0.00 O ATOM 558 CB LEU A 39 99.997 -14.360 -8.684 1.00 0.00 C ATOM 559 CG LEU A 39 98.919 -13.828 -7.725 1.00 0.00 C ATOM 560 CD1 LEU A 39 97.519 -14.183 -8.246 1.00 0.00 C ATOM 561 CD2 LEU A 39 99.129 -14.462 -6.345 1.00 0.00 C ATOM 0 H LEU A 39 101.442 -15.009 -10.570 1.00 0.00 H new ATOM 0 HA LEU A 39 98.825 -14.218 -10.493 1.00 0.00 H new ATOM 0 HB2 LEU A 39 99.980 -15.450 -8.689 1.00 0.00 H new ATOM 0 HB3 LEU A 39 100.984 -14.058 -8.333 1.00 0.00 H new ATOM 0 HG LEU A 39 99.000 -12.743 -7.656 1.00 0.00 H new ATOM 0 HD11 LEU A 39 96.766 -13.800 -7.557 1.00 0.00 H new ATOM 0 HD12 LEU A 39 97.372 -13.735 -9.229 1.00 0.00 H new ATOM 0 HD13 LEU A 39 97.423 -15.266 -8.323 1.00 0.00 H new ATOM 0 HD21 LEU A 39 98.370 -14.092 -5.655 1.00 0.00 H new ATOM 0 HD22 LEU A 39 99.048 -15.546 -6.426 1.00 0.00 H new ATOM 0 HD23 LEU A 39 100.118 -14.199 -5.971 1.00 0.00 H new ATOM 573 N GLY A 40 100.825 -11.646 -10.286 1.00 0.00 N ATOM 574 CA GLY A 40 100.855 -10.187 -10.286 1.00 0.00 C ATOM 575 C GLY A 40 99.989 -9.621 -11.408 1.00 0.00 C ATOM 576 O GLY A 40 99.118 -8.780 -11.171 1.00 0.00 O ATOM 0 H GLY A 40 101.728 -12.092 -10.444 1.00 0.00 H new ATOM 0 HA2 GLY A 40 100.502 -9.813 -9.325 1.00 0.00 H new ATOM 0 HA3 GLY A 40 101.882 -9.841 -10.405 1.00 0.00 H new ATOM 580 N ILE A 41 100.232 -10.089 -12.629 1.00 0.00 N ATOM 581 CA ILE A 41 99.464 -9.625 -13.784 1.00 0.00 C ATOM 582 C ILE A 41 97.969 -9.835 -13.541 1.00 0.00 C ATOM 583 O ILE A 41 97.145 -8.989 -13.894 1.00 0.00 O ATOM 584 CB ILE A 41 99.905 -10.381 -15.050 1.00 0.00 C ATOM 585 CG1 ILE A 41 101.286 -9.881 -15.493 1.00 0.00 C ATOM 586 CG2 ILE A 41 98.902 -10.141 -16.185 1.00 0.00 C ATOM 587 CD1 ILE A 41 102.343 -10.237 -14.444 1.00 0.00 C ATOM 0 H ILE A 41 100.948 -10.783 -12.845 1.00 0.00 H new ATOM 0 HA ILE A 41 99.651 -8.561 -13.926 1.00 0.00 H new ATOM 0 HB ILE A 41 99.949 -11.446 -14.824 1.00 0.00 H new ATOM 0 HG12 ILE A 41 101.551 -10.327 -16.452 1.00 0.00 H new ATOM 0 HG13 ILE A 41 101.259 -8.801 -15.640 1.00 0.00 H new ATOM 0 HG21 ILE A 41 99.224 -10.681 -17.076 1.00 0.00 H new ATOM 0 HG22 ILE A 41 97.917 -10.497 -15.882 1.00 0.00 H new ATOM 0 HG23 ILE A 41 98.851 -9.075 -16.406 1.00 0.00 H new ATOM 0 HD11 ILE A 41 103.318 -9.876 -14.772 1.00 0.00 H new ATOM 0 HD12 ILE A 41 102.084 -9.770 -13.494 1.00 0.00 H new ATOM 0 HD13 ILE A 41 102.381 -11.319 -14.318 1.00 0.00 H new ATOM 599 N ILE A 42 97.627 -10.968 -12.945 1.00 0.00 N ATOM 600 CA ILE A 42 96.230 -11.280 -12.669 1.00 0.00 C ATOM 601 C ILE A 42 95.642 -10.287 -11.669 1.00 0.00 C ATOM 602 O ILE A 42 94.506 -9.844 -11.818 1.00 0.00 O ATOM 603 CB ILE A 42 96.117 -12.699 -12.105 1.00 0.00 C ATOM 604 CG1 ILE A 42 96.948 -13.665 -12.960 1.00 0.00 C ATOM 605 CG2 ILE A 42 94.652 -13.139 -12.115 1.00 0.00 C ATOM 606 CD1 ILE A 42 96.592 -13.503 -14.442 1.00 0.00 C ATOM 0 H ILE A 42 98.291 -11.682 -12.645 1.00 0.00 H new ATOM 0 HA ILE A 42 95.671 -11.210 -13.602 1.00 0.00 H new ATOM 0 HB ILE A 42 96.493 -12.710 -11.082 1.00 0.00 H new ATOM 0 HG12 ILE A 42 98.010 -13.472 -12.811 1.00 0.00 H new ATOM 0 HG13 ILE A 42 96.763 -14.692 -12.645 1.00 0.00 H new ATOM 0 HG21 ILE A 42 94.573 -14.149 -11.713 1.00 0.00 H new ATOM 0 HG22 ILE A 42 94.063 -12.457 -11.501 1.00 0.00 H new ATOM 0 HG23 ILE A 42 94.275 -13.124 -13.138 1.00 0.00 H new ATOM 0 HD11 ILE A 42 97.189 -14.194 -15.037 1.00 0.00 H new ATOM 0 HD12 ILE A 42 95.534 -13.719 -14.588 1.00 0.00 H new ATOM 0 HD13 ILE A 42 96.800 -12.480 -14.756 1.00 0.00 H new ATOM 618 N SER A 43 96.418 -9.952 -10.647 1.00 0.00 N ATOM 619 CA SER A 43 95.954 -9.021 -9.622 1.00 0.00 C ATOM 620 C SER A 43 95.592 -7.660 -10.217 1.00 0.00 C ATOM 621 O SER A 43 94.502 -7.139 -9.973 1.00 0.00 O ATOM 622 CB SER A 43 97.039 -8.838 -8.561 1.00 0.00 C ATOM 623 OG SER A 43 96.736 -7.696 -7.771 1.00 0.00 O ATOM 0 H SER A 43 97.364 -10.306 -10.504 1.00 0.00 H new ATOM 0 HA SER A 43 95.056 -9.444 -9.171 1.00 0.00 H new ATOM 0 HB2 SER A 43 97.100 -9.725 -7.930 1.00 0.00 H new ATOM 0 HB3 SER A 43 98.012 -8.717 -9.037 1.00 0.00 H new ATOM 0 HG SER A 43 97.429 -7.577 -7.089 1.00 0.00 H new ATOM 629 N ILE A 44 96.508 -7.081 -10.985 1.00 0.00 N ATOM 630 CA ILE A 44 96.260 -5.771 -11.583 1.00 0.00 C ATOM 631 C ILE A 44 95.060 -5.811 -12.532 1.00 0.00 C ATOM 632 O ILE A 44 94.210 -4.917 -12.505 1.00 0.00 O ATOM 633 CB ILE A 44 97.514 -5.282 -12.318 1.00 0.00 C ATOM 634 CG1 ILE A 44 97.193 -4.011 -13.120 1.00 0.00 C ATOM 635 CG2 ILE A 44 98.015 -6.369 -13.263 1.00 0.00 C ATOM 636 CD1 ILE A 44 98.492 -3.268 -13.436 1.00 0.00 C ATOM 0 H ILE A 44 97.416 -7.489 -11.207 1.00 0.00 H new ATOM 0 HA ILE A 44 96.024 -5.070 -10.782 1.00 0.00 H new ATOM 0 HB ILE A 44 98.287 -5.055 -11.584 1.00 0.00 H new ATOM 0 HG12 ILE A 44 96.676 -4.271 -14.044 1.00 0.00 H new ATOM 0 HG13 ILE A 44 96.523 -3.368 -12.550 1.00 0.00 H new ATOM 0 HG21 ILE A 44 98.906 -6.017 -13.783 1.00 0.00 H new ATOM 0 HG22 ILE A 44 98.259 -7.264 -12.691 1.00 0.00 H new ATOM 0 HG23 ILE A 44 97.239 -6.604 -13.991 1.00 0.00 H new ATOM 0 HD11 ILE A 44 98.266 -2.366 -14.005 1.00 0.00 H new ATOM 0 HD12 ILE A 44 98.991 -2.995 -12.506 1.00 0.00 H new ATOM 0 HD13 ILE A 44 99.146 -3.913 -14.023 1.00 0.00 H new ATOM 648 N VAL A 45 94.982 -6.847 -13.360 1.00 0.00 N ATOM 649 CA VAL A 45 93.867 -6.970 -14.293 1.00 0.00 C ATOM 650 C VAL A 45 92.543 -6.933 -13.531 1.00 0.00 C ATOM 651 O VAL A 45 91.584 -6.279 -13.950 1.00 0.00 O ATOM 652 CB VAL A 45 93.979 -8.285 -15.078 1.00 0.00 C ATOM 653 CG1 VAL A 45 92.689 -8.542 -15.865 1.00 0.00 C ATOM 654 CG2 VAL A 45 95.152 -8.194 -16.058 1.00 0.00 C ATOM 0 H VAL A 45 95.665 -7.603 -13.405 1.00 0.00 H new ATOM 0 HA VAL A 45 93.900 -6.135 -14.993 1.00 0.00 H new ATOM 0 HB VAL A 45 94.141 -9.103 -14.376 1.00 0.00 H new ATOM 0 HG11 VAL A 45 92.780 -9.477 -16.418 1.00 0.00 H new ATOM 0 HG12 VAL A 45 91.849 -8.609 -15.174 1.00 0.00 H new ATOM 0 HG13 VAL A 45 92.520 -7.723 -16.564 1.00 0.00 H new ATOM 0 HG21 VAL A 45 95.233 -9.127 -16.616 1.00 0.00 H new ATOM 0 HG22 VAL A 45 94.984 -7.370 -16.751 1.00 0.00 H new ATOM 0 HG23 VAL A 45 96.075 -8.021 -15.505 1.00 0.00 H new ATOM 664 N LEU A 46 92.500 -7.646 -12.411 1.00 0.00 N ATOM 665 CA LEU A 46 91.294 -7.701 -11.595 1.00 0.00 C ATOM 666 C LEU A 46 91.012 -6.344 -10.943 1.00 0.00 C ATOM 667 O LEU A 46 89.854 -5.998 -10.718 1.00 0.00 O ATOM 668 CB LEU A 46 91.443 -8.797 -10.513 1.00 0.00 C ATOM 669 CG LEU A 46 90.868 -10.150 -11.000 1.00 0.00 C ATOM 670 CD1 LEU A 46 89.329 -10.131 -10.957 1.00 0.00 C ATOM 671 CD2 LEU A 46 91.344 -10.456 -12.436 1.00 0.00 C ATOM 0 H LEU A 46 93.282 -8.191 -12.049 1.00 0.00 H new ATOM 0 HA LEU A 46 90.450 -7.947 -12.240 1.00 0.00 H new ATOM 0 HB2 LEU A 46 92.496 -8.918 -10.257 1.00 0.00 H new ATOM 0 HB3 LEU A 46 90.928 -8.486 -9.604 1.00 0.00 H new ATOM 0 HG LEU A 46 91.231 -10.931 -10.332 1.00 0.00 H new ATOM 0 HD11 LEU A 46 88.943 -11.090 -11.303 1.00 0.00 H new ATOM 0 HD12 LEU A 46 88.996 -9.953 -9.935 1.00 0.00 H new ATOM 0 HD13 LEU A 46 88.957 -9.336 -11.603 1.00 0.00 H new ATOM 0 HD21 LEU A 46 90.930 -11.410 -12.761 1.00 0.00 H new ATOM 0 HD22 LEU A 46 91.006 -9.666 -13.107 1.00 0.00 H new ATOM 0 HD23 LEU A 46 92.433 -10.507 -12.455 1.00 0.00 H new ATOM 683 N VAL A 47 92.058 -5.578 -10.646 1.00 0.00 N ATOM 684 CA VAL A 47 91.867 -4.272 -10.025 1.00 0.00 C ATOM 685 C VAL A 47 91.204 -3.321 -11.015 1.00 0.00 C ATOM 686 O VAL A 47 90.411 -2.459 -10.635 1.00 0.00 O ATOM 687 CB VAL A 47 93.216 -3.704 -9.561 1.00 0.00 C ATOM 688 CG1 VAL A 47 93.057 -2.233 -9.160 1.00 0.00 C ATOM 689 CG2 VAL A 47 93.715 -4.503 -8.352 1.00 0.00 C ATOM 0 H VAL A 47 93.030 -5.833 -10.822 1.00 0.00 H new ATOM 0 HA VAL A 47 91.220 -4.383 -9.155 1.00 0.00 H new ATOM 0 HB VAL A 47 93.933 -3.779 -10.378 1.00 0.00 H new ATOM 0 HG11 VAL A 47 94.019 -1.839 -8.832 1.00 0.00 H new ATOM 0 HG12 VAL A 47 92.702 -1.659 -10.016 1.00 0.00 H new ATOM 0 HG13 VAL A 47 92.336 -2.154 -8.346 1.00 0.00 H new ATOM 0 HG21 VAL A 47 94.673 -4.102 -8.021 1.00 0.00 H new ATOM 0 HG22 VAL A 47 92.990 -4.427 -7.542 1.00 0.00 H new ATOM 0 HG23 VAL A 47 93.838 -5.549 -8.633 1.00 0.00 H new ATOM 699 N ALA A 48 91.540 -3.481 -12.287 1.00 0.00 N ATOM 700 CA ALA A 48 90.975 -2.631 -13.324 1.00 0.00 C ATOM 701 C ALA A 48 89.513 -2.969 -13.587 1.00 0.00 C ATOM 702 O ALA A 48 88.667 -2.079 -13.660 1.00 0.00 O ATOM 703 CB ALA A 48 91.781 -2.783 -14.615 1.00 0.00 C ATOM 0 H ALA A 48 92.196 -4.186 -12.624 1.00 0.00 H new ATOM 0 HA ALA A 48 91.026 -1.599 -12.977 1.00 0.00 H new ATOM 0 HB1 ALA A 48 91.354 -2.144 -15.388 1.00 0.00 H new ATOM 0 HB2 ALA A 48 92.816 -2.491 -14.434 1.00 0.00 H new ATOM 0 HB3 ALA A 48 91.749 -3.822 -14.944 1.00 0.00 H new ATOM 709 N THR A 49 89.222 -4.253 -13.751 1.00 0.00 N ATOM 710 CA THR A 49 87.855 -4.675 -14.028 1.00 0.00 C ATOM 711 C THR A 49 86.910 -4.265 -12.898 1.00 0.00 C ATOM 712 O THR A 49 85.828 -3.731 -13.149 1.00 0.00 O ATOM 713 CB THR A 49 87.803 -6.194 -14.227 1.00 0.00 C ATOM 714 OG1 THR A 49 88.947 -6.611 -14.960 1.00 0.00 O ATOM 715 CG2 THR A 49 86.537 -6.573 -15.002 1.00 0.00 C ATOM 0 H THR A 49 89.903 -5.011 -13.698 1.00 0.00 H new ATOM 0 HA THR A 49 87.528 -4.180 -14.942 1.00 0.00 H new ATOM 0 HB THR A 49 87.789 -6.685 -13.254 1.00 0.00 H new ATOM 0 HG1 THR A 49 88.918 -7.582 -15.087 1.00 0.00 H new ATOM 0 HG21 THR A 49 86.505 -7.654 -15.141 1.00 0.00 H new ATOM 0 HG22 THR A 49 85.658 -6.253 -14.442 1.00 0.00 H new ATOM 0 HG23 THR A 49 86.546 -6.082 -15.975 1.00 0.00 H new ATOM 723 N VAL A 50 87.314 -4.519 -11.655 1.00 0.00 N ATOM 724 CA VAL A 50 86.472 -4.171 -10.512 1.00 0.00 C ATOM 725 C VAL A 50 86.363 -2.657 -10.350 1.00 0.00 C ATOM 726 O VAL A 50 85.307 -2.147 -9.989 1.00 0.00 O ATOM 727 CB VAL A 50 87.022 -4.787 -9.221 1.00 0.00 C ATOM 728 CG1 VAL A 50 87.175 -6.303 -9.393 1.00 0.00 C ATOM 729 CG2 VAL A 50 88.378 -4.158 -8.888 1.00 0.00 C ATOM 0 H VAL A 50 88.203 -4.957 -11.415 1.00 0.00 H new ATOM 0 HA VAL A 50 85.478 -4.576 -10.704 1.00 0.00 H new ATOM 0 HB VAL A 50 86.328 -4.592 -8.404 1.00 0.00 H new ATOM 0 HG11 VAL A 50 87.566 -6.736 -8.472 1.00 0.00 H new ATOM 0 HG12 VAL A 50 86.204 -6.744 -9.617 1.00 0.00 H new ATOM 0 HG13 VAL A 50 87.864 -6.509 -10.212 1.00 0.00 H new ATOM 0 HG21 VAL A 50 88.767 -4.597 -7.970 1.00 0.00 H new ATOM 0 HG22 VAL A 50 89.076 -4.345 -9.704 1.00 0.00 H new ATOM 0 HG23 VAL A 50 88.257 -3.083 -8.753 1.00 0.00 H new ATOM 739 N LEU A 51 87.451 -1.936 -10.612 1.00 0.00 N ATOM 740 CA LEU A 51 87.422 -0.482 -10.479 1.00 0.00 C ATOM 741 C LEU A 51 86.480 0.122 -11.507 1.00 0.00 C ATOM 742 O LEU A 51 85.731 1.047 -11.204 1.00 0.00 O ATOM 743 CB LEU A 51 88.836 0.087 -10.659 1.00 0.00 C ATOM 744 CG LEU A 51 88.852 1.604 -10.403 1.00 0.00 C ATOM 745 CD1 LEU A 51 88.622 1.902 -8.910 1.00 0.00 C ATOM 746 CD2 LEU A 51 90.212 2.162 -10.833 1.00 0.00 C ATOM 0 H LEU A 51 88.345 -2.324 -10.911 1.00 0.00 H new ATOM 0 HA LEU A 51 87.060 -0.226 -9.483 1.00 0.00 H new ATOM 0 HB2 LEU A 51 89.522 -0.409 -9.973 1.00 0.00 H new ATOM 0 HB3 LEU A 51 89.190 -0.120 -11.669 1.00 0.00 H new ATOM 0 HG LEU A 51 88.053 2.074 -10.976 1.00 0.00 H new ATOM 0 HD11 LEU A 51 88.637 2.980 -8.748 1.00 0.00 H new ATOM 0 HD12 LEU A 51 87.655 1.502 -8.604 1.00 0.00 H new ATOM 0 HD13 LEU A 51 89.411 1.436 -8.320 1.00 0.00 H new ATOM 0 HD21 LEU A 51 90.236 3.237 -10.657 1.00 0.00 H new ATOM 0 HD22 LEU A 51 91.002 1.682 -10.255 1.00 0.00 H new ATOM 0 HD23 LEU A 51 90.367 1.965 -11.894 1.00 0.00 H new ATOM 758 N LYS A 52 86.520 -0.404 -12.722 1.00 0.00 N ATOM 759 CA LYS A 52 85.661 0.101 -13.783 1.00 0.00 C ATOM 760 C LYS A 52 84.190 -0.115 -13.427 1.00 0.00 C ATOM 761 O LYS A 52 83.400 0.815 -13.458 1.00 0.00 O ATOM 762 CB LYS A 52 86.013 -0.617 -15.111 1.00 0.00 C ATOM 763 CG LYS A 52 86.157 0.399 -16.260 1.00 0.00 C ATOM 764 CD LYS A 52 87.527 1.103 -16.176 1.00 0.00 C ATOM 765 CE LYS A 52 88.600 0.273 -16.901 1.00 0.00 C ATOM 766 NZ LYS A 52 89.944 0.629 -16.366 1.00 0.00 N ATOM 0 H LYS A 52 87.132 -1.173 -12.996 1.00 0.00 H new ATOM 0 HA LYS A 52 85.824 1.172 -13.901 1.00 0.00 H new ATOM 0 HB2 LYS A 52 86.943 -1.174 -14.993 1.00 0.00 H new ATOM 0 HB3 LYS A 52 85.236 -1.341 -15.355 1.00 0.00 H new ATOM 0 HG2 LYS A 52 86.059 -0.109 -17.219 1.00 0.00 H new ATOM 0 HG3 LYS A 52 85.356 1.137 -16.206 1.00 0.00 H new ATOM 0 HD2 LYS A 52 87.462 2.095 -16.623 1.00 0.00 H new ATOM 0 HD3 LYS A 52 87.809 1.242 -15.132 1.00 0.00 H new ATOM 0 HE2 LYS A 52 88.410 -0.791 -16.760 1.00 0.00 H new ATOM 0 HE3 LYS A 52 88.561 0.464 -17.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 90.484 1.137 -17.095 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 89.835 1.237 -15.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 90.453 -0.238 -16.100 1.00 0.00 H new ATOM 780 N THR A 53 83.831 -1.347 -13.097 1.00 0.00 N ATOM 781 CA THR A 53 82.444 -1.664 -12.763 1.00 0.00 C ATOM 782 C THR A 53 81.955 -0.935 -11.507 1.00 0.00 C ATOM 783 O THR A 53 80.848 -0.389 -11.490 1.00 0.00 O ATOM 784 CB THR A 53 82.300 -3.173 -12.556 1.00 0.00 C ATOM 785 OG1 THR A 53 83.209 -3.598 -11.550 1.00 0.00 O ATOM 786 CG2 THR A 53 82.610 -3.901 -13.865 1.00 0.00 C ATOM 0 H THR A 53 84.472 -2.139 -13.052 1.00 0.00 H new ATOM 0 HA THR A 53 81.829 -1.327 -13.597 1.00 0.00 H new ATOM 0 HB THR A 53 81.280 -3.403 -12.248 1.00 0.00 H new ATOM 0 HG1 THR A 53 84.099 -3.715 -11.942 1.00 0.00 H new ATOM 0 HG21 THR A 53 82.507 -4.976 -13.717 1.00 0.00 H new ATOM 0 HG22 THR A 53 81.914 -3.573 -14.637 1.00 0.00 H new ATOM 0 HG23 THR A 53 83.630 -3.673 -14.175 1.00 0.00 H new ATOM 794 N ILE A 54 82.758 -0.958 -10.448 1.00 0.00 N ATOM 795 CA ILE A 54 82.361 -0.332 -9.188 1.00 0.00 C ATOM 796 C ILE A 54 82.135 1.171 -9.321 1.00 0.00 C ATOM 797 O ILE A 54 81.099 1.675 -8.896 1.00 0.00 O ATOM 798 CB ILE A 54 83.418 -0.609 -8.113 1.00 0.00 C ATOM 799 CG1 ILE A 54 83.435 -2.107 -7.792 1.00 0.00 C ATOM 800 CG2 ILE A 54 83.087 0.175 -6.838 1.00 0.00 C ATOM 801 CD1 ILE A 54 84.707 -2.448 -7.015 1.00 0.00 C ATOM 0 H ILE A 54 83.678 -1.398 -10.434 1.00 0.00 H new ATOM 0 HA ILE A 54 81.408 -0.773 -8.897 1.00 0.00 H new ATOM 0 HB ILE A 54 84.394 -0.297 -8.484 1.00 0.00 H new ATOM 0 HG12 ILE A 54 82.556 -2.374 -7.206 1.00 0.00 H new ATOM 0 HG13 ILE A 54 83.392 -2.688 -8.713 1.00 0.00 H new ATOM 0 HG21 ILE A 54 83.843 -0.028 -6.080 1.00 0.00 H new ATOM 0 HG22 ILE A 54 83.073 1.242 -7.060 1.00 0.00 H new ATOM 0 HG23 ILE A 54 82.109 -0.131 -6.466 1.00 0.00 H new ATOM 0 HD11 ILE A 54 84.719 -3.514 -6.787 1.00 0.00 H new ATOM 0 HD12 ILE A 54 85.580 -2.196 -7.617 1.00 0.00 H new ATOM 0 HD13 ILE A 54 84.730 -1.878 -6.086 1.00 0.00 H new ATOM 813 N VAL A 55 83.101 1.891 -9.878 1.00 0.00 N ATOM 814 CA VAL A 55 82.954 3.339 -10.010 1.00 0.00 C ATOM 815 C VAL A 55 81.958 3.694 -11.111 1.00 0.00 C ATOM 816 O VAL A 55 81.304 4.730 -11.047 1.00 0.00 O ATOM 817 CB VAL A 55 84.311 3.999 -10.298 1.00 0.00 C ATOM 818 CG1 VAL A 55 85.350 3.482 -9.298 1.00 0.00 C ATOM 819 CG2 VAL A 55 84.764 3.691 -11.741 1.00 0.00 C ATOM 0 H VAL A 55 83.976 1.510 -10.239 1.00 0.00 H new ATOM 0 HA VAL A 55 82.571 3.719 -9.063 1.00 0.00 H new ATOM 0 HB VAL A 55 84.212 5.079 -10.192 1.00 0.00 H new ATOM 0 HG11 VAL A 55 86.314 3.949 -9.501 1.00 0.00 H new ATOM 0 HG12 VAL A 55 85.033 3.728 -8.284 1.00 0.00 H new ATOM 0 HG13 VAL A 55 85.443 2.400 -9.397 1.00 0.00 H new ATOM 0 HG21 VAL A 55 85.727 4.166 -11.929 1.00 0.00 H new ATOM 0 HG22 VAL A 55 84.860 2.613 -11.870 1.00 0.00 H new ATOM 0 HG23 VAL A 55 84.026 4.077 -12.444 1.00 0.00 H new ATOM 829 N LEU A 56 81.854 2.845 -12.124 1.00 0.00 N ATOM 830 CA LEU A 56 80.946 3.108 -13.235 1.00 0.00 C ATOM 831 C LEU A 56 79.474 2.962 -12.841 1.00 0.00 C ATOM 832 O LEU A 56 78.612 3.617 -13.426 1.00 0.00 O ATOM 833 CB LEU A 56 81.272 2.165 -14.395 1.00 0.00 C ATOM 834 CG LEU A 56 80.332 2.425 -15.603 1.00 0.00 C ATOM 835 CD1 LEU A 56 81.134 2.344 -16.907 1.00 0.00 C ATOM 836 CD2 LEU A 56 79.215 1.370 -15.648 1.00 0.00 C ATOM 0 H LEU A 56 82.381 1.975 -12.201 1.00 0.00 H new ATOM 0 HA LEU A 56 81.093 4.145 -13.538 1.00 0.00 H new ATOM 0 HB2 LEU A 56 82.309 2.303 -14.700 1.00 0.00 H new ATOM 0 HB3 LEU A 56 81.171 1.130 -14.067 1.00 0.00 H new ATOM 0 HG LEU A 56 79.893 3.416 -15.492 1.00 0.00 H new ATOM 0 HD11 LEU A 56 80.472 2.527 -17.753 1.00 0.00 H new ATOM 0 HD12 LEU A 56 81.924 3.095 -16.895 1.00 0.00 H new ATOM 0 HD13 LEU A 56 81.577 1.353 -17.001 1.00 0.00 H new ATOM 0 HD21 LEU A 56 78.564 1.565 -16.500 1.00 0.00 H new ATOM 0 HD22 LEU A 56 79.655 0.378 -15.748 1.00 0.00 H new ATOM 0 HD23 LEU A 56 78.632 1.418 -14.728 1.00 0.00 H new ATOM 848 N ILE A 57 79.169 2.095 -11.878 1.00 0.00 N ATOM 849 CA ILE A 57 77.769 1.902 -11.488 1.00 0.00 C ATOM 850 C ILE A 57 77.133 3.194 -10.930 1.00 0.00 C ATOM 851 O ILE A 57 76.099 3.626 -11.439 1.00 0.00 O ATOM 852 CB ILE A 57 77.655 0.726 -10.485 1.00 0.00 C ATOM 853 CG1 ILE A 57 77.614 -0.603 -11.252 1.00 0.00 C ATOM 854 CG2 ILE A 57 76.380 0.847 -9.639 1.00 0.00 C ATOM 855 CD1 ILE A 57 77.820 -1.765 -10.277 1.00 0.00 C ATOM 0 H ILE A 57 79.846 1.530 -11.366 1.00 0.00 H new ATOM 0 HA ILE A 57 77.202 1.649 -12.384 1.00 0.00 H new ATOM 0 HB ILE A 57 78.522 0.757 -9.826 1.00 0.00 H new ATOM 0 HG12 ILE A 57 76.658 -0.710 -11.764 1.00 0.00 H new ATOM 0 HG13 ILE A 57 78.389 -0.616 -12.018 1.00 0.00 H new ATOM 0 HG21 ILE A 57 76.324 0.010 -8.943 1.00 0.00 H new ATOM 0 HG22 ILE A 57 76.402 1.782 -9.080 1.00 0.00 H new ATOM 0 HG23 ILE A 57 75.507 0.835 -10.292 1.00 0.00 H new ATOM 0 HD11 ILE A 57 77.791 -2.708 -10.823 1.00 0.00 H new ATOM 0 HD12 ILE A 57 78.787 -1.660 -9.785 1.00 0.00 H new ATOM 0 HD13 ILE A 57 77.029 -1.755 -9.527 1.00 0.00 H new ATOM 867 N PRO A 58 77.696 3.824 -9.922 1.00 0.00 N ATOM 868 CA PRO A 58 77.108 5.078 -9.357 1.00 0.00 C ATOM 869 C PRO A 58 77.177 6.229 -10.358 1.00 0.00 C ATOM 870 O PRO A 58 76.343 7.136 -10.338 1.00 0.00 O ATOM 871 CB PRO A 58 77.964 5.358 -8.111 1.00 0.00 C ATOM 872 CG PRO A 58 79.265 4.677 -8.382 1.00 0.00 C ATOM 873 CD PRO A 58 78.924 3.437 -9.209 1.00 0.00 C ATOM 0 HA PRO A 58 76.049 4.974 -9.120 1.00 0.00 H new ATOM 0 HB2 PRO A 58 78.102 6.428 -7.958 1.00 0.00 H new ATOM 0 HB3 PRO A 58 77.492 4.966 -7.210 1.00 0.00 H new ATOM 0 HG2 PRO A 58 79.944 5.334 -8.925 1.00 0.00 H new ATOM 0 HG3 PRO A 58 79.763 4.402 -7.452 1.00 0.00 H new ATOM 0 HD2 PRO A 58 79.727 3.184 -9.901 1.00 0.00 H new ATOM 0 HD3 PRO A 58 78.762 2.565 -8.576 1.00 0.00 H new ATOM 881 N PHE A 59 78.176 6.183 -11.229 1.00 0.00 N ATOM 882 CA PHE A 59 78.362 7.205 -12.230 1.00 0.00 C ATOM 883 C PHE A 59 77.105 7.345 -13.086 1.00 0.00 C ATOM 884 O PHE A 59 76.632 8.455 -13.330 1.00 0.00 O ATOM 885 CB PHE A 59 79.560 6.824 -13.107 1.00 0.00 C ATOM 886 CG PHE A 59 80.886 7.139 -12.422 1.00 0.00 C ATOM 887 CD1 PHE A 59 80.990 7.287 -11.019 1.00 0.00 C ATOM 888 CD2 PHE A 59 82.030 7.299 -13.216 1.00 0.00 C ATOM 889 CE1 PHE A 59 82.227 7.587 -10.438 1.00 0.00 C ATOM 890 CE2 PHE A 59 83.265 7.597 -12.625 1.00 0.00 C ATOM 891 CZ PHE A 59 83.362 7.742 -11.239 1.00 0.00 C ATOM 0 H PHE A 59 78.872 5.438 -11.256 1.00 0.00 H new ATOM 0 HA PHE A 59 78.551 8.163 -11.745 1.00 0.00 H new ATOM 0 HB2 PHE A 59 79.515 5.760 -13.341 1.00 0.00 H new ATOM 0 HB3 PHE A 59 79.503 7.361 -14.054 1.00 0.00 H new ATOM 0 HD1 PHE A 59 80.115 7.169 -10.397 1.00 0.00 H new ATOM 0 HD2 PHE A 59 81.959 7.192 -14.288 1.00 0.00 H new ATOM 0 HE1 PHE A 59 82.305 7.699 -9.367 1.00 0.00 H new ATOM 0 HE2 PHE A 59 84.143 7.715 -13.242 1.00 0.00 H new ATOM 0 HZ PHE A 59 84.315 7.974 -10.786 1.00 0.00 H new ATOM 901 N LEU A 60 76.565 6.214 -13.542 1.00 0.00 N ATOM 902 CA LEU A 60 75.360 6.239 -14.369 1.00 0.00 C ATOM 903 C LEU A 60 74.113 6.348 -13.492 1.00 0.00 C ATOM 904 O LEU A 60 73.029 5.913 -13.882 1.00 0.00 O ATOM 905 CB LEU A 60 75.288 4.965 -15.229 1.00 0.00 C ATOM 906 CG LEU A 60 76.196 5.094 -16.468 1.00 0.00 C ATOM 907 CD1 LEU A 60 75.601 6.085 -17.489 1.00 0.00 C ATOM 908 CD2 LEU A 60 77.588 5.572 -16.035 1.00 0.00 C ATOM 0 H LEU A 60 76.937 5.283 -13.356 1.00 0.00 H new ATOM 0 HA LEU A 60 75.403 7.110 -15.023 1.00 0.00 H new ATOM 0 HB2 LEU A 60 75.593 4.102 -14.637 1.00 0.00 H new ATOM 0 HB3 LEU A 60 74.259 4.789 -15.542 1.00 0.00 H new ATOM 0 HG LEU A 60 76.272 4.116 -16.944 1.00 0.00 H new ATOM 0 HD11 LEU A 60 76.261 6.157 -18.353 1.00 0.00 H new ATOM 0 HD12 LEU A 60 74.621 5.732 -17.810 1.00 0.00 H new ATOM 0 HD13 LEU A 60 75.500 7.067 -17.027 1.00 0.00 H new ATOM 0 HD21 LEU A 60 78.230 5.663 -16.911 1.00 0.00 H new ATOM 0 HD22 LEU A 60 77.503 6.542 -15.544 1.00 0.00 H new ATOM 0 HD23 LEU A 60 78.021 4.851 -15.341 1.00 0.00 H new ATOM 920 N GLU A 61 74.272 6.934 -12.305 1.00 0.00 N ATOM 921 CA GLU A 61 73.151 7.102 -11.375 1.00 0.00 C ATOM 922 C GLU A 61 73.237 8.454 -10.675 1.00 0.00 C ATOM 923 O GLU A 61 74.286 9.098 -10.671 1.00 0.00 O ATOM 924 CB GLU A 61 73.165 5.988 -10.321 1.00 0.00 C ATOM 925 CG GLU A 61 72.842 4.641 -10.974 1.00 0.00 C ATOM 926 CD GLU A 61 71.402 4.633 -11.479 1.00 0.00 C ATOM 927 OE1 GLU A 61 70.520 4.958 -10.700 1.00 0.00 O ATOM 928 OE2 GLU A 61 71.202 4.301 -12.635 1.00 0.00 O ATOM 0 H GLU A 61 75.161 7.299 -11.964 1.00 0.00 H new ATOM 0 HA GLU A 61 72.224 7.051 -11.947 1.00 0.00 H new ATOM 0 HB2 GLU A 61 74.143 5.943 -9.841 1.00 0.00 H new ATOM 0 HB3 GLU A 61 72.436 6.206 -9.540 1.00 0.00 H new ATOM 0 HG2 GLU A 61 73.527 4.456 -11.802 1.00 0.00 H new ATOM 0 HG3 GLU A 61 72.987 3.835 -10.254 1.00 0.00 H new ATOM 935 N GLN A 62 72.124 8.878 -10.082 1.00 0.00 N ATOM 936 CA GLN A 62 72.081 10.156 -9.379 1.00 0.00 C ATOM 937 C GLN A 62 72.957 10.110 -8.131 1.00 0.00 C ATOM 938 O GLN A 62 73.451 11.138 -7.670 1.00 0.00 O ATOM 939 CB GLN A 62 70.640 10.484 -8.980 1.00 0.00 C ATOM 940 CG GLN A 62 69.822 10.804 -10.232 1.00 0.00 C ATOM 941 CD GLN A 62 70.268 12.137 -10.822 1.00 0.00 C ATOM 942 OE1 GLN A 62 70.409 13.121 -10.097 1.00 0.00 O ATOM 943 NE2 GLN A 62 70.500 12.228 -12.103 1.00 0.00 N ATOM 0 H GLN A 62 71.246 8.359 -10.074 1.00 0.00 H new ATOM 0 HA GLN A 62 72.459 10.930 -10.047 1.00 0.00 H new ATOM 0 HB2 GLN A 62 70.198 9.641 -8.450 1.00 0.00 H new ATOM 0 HB3 GLN A 62 70.625 11.333 -8.297 1.00 0.00 H new ATOM 0 HG2 GLN A 62 69.946 10.011 -10.970 1.00 0.00 H new ATOM 0 HG3 GLN A 62 68.762 10.844 -9.983 1.00 0.00 H new ATOM 0 HE21 GLN A 62 70.382 11.411 -12.702 1.00 0.00 H new ATOM 0 HE22 GLN A 62 70.799 13.116 -12.505 1.00 0.00 H new ATOM 952 N ASN A 63 73.144 8.911 -7.588 1.00 0.00 N ATOM 953 CA ASN A 63 73.962 8.741 -6.392 1.00 0.00 C ATOM 954 C ASN A 63 75.257 9.539 -6.507 1.00 0.00 C ATOM 955 CB ASN A 63 74.290 7.260 -6.190 1.00 0.00 C ATOM 956 CG ASN A 63 73.003 6.444 -6.128 1.00 0.00 C ATOM 957 OD1 ASN A 63 71.984 6.927 -5.635 1.00 0.00 O ATOM 958 ND2 ASN A 63 72.989 5.228 -6.602 1.00 0.00 N ATOM 0 H ASN A 63 72.743 8.048 -7.954 1.00 0.00 H new ATOM 0 HA ASN A 63 73.398 9.109 -5.535 1.00 0.00 H new ATOM 0 HB2 ASN A 63 74.917 6.903 -7.007 1.00 0.00 H new ATOM 0 HB3 ASN A 63 74.859 7.127 -5.270 1.00 0.00 H new ATOM 0 HD21 ASN A 63 72.132 4.676 -6.564 1.00 0.00 H new ATOM 0 HD22 ASN A 63 73.835 4.830 -7.010 1.00 0.00 H new TER 965 ASN A 63 ATOM 966 N CYS B 1 72.410 22.562 -15.542 1.00 0.00 N ATOM 967 CA CYS B 1 71.348 21.840 -14.786 1.00 0.00 C ATOM 968 C CYS B 1 71.998 20.878 -13.794 1.00 0.00 C ATOM 969 O CYS B 1 72.847 21.277 -12.996 1.00 0.00 O ATOM 970 CB CYS B 1 70.466 21.066 -15.769 1.00 0.00 C ATOM 971 SG CYS B 1 69.934 22.169 -17.102 1.00 0.00 S ATOM 0 H1 CYS B 1 71.970 23.242 -16.194 1.00 0.00 H new ATOM 0 H2 CYS B 1 73.026 23.070 -14.876 1.00 0.00 H new ATOM 0 H3 CYS B 1 72.976 21.878 -16.084 1.00 0.00 H new ATOM 0 HA CYS B 1 70.732 22.553 -14.238 1.00 0.00 H new ATOM 0 HB2 CYS B 1 71.017 20.221 -16.181 1.00 0.00 H new ATOM 0 HB3 CYS B 1 69.597 20.659 -15.252 1.00 0.00 H new ATOM 975 N SER B 2 71.595 19.612 -13.848 1.00 0.00 N ATOM 976 CA SER B 2 72.148 18.607 -12.948 1.00 0.00 C ATOM 977 C SER B 2 73.658 18.496 -13.134 1.00 0.00 C ATOM 978 O SER B 2 74.411 18.471 -12.161 1.00 0.00 O ATOM 979 CB SER B 2 71.497 17.250 -13.220 1.00 0.00 C ATOM 980 OG SER B 2 72.025 16.287 -12.316 1.00 0.00 O ATOM 0 H SER B 2 70.894 19.260 -14.500 1.00 0.00 H new ATOM 0 HA SER B 2 71.941 18.910 -11.922 1.00 0.00 H new ATOM 0 HB2 SER B 2 70.416 17.322 -13.102 1.00 0.00 H new ATOM 0 HB3 SER B 2 71.686 16.942 -14.249 1.00 0.00 H new ATOM 0 HG SER B 2 71.609 15.416 -12.486 1.00 0.00 H new ATOM 986 N THR B 3 74.091 18.436 -14.390 1.00 0.00 N ATOM 987 CA THR B 3 75.514 18.332 -14.698 1.00 0.00 C ATOM 988 C THR B 3 76.177 17.256 -13.843 1.00 0.00 C ATOM 989 O THR B 3 76.491 17.483 -12.674 1.00 0.00 O ATOM 990 CB THR B 3 76.200 19.677 -14.451 1.00 0.00 C ATOM 991 OG1 THR B 3 75.939 20.102 -13.120 1.00 0.00 O ATOM 992 CG2 THR B 3 75.662 20.715 -15.435 1.00 0.00 C ATOM 0 H THR B 3 73.481 18.457 -15.207 1.00 0.00 H new ATOM 0 HA THR B 3 75.617 18.056 -15.747 1.00 0.00 H new ATOM 0 HB THR B 3 77.275 19.569 -14.594 1.00 0.00 H new ATOM 0 HG1 THR B 3 75.883 19.320 -12.532 1.00 0.00 H new ATOM 0 HG21 THR B 3 76.152 21.673 -15.258 1.00 0.00 H new ATOM 0 HG22 THR B 3 75.863 20.388 -16.455 1.00 0.00 H new ATOM 0 HG23 THR B 3 74.587 20.826 -15.295 1.00 0.00 H new ATOM 1000 N VAL B 4 76.394 16.082 -14.437 1.00 0.00 N ATOM 1001 CA VAL B 4 77.026 14.970 -13.727 1.00 0.00 C ATOM 1002 C VAL B 4 77.937 14.189 -14.670 1.00 0.00 C ATOM 1003 O VAL B 4 79.098 13.930 -14.354 1.00 0.00 O ATOM 1004 CB VAL B 4 75.951 14.043 -13.147 1.00 0.00 C ATOM 1005 CG1 VAL B 4 75.137 13.409 -14.283 1.00 0.00 C ATOM 1006 CG2 VAL B 4 76.620 12.944 -12.318 1.00 0.00 C ATOM 0 H VAL B 4 76.143 15.877 -15.404 1.00 0.00 H new ATOM 0 HA VAL B 4 77.629 15.370 -12.912 1.00 0.00 H new ATOM 0 HB VAL B 4 75.282 14.623 -12.512 1.00 0.00 H new ATOM 0 HG11 VAL B 4 74.376 12.752 -13.862 1.00 0.00 H new ATOM 0 HG12 VAL B 4 74.657 14.193 -14.868 1.00 0.00 H new ATOM 0 HG13 VAL B 4 75.800 12.831 -14.927 1.00 0.00 H new ATOM 0 HG21 VAL B 4 75.857 12.284 -11.905 1.00 0.00 H new ATOM 0 HG22 VAL B 4 77.293 12.368 -12.953 1.00 0.00 H new ATOM 0 HG23 VAL B 4 77.187 13.396 -11.505 1.00 0.00 H new ATOM 1016 N SER B 5 77.404 13.820 -15.830 1.00 0.00 N ATOM 1017 CA SER B 5 78.175 13.073 -16.815 1.00 0.00 C ATOM 1018 C SER B 5 79.595 13.639 -16.966 1.00 0.00 C ATOM 1019 O SER B 5 80.570 12.954 -16.661 1.00 0.00 O ATOM 1020 CB SER B 5 77.436 13.087 -18.162 1.00 0.00 C ATOM 1021 OG SER B 5 76.663 11.903 -18.275 1.00 0.00 O ATOM 0 H SER B 5 76.445 14.025 -16.110 1.00 0.00 H new ATOM 0 HA SER B 5 78.274 12.044 -16.470 1.00 0.00 H new ATOM 0 HB2 SER B 5 76.793 13.965 -18.230 1.00 0.00 H new ATOM 0 HB3 SER B 5 78.150 13.151 -18.983 1.00 0.00 H new ATOM 0 HG SER B 5 76.426 11.580 -17.380 1.00 0.00 H new ATOM 1027 N PRO B 6 79.736 14.859 -17.435 1.00 0.00 N ATOM 1028 CA PRO B 6 81.078 15.491 -17.630 1.00 0.00 C ATOM 1029 C PRO B 6 81.899 15.523 -16.339 1.00 0.00 C ATOM 1030 O PRO B 6 83.017 16.039 -16.319 1.00 0.00 O ATOM 1031 CB PRO B 6 80.752 16.916 -18.132 1.00 0.00 C ATOM 1032 CG PRO B 6 79.317 17.143 -17.773 1.00 0.00 C ATOM 1033 CD PRO B 6 78.651 15.772 -17.830 1.00 0.00 C ATOM 0 HA PRO B 6 81.695 14.929 -18.331 1.00 0.00 H new ATOM 0 HB2 PRO B 6 81.397 17.657 -17.660 1.00 0.00 H new ATOM 0 HB3 PRO B 6 80.906 16.999 -19.208 1.00 0.00 H new ATOM 0 HG2 PRO B 6 79.227 17.580 -16.778 1.00 0.00 H new ATOM 0 HG3 PRO B 6 78.845 17.836 -18.469 1.00 0.00 H new ATOM 0 HD2 PRO B 6 77.802 15.707 -17.150 1.00 0.00 H new ATOM 0 HD3 PRO B 6 78.277 15.546 -18.829 1.00 0.00 H new ATOM 1041 N GLY B 7 81.341 14.969 -15.262 1.00 0.00 N ATOM 1042 CA GLY B 7 82.033 14.938 -13.970 1.00 0.00 C ATOM 1043 C GLY B 7 82.414 13.510 -13.589 1.00 0.00 C ATOM 1044 O GLY B 7 83.596 13.162 -13.535 1.00 0.00 O ATOM 0 H GLY B 7 80.417 14.537 -15.257 1.00 0.00 H new ATOM 0 HA2 GLY B 7 82.929 15.557 -14.018 1.00 0.00 H new ATOM 0 HA3 GLY B 7 81.392 15.365 -13.199 1.00 0.00 H new ATOM 1048 N VAL B 8 81.411 12.685 -13.324 1.00 0.00 N ATOM 1049 CA VAL B 8 81.663 11.302 -12.947 1.00 0.00 C ATOM 1050 C VAL B 8 82.437 10.582 -14.056 1.00 0.00 C ATOM 1051 O VAL B 8 83.455 9.927 -13.804 1.00 0.00 O ATOM 1052 CB VAL B 8 80.334 10.596 -12.665 1.00 0.00 C ATOM 1053 CG1 VAL B 8 79.503 11.436 -11.692 1.00 0.00 C ATOM 1054 CG2 VAL B 8 79.555 10.411 -13.969 1.00 0.00 C ATOM 0 H VAL B 8 80.426 12.945 -13.362 1.00 0.00 H new ATOM 0 HA VAL B 8 82.270 11.280 -12.042 1.00 0.00 H new ATOM 0 HB VAL B 8 80.536 9.620 -12.225 1.00 0.00 H new ATOM 0 HG11 VAL B 8 78.557 10.932 -11.492 1.00 0.00 H new ATOM 0 HG12 VAL B 8 80.052 11.561 -10.759 1.00 0.00 H new ATOM 0 HG13 VAL B 8 79.307 12.414 -12.131 1.00 0.00 H new ATOM 0 HG21 VAL B 8 78.611 9.908 -13.760 1.00 0.00 H new ATOM 0 HG22 VAL B 8 79.356 11.385 -14.416 1.00 0.00 H new ATOM 0 HG23 VAL B 8 80.142 9.808 -14.661 1.00 0.00 H new ATOM 1064 N LEU B 9 81.974 10.730 -15.291 1.00 0.00 N ATOM 1065 CA LEU B 9 82.659 10.109 -16.413 1.00 0.00 C ATOM 1066 C LEU B 9 84.104 10.607 -16.433 1.00 0.00 C ATOM 1067 O LEU B 9 85.056 9.825 -16.592 1.00 0.00 O ATOM 1068 CB LEU B 9 81.929 10.445 -17.719 1.00 0.00 C ATOM 1069 CG LEU B 9 80.437 10.087 -17.574 1.00 0.00 C ATOM 1070 CD1 LEU B 9 79.656 10.573 -18.802 1.00 0.00 C ATOM 1071 CD2 LEU B 9 80.274 8.565 -17.428 1.00 0.00 C ATOM 0 H LEU B 9 81.141 11.265 -15.537 1.00 0.00 H new ATOM 0 HA LEU B 9 82.661 9.024 -16.309 1.00 0.00 H new ATOM 0 HB2 LEU B 9 82.040 11.505 -17.949 1.00 0.00 H new ATOM 0 HB3 LEU B 9 82.369 9.891 -18.548 1.00 0.00 H new ATOM 0 HG LEU B 9 80.044 10.578 -16.684 1.00 0.00 H new ATOM 0 HD11 LEU B 9 78.603 10.315 -18.689 1.00 0.00 H new ATOM 0 HD12 LEU B 9 79.757 11.655 -18.893 1.00 0.00 H new ATOM 0 HD13 LEU B 9 80.053 10.095 -19.698 1.00 0.00 H new ATOM 0 HD21 LEU B 9 79.217 8.320 -17.326 1.00 0.00 H new ATOM 0 HD22 LEU B 9 80.678 8.069 -18.311 1.00 0.00 H new ATOM 0 HD23 LEU B 9 80.812 8.225 -16.543 1.00 0.00 H new ATOM 1083 N ALA B 10 84.279 11.909 -16.194 1.00 0.00 N ATOM 1084 CA ALA B 10 85.620 12.464 -16.121 1.00 0.00 C ATOM 1085 C ALA B 10 86.401 11.620 -15.118 1.00 0.00 C ATOM 1086 O ALA B 10 87.603 11.374 -15.255 1.00 0.00 O ATOM 1087 CB ALA B 10 85.573 13.930 -15.667 1.00 0.00 C ATOM 0 H ALA B 10 83.524 12.580 -16.052 1.00 0.00 H new ATOM 0 HA ALA B 10 86.099 12.443 -17.100 1.00 0.00 H new ATOM 0 HB1 ALA B 10 86.586 14.328 -15.618 1.00 0.00 H new ATOM 0 HB2 ALA B 10 84.988 14.513 -16.378 1.00 0.00 H new ATOM 0 HB3 ALA B 10 85.111 13.991 -14.681 1.00 0.00 H new ATOM 1093 N GLY B 11 85.666 11.149 -14.115 1.00 0.00 N ATOM 1094 CA GLY B 11 86.238 10.300 -13.089 1.00 0.00 C ATOM 1095 C GLY B 11 86.708 8.981 -13.695 1.00 0.00 C ATOM 1096 O GLY B 11 87.740 8.443 -13.292 1.00 0.00 O ATOM 0 H GLY B 11 84.672 11.344 -13.996 1.00 0.00 H new ATOM 0 HA2 GLY B 11 87.076 10.808 -12.612 1.00 0.00 H new ATOM 0 HA3 GLY B 11 85.498 10.108 -12.312 1.00 0.00 H new ATOM 1100 N ILE B 12 85.957 8.454 -14.669 1.00 0.00 N ATOM 1101 CA ILE B 12 86.357 7.202 -15.288 1.00 0.00 C ATOM 1102 C ILE B 12 87.758 7.369 -15.890 1.00 0.00 C ATOM 1103 O ILE B 12 88.614 6.496 -15.729 1.00 0.00 O ATOM 1104 CB ILE B 12 85.303 6.757 -16.346 1.00 0.00 C ATOM 1105 CG1 ILE B 12 85.065 5.230 -16.253 1.00 0.00 C ATOM 1106 CG2 ILE B 12 85.752 7.104 -17.771 1.00 0.00 C ATOM 1107 CD1 ILE B 12 84.070 4.915 -15.126 1.00 0.00 C ATOM 0 H ILE B 12 85.097 8.865 -15.031 1.00 0.00 H new ATOM 0 HA ILE B 12 86.401 6.409 -14.541 1.00 0.00 H new ATOM 0 HB ILE B 12 84.379 7.294 -16.131 1.00 0.00 H new ATOM 0 HG12 ILE B 12 84.681 4.856 -17.202 1.00 0.00 H new ATOM 0 HG13 ILE B 12 86.009 4.718 -16.068 1.00 0.00 H new ATOM 0 HG21 ILE B 12 84.992 6.779 -18.481 1.00 0.00 H new ATOM 0 HG22 ILE B 12 85.891 8.182 -17.856 1.00 0.00 H new ATOM 0 HG23 ILE B 12 86.693 6.599 -17.989 1.00 0.00 H new ATOM 0 HD11 ILE B 12 83.911 3.838 -15.071 1.00 0.00 H new ATOM 0 HD12 ILE B 12 84.470 5.272 -14.177 1.00 0.00 H new ATOM 0 HD13 ILE B 12 83.121 5.412 -15.329 1.00 0.00 H new ATOM 1119 N VAL B 13 87.997 8.496 -16.570 1.00 0.00 N ATOM 1120 CA VAL B 13 89.328 8.714 -17.154 1.00 0.00 C ATOM 1121 C VAL B 13 90.378 8.709 -16.045 1.00 0.00 C ATOM 1122 O VAL B 13 91.412 8.055 -16.167 1.00 0.00 O ATOM 1123 CB VAL B 13 89.407 10.026 -18.000 1.00 0.00 C ATOM 1124 CG1 VAL B 13 88.010 10.492 -18.365 1.00 0.00 C ATOM 1125 CG2 VAL B 13 90.120 11.171 -17.256 1.00 0.00 C ATOM 0 H VAL B 13 87.320 9.243 -16.726 1.00 0.00 H new ATOM 0 HA VAL B 13 89.527 7.896 -17.846 1.00 0.00 H new ATOM 0 HB VAL B 13 89.986 9.786 -18.892 1.00 0.00 H new ATOM 0 HG11 VAL B 13 88.074 11.407 -18.954 1.00 0.00 H new ATOM 0 HG12 VAL B 13 87.509 9.719 -18.948 1.00 0.00 H new ATOM 0 HG13 VAL B 13 87.442 10.686 -17.455 1.00 0.00 H new ATOM 0 HG21 VAL B 13 90.146 12.057 -17.891 1.00 0.00 H new ATOM 0 HG22 VAL B 13 89.581 11.399 -16.337 1.00 0.00 H new ATOM 0 HG23 VAL B 13 91.139 10.869 -17.014 1.00 0.00 H new ATOM 1135 N VAL B 14 90.107 9.435 -14.961 1.00 0.00 N ATOM 1136 CA VAL B 14 91.056 9.484 -13.852 1.00 0.00 C ATOM 1137 C VAL B 14 91.496 8.070 -13.484 1.00 0.00 C ATOM 1138 O VAL B 14 92.688 7.800 -13.307 1.00 0.00 O ATOM 1139 CB VAL B 14 90.422 10.167 -12.638 1.00 0.00 C ATOM 1140 CG1 VAL B 14 91.403 10.135 -11.466 1.00 0.00 C ATOM 1141 CG2 VAL B 14 90.095 11.622 -12.988 1.00 0.00 C ATOM 0 H VAL B 14 89.258 9.985 -14.828 1.00 0.00 H new ATOM 0 HA VAL B 14 91.927 10.061 -14.161 1.00 0.00 H new ATOM 0 HB VAL B 14 89.507 9.643 -12.361 1.00 0.00 H new ATOM 0 HG11 VAL B 14 90.952 10.621 -10.601 1.00 0.00 H new ATOM 0 HG12 VAL B 14 91.640 9.100 -11.218 1.00 0.00 H new ATOM 0 HG13 VAL B 14 92.317 10.661 -11.742 1.00 0.00 H new ATOM 0 HG21 VAL B 14 89.643 12.111 -12.125 1.00 0.00 H new ATOM 0 HG22 VAL B 14 91.011 12.145 -13.263 1.00 0.00 H new ATOM 0 HG23 VAL B 14 89.398 11.647 -13.825 1.00 0.00 H new ATOM 1151 N GLY B 15 90.528 7.165 -13.391 1.00 0.00 N ATOM 1152 CA GLY B 15 90.827 5.776 -13.067 1.00 0.00 C ATOM 1153 C GLY B 15 91.739 5.173 -14.130 1.00 0.00 C ATOM 1154 O GLY B 15 92.656 4.410 -13.819 1.00 0.00 O ATOM 0 H GLY B 15 89.538 7.366 -13.534 1.00 0.00 H new ATOM 0 HA2 GLY B 15 91.307 5.718 -12.090 1.00 0.00 H new ATOM 0 HA3 GLY B 15 89.902 5.203 -13.003 1.00 0.00 H new ATOM 1158 N ASP B 16 91.482 5.526 -15.386 1.00 0.00 N ATOM 1159 CA ASP B 16 92.286 5.019 -16.494 1.00 0.00 C ATOM 1160 C ASP B 16 93.750 5.415 -16.324 1.00 0.00 C ATOM 1161 O ASP B 16 94.646 4.583 -16.464 1.00 0.00 O ATOM 1162 CB ASP B 16 91.759 5.574 -17.820 1.00 0.00 C ATOM 1163 CG ASP B 16 92.337 4.776 -18.984 1.00 0.00 C ATOM 1164 OD1 ASP B 16 92.464 3.571 -18.846 1.00 0.00 O ATOM 1165 OD2 ASP B 16 92.644 5.383 -19.997 1.00 0.00 O ATOM 0 H ASP B 16 90.729 6.157 -15.661 1.00 0.00 H new ATOM 0 HA ASP B 16 92.214 3.931 -16.499 1.00 0.00 H new ATOM 0 HB2 ASP B 16 90.670 5.523 -17.838 1.00 0.00 H new ATOM 0 HB3 ASP B 16 92.031 6.625 -17.918 1.00 0.00 H new ATOM 1170 N LEU B 17 93.987 6.689 -16.025 1.00 0.00 N ATOM 1171 CA LEU B 17 95.352 7.174 -15.841 1.00 0.00 C ATOM 1172 C LEU B 17 96.043 6.379 -14.734 1.00 0.00 C ATOM 1173 O LEU B 17 97.190 5.954 -14.885 1.00 0.00 O ATOM 1174 CB LEU B 17 95.336 8.675 -15.480 1.00 0.00 C ATOM 1175 CG LEU B 17 95.285 9.532 -16.753 1.00 0.00 C ATOM 1176 CD1 LEU B 17 93.959 9.302 -17.481 1.00 0.00 C ATOM 1177 CD2 LEU B 17 95.399 11.009 -16.370 1.00 0.00 C ATOM 0 H LEU B 17 93.262 7.397 -15.906 1.00 0.00 H new ATOM 0 HA LEU B 17 95.903 7.040 -16.772 1.00 0.00 H new ATOM 0 HB2 LEU B 17 94.473 8.895 -14.851 1.00 0.00 H new ATOM 0 HB3 LEU B 17 96.225 8.926 -14.901 1.00 0.00 H new ATOM 0 HG LEU B 17 96.110 9.253 -17.409 1.00 0.00 H new ATOM 0 HD11 LEU B 17 93.929 9.913 -18.383 1.00 0.00 H new ATOM 0 HD12 LEU B 17 93.870 8.250 -17.752 1.00 0.00 H new ATOM 0 HD13 LEU B 17 93.132 9.579 -16.827 1.00 0.00 H new ATOM 0 HD21 LEU B 17 95.363 11.622 -17.270 1.00 0.00 H new ATOM 0 HD22 LEU B 17 94.572 11.280 -15.714 1.00 0.00 H new ATOM 0 HD23 LEU B 17 96.343 11.179 -15.853 1.00 0.00 H new ATOM 1189 N VAL B 18 95.337 6.180 -13.625 1.00 0.00 N ATOM 1190 CA VAL B 18 95.902 5.431 -12.510 1.00 0.00 C ATOM 1191 C VAL B 18 96.378 4.058 -12.983 1.00 0.00 C ATOM 1192 O VAL B 18 97.488 3.631 -12.658 1.00 0.00 O ATOM 1193 CB VAL B 18 94.858 5.273 -11.399 1.00 0.00 C ATOM 1194 CG1 VAL B 18 95.383 4.319 -10.322 1.00 0.00 C ATOM 1195 CG2 VAL B 18 94.583 6.641 -10.769 1.00 0.00 C ATOM 0 H VAL B 18 94.387 6.521 -13.476 1.00 0.00 H new ATOM 0 HA VAL B 18 96.756 5.981 -12.115 1.00 0.00 H new ATOM 0 HB VAL B 18 93.940 4.867 -11.823 1.00 0.00 H new ATOM 0 HG11 VAL B 18 94.636 4.211 -9.536 1.00 0.00 H new ATOM 0 HG12 VAL B 18 95.585 3.344 -10.766 1.00 0.00 H new ATOM 0 HG13 VAL B 18 96.302 4.721 -9.896 1.00 0.00 H new ATOM 0 HG21 VAL B 18 93.841 6.535 -9.978 1.00 0.00 H new ATOM 0 HG22 VAL B 18 95.506 7.040 -10.349 1.00 0.00 H new ATOM 0 HG23 VAL B 18 94.206 7.323 -11.531 1.00 0.00 H new ATOM 1205 N LEU B 19 95.540 3.369 -13.753 1.00 0.00 N ATOM 1206 CA LEU B 19 95.907 2.052 -14.258 1.00 0.00 C ATOM 1207 C LEU B 19 97.142 2.152 -15.149 1.00 0.00 C ATOM 1208 O LEU B 19 98.075 1.373 -15.011 1.00 0.00 O ATOM 1209 CB LEU B 19 94.751 1.435 -15.062 1.00 0.00 C ATOM 1210 CG LEU B 19 93.669 0.876 -14.118 1.00 0.00 C ATOM 1211 CD1 LEU B 19 92.351 0.741 -14.893 1.00 0.00 C ATOM 1212 CD2 LEU B 19 94.080 -0.512 -13.585 1.00 0.00 C ATOM 0 H LEU B 19 94.616 3.695 -14.037 1.00 0.00 H new ATOM 0 HA LEU B 19 96.126 1.413 -13.402 1.00 0.00 H new ATOM 0 HB2 LEU B 19 94.315 2.188 -15.718 1.00 0.00 H new ATOM 0 HB3 LEU B 19 95.131 0.638 -15.701 1.00 0.00 H new ATOM 0 HG LEU B 19 93.549 1.558 -13.276 1.00 0.00 H new ATOM 0 HD11 LEU B 19 91.579 0.346 -14.232 1.00 0.00 H new ATOM 0 HD12 LEU B 19 92.045 1.719 -15.264 1.00 0.00 H new ATOM 0 HD13 LEU B 19 92.491 0.062 -15.734 1.00 0.00 H new ATOM 0 HD21 LEU B 19 93.304 -0.891 -12.920 1.00 0.00 H new ATOM 0 HD22 LEU B 19 94.209 -1.199 -14.421 1.00 0.00 H new ATOM 0 HD23 LEU B 19 95.018 -0.428 -13.037 1.00 0.00 H new ATOM 1224 N THR B 20 97.138 3.113 -16.065 1.00 0.00 N ATOM 1225 CA THR B 20 98.266 3.287 -16.975 1.00 0.00 C ATOM 1226 C THR B 20 99.585 3.276 -16.207 1.00 0.00 C ATOM 1227 O THR B 20 100.516 2.546 -16.560 1.00 0.00 O ATOM 1228 CB THR B 20 98.126 4.609 -17.732 1.00 0.00 C ATOM 1229 OG1 THR B 20 96.818 4.704 -18.279 1.00 0.00 O ATOM 1230 CG2 THR B 20 99.159 4.667 -18.859 1.00 0.00 C ATOM 0 H THR B 20 96.376 3.778 -16.198 1.00 0.00 H new ATOM 0 HA THR B 20 98.266 2.459 -17.684 1.00 0.00 H new ATOM 0 HB THR B 20 98.294 5.440 -17.046 1.00 0.00 H new ATOM 0 HG1 THR B 20 96.167 4.809 -17.554 1.00 0.00 H new ATOM 0 HG21 THR B 20 99.058 5.609 -19.397 1.00 0.00 H new ATOM 0 HG22 THR B 20 100.162 4.596 -18.438 1.00 0.00 H new ATOM 0 HG23 THR B 20 98.995 3.837 -19.546 1.00 0.00 H new ATOM 1238 N VAL B 21 99.661 4.087 -15.160 1.00 0.00 N ATOM 1239 CA VAL B 21 100.874 4.164 -14.353 1.00 0.00 C ATOM 1240 C VAL B 21 101.184 2.817 -13.704 1.00 0.00 C ATOM 1241 O VAL B 21 102.337 2.374 -13.686 1.00 0.00 O ATOM 1242 CB VAL B 21 100.707 5.228 -13.267 1.00 0.00 C ATOM 1243 CG1 VAL B 21 101.967 5.279 -12.400 1.00 0.00 C ATOM 1244 CG2 VAL B 21 100.486 6.592 -13.921 1.00 0.00 C ATOM 0 H VAL B 21 98.904 4.697 -14.850 1.00 0.00 H new ATOM 0 HA VAL B 21 101.703 4.433 -15.007 1.00 0.00 H new ATOM 0 HB VAL B 21 99.848 4.977 -12.644 1.00 0.00 H new ATOM 0 HG11 VAL B 21 101.846 6.038 -11.627 1.00 0.00 H new ATOM 0 HG12 VAL B 21 102.127 4.307 -11.933 1.00 0.00 H new ATOM 0 HG13 VAL B 21 102.827 5.529 -13.022 1.00 0.00 H new ATOM 0 HG21 VAL B 21 100.367 7.351 -13.148 1.00 0.00 H new ATOM 0 HG22 VAL B 21 101.345 6.840 -14.544 1.00 0.00 H new ATOM 0 HG23 VAL B 21 99.588 6.558 -14.538 1.00 0.00 H new ATOM 1254 N LEU B 22 100.157 2.174 -13.160 1.00 0.00 N ATOM 1255 CA LEU B 22 100.341 0.887 -12.496 1.00 0.00 C ATOM 1256 C LEU B 22 100.925 -0.152 -13.456 1.00 0.00 C ATOM 1257 O LEU B 22 101.855 -0.876 -13.100 1.00 0.00 O ATOM 1258 CB LEU B 22 98.998 0.395 -11.934 1.00 0.00 C ATOM 1259 CG LEU B 22 99.230 -0.602 -10.782 1.00 0.00 C ATOM 1260 CD1 LEU B 22 99.834 0.112 -9.551 1.00 0.00 C ATOM 1261 CD2 LEU B 22 97.887 -1.242 -10.401 1.00 0.00 C ATOM 0 H LEU B 22 99.197 2.518 -13.165 1.00 0.00 H new ATOM 0 HA LEU B 22 101.048 1.021 -11.677 1.00 0.00 H new ATOM 0 HB2 LEU B 22 98.413 1.243 -11.577 1.00 0.00 H new ATOM 0 HB3 LEU B 22 98.418 -0.082 -12.725 1.00 0.00 H new ATOM 0 HG LEU B 22 99.932 -1.368 -11.111 1.00 0.00 H new ATOM 0 HD11 LEU B 22 99.989 -0.611 -8.751 1.00 0.00 H new ATOM 0 HD12 LEU B 22 100.789 0.562 -9.823 1.00 0.00 H new ATOM 0 HD13 LEU B 22 99.151 0.890 -9.210 1.00 0.00 H new ATOM 0 HD21 LEU B 22 98.039 -1.950 -9.586 1.00 0.00 H new ATOM 0 HD22 LEU B 22 97.191 -0.466 -10.082 1.00 0.00 H new ATOM 0 HD23 LEU B 22 97.476 -1.765 -11.264 1.00 0.00 H new ATOM 1273 N ILE B 23 100.387 -0.222 -14.673 1.00 0.00 N ATOM 1274 CA ILE B 23 100.889 -1.179 -15.653 1.00 0.00 C ATOM 1275 C ILE B 23 102.367 -0.908 -15.918 1.00 0.00 C ATOM 1276 O ILE B 23 103.196 -1.816 -15.860 1.00 0.00 O ATOM 1277 CB ILE B 23 100.105 -1.078 -16.969 1.00 0.00 C ATOM 1278 CG1 ILE B 23 98.590 -1.263 -16.706 1.00 0.00 C ATOM 1279 CG2 ILE B 23 100.609 -2.155 -17.943 1.00 0.00 C ATOM 1280 CD1 ILE B 23 98.205 -2.751 -16.681 1.00 0.00 C ATOM 0 H ILE B 23 99.617 0.362 -14.999 1.00 0.00 H new ATOM 0 HA ILE B 23 100.762 -2.184 -15.252 1.00 0.00 H new ATOM 0 HB ILE B 23 100.260 -0.092 -17.407 1.00 0.00 H new ATOM 0 HG12 ILE B 23 98.325 -0.801 -15.755 1.00 0.00 H new ATOM 0 HG13 ILE B 23 98.019 -0.750 -17.480 1.00 0.00 H new ATOM 0 HG21 ILE B 23 100.055 -2.087 -18.879 1.00 0.00 H new ATOM 0 HG22 ILE B 23 101.670 -2.002 -18.138 1.00 0.00 H new ATOM 0 HG23 ILE B 23 100.460 -3.141 -17.504 1.00 0.00 H new ATOM 0 HD11 ILE B 23 97.135 -2.847 -16.494 1.00 0.00 H new ATOM 0 HD12 ILE B 23 98.448 -3.206 -17.641 1.00 0.00 H new ATOM 0 HD13 ILE B 23 98.758 -3.257 -15.890 1.00 0.00 H new ATOM 1292 N ALA B 24 102.693 0.355 -16.192 1.00 0.00 N ATOM 1293 CA ALA B 24 104.082 0.736 -16.445 1.00 0.00 C ATOM 1294 C ALA B 24 104.987 0.146 -15.363 1.00 0.00 C ATOM 1295 O ALA B 24 106.045 -0.420 -15.650 1.00 0.00 O ATOM 1296 CB ALA B 24 104.215 2.259 -16.447 1.00 0.00 C ATOM 0 H ALA B 24 102.024 1.123 -16.244 1.00 0.00 H new ATOM 0 HA ALA B 24 104.382 0.349 -17.419 1.00 0.00 H new ATOM 0 HB1 ALA B 24 105.253 2.533 -16.636 1.00 0.00 H new ATOM 0 HB2 ALA B 24 103.581 2.679 -17.228 1.00 0.00 H new ATOM 0 HB3 ALA B 24 103.906 2.652 -15.478 1.00 0.00 H new ATOM 1302 N LEU B 25 104.556 0.273 -14.114 1.00 0.00 N ATOM 1303 CA LEU B 25 105.326 -0.263 -12.999 1.00 0.00 C ATOM 1304 C LEU B 25 105.384 -1.789 -13.108 1.00 0.00 C ATOM 1305 O LEU B 25 106.387 -2.414 -12.765 1.00 0.00 O ATOM 1306 CB LEU B 25 104.667 0.161 -11.670 1.00 0.00 C ATOM 1307 CG LEU B 25 105.721 0.332 -10.556 1.00 0.00 C ATOM 1308 CD1 LEU B 25 106.563 -0.945 -10.432 1.00 0.00 C ATOM 1309 CD2 LEU B 25 106.640 1.540 -10.856 1.00 0.00 C ATOM 0 H LEU B 25 103.687 0.737 -13.849 1.00 0.00 H new ATOM 0 HA LEU B 25 106.343 0.129 -13.027 1.00 0.00 H new ATOM 0 HB2 LEU B 25 104.127 1.097 -11.811 1.00 0.00 H new ATOM 0 HB3 LEU B 25 103.934 -0.587 -11.369 1.00 0.00 H new ATOM 0 HG LEU B 25 105.203 0.515 -9.615 1.00 0.00 H new ATOM 0 HD11 LEU B 25 107.305 -0.817 -9.644 1.00 0.00 H new ATOM 0 HD12 LEU B 25 105.914 -1.786 -10.187 1.00 0.00 H new ATOM 0 HD13 LEU B 25 107.069 -1.141 -11.378 1.00 0.00 H new ATOM 0 HD21 LEU B 25 107.376 1.644 -10.059 1.00 0.00 H new ATOM 0 HD22 LEU B 25 107.152 1.381 -11.805 1.00 0.00 H new ATOM 0 HD23 LEU B 25 106.040 2.448 -10.916 1.00 0.00 H new ATOM 1321 N ALA B 26 104.292 -2.374 -13.589 1.00 0.00 N ATOM 1322 CA ALA B 26 104.209 -3.823 -13.743 1.00 0.00 C ATOM 1323 C ALA B 26 105.286 -4.339 -14.695 1.00 0.00 C ATOM 1324 O ALA B 26 106.074 -5.209 -14.332 1.00 0.00 O ATOM 1325 CB ALA B 26 102.824 -4.214 -14.271 1.00 0.00 C ATOM 0 H ALA B 26 103.454 -1.869 -13.878 1.00 0.00 H new ATOM 0 HA ALA B 26 104.369 -4.277 -12.765 1.00 0.00 H new ATOM 0 HB1 ALA B 26 102.770 -5.297 -14.383 1.00 0.00 H new ATOM 0 HB2 ALA B 26 102.060 -3.883 -13.568 1.00 0.00 H new ATOM 0 HB3 ALA B 26 102.656 -3.740 -15.238 1.00 0.00 H new ATOM 1331 N VAL B 27 105.330 -3.800 -15.911 1.00 0.00 N ATOM 1332 CA VAL B 27 106.335 -4.240 -16.871 1.00 0.00 C ATOM 1333 C VAL B 27 107.724 -4.029 -16.282 1.00 0.00 C ATOM 1334 O VAL B 27 108.622 -4.848 -16.480 1.00 0.00 O ATOM 1335 CB VAL B 27 106.192 -3.480 -18.195 1.00 0.00 C ATOM 1336 CG1 VAL B 27 106.117 -1.985 -17.922 1.00 0.00 C ATOM 1337 CG2 VAL B 27 107.394 -3.776 -19.100 1.00 0.00 C ATOM 0 H VAL B 27 104.697 -3.075 -16.248 1.00 0.00 H new ATOM 0 HA VAL B 27 106.189 -5.300 -17.077 1.00 0.00 H new ATOM 0 HB VAL B 27 105.279 -3.804 -18.694 1.00 0.00 H new ATOM 0 HG11 VAL B 27 106.015 -1.448 -18.865 1.00 0.00 H new ATOM 0 HG12 VAL B 27 105.255 -1.773 -17.289 1.00 0.00 H new ATOM 0 HG13 VAL B 27 107.027 -1.661 -17.416 1.00 0.00 H new ATOM 0 HG21 VAL B 27 107.285 -3.233 -20.039 1.00 0.00 H new ATOM 0 HG22 VAL B 27 108.311 -3.460 -18.602 1.00 0.00 H new ATOM 0 HG23 VAL B 27 107.442 -4.846 -19.303 1.00 0.00 H new ATOM 1347 N TYR B 28 107.891 -2.936 -15.542 1.00 0.00 N ATOM 1348 CA TYR B 28 109.178 -2.655 -14.918 1.00 0.00 C ATOM 1349 C TYR B 28 109.555 -3.794 -13.973 1.00 0.00 C ATOM 1350 O TYR B 28 110.697 -4.250 -13.958 1.00 0.00 O ATOM 1351 CB TYR B 28 109.111 -1.338 -14.142 1.00 0.00 C ATOM 1352 CG TYR B 28 110.510 -0.903 -13.771 1.00 0.00 C ATOM 1353 CD1 TYR B 28 111.372 -0.409 -14.757 1.00 0.00 C ATOM 1354 CD2 TYR B 28 110.947 -0.993 -12.443 1.00 0.00 C ATOM 1355 CE1 TYR B 28 112.669 -0.006 -14.417 1.00 0.00 C ATOM 1356 CE2 TYR B 28 112.244 -0.589 -12.103 1.00 0.00 C ATOM 1357 CZ TYR B 28 113.105 -0.096 -13.090 1.00 0.00 C ATOM 1358 OH TYR B 28 114.384 0.301 -12.756 1.00 0.00 O ATOM 0 H TYR B 28 107.165 -2.242 -15.363 1.00 0.00 H new ATOM 0 HA TYR B 28 109.936 -2.568 -15.696 1.00 0.00 H new ATOM 0 HB2 TYR B 28 108.628 -0.571 -14.747 1.00 0.00 H new ATOM 0 HB3 TYR B 28 108.507 -1.463 -13.244 1.00 0.00 H new ATOM 0 HD1 TYR B 28 111.036 -0.339 -15.781 1.00 0.00 H new ATOM 0 HD2 TYR B 28 110.283 -1.374 -11.681 1.00 0.00 H new ATOM 0 HE1 TYR B 28 113.333 0.374 -15.179 1.00 0.00 H new ATOM 0 HE2 TYR B 28 112.580 -0.658 -11.079 1.00 0.00 H new ATOM 0 HH TYR B 28 114.525 0.174 -11.795 1.00 0.00 H new ATOM 1368 N PHE B 29 108.578 -4.251 -13.191 1.00 0.00 N ATOM 1369 CA PHE B 29 108.802 -5.341 -12.251 1.00 0.00 C ATOM 1370 C PHE B 29 109.224 -6.612 -12.992 1.00 0.00 C ATOM 1371 O PHE B 29 110.123 -7.325 -12.549 1.00 0.00 O ATOM 1372 CB PHE B 29 107.514 -5.587 -11.453 1.00 0.00 C ATOM 1373 CG PHE B 29 107.589 -6.907 -10.710 1.00 0.00 C ATOM 1374 CD1 PHE B 29 108.641 -7.152 -9.818 1.00 0.00 C ATOM 1375 CD2 PHE B 29 106.609 -7.888 -10.919 1.00 0.00 C ATOM 1376 CE1 PHE B 29 108.710 -8.373 -9.137 1.00 0.00 C ATOM 1377 CE2 PHE B 29 106.679 -9.109 -10.240 1.00 0.00 C ATOM 1378 CZ PHE B 29 107.731 -9.352 -9.348 1.00 0.00 C ATOM 0 H PHE B 29 107.627 -3.882 -13.192 1.00 0.00 H new ATOM 0 HA PHE B 29 109.606 -5.069 -11.567 1.00 0.00 H new ATOM 0 HB2 PHE B 29 107.358 -4.773 -10.745 1.00 0.00 H new ATOM 0 HB3 PHE B 29 106.658 -5.591 -12.127 1.00 0.00 H new ATOM 0 HD1 PHE B 29 109.398 -6.399 -9.656 1.00 0.00 H new ATOM 0 HD2 PHE B 29 105.798 -7.700 -11.606 1.00 0.00 H new ATOM 0 HE1 PHE B 29 109.520 -8.560 -8.447 1.00 0.00 H new ATOM 0 HE2 PHE B 29 105.923 -9.863 -10.403 1.00 0.00 H new ATOM 0 HZ PHE B 29 107.787 -10.294 -8.823 1.00 0.00 H new ATOM 1388 N LEU B 30 108.574 -6.888 -14.118 1.00 0.00 N ATOM 1389 CA LEU B 30 108.901 -8.078 -14.899 1.00 0.00 C ATOM 1390 C LEU B 30 110.369 -8.031 -15.324 1.00 0.00 C ATOM 1391 O LEU B 30 111.063 -9.048 -15.306 1.00 0.00 O ATOM 1392 CB LEU B 30 107.994 -8.166 -16.148 1.00 0.00 C ATOM 1393 CG LEU B 30 106.677 -8.889 -15.822 1.00 0.00 C ATOM 1394 CD1 LEU B 30 105.785 -7.989 -14.967 1.00 0.00 C ATOM 1395 CD2 LEU B 30 105.948 -9.216 -17.128 1.00 0.00 C ATOM 0 H LEU B 30 107.827 -6.313 -14.507 1.00 0.00 H new ATOM 0 HA LEU B 30 108.734 -8.961 -14.282 1.00 0.00 H new ATOM 0 HB2 LEU B 30 107.781 -7.163 -16.518 1.00 0.00 H new ATOM 0 HB3 LEU B 30 108.516 -8.696 -16.945 1.00 0.00 H new ATOM 0 HG LEU B 30 106.897 -9.805 -15.274 1.00 0.00 H new ATOM 0 HD11 LEU B 30 104.854 -8.509 -14.741 1.00 0.00 H new ATOM 0 HD12 LEU B 30 106.299 -7.744 -14.038 1.00 0.00 H new ATOM 0 HD13 LEU B 30 105.565 -7.071 -15.512 1.00 0.00 H new ATOM 0 HD21 LEU B 30 105.013 -9.729 -16.904 1.00 0.00 H new ATOM 0 HD22 LEU B 30 105.735 -8.293 -17.667 1.00 0.00 H new ATOM 0 HD23 LEU B 30 106.576 -9.859 -17.744 1.00 0.00 H new ATOM 1407 N GLY B 31 110.832 -6.846 -15.704 1.00 0.00 N ATOM 1408 CA GLY B 31 112.216 -6.679 -16.130 1.00 0.00 C ATOM 1409 C GLY B 31 112.401 -7.154 -17.567 1.00 0.00 C ATOM 1410 O GLY B 31 111.692 -8.048 -18.029 1.00 0.00 O ATOM 0 H GLY B 31 110.274 -5.992 -15.726 1.00 0.00 H new ATOM 0 HA2 GLY B 31 112.502 -5.630 -16.049 1.00 0.00 H new ATOM 0 HA3 GLY B 31 112.875 -7.241 -15.469 1.00 0.00 H new ATOM 1414 N ARG B 32 113.355 -6.551 -18.267 1.00 0.00 N ATOM 1415 CA ARG B 32 113.621 -6.921 -19.652 1.00 0.00 C ATOM 1416 C ARG B 32 114.410 -8.229 -19.711 1.00 0.00 C ATOM 1417 O ARG B 32 113.845 -9.313 -19.561 1.00 0.00 O ATOM 1418 CB ARG B 32 114.407 -5.796 -20.349 1.00 0.00 C ATOM 1419 CG ARG B 32 114.136 -5.813 -21.859 1.00 0.00 C ATOM 1420 CD ARG B 32 114.491 -7.185 -22.438 1.00 0.00 C ATOM 1421 NE ARG B 32 114.625 -7.101 -23.887 1.00 0.00 N ATOM 1422 CZ ARG B 32 115.733 -6.627 -24.449 1.00 0.00 C ATOM 1423 NH1 ARG B 32 116.724 -6.227 -23.701 1.00 0.00 N ATOM 1424 NH2 ARG B 32 115.828 -6.562 -25.749 1.00 0.00 N ATOM 0 H ARG B 32 113.953 -5.810 -17.902 1.00 0.00 H new ATOM 0 HA ARG B 32 112.672 -7.066 -20.168 1.00 0.00 H new ATOM 0 HB2 ARG B 32 114.120 -4.831 -19.932 1.00 0.00 H new ATOM 0 HB3 ARG B 32 115.474 -5.919 -20.163 1.00 0.00 H new ATOM 0 HG2 ARG B 32 113.087 -5.588 -22.051 1.00 0.00 H new ATOM 0 HG3 ARG B 32 114.724 -5.038 -22.351 1.00 0.00 H new ATOM 0 HD2 ARG B 32 115.423 -7.543 -22.000 1.00 0.00 H new ATOM 0 HD3 ARG B 32 113.718 -7.908 -22.178 1.00 0.00 H new ATOM 0 HE ARG B 32 113.855 -7.411 -24.480 1.00 0.00 H new ATOM 0 HH11 ARG B 32 116.649 -6.278 -22.685 1.00 0.00 H new ATOM 0 HH12 ARG B 32 117.574 -5.863 -24.132 1.00 0.00 H new ATOM 0 HH21 ARG B 32 115.053 -6.875 -26.333 1.00 0.00 H new ATOM 0 HH22 ARG B 32 116.678 -6.198 -26.181 1.00 0.00 H new TER 1438 ARG B 32